#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dwq s VAL 2 N 0.00 5.15 0.45 2.03 1.01 -1.26 -5.06 120.40 122.72 1dwq s VAL 2 Ca 0.00 0.97 -0.06 0.00 0.00 0.00 0.00 61.98 62.89 1dwq s VAL 2 Cb 0.00 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1dwq s VAL 2 CO 0.00 0.35 0.76 0.42 0.00 0.00 0.00 175.10 176.63 1dwq s THR 3 N 0.41 4.90 0.24 3.92 -4.23 -1.26 -4.49 115.64 115.14 1dwq s THR 3 Ca 0.26 0.25 -0.06 0.00 -1.18 0.00 0.00 61.69 60.96 1dwq s THR 3 Cb -0.16 -3.83 -0.02 0.00 1.34 0.00 0.00 72.50 69.84 1dwq s THR 3 CO 0.11 -0.74 0.33 0.00 -0.54 0.00 0.00 174.62 173.78 1dwq s ALA 4 N -2.61 0.49 -0.28 3.99 0.00 -1.26 -4.98 121.76 117.10 1dwq s ALA 4 Ca 0.48 -1.31 -0.07 0.00 0.00 0.00 0.00 51.96 51.06 1dwq s ALA 4 Cb -0.10 1.22 -0.01 0.00 0.00 0.00 0.00 23.12 24.23 1dwq s ALA 4 CO 0.41 -0.74 0.08 -1.58 0.00 0.00 0.00 175.76 173.93 1dwq s HIS 5 N -3.95 3.12 -0.09 0.00 5.65 -1.26 -0.43 115.29 118.32 1dwq s HIS 5 Ca 0.30 -0.73 -0.06 0.00 0.25 0.00 0.00 55.06 54.82 1dwq s HIS 5 Cb 0.02 -2.25 -0.04 0.00 -1.18 0.00 0.00 32.58 29.13 1dwq s HIS 5 CO 0.12 -0.49 0.14 -0.06 -0.65 0.00 0.00 174.74 173.81 1dwq s PHE 6 N 1.55 3.57 -0.26 3.88 0.40 0.24 -1.42 117.98 125.94 1dwq s PHE 6 Ca 0.04 0.47 -0.02 0.00 -0.60 0.00 0.00 56.93 56.82 1dwq s PHE 6 Cb -0.16 -1.90 0.03 0.00 0.51 0.00 0.00 43.02 41.49 1dwq s PHE 6 CO 0.03 0.70 -0.05 0.08 0.70 0.00 0.00 175.22 176.68 1dwq s VAL 7 N -1.10 2.94 -0.14 -0.44 1.01 -0.39 -1.16 120.40 121.11 1dwq s VAL 7 Ca 0.18 -1.04 -0.13 0.00 0.00 0.00 0.00 61.98 60.99 1dwq s VAL 7 Cb -0.12 -2.51 -0.05 0.00 0.00 0.00 0.00 36.38 33.70 1dwq s VAL 7 CO 0.08 0.16 0.28 -0.76 0.00 0.00 0.00 175.10 174.86 1dwq s LEU 8 N 1.33 4.28 -0.19 3.92 1.43 0.05 -1.32 118.68 128.17 1dwq s LEU 8 Ca -0.00 0.53 0.00 0.00 -1.03 0.00 0.00 54.13 53.63 1dwq s LEU 8 Cb -0.17 -2.34 0.05 0.00 0.03 0.00 0.00 46.19 43.75 1dwq s LEU 8 CO -0.04 0.16 -0.07 -0.63 0.23 0.00 0.00 176.35 176.00 1dwq s ILE 9 N 0.15 1.37 1.14 -0.59 -1.09 0.13 -3.15 121.20 119.16 1dwq s ILE 9 Ca 0.16 -0.89 -0.12 0.00 -2.23 0.00 0.00 60.65 57.57 1dwq s ILE 9 Cb -0.13 -1.54 0.27 0.00 -1.58 0.00 0.00 42.46 39.48 1dwq s ILE 9 CO 0.04 0.08 1.04 -1.38 -1.23 0.00 0.00 174.94 173.50 1dwq s HIS 10 N 1.50 1.40 0.50 3.97 -3.43 -1.26 -1.58 115.29 116.39 1dwq s HIS 10 Ca -0.01 1.23 0.07 0.00 -0.80 0.00 0.00 55.06 55.54 1dwq s HIS 10 Cb -0.16 -3.13 0.04 0.00 -1.43 0.00 0.00 32.58 27.90 1dwq s HIS 10 CO -0.08 -3.75 0.69 -0.08 -2.00 0.00 0.00 174.74 169.52 1dwq s THR 11 N -2.50 2.67 0.71 -5.38 -1.32 -1.25 -4.51 115.64 104.05 1dwq s THR 11 Ca 0.68 -0.92 -0.16 0.00 -1.21 0.00 0.00 61.69 60.07 1dwq s THR 11 Cb -0.24 -2.74 0.02 0.00 -1.51 0.00 0.00 72.50 68.02 1dwq s THR 11 CO 0.64 0.00 1.16 2.30 -2.21 0.00 0.00 174.62 176.51 1dwq n ILE 12 N -2.09 3.56 0.00 5.08 -5.35 -1.26 -1.73 119.36 117.58 1dwq n ILE 12 Ca 0.10 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.20 1dwq n ILE 12 Cb 0.60 -1.29 0.00 0.00 -1.74 0.00 0.00 39.64 37.21 1dwq n ILE 12 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1dwq n HIS 14 N -1.67 0.00 -3.47 0.00 8.25 -0.70 -1.59 115.22 116.03 1dwq n HIS 14 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.41 1dwq n HIS 14 Cb 0.00 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.12 1dwq n HIS 14 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1dwq n GLY 15 N 5.00 1.48 0.28 -1.41 0.00 -1.26 -2.12 105.19 107.16 1dwq n GLY 15 Ca 0.00 -1.17 0.10 0.00 0.00 0.00 0.00 46.02 44.95 1dwq n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dwq h ALA 16 N 1.99 2.04 -1.02 4.61 0.00 -1.89 -2.61 119.26 122.39 1dwq h ALA 16 Ca -0.19 -0.00 0.30 0.00 0.00 0.00 0.00 54.91 55.01 1dwq h ALA 16 Cb 0.70 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 1dwq h ALA 16 CO 0.24 -0.09 0.82 0.11 0.00 0.00 0.00 179.25 180.34 1dwq h TRP 17 N 0.00 0.00 0.00 0.00 5.08 -1.94 0.11 115.95 119.20 1dwq h TRP 17 Ca 0.03 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.00 1dwq h TRP 17 Cb 0.14 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.30 1dwq h TRP 17 CO 0.00 0.00 0.00 0.44 -1.28 0.00 0.00 178.44 177.60 1dwq n ILE 18 N -3.96 1.00 -0.75 0.12 -6.64 -0.98 -1.84 119.36 106.31 1dwq n ILE 18 Ca 0.22 0.29 0.07 0.00 -1.77 0.00 0.00 62.75 61.56 1dwq n ILE 18 Cb 1.17 -1.15 0.38 0.00 -1.44 0.00 0.00 39.64 38.59 1dwq n ILE 18 CO 0.00 0.00 0.00 0.79 -1.77 0.00 0.00 176.55 175.57 1dwq n TRP 19 N -1.86 1.92 0.35 4.28 7.02 0.38 -4.45 117.44 125.08 1dwq n TRP 19 Ca 0.02 -0.67 0.14 0.00 -1.02 0.00 0.00 57.50 55.98 1dwq n TRP 19 Cb 0.17 -0.48 0.52 0.00 -2.42 0.00 0.00 31.31 29.11 1dwq n TRP 19 CO 0.00 0.00 0.00 1.12 -2.02 0.00 0.00 177.69 176.79 1dwq h HIS 20 N 3.73 0.00 0.04 -5.99 2.07 -1.53 -0.13 115.15 113.34 1dwq h HIS 20 Ca 0.00 0.00 -0.36 0.00 -2.85 0.00 0.00 60.37 57.16 1dwq h HIS 20 Cb 1.86 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 31.80 1dwq h HIS 20 CO 1.01 0.00 -2.05 1.63 -3.07 0.00 0.00 177.93 175.46 1dwq n LYS 21 N -2.71 0.64 -0.11 5.12 4.76 -1.26 -4.42 118.16 120.18 1dwq n LYS 21 Ca 0.02 0.32 -0.12 0.00 -2.87 0.00 0.00 58.31 55.66 1dwq n LYS 21 Cb 0.33 -1.63 -0.03 0.00 -1.84 0.00 0.00 35.03 31.86 1dwq n LYS 21 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1dwq h LEU 22 N -0.48 0.65 -0.32 -0.35 5.85 -1.68 -3.07 115.31 115.93 1dwq h LEU 22 Ca -0.51 -0.38 0.07 0.00 0.84 0.00 0.00 57.88 57.90 1dwq h LEU 22 Cb 1.72 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 42.49 1dwq h LEU 22 CO -0.15 0.89 -0.25 0.50 -0.34 0.00 0.00 178.44 179.08 1dwq h LYS 23 N 0.42 -0.22 -0.88 1.25 3.64 -1.24 -1.73 116.57 117.81 1dwq h LYS 23 Ca 0.08 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.54 1dwq h LYS 23 Cb 0.61 0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.43 1dwq h LYS 23 CO 0.04 -0.14 0.57 -1.00 -2.27 0.00 0.00 179.45 176.64 1dwq h PRO 24 N -0.23 0.93 -0.37 1.90 0.13 -1.77 -2.01 132.00 130.58 1dwq h PRO 24 Ca 0.16 -0.06 0.05 0.00 -0.87 0.00 0.00 66.00 65.29 1dwq h PRO 24 Cb 0.48 -0.21 -0.05 0.00 0.13 0.00 0.00 31.00 31.35 1dwq h PRO 24 CO -0.45 0.62 0.09 0.00 -0.23 0.00 0.00 178.00 178.03 1dwq h ALA 25 N 1.53 0.41 -0.26 -0.56 0.00 -1.29 0.38 119.26 119.47 1dwq h ALA 25 Ca 0.38 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.25 1dwq h ALA 25 Cb 0.25 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1dwq h ALA 25 CO -0.15 -0.31 -0.30 -0.07 0.00 0.00 0.00 179.25 178.42 1dwq h LEU 26 N 0.23 0.55 -0.72 0.00 3.38 -1.08 -2.56 115.31 115.10 1dwq h LEU 26 Ca 0.18 -0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1dwq h LEU 26 Cb 0.19 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1dwq h LEU 26 CO -0.21 0.82 -0.53 -0.33 0.09 0.00 0.00 178.44 178.28 1dwq h GLU 27 N 0.46 0.00 0.00 1.13 5.08 -0.95 -2.08 114.58 118.22 1dwq h GLU 27 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1dwq h GLU 27 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1dwq h GLU 27 CO 0.06 0.53 0.00 0.00 -1.00 0.00 0.00 179.01 178.60 1dwq h ARG 28 N 0.00 0.00 -0.54 2.33 3.08 -0.49 -1.23 114.38 117.53 1dwq h ARG 28 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1dwq h ARG 28 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1dwq h ARG 28 CO 0.07 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.97 1dwq n ALA 29 N -1.91 2.42 -0.73 0.04 0.00 -0.94 -4.94 120.51 114.45 1dwq n ALA 29 Ca 0.01 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.45 1dwq n ALA 29 Cb 0.21 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1dwq n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dwq n GLY 30 N 1.43 0.70 3.81 0.00 0.00 -0.46 -4.87 105.19 105.79 1dwq n GLY 30 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1dwq n GLY 30 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1dwq s HIS 31 N -2.40 3.09 -0.12 1.61 3.76 -0.83 -4.67 115.29 115.74 1dwq s HIS 31 Ca 0.00 1.48 -0.12 0.00 -0.15 0.00 0.00 55.06 56.27 1dwq s HIS 31 Cb 0.00 -2.94 -0.05 0.00 1.11 0.00 0.00 32.58 30.70 1dwq s HIS 31 CO 0.00 -1.06 0.27 0.21 -0.85 0.00 0.00 174.74 173.31 1dwq s LYS 32 N -4.38 3.96 -0.07 1.40 2.20 0.42 -4.43 119.74 118.85 1dwq s LYS 32 Ca 0.61 0.09 0.05 0.00 -0.36 0.00 0.00 55.97 56.36 1dwq s LYS 32 Cb -0.15 -3.32 -0.00 0.00 -1.51 0.00 0.00 37.83 32.85 1dwq s LYS 32 CO 0.42 0.49 -0.22 0.08 -0.36 0.00 0.00 175.35 175.76 1dwq s VAL 33 N -0.29 1.87 -0.18 4.02 1.01 -1.26 -0.60 120.40 124.98 1dwq s VAL 33 Ca 0.17 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 1dwq s VAL 33 Cb -0.13 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.64 1dwq s VAL 33 CO 0.06 0.52 -0.14 -0.89 0.00 0.00 0.00 175.10 174.65 1dwq s THR 34 N 0.11 2.69 -0.23 3.92 2.01 -0.31 -4.96 115.64 118.87 1dwq s THR 34 Ca -0.10 -0.74 0.02 0.00 0.31 0.00 0.00 61.69 61.18 1dwq s THR 34 Cb -0.15 -2.16 0.04 0.00 0.01 0.00 0.00 72.50 70.24 1dwq s THR 34 CO 0.05 0.50 -0.14 0.00 -0.69 0.00 0.00 174.62 174.34 1dwq s ALA 35 N 1.12 2.50 0.17 7.40 0.00 -1.26 -0.77 121.76 130.91 1dwq s ALA 35 Ca 0.00 -1.52 0.05 0.00 0.00 0.00 0.00 51.96 50.49 1dwq s ALA 35 Cb -0.14 -1.45 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 1dwq s ALA 35 CO -0.04 -0.83 0.19 -0.51 0.00 0.00 0.00 175.76 174.56 1dwq s LEU 36 N 1.20 3.96 -0.12 0.00 1.43 -1.19 -4.84 118.68 119.13 1dwq s LEU 36 Ca -0.02 -0.06 -0.11 0.00 -1.03 0.00 0.00 54.13 52.91 1dwq s LEU 36 Cb -0.17 -2.55 -0.05 0.00 0.03 0.00 0.00 46.19 43.45 1dwq s LEU 36 CO -0.08 0.05 0.22 -1.81 0.23 0.00 0.00 176.35 174.96 1dwq s ASP 37 N -3.24 6.44 0.81 2.29 1.01 -1.26 -3.99 116.67 118.73 1dwq s ASP 37 Ca 0.32 0.52 -0.05 0.00 0.71 0.00 0.00 52.55 54.06 1dwq s ASP 37 Cb -0.10 -2.13 0.16 0.00 1.01 0.00 0.00 42.92 41.86 1dwq s ASP 37 CO 0.25 0.28 1.11 -0.04 0.21 0.00 0.00 175.17 176.98 1dwq s MET 38 N -0.42 1.24 0.45 8.23 -1.94 -1.26 -4.65 119.30 120.95 1dwq s MET 38 Ca 0.16 -1.02 -0.25 0.00 -1.71 0.00 0.00 55.69 52.86 1dwq s MET 38 Cb -0.13 -2.19 -0.09 0.00 2.01 0.00 0.00 34.83 34.44 1dwq s MET 38 CO 0.05 -1.82 1.39 0.00 -0.01 0.00 0.00 175.02 174.62 1dwq n ALA 39 N -3.15 1.85 -2.29 3.03 0.00 -0.74 -2.29 120.51 116.91 1dwq n ALA 39 Ca 0.16 0.25 -0.12 0.00 0.00 0.00 0.00 53.44 53.74 1dwq n ALA 39 Cb 0.60 -2.36 -0.01 0.00 0.00 0.00 0.00 19.45 17.68 1dwq n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dwq n ALA 40 N -0.24 -0.71 -2.44 0.00 0.00 -1.25 -4.95 120.51 110.92 1dwq n ALA 40 Ca 0.06 0.11 -0.20 0.00 0.00 0.00 0.00 53.44 53.40 1dwq n ALA 40 Cb 0.41 -1.42 -0.11 0.00 0.00 0.00 0.00 19.45 18.34 1dwq n ALA 40 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1dwq s SER 41 N -2.02 2.45 1.70 0.00 0.01 -0.97 -4.73 113.70 110.14 1dwq s SER 41 Ca 0.00 -0.87 0.00 0.00 1.31 0.00 0.00 55.95 56.39 1dwq s SER 41 Cb 0.00 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.10 1dwq s SER 41 CO 0.00 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.17 1dwq n GLY 42 N 0.25 3.68 1.51 3.44 0.00 -0.90 -1.34 105.19 111.83 1dwq n GLY 42 Ca -0.13 0.02 -0.01 0.00 0.00 0.00 0.00 46.02 45.89 1dwq n GLY 42 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1dwq n ILE 43 N 0.00 2.67 -1.88 -0.61 -5.35 -1.26 -4.98 119.36 107.95 1dwq n ILE 43 Ca 0.00 -1.93 -0.42 0.00 -0.27 0.00 0.00 62.75 60.13 1dwq n ILE 43 Cb 0.00 -0.32 -0.02 0.00 -1.74 0.00 0.00 39.64 37.56 1dwq n ILE 43 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1dwq s ASP 44 N -1.61 6.51 0.00 7.28 2.15 -0.45 -4.89 116.67 125.66 1dwq s ASP 44 Ca 0.49 2.77 0.21 0.00 0.43 0.00 0.00 52.55 56.46 1dwq s ASP 44 Cb 0.41 -2.62 1.04 0.00 -0.30 0.00 0.00 42.92 41.44 1dwq s ASP 44 CO 0.09 -0.83 1.69 -0.81 -0.17 0.00 0.00 175.17 175.14 1dwq n PRO 45 N 2.84 0.22 -2.51 4.34 -0.04 -1.26 -4.50 135.00 134.08 1dwq n PRO 45 Ca 0.10 0.10 -0.32 0.00 -0.04 0.00 0.00 63.50 63.33 1dwq n PRO 45 Cb 0.38 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.30 1dwq n PRO 45 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1dwq s ARG 46 N -2.70 4.01 0.18 0.54 0.52 -1.26 -5.01 118.95 115.23 1dwq s ARG 46 Ca 0.17 0.99 0.04 0.00 -0.52 0.00 0.00 55.73 56.41 1dwq s ARG 46 Cb 0.14 -2.15 -0.03 0.00 0.52 0.00 0.00 34.95 33.43 1dwq s ARG 46 CO 0.35 -0.21 0.27 -0.65 0.02 0.00 0.00 175.30 175.08 1dwq s GLN 47 N -3.85 3.33 0.56 3.54 -1.52 -1.26 -3.82 119.66 116.64 1dwq s GLN 47 Ca 0.60 -0.69 0.27 0.00 -1.95 0.00 0.00 55.36 53.58 1dwq s GLN 47 Cb -0.10 -2.88 1.64 0.00 -0.22 0.00 0.00 33.01 31.45 1dwq s GLN 47 CO 0.27 0.49 2.19 0.97 -0.25 0.00 0.00 175.29 178.96 1dwq h ILE 48 N 1.59 0.62 0.00 1.08 6.09 -1.90 -1.08 117.51 123.91 1dwq h ILE 48 Ca -0.49 -0.16 0.00 0.00 -1.37 0.00 0.00 64.86 62.84 1dwq h ILE 48 Cb 1.20 1.10 0.00 0.00 0.47 0.00 0.00 36.82 39.60 1dwq h ILE 48 CO 0.66 0.04 0.00 -0.62 -3.07 0.00 0.00 178.15 175.16 1dwq n GLU 49 N -3.89 0.03 -0.21 2.19 4.71 -1.26 -1.22 120.64 120.99 1dwq n GLU 49 Ca -0.03 0.15 0.11 0.00 -0.01 0.00 0.00 57.16 57.39 1dwq n GLU 49 Cb 0.13 -1.50 0.25 0.00 -1.01 0.00 0.00 31.44 29.31 1dwq n GLU 49 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1dwq n GLN 50 N -1.48 2.41 -3.66 3.49 0.00 -0.41 -4.89 117.38 112.85 1dwq n GLN 50 Ca 0.05 -2.15 -0.36 0.00 0.00 0.00 0.00 57.00 54.55 1dwq n GLN 50 Cb 0.23 -1.50 -0.08 0.00 0.00 0.00 0.00 30.24 28.89 1dwq n GLN 50 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1dwq s ILE 51 N -1.45 5.37 -1.41 -0.39 -1.09 -0.36 -4.99 121.20 116.88 1dwq s ILE 51 Ca 0.39 0.27 0.11 0.00 -2.23 0.00 0.00 60.65 59.19 1dwq s ILE 51 Cb 0.22 -3.52 0.09 0.00 -1.58 0.00 0.00 42.46 37.67 1dwq s ILE 51 CO 0.31 0.39 0.86 0.59 -1.23 0.00 0.00 174.94 175.85 1dwq n ASN 52 N 3.84 1.93 -3.69 3.58 4.13 -1.26 -5.00 115.26 118.79 1dwq n ASN 52 Ca -0.15 -1.47 -0.07 0.00 1.68 0.00 0.00 54.58 54.58 1dwq n ASN 52 Cb 0.52 0.01 -0.02 0.00 -1.54 0.00 0.00 39.78 38.75 1dwq n ASN 52 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1dwq s SER 53 N -0.95 -0.31 0.36 6.41 1.04 -1.26 -4.95 113.70 114.04 1dwq s SER 53 Ca 0.13 -0.33 0.11 0.00 0.48 0.00 0.00 55.95 56.33 1dwq s SER 53 Cb 0.09 0.57 0.69 0.00 0.10 0.00 0.00 66.02 67.48 1dwq s SER 53 CO 0.14 -1.02 1.83 0.15 0.98 0.00 0.00 173.24 175.32 1dwq h PHE 54 N 2.00 0.12 -0.39 5.02 3.04 -1.89 -0.28 116.94 124.56 1dwq h PHE 54 Ca -0.24 -0.02 -0.10 0.00 3.98 0.00 0.00 57.97 61.58 1dwq h PHE 54 Cb 1.25 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 39.72 1dwq h PHE 54 CO 0.35 0.42 -0.18 -0.44 -2.02 0.00 0.00 178.31 176.43 1dwq h ASP 55 N 0.10 0.75 -0.21 0.41 5.19 -1.97 -1.74 116.42 118.94 1dwq h ASP 55 Ca 0.01 -0.25 -0.14 0.00 -0.62 0.00 0.00 57.03 56.04 1dwq h ASP 55 Cb 0.61 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.91 1dwq h ASP 55 CO 0.04 0.93 -0.35 -0.33 -3.12 0.00 0.00 179.24 176.41 1dwq h GLU 56 N 0.66 0.74 -0.45 3.56 5.08 -1.68 -2.75 114.58 119.74 1dwq h GLU 56 Ca 0.10 -0.36 0.05 0.00 -1.00 0.00 0.00 59.36 58.16 1dwq h GLU 56 Cb 0.67 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1dwq h GLU 56 CO 0.05 0.98 0.30 -0.92 -1.00 0.00 0.00 179.01 178.42 1dwq h TYR 57 N 0.62 0.38 0.00 4.33 3.20 -0.81 -1.84 116.97 122.85 1dwq h TYR 57 Ca 0.06 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1dwq h TYR 57 Cb 0.89 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 39.03 1dwq h TYR 57 CO 0.05 0.21 0.00 0.43 -1.64 0.00 0.00 178.16 177.21 1dwq n SER 58 N -4.48 0.00 -0.15 -2.11 7.64 -0.68 -1.80 113.62 112.05 1dwq n SER 58 Ca 0.06 -0.71 -0.03 0.00 1.01 0.00 0.00 58.87 59.19 1dwq n SER 58 Cb 0.24 -0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.49 1dwq n SER 58 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1dwq h GLU 59 N 0.00 0.25 -0.93 1.43 4.22 -1.39 0.74 114.58 118.89 1dwq h GLU 59 Ca 0.00 -0.01 0.19 0.00 0.08 0.00 0.00 59.36 59.62 1dwq h GLU 59 Cb 0.00 -0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.12 1dwq h GLU 59 CO 0.00 0.16 0.60 -1.35 -2.18 0.00 0.00 179.01 176.25 1dwq h PRO 60 N 0.26 0.52 -0.12 0.92 0.11 -1.83 -0.52 132.00 131.35 1dwq h PRO 60 Ca 0.23 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.14 1dwq h PRO 60 Cb 0.28 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.28 1dwq h PRO 60 CO -0.28 0.35 -0.57 1.25 -0.21 0.00 0.00 178.00 178.53 1dwq h LEU 61 N 0.54 0.70 -0.96 2.35 5.85 -1.20 -2.62 115.31 119.98 1dwq h LEU 61 Ca 0.50 -0.64 -0.10 0.00 0.84 0.00 0.00 57.88 58.48 1dwq h LEU 61 Cb 1.05 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1dwq h LEU 61 CO -0.23 1.23 -0.38 -0.07 -0.34 0.00 0.00 178.44 178.65 1dwq h LEU 62 N 0.23 0.29 -0.24 2.25 3.38 -0.42 -1.20 115.31 119.60 1dwq h LEU 62 Ca -0.04 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 1dwq h LEU 62 Cb 1.21 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1dwq h LEU 62 CO 0.12 0.65 -0.14 0.74 0.09 0.00 0.00 178.44 179.89 1dwq h THR 63 N 0.24 1.31 0.11 0.22 2.02 -1.19 0.21 112.91 115.83 1dwq h THR 63 Ca 0.03 -1.24 0.01 0.00 0.77 0.00 0.00 66.41 65.98 1dwq h THR 63 Cb 0.78 1.60 -0.03 0.00 -1.74 0.00 0.00 68.15 68.76 1dwq h THR 63 CO 0.06 0.39 -0.20 0.15 0.37 0.00 0.00 175.52 176.29 1dwq h PHE 64 N 0.23 -0.51 -0.78 3.16 3.57 -1.30 -0.45 116.94 120.86 1dwq h PHE 64 Ca 0.05 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 1dwq h PHE 64 Cb 0.66 0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.57 1dwq h PHE 64 CO 0.07 -0.29 0.40 -0.07 -2.23 0.00 0.00 178.31 176.19 1dwq h LEU 65 N -0.38 0.99 -1.16 0.59 3.38 -1.15 -0.03 115.31 117.55 1dwq h LEU 65 Ca 0.02 -0.10 0.09 0.00 0.09 0.00 0.00 57.88 57.99 1dwq h LEU 65 Cb 0.39 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.83 1dwq h LEU 65 CO -0.10 0.81 0.59 -0.08 0.09 0.00 0.00 178.44 179.75 1dwq h GLU 66 N 1.10 0.92 -0.01 1.13 4.57 0.14 -2.22 114.58 120.21 1dwq h GLU 66 Ca 0.27 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.40 1dwq h GLU 66 Cb 0.06 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 28.45 1dwq h GLU 66 CO -0.04 0.61 -0.27 1.63 -1.18 0.00 0.00 179.01 179.76 1dwq n LYS 67 N -4.53 1.14 -1.67 1.92 5.02 -0.24 -4.92 118.16 114.87 1dwq n LYS 67 Ca 0.15 -0.77 -0.45 0.00 -2.02 0.00 0.00 58.31 55.22 1dwq n LYS 67 Cb 0.28 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.78 1dwq n LYS 67 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1dwq n LEU 68 N -0.26 3.14 -4.72 -0.35 4.77 -0.19 -4.87 117.00 114.52 1dwq n LEU 68 Ca 0.12 1.12 -0.40 0.00 -0.03 0.00 0.00 56.01 56.82 1dwq n LEU 68 Cb 0.40 -1.43 0.02 0.00 -2.33 0.00 0.00 43.42 40.07 1dwq n LEU 68 CO 0.25 -0.40 0.94 -2.65 -1.33 0.00 0.00 177.39 174.20 1dwq n PRO 69 N 2.53 2.00 -1.67 3.23 -0.02 -1.26 -4.84 135.00 134.96 1dwq n PRO 69 Ca 0.13 0.71 -0.46 0.00 -2.02 0.00 0.00 63.50 61.87 1dwq n PRO 69 Cb 0.31 -2.47 -0.04 0.00 -0.02 0.00 0.00 33.50 31.28 1dwq n PRO 69 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1dwq n GLN 70 N -0.11 2.21 -0.29 -0.52 7.27 -1.26 -0.58 117.38 124.10 1dwq n GLN 70 Ca 0.06 0.80 0.00 0.00 0.07 0.00 0.00 57.00 57.93 1dwq n GLN 70 Cb 0.41 -2.58 0.00 0.00 2.41 0.00 0.00 30.24 30.47 1dwq n GLN 70 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1dwq n GLY 71 N 3.53 1.30 3.84 1.69 0.00 -1.26 -5.04 105.19 109.25 1dwq n GLY 71 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1dwq n GLY 71 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dwq s GLU 72 N -0.41 4.04 0.03 1.61 2.02 0.25 -5.08 118.70 121.17 1dwq s GLU 72 Ca 0.00 0.63 0.03 0.00 0.02 0.00 0.00 54.97 55.65 1dwq s GLU 72 Cb 0.00 -2.70 -0.02 0.00 0.10 0.00 0.00 34.13 31.51 1dwq s GLU 72 CO 0.00 0.32 -0.09 0.15 0.02 0.00 0.00 175.26 175.65 1dwq s LYS 73 N -2.45 0.64 0.28 1.61 1.02 -1.26 -4.73 119.74 114.85 1dwq s LYS 73 Ca 0.46 -0.62 0.09 0.00 0.02 0.00 0.00 55.97 55.92 1dwq s LYS 73 Cb -0.13 -0.54 -0.06 0.00 -0.52 0.00 0.00 37.83 36.58 1dwq s LYS 73 CO 0.19 0.13 -0.13 0.14 -0.92 0.00 0.00 175.35 174.76 1dwq s VAL 74 N -0.90 2.09 -0.29 3.17 -7.23 0.41 -4.59 120.40 113.06 1dwq s VAL 74 Ca -0.03 -2.25 -0.08 0.00 -1.81 0.00 0.00 61.98 57.80 1dwq s VAL 74 Cb -0.07 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.47 1dwq s VAL 74 CO 0.01 -0.36 0.11 -0.63 -0.31 0.00 0.00 175.10 173.92 1dwq s ILE 75 N -2.73 4.30 -0.19 -0.62 1.01 -0.50 -0.33 121.20 122.14 1dwq s ILE 75 Ca 0.29 -0.47 -0.19 0.00 0.00 0.00 0.00 60.65 60.29 1dwq s ILE 75 Cb -0.00 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 1dwq s ILE 75 CO 0.13 0.13 0.53 -0.63 0.00 0.00 0.00 174.94 175.10 1dwq s ILE 76 N 1.57 5.11 -0.22 2.92 1.01 -0.82 -1.27 121.20 129.51 1dwq s ILE 76 Ca 0.04 0.98 -0.05 0.00 0.00 0.00 0.00 60.65 61.63 1dwq s ILE 76 Cb -0.17 -3.85 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 1dwq s ILE 76 CO 0.04 0.19 -0.01 -0.69 0.00 0.00 0.00 174.94 174.48 1dwq s VAL 77 N 1.50 3.74 -0.04 2.92 1.01 -0.44 0.29 120.40 129.39 1dwq s VAL 77 Ca 0.25 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.90 1dwq s VAL 77 Cb -0.15 -2.70 -0.01 0.00 0.00 0.00 0.00 36.38 33.52 1dwq s VAL 77 CO 0.10 0.41 -0.17 -0.83 0.00 0.00 0.00 175.10 174.61 1dwq s GLY 78 N 1.31 0.90 0.03 4.51 0.00 -0.01 0.19 107.32 114.24 1dwq s GLY 78 Ca 0.04 -0.70 0.02 0.00 0.00 0.00 0.00 44.72 44.08 1dwq s GLY 78 CO 0.00 -0.42 0.04 -1.83 0.00 0.00 0.00 173.10 170.90 1dwq s GLU 79 N -0.07 2.87 0.00 2.90 -1.05 -0.62 -1.20 118.70 121.53 1dwq s GLU 79 Ca -0.01 -0.61 0.00 0.00 -0.15 0.00 0.00 54.97 54.20 1dwq s GLU 79 Cb -0.10 -2.73 0.00 0.00 -0.44 0.00 0.00 34.13 30.86 1dwq s GLU 79 CO 0.01 0.61 0.00 0.45 0.95 0.00 0.00 175.26 177.28 1dwq n SER 80 N 1.03 0.00 0.00 0.83 2.88 -0.97 -3.95 113.62 113.44 1dwq n SER 80 Ca -0.12 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.42 1dwq n SER 80 Cb 0.52 -0.03 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 1dwq n SER 80 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1dwq n ALA 82 N 0.05 0.00 0.27 -1.46 0.00 -1.26 -0.53 120.51 117.58 1dwq n ALA 82 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1dwq n ALA 82 Cb 0.00 -0.38 0.75 0.00 0.00 0.00 0.00 19.45 19.82 1dwq n ALA 82 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1dwq h GLY 83 N 0.00 0.00 1.84 0.00 0.00 -1.79 0.60 103.07 103.72 1dwq h GLY 83 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 1dwq h GLY 83 CO 0.00 0.00 -0.61 1.41 0.00 0.00 0.00 176.54 177.34 1dwq h LEU 84 N 0.00 0.19 -0.36 3.11 3.38 -1.87 -2.55 115.31 117.21 1dwq h LEU 84 Ca -0.00 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.70 1dwq h LEU 84 Cb 0.22 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1dwq h LEU 84 CO 0.01 0.75 -0.42 0.78 0.09 0.00 0.00 178.44 179.65 1dwq h ASN 85 N 0.12 0.99 -0.33 -0.43 2.35 -1.30 -1.55 115.58 115.43 1dwq h ASN 85 Ca -0.01 -0.48 0.04 0.00 -0.55 0.00 0.00 56.30 55.30 1dwq h ASN 85 Cb 1.10 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 39.15 1dwq h ASN 85 CO 0.09 1.27 0.11 0.40 -1.65 0.00 0.00 177.43 177.65 1dwq h ILE 86 N 0.73 0.90 -0.67 2.81 2.04 -1.25 -0.89 117.51 121.17 1dwq h ILE 86 Ca 0.05 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 65.79 1dwq h ILE 86 Cb 1.02 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 1dwq h ILE 86 CO 0.10 0.05 0.28 0.00 0.00 0.00 0.00 178.15 178.58 1dwq h ALA 87 N 1.21 0.87 -0.56 1.87 0.00 -1.35 0.31 119.26 121.62 1dwq h ALA 87 Ca 0.15 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1dwq h ALA 87 Cb 0.12 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1dwq h ALA 87 CO -0.16 0.48 0.16 0.82 0.00 0.00 0.00 179.25 180.55 1dwq h ILE 88 N 0.95 1.24 -0.11 0.00 2.04 -1.13 -2.56 117.51 117.93 1dwq h ILE 88 Ca 0.23 -0.84 -0.20 0.00 1.00 0.00 0.00 64.86 65.05 1dwq h ILE 88 Cb 0.19 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1dwq h ILE 88 CO -0.02 0.31 -0.76 0.00 0.00 0.00 0.00 178.15 177.68 1dwq h ALA 89 N 1.03 0.46 -0.08 1.87 0.00 -0.74 -3.20 119.26 118.59 1dwq h ALA 89 Ca 0.18 -0.61 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 1dwq h ALA 89 Cb 0.31 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1dwq h ALA 89 CO -0.00 0.73 -0.42 0.00 0.00 0.00 0.00 179.25 179.55 1dwq h ALA 90 N 0.75 1.15 0.00 0.00 0.00 -0.34 -0.38 119.26 120.45 1dwq h ALA 90 Ca -0.04 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.40 1dwq h ALA 90 Cb 1.36 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1dwq h ALA 90 CO 0.14 0.58 -0.27 -0.44 0.00 0.00 0.00 179.25 179.26 1dwq h ASP 91 N 0.15 0.00 0.25 0.00 3.32 -1.47 -2.09 116.42 116.58 1dwq h ASP 91 Ca 0.01 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.73 1dwq h ASP 91 Cb 0.81 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.31 1dwq h ASP 91 CO 0.06 0.27 -1.97 0.54 -1.72 0.00 0.00 179.24 176.42 1dwq n ARG 92 N -3.71 0.69 -2.21 3.56 1.74 -0.87 -4.66 116.66 111.21 1dwq n ARG 92 Ca -0.01 0.23 -0.12 0.00 -0.77 0.00 0.00 57.85 57.18 1dwq n ARG 92 Cb 0.38 -1.70 0.04 0.00 -1.02 0.00 0.00 32.46 30.16 1dwq n ARG 92 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1dwq n TYR 93 N -3.18 1.88 -0.18 -1.55 4.02 -0.21 -4.94 117.16 113.00 1dwq n TYR 93 Ca -0.27 -2.06 0.28 0.00 -0.01 0.00 0.00 57.90 55.85 1dwq n TYR 93 Cb 1.06 -0.28 0.72 0.00 -0.02 0.00 0.00 39.34 40.82 1dwq n TYR 93 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 176.86 175.61 1dwq h VAL 94 N 3.61 0.55 -0.00 -0.72 3.04 -1.58 0.16 116.25 121.31 1dwq h VAL 94 Ca 0.13 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.82 1dwq h VAL 94 Cb 1.42 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 31.25 1dwq h VAL 94 CO 0.46 0.00 -0.00 0.47 -1.01 0.00 0.00 177.57 177.49 1dwq n ASP 95 N -4.26 0.35 -0.66 3.17 10.43 -1.26 -2.52 116.55 121.80 1dwq n ASP 95 Ca 0.18 -1.08 0.10 0.00 2.57 0.00 0.00 54.79 56.57 1dwq n ASP 95 Cb 0.96 -0.01 0.05 0.00 1.84 0.00 0.00 41.12 43.96 1dwq n ASP 95 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1dwq n LYS 96 N -0.74 1.66 -3.86 -1.24 5.02 0.57 -4.89 118.16 114.68 1dwq n LYS 96 Ca 0.22 -1.40 -0.36 0.00 -2.02 0.00 0.00 58.31 54.76 1dwq n LYS 96 Cb 0.17 -1.37 -0.13 0.00 -0.02 0.00 0.00 35.03 33.68 1dwq n LYS 96 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1dwq s ILE 97 N -1.83 3.28 0.20 -0.18 1.01 -1.05 -0.45 121.20 122.19 1dwq s ILE 97 Ca 0.20 -1.15 0.02 0.00 0.00 0.00 0.00 60.65 59.73 1dwq s ILE 97 Cb 0.16 -2.80 -0.09 0.00 0.01 0.00 0.00 42.46 39.73 1dwq s ILE 97 CO 0.33 -0.03 1.47 0.00 0.00 0.00 0.00 174.94 176.71 1dwq h ALA 98 N 8.09 0.68 -1.44 9.38 0.00 -0.98 -3.46 119.26 131.52 1dwq h ALA 98 Ca -0.26 -0.61 0.16 0.00 0.00 0.00 0.00 54.91 54.20 1dwq h ALA 98 Cb 1.09 -0.07 -0.23 0.00 0.00 0.00 0.00 17.79 18.57 1dwq h ALA 98 CO 0.57 0.79 0.72 0.00 0.00 0.00 0.00 179.25 181.32 1dwq s ALA 99 N -3.56 -2.01 -0.12 0.00 0.00 -1.24 -4.43 121.76 110.40 1dwq s ALA 99 Ca -0.04 1.65 -0.04 0.00 0.00 0.00 0.00 51.96 53.52 1dwq s ALA 99 Cb 0.11 -0.79 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 1dwq s ALA 99 CO 0.82 -0.36 0.04 0.20 0.00 0.00 0.00 175.76 176.46 1dwq s GLY 100 N -1.36 1.92 -0.10 0.00 0.00 -0.10 -1.94 107.32 105.74 1dwq s GLY 100 Ca 0.04 -0.76 0.04 0.00 0.00 0.00 0.00 44.72 44.04 1dwq s GLY 100 CO -0.03 -0.33 -0.22 0.14 0.00 0.00 0.00 173.10 172.65 1dwq s VAL 101 N -0.50 2.22 -0.30 1.40 1.01 0.15 -1.85 120.40 122.52 1dwq s VAL 101 Ca 0.10 -0.97 -0.07 0.00 0.00 0.00 0.00 61.98 61.04 1dwq s VAL 101 Cb -0.12 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.42 1dwq s VAL 101 CO 0.02 0.56 0.08 -0.36 0.00 0.00 0.00 175.10 175.40 1dwq s PHE 102 N 0.30 3.17 -0.47 5.22 0.40 0.16 -0.83 117.98 125.92 1dwq s PHE 102 Ca -0.17 -1.08 -0.10 0.00 -0.60 0.00 0.00 56.93 54.98 1dwq s PHE 102 Cb -0.17 -2.25 0.11 0.00 0.51 0.00 0.00 43.02 41.21 1dwq s PHE 102 CO 0.08 -0.61 0.35 -1.58 0.70 0.00 0.00 175.22 174.16 1dwq s HIS 103 N 1.48 3.38 -1.54 0.36 2.46 -0.34 -0.06 115.29 121.02 1dwq s HIS 103 Ca 0.02 -1.70 -0.04 0.00 0.47 0.00 0.00 55.06 53.80 1dwq s HIS 103 Cb -0.18 -3.41 0.04 0.00 -0.13 0.00 0.00 32.58 28.90 1dwq s HIS 103 CO 0.02 -0.96 0.27 0.09 -2.47 0.00 0.00 174.74 171.69 1dwq n ASN 104 N 4.96 -0.10 -4.44 9.88 3.02 0.03 -2.63 115.26 125.98 1dwq n ASN 104 Ca -0.09 -1.16 -0.27 0.00 -0.03 0.00 0.00 54.58 53.03 1dwq n ASN 104 Cb 0.41 -2.20 -0.11 0.00 -0.61 0.00 0.00 39.78 37.26 1dwq n ASN 104 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1dwq s SER 105 N -4.19 3.50 0.27 6.41 0.15 -1.26 -2.29 113.70 116.30 1dwq s SER 105 Ca 0.14 -0.86 -0.30 0.00 0.70 0.00 0.00 55.95 55.62 1dwq s SER 105 Cb -0.08 -0.29 -0.13 0.00 -1.71 0.00 0.00 66.02 63.82 1dwq s SER 105 CO 0.96 0.11 1.43 0.18 1.20 0.00 0.00 173.24 177.12 1dwq n LEU 106 N 0.17 3.53 -3.95 3.45 4.32 0.31 -4.88 117.00 119.95 1dwq n LEU 106 Ca -0.12 1.16 -0.30 0.00 -0.02 0.00 0.00 56.01 56.73 1dwq n LEU 106 Cb 0.56 -1.48 -0.13 0.00 -1.62 0.00 0.00 43.42 40.75 1dwq n LEU 106 CO 0.30 -0.32 -0.11 -0.22 -1.22 0.00 0.00 177.39 175.83 1dwq s LEU 107 N -0.29 4.56 1.10 2.23 2.96 -1.26 -3.95 118.68 124.04 1dwq s LEU 107 Ca 0.65 -3.30 -0.12 0.00 -0.22 0.00 0.00 54.13 51.14 1dwq s LEU 107 Cb -0.59 -1.66 0.25 0.00 0.50 0.00 0.00 46.19 44.69 1dwq s LEU 107 CO 0.52 -0.19 1.05 -2.84 -1.32 0.00 0.00 176.35 173.57 1dwq s PRO 108 N -0.68 -0.46 0.10 0.98 0.02 -1.26 -4.93 135.00 128.77 1dwq s PRO 108 Ca 0.20 0.94 0.01 0.00 0.02 0.00 0.00 61.00 62.17 1dwq s PRO 108 Cb -0.18 -1.60 -0.01 0.00 0.02 0.00 0.00 34.50 32.73 1dwq s PRO 108 CO -0.06 -3.44 0.05 -0.40 -0.33 0.00 0.00 177.00 172.82 1dwq n ASP 109 N -4.73 0.60 -0.01 2.53 5.68 -1.26 -5.03 116.55 114.34 1dwq n ASP 109 Ca 0.05 -1.56 0.09 0.00 -0.50 0.00 0.00 54.79 52.87 1dwq n ASP 109 Cb 0.54 0.32 -0.13 0.00 -1.14 0.00 0.00 41.12 40.71 1dwq n ASP 109 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1dwq n THR 110 N -0.21 0.00 0.40 2.12 -2.24 -1.26 -4.26 114.28 108.82 1dwq n THR 110 Ca -0.00 -0.34 0.12 0.00 -2.27 0.00 0.00 64.05 61.55 1dwq n THR 110 Cb 0.16 0.29 0.08 0.00 -2.10 0.00 0.00 70.33 68.76 1dwq n THR 110 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1dwq h VAL 111 N 0.00 0.00 -1.63 2.28 -1.51 -1.98 -3.41 116.25 110.01 1dwq h VAL 111 Ca 0.00 -0.68 -0.57 0.00 -1.23 0.00 0.00 66.70 64.22 1dwq h VAL 111 Cb 0.75 1.18 -0.09 0.00 -2.13 0.00 0.00 31.29 31.00 1dwq h VAL 111 CO 0.00 0.00 -0.51 -1.00 -1.23 0.00 0.00 177.57 174.83 1dwq s HIS 112 N -3.25 2.60 0.51 5.19 3.76 -1.26 -5.10 115.29 117.75 1dwq s HIS 112 Ca 0.03 -0.58 -0.20 0.00 -0.15 0.00 0.00 55.06 54.16 1dwq s HIS 112 Cb 0.12 -1.91 -0.09 0.00 1.11 0.00 0.00 32.58 31.81 1dwq s HIS 112 CO 0.76 0.23 0.73 0.45 -0.85 0.00 0.00 174.74 176.05 1dwq n SER 113 N -1.20 -0.13 -0.40 1.40 2.88 -1.26 -4.72 113.62 110.20 1dwq n SER 113 Ca -0.02 0.85 0.36 0.00 -1.33 0.00 0.00 58.87 58.73 1dwq n SER 113 Cb 0.64 -1.25 0.63 0.00 -0.75 0.00 0.00 64.21 63.49 1dwq n SER 113 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1dwq h PRO 114 N 0.69 0.02 0.00 -1.46 0.11 -1.77 -1.77 132.00 127.82 1dwq h PRO 114 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1dwq h PRO 114 Cb 1.38 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.48 1dwq h PRO 114 CO 0.51 0.01 0.00 -1.13 -0.21 0.00 0.00 178.00 177.18 1dwq n SER 115 N -4.99 0.00 -0.24 -2.05 3.41 -1.25 -4.37 113.62 104.13 1dwq n SER 115 Ca 0.39 -0.84 -0.01 0.00 -0.26 0.00 0.00 58.87 58.15 1dwq n SER 115 Cb 1.41 -0.04 0.11 0.00 -0.26 0.00 0.00 64.21 65.43 1dwq n SER 115 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1dwq h TYR 116 N 0.00 0.72 0.00 7.33 3.20 -1.66 -0.64 116.97 125.91 1dwq h TYR 116 Ca 0.00 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 1dwq h TYR 116 Cb 0.04 -0.22 -0.00 0.00 1.54 0.00 0.00 36.73 38.08 1dwq h TYR 116 CO 0.00 0.34 -0.14 1.79 -1.64 0.00 0.00 178.16 178.51 1dwq h THR 117 N 0.71 0.27 -0.28 1.81 1.35 -1.83 -1.43 112.91 113.51 1dwq h THR 117 Ca 0.31 -1.17 -0.06 0.00 -0.55 0.00 0.00 66.41 64.93 1dwq h THR 117 Cb 0.20 1.95 -0.01 0.00 -1.73 0.00 0.00 68.15 68.56 1dwq h THR 117 CO -0.19 0.14 -0.08 0.58 -0.25 0.00 0.00 175.52 175.72 1dwq h VAL 118 N 0.00 1.29 0.00 6.82 2.07 -1.45 0.83 116.25 125.81 1dwq h VAL 118 Ca -0.00 -1.12 0.01 0.00 0.82 0.00 0.00 66.70 66.41 1dwq h VAL 118 Cb 0.94 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1dwq h VAL 118 CO 0.02 0.35 -0.06 -0.33 0.02 0.00 0.00 177.57 177.58 1dwq h GLU 119 N 0.29 -0.10 -0.42 1.57 5.08 -1.07 -1.51 114.58 118.42 1dwq h GLU 119 Ca 0.07 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1dwq h GLU 119 Cb 0.57 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 1dwq h GLU 119 CO 0.03 -0.07 0.10 0.87 -1.00 0.00 0.00 179.01 178.94 1dwq h LYS 120 N -0.10 0.68 -0.68 2.33 1.79 -1.01 -2.45 116.57 117.12 1dwq h LYS 120 Ca 0.02 -0.17 0.03 0.00 -2.18 0.00 0.00 60.65 58.35 1dwq h LYS 120 Cb 0.13 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 30.65 1dwq h LYS 120 CO -0.06 0.69 0.43 1.25 -1.08 0.00 0.00 179.45 180.68 1dwq h LEU 121 N 0.55 0.70 -1.73 2.94 5.85 -0.63 -2.01 115.31 120.98 1dwq h LEU 121 Ca 0.13 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1dwq h LEU 121 Cb 0.32 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 1dwq h LEU 121 CO 0.00 0.49 -0.13 -0.07 -0.34 0.00 0.00 178.44 178.39 1dwq h LEU 122 N 0.84 0.00 -0.28 2.25 3.38 -1.11 0.54 115.31 120.93 1dwq h LEU 122 Ca 0.27 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.12 1dwq h LEU 122 Cb 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1dwq h LEU 122 CO -0.10 0.13 -0.31 -0.08 0.09 0.00 0.00 178.44 178.17 1dwq h GLU 123 N 0.00 0.71 -0.05 1.13 4.81 -0.98 -2.45 114.58 117.75 1dwq h GLU 123 Ca -0.00 -0.39 -0.14 0.00 -0.13 0.00 0.00 59.36 58.71 1dwq h GLU 123 Cb 0.44 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1dwq h GLU 123 CO 0.02 1.00 -0.59 0.66 -0.73 0.00 0.00 179.01 179.37 1dwq h SER 124 N 0.45 0.17 -2.25 1.04 4.64 -0.37 -3.39 113.55 113.83 1dwq h SER 124 Ca 0.04 -0.10 -0.54 0.00 -0.47 0.00 0.00 61.79 60.72 1dwq h SER 124 Cb 0.89 -0.05 -0.36 0.00 -0.31 0.00 0.00 62.40 62.57 1dwq h SER 124 CO 0.08 0.72 -0.91 0.12 -0.87 0.00 0.00 176.83 175.97 1dwq s PHE 125 N -3.74 0.76 -0.65 4.77 5.36 0.17 -4.95 117.98 119.71 1dwq s PHE 125 Ca -0.03 -2.06 0.24 0.00 -0.96 0.00 0.00 56.93 54.13 1dwq s PHE 125 Cb 0.12 -0.79 0.38 0.00 -0.34 0.00 0.00 43.02 42.40 1dwq s PHE 125 CO 0.78 -0.87 1.36 -0.35 -1.46 0.00 0.00 175.22 174.68 1dwq n PRO 126 N 3.02 0.29 -3.98 10.12 -0.04 -0.92 -4.44 135.00 139.04 1dwq n PRO 126 Ca 0.26 0.10 -0.33 0.00 -0.04 0.00 0.00 63.50 63.49 1dwq n PRO 126 Cb 0.47 -1.70 -0.14 0.00 -0.04 0.00 0.00 33.50 32.10 1dwq n PRO 126 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1dwq s ASP 127 N -4.25 4.72 -0.24 3.54 3.68 -1.26 -4.91 116.67 117.95 1dwq s ASP 127 Ca 0.07 -1.47 0.07 0.00 2.13 0.00 0.00 52.55 53.35 1dwq s ASP 127 Cb 0.13 -1.65 0.56 0.00 -1.45 0.00 0.00 42.92 40.52 1dwq s ASP 127 CO 0.71 -0.26 1.53 0.79 0.13 0.00 0.00 175.17 178.07 1dwq n TRP 128 N 4.50 1.85 0.00 -5.34 7.02 -1.26 -4.99 117.44 119.22 1dwq n TRP 128 Ca -0.11 -0.94 0.00 0.00 -1.02 0.00 0.00 57.50 55.43 1dwq n TRP 128 Cb 0.43 -0.56 0.00 0.00 -2.42 0.00 0.00 31.31 28.76 1dwq n TRP 128 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1dwq n ARG 129 N -0.03 0.00 -0.00 -0.99 1.74 -1.26 -1.82 116.66 114.29 1dwq n ARG 129 Ca 0.30 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.40 1dwq n ARG 129 Cb 1.13 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 32.65 1dwq n ARG 129 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1dwq n ASP 130 N 10.38 0.05 -4.78 0.55 5.75 -1.26 -4.94 116.55 122.31 1dwq n ASP 130 Ca 0.00 -1.92 -0.41 0.00 -0.01 0.00 0.00 54.79 52.45 1dwq n ASP 130 Cb 0.00 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1dwq n ASP 130 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1dwq s THR 131 N -1.99 2.00 0.13 2.12 2.01 -0.76 -4.01 115.64 115.16 1dwq s THR 131 Ca 0.05 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.11 1dwq s THR 131 Cb 0.02 -3.00 -0.04 0.00 0.01 0.00 0.00 72.50 69.49 1dwq s THR 131 CO 0.03 0.00 -0.02 -1.61 -0.69 0.00 0.00 174.62 172.33 1dwq s GLU 132 N -2.15 2.39 0.15 4.92 2.02 -0.02 -4.87 118.70 121.15 1dwq s GLU 132 Ca 0.54 -1.01 0.09 0.00 0.02 0.00 0.00 54.97 54.61 1dwq s GLU 132 Cb -0.47 -2.40 -0.04 0.00 0.10 0.00 0.00 34.13 31.32 1dwq s GLU 132 CO 0.63 0.49 -0.21 0.71 0.02 0.00 0.00 175.26 176.91 1dwq s TYR 133 N -1.49 1.93 0.24 1.61 1.51 -1.26 -0.23 117.35 119.66 1dwq s TYR 133 Ca 0.26 -0.43 -0.07 0.00 -1.01 0.00 0.00 57.07 55.82 1dwq s TYR 133 Cb -0.10 -0.99 -0.02 0.00 -0.11 0.00 0.00 41.96 40.74 1dwq s TYR 133 CO 0.17 0.33 0.33 -0.06 -1.11 0.00 0.00 175.55 175.22 1dwq s PHE 134 N -1.68 0.75 0.04 2.71 0.40 0.02 -4.96 117.98 115.25 1dwq s PHE 134 Ca 0.14 -1.04 -0.01 0.00 -0.60 0.00 0.00 56.93 55.42 1dwq s PHE 134 Cb -0.08 -0.14 -0.03 0.00 0.51 0.00 0.00 43.02 43.28 1dwq s PHE 134 CO 0.07 -0.86 -0.02 0.95 0.70 0.00 0.00 175.22 176.06 1dwq s THR 135 N -4.01 0.17 0.13 0.64 -4.23 -1.26 -0.68 115.64 106.40 1dwq s THR 135 Ca 0.30 -1.39 -0.02 0.00 -1.18 0.00 0.00 61.69 59.40 1dwq s THR 135 Cb 0.02 -0.96 -0.04 0.00 1.34 0.00 0.00 72.50 72.87 1dwq s THR 135 CO 0.11 -0.76 0.09 0.72 -0.54 0.00 0.00 174.62 174.23 1dwq s PHE 136 N -2.83 0.79 -0.15 3.99 -0.12 -0.54 -4.94 117.98 114.19 1dwq s PHE 136 Ca -0.03 -1.17 -0.12 0.00 -0.05 0.00 0.00 56.93 55.56 1dwq s PHE 136 Cb 0.00 -0.42 -0.05 0.00 -0.63 0.00 0.00 43.02 41.92 1dwq s PHE 136 CO -0.06 -0.55 0.25 0.99 -0.05 0.00 0.00 175.22 175.80 1dwq s THR 137 N -4.04 5.33 0.43 -4.49 2.01 -1.26 0.66 115.64 114.29 1dwq s THR 137 Ca 0.23 0.45 -0.04 0.00 0.31 0.00 0.00 61.69 62.64 1dwq s THR 137 Cb 0.07 -3.57 0.09 0.00 0.01 0.00 0.00 72.50 69.10 1dwq s THR 137 CO 0.01 0.45 0.59 -0.46 -0.69 0.00 0.00 174.62 174.52 1dwq n ASN 138 N 3.15 0.35 0.13 3.53 0.23 0.25 -4.85 115.26 118.05 1dwq n ASN 138 Ca -0.14 -1.40 0.12 0.00 -0.53 0.00 0.00 54.58 52.64 1dwq n ASN 138 Cb 0.52 -0.42 0.47 0.00 -2.08 0.00 0.00 39.78 38.27 1dwq n ASN 138 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 1dwq n ILE 139 N -2.54 0.75 -0.32 1.53 -5.35 -1.26 -0.95 119.36 111.22 1dwq n ILE 139 Ca 0.08 0.05 0.10 0.00 -0.27 0.00 0.00 62.75 62.71 1dwq n ILE 139 Cb 0.29 -0.97 0.27 0.00 -1.74 0.00 0.00 39.64 37.49 1dwq n ILE 139 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1dwq n THR 140 N -2.29 1.03 0.00 7.28 -2.24 -1.26 -4.95 114.28 111.84 1dwq n THR 140 Ca 0.03 -1.01 0.00 0.00 -2.27 0.00 0.00 64.05 60.80 1dwq n THR 140 Cb 0.30 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 1dwq n THR 140 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dwq n GLY 141 N 1.27 0.26 3.78 3.38 0.00 -0.12 -5.06 105.19 108.69 1dwq n GLY 141 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1dwq n GLY 141 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dwq s GLU 142 N -0.97 3.26 -0.32 1.61 8.01 -1.26 -4.63 118.70 124.40 1dwq s GLU 142 Ca 0.00 1.45 -0.16 0.00 0.01 0.00 0.00 54.97 56.27 1dwq s GLU 142 Cb 0.00 -2.01 -0.02 0.00 -4.31 0.00 0.00 34.13 27.79 1dwq s GLU 142 CO 0.00 -0.89 0.40 0.99 0.01 0.00 0.00 175.26 175.77 1dwq s THR 143 N -2.06 5.13 -0.12 3.63 2.01 -1.26 0.86 115.64 123.83 1dwq s THR 143 Ca 0.69 0.29 -0.07 0.00 0.31 0.00 0.00 61.69 62.91 1dwq s THR 143 Cb -0.21 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 1dwq s THR 143 CO 0.31 -0.04 0.15 -0.63 -0.69 0.00 0.00 174.62 173.72 1dwq s ILE 144 N 2.12 5.49 -0.19 1.82 -1.09 0.21 -4.92 121.20 124.64 1dwq s ILE 144 Ca 0.14 0.23 -0.09 0.00 -2.23 0.00 0.00 60.65 58.71 1dwq s ILE 144 Cb -0.16 -3.41 -0.05 0.00 -1.58 0.00 0.00 42.46 37.26 1dwq s ILE 144 CO 0.11 0.61 0.10 -0.89 -1.23 0.00 0.00 174.94 173.64 1dwq s THR 145 N -0.96 5.08 0.27 2.92 2.01 -1.26 -1.47 115.64 122.24 1dwq s THR 145 Ca 0.15 0.07 0.08 0.00 0.31 0.00 0.00 61.69 62.30 1dwq s THR 145 Cb -0.12 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 1dwq s THR 145 CO 0.04 0.44 0.16 0.42 -0.69 0.00 0.00 174.62 174.99 1dwq s THR 146 N 0.42 4.08 0.11 -0.82 -4.23 0.15 -4.37 115.64 110.97 1dwq s THR 146 Ca 0.05 -1.53 0.03 0.00 -1.18 0.00 0.00 61.69 59.07 1dwq s THR 146 Cb -0.12 -3.24 -0.04 0.00 1.34 0.00 0.00 72.50 70.44 1dwq s THR 146 CO -0.00 -0.33 -0.08 0.00 -0.54 0.00 0.00 174.62 173.66 1dwq s MET 147 N -3.82 0.91 -0.20 3.99 0.23 -0.24 -0.80 119.30 119.36 1dwq s MET 147 Ca 0.34 -1.36 0.01 0.00 -1.03 0.00 0.00 55.69 53.65 1dwq s MET 147 Cb -0.07 -0.37 0.04 0.00 -1.53 0.00 0.00 34.83 32.90 1dwq s MET 147 CO 0.24 0.02 -0.12 0.21 -2.03 0.00 0.00 175.02 173.34 1dwq s LYS 148 N -3.73 2.18 0.35 3.16 2.20 0.67 -2.10 119.74 122.48 1dwq s LYS 148 Ca 0.13 -0.89 -0.28 0.00 -0.36 0.00 0.00 55.97 54.57 1dwq s LYS 148 Cb 0.04 -2.47 -0.10 0.00 -1.51 0.00 0.00 37.83 33.79 1dwq s LYS 148 CO -0.03 -0.41 1.28 -0.51 -0.36 0.00 0.00 175.35 175.33 1dwq s LEU 149 N 1.35 4.37 0.35 5.43 1.43 -1.26 -0.84 118.68 129.52 1dwq s LEU 149 Ca -0.01 2.63 -0.20 0.00 -1.03 0.00 0.00 54.13 55.52 1dwq s LEU 149 Cb -0.16 -3.73 -0.10 0.00 0.03 0.00 0.00 46.19 42.23 1dwq s LEU 149 CO -0.08 -0.59 0.85 -0.83 0.23 0.00 0.00 176.35 175.93 1dwq s GLY 150 N -0.61 2.46 0.37 -3.19 0.00 -1.26 -4.83 107.32 100.26 1dwq s GLY 150 Ca 0.51 0.28 0.16 0.00 0.00 0.00 0.00 44.72 45.67 1dwq s GLY 150 CO 0.50 0.57 1.77 0.74 0.00 0.00 0.00 173.10 176.68 1dwq h PHE 151 N 2.40 0.00 -0.28 1.90 0.04 -1.94 0.28 116.94 119.34 1dwq h PHE 151 Ca -0.48 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.12 1dwq h PHE 151 Cb 1.18 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.33 1dwq h PHE 151 CO 0.62 0.40 -0.47 0.28 -0.60 0.00 0.00 178.31 178.53 1dwq h VAL 152 N 0.00 1.29 -0.20 -0.55 2.07 -1.94 0.18 116.25 117.09 1dwq h VAL 152 Ca -0.00 -1.66 -0.00 0.00 0.82 0.00 0.00 66.70 65.85 1dwq h VAL 152 Cb 0.80 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 1dwq h VAL 152 CO 0.05 0.54 0.11 0.25 0.02 0.00 0.00 177.57 178.54 1dwq h LEU 153 N 0.59 0.25 -0.16 2.57 5.85 -1.60 0.28 115.31 123.10 1dwq h LEU 153 Ca 0.02 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.70 1dwq h LEU 153 Cb 1.07 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 1dwq h LEU 153 CO 0.11 0.26 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.30 1dwq h LEU 154 N 0.23 -0.30 -0.31 2.25 4.07 -0.46 0.39 115.31 121.19 1dwq h LEU 154 Ca 0.07 0.07 -0.07 0.00 0.08 0.00 0.00 57.88 58.03 1dwq h LEU 154 Cb 0.06 0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.95 1dwq h LEU 154 CO -0.01 -0.12 -0.07 -0.09 -1.08 0.00 0.00 178.44 177.07 1dwq h ARG 155 N -0.08 0.59 0.03 1.13 9.65 -0.16 -1.20 114.38 124.32 1dwq h ARG 155 Ca 0.09 -0.22 -0.35 0.00 -1.10 0.00 0.00 59.98 58.40 1dwq h ARG 155 Cb 0.22 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.71 1dwq h ARG 155 CO -0.21 0.78 -2.11 0.39 2.80 0.00 0.00 179.97 181.62 1dwq n GLU 156 N -4.47 0.68 -0.11 0.20 1.02 0.95 -3.20 120.64 115.71 1dwq n GLU 156 Ca -0.03 0.18 -0.22 0.00 -0.02 0.00 0.00 57.16 57.07 1dwq n GLU 156 Cb 0.32 -1.65 -0.12 0.00 -0.02 0.00 0.00 31.44 29.97 1dwq n GLU 156 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1dwq n ASN 157 N -3.11 1.99 -0.10 1.62 4.13 0.14 -4.27 115.26 115.66 1dwq n ASN 157 Ca -0.30 0.13 -0.19 0.00 1.68 0.00 0.00 54.58 55.89 1dwq n ASN 157 Cb 1.07 -0.67 -0.09 0.00 -1.54 0.00 0.00 39.78 38.54 1dwq n ASN 157 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1dwq n LEU 158 N -3.72 1.87 -2.20 3.41 4.32 -1.06 -3.65 117.00 115.96 1dwq n LEU 158 Ca -0.44 0.45 -0.25 0.00 -0.02 0.00 0.00 56.01 55.74 1dwq n LEU 158 Cb 0.94 -0.92 0.16 0.00 -1.62 0.00 0.00 43.42 41.97 1dwq n LEU 158 CO 0.22 0.17 1.29 0.49 -1.22 0.00 0.00 177.39 178.33 1dwq n PHE 159 N -4.44 2.98 -0.30 -1.77 3.01 -0.46 -3.17 117.46 113.31 1dwq n PHE 159 Ca -0.30 -1.99 0.01 0.00 1.01 0.00 0.00 57.45 56.18 1dwq n PHE 159 Cb 0.63 -1.01 0.08 0.00 -0.01 0.00 0.00 39.48 39.17 1dwq n PHE 159 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1dwq h THR 160 N 0.97 0.12 -0.39 4.37 2.02 -1.73 -0.57 112.91 117.70 1dwq h THR 160 Ca 0.61 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.79 1dwq h THR 160 Cb 2.46 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 68.99 1dwq h THR 160 CO 1.14 0.00 0.00 0.29 0.37 0.00 0.00 175.52 177.32 1dwq n LYS 161 N -5.52 3.12 -2.89 6.66 4.76 -1.26 -4.92 118.16 118.10 1dwq n LYS 161 Ca 0.11 -2.55 -0.34 0.00 -2.87 0.00 0.00 58.31 52.66 1dwq n LYS 161 Cb 0.41 -1.63 -0.07 0.00 -1.84 0.00 0.00 35.03 31.90 1dwq n LYS 161 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1dwq n THR 163 N -0.15 1.96 -0.22 0.00 -1.04 -1.26 -4.76 114.28 108.80 1dwq n THR 163 Ca 0.04 -0.46 -0.00 0.00 -2.04 0.00 0.00 64.05 61.59 1dwq n THR 163 Cb 0.53 -0.66 0.22 0.00 -1.82 0.00 0.00 70.33 68.59 1dwq n THR 163 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1dwq h ASP 164 N -0.02 0.89 0.59 8.00 3.45 -1.97 0.55 116.42 127.89 1dwq h ASP 164 Ca -0.45 -0.04 -0.08 0.00 0.43 0.00 0.00 57.03 56.88 1dwq h ASP 164 Cb 1.38 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.91 1dwq h ASP 164 CO 0.45 0.67 -0.40 1.23 -1.57 0.00 0.00 179.24 179.61 1dwq h GLY 165 N 1.05 0.00 0.77 2.75 0.00 -1.98 -0.45 103.07 105.20 1dwq h GLY 165 Ca 0.27 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.46 1dwq h GLY 165 CO -0.05 0.00 -0.54 0.83 0.00 0.00 0.00 176.54 176.78 1dwq h GLU 166 N 0.00 0.41 -0.36 4.80 4.39 -1.70 -1.46 114.58 120.66 1dwq h GLU 166 Ca -0.00 -0.40 -0.01 0.00 0.34 0.00 0.00 59.36 59.28 1dwq h GLU 166 Cb 0.81 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.55 1dwq h GLU 166 CO 0.05 1.06 0.20 -0.92 -1.16 0.00 0.00 179.01 178.24 1dwq h TYR 167 N -0.10 0.50 -0.86 4.33 3.20 -0.86 -0.87 116.97 122.31 1dwq h TYR 167 Ca -0.06 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.77 1dwq h TYR 167 Cb 1.23 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 39.30 1dwq h TYR 167 CO 0.14 0.40 0.44 1.49 -1.64 0.00 0.00 178.16 179.00 1dwq h GLU 168 N 0.46 1.22 -0.18 1.82 4.57 -1.15 -2.13 114.58 119.20 1dwq h GLU 168 Ca 0.13 -0.16 0.05 0.00 -1.18 0.00 0.00 59.36 58.19 1dwq h GLU 168 Cb 0.07 -0.23 -0.05 0.00 -0.16 0.00 0.00 28.75 28.38 1dwq h GLU 168 CO -0.02 0.92 -0.16 1.25 -1.18 0.00 0.00 179.01 179.82 1dwq h LEU 169 N 1.22 -0.51 -0.44 1.64 6.46 -0.59 -2.00 115.31 121.09 1dwq h LEU 169 Ca 0.30 0.10 0.09 0.00 -0.12 0.00 0.00 57.88 58.25 1dwq h LEU 169 Cb 0.08 0.25 -0.09 0.00 -0.73 0.00 0.00 40.66 40.17 1dwq h LEU 169 CO -0.04 -0.20 -0.16 0.00 -0.62 0.00 0.00 178.44 177.41 1dwq h ALA 170 N 0.91 0.19 -0.54 1.25 0.00 -0.75 -0.06 119.26 120.27 1dwq h ALA 170 Ca 0.11 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1dwq h ALA 170 Cb 0.34 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1dwq h ALA 170 CO -0.28 -0.51 0.29 0.87 0.00 0.00 0.00 179.25 179.62 1dwq h LYS 171 N -0.07 0.74 0.00 0.00 1.57 -1.18 -1.69 116.57 115.94 1dwq h LYS 171 Ca 0.21 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 1dwq h LYS 171 Cb 0.40 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 1dwq h LYS 171 CO -0.49 0.55 -0.10 0.52 -0.57 0.00 0.00 179.45 179.36 1dwq h MET 172 N 0.75 0.00 0.00 3.15 2.86 -0.27 -3.34 114.93 118.08 1dwq h MET 172 Ca 0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1dwq h MET 172 Cb 0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.69 1dwq h MET 172 CO -0.03 0.10 0.00 1.33 1.06 0.00 0.00 176.91 179.37 1dwq n VAL 173 N -3.22 0.08 -2.12 -2.22 0.24 -0.84 -5.06 118.33 105.19 1dwq n VAL 173 Ca 0.01 -0.35 -0.40 0.00 -2.04 0.00 0.00 64.34 61.56 1dwq n VAL 173 Cb 0.38 1.29 -0.02 0.00 -1.47 0.00 0.00 33.84 34.02 1dwq n VAL 173 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 1dwq s MET 174 N -0.08 4.21 0.35 7.34 0.00 -0.66 -4.71 119.30 125.75 1dwq s MET 174 Ca 0.00 2.15 0.03 0.00 0.00 0.00 0.00 55.69 57.87 1dwq s MET 174 Cb 0.00 -2.94 -0.04 0.00 0.00 0.00 0.00 34.83 31.85 1dwq s MET 174 CO 0.00 -0.28 0.11 1.03 0.00 0.00 0.00 175.02 175.88 1dwq s ARG 175 N -1.97 1.72 0.64 4.11 0.52 -0.62 -5.04 118.95 118.31 1dwq s ARG 175 Ca 0.52 -2.00 -0.13 0.00 -0.52 0.00 0.00 55.73 53.59 1dwq s ARG 175 Cb -0.38 -0.53 -0.02 0.00 0.52 0.00 0.00 34.95 34.54 1dwq s ARG 175 CO 0.50 -0.37 1.06 0.15 0.02 0.00 0.00 175.30 176.65 1dwq s LYS 176 N -3.82 3.14 0.25 3.54 1.02 -1.26 -4.31 119.74 118.29 1dwq s LYS 176 Ca 0.31 1.09 -0.02 0.00 0.02 0.00 0.00 55.97 57.37 1dwq s LYS 176 Cb 0.05 -2.01 0.01 0.00 -0.52 0.00 0.00 37.83 35.36 1dwq s LYS 176 CO 0.15 -0.95 0.35 0.41 -0.92 0.00 0.00 175.35 174.40 1dwq n GLY 177 N -1.45 2.36 3.40 -3.33 0.00 -0.89 -4.16 105.19 101.13 1dwq n GLY 177 Ca 0.08 -1.53 -0.16 0.00 0.00 0.00 0.00 46.02 44.41 1dwq n GLY 177 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dwq s SER 178 N -2.53 -0.46 0.09 1.61 0.15 -1.26 -1.08 113.70 110.20 1dwq s SER 178 Ca 0.20 0.48 0.25 0.00 0.70 0.00 0.00 55.95 57.58 1dwq s SER 178 Cb -0.01 0.48 0.45 0.00 -1.71 0.00 0.00 66.02 65.23 1dwq s SER 178 CO 0.14 -0.52 1.39 0.18 1.20 0.00 0.00 173.24 175.64 1dwq n LEU 179 N 1.17 0.61 -4.24 3.45 4.77 -1.26 -4.95 117.00 116.55 1dwq n LEU 179 Ca -0.20 0.20 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 1dwq n LEU 179 Cb 0.57 -0.22 -0.04 0.00 -2.33 0.00 0.00 43.42 41.40 1dwq n LEU 179 CO 0.22 -0.01 -0.05 0.49 -1.33 0.00 0.00 177.39 176.71 1dwq n PHE 180 N -1.93 -1.64 -0.02 -1.77 3.01 -1.26 -4.84 117.46 109.01 1dwq n PHE 180 Ca 0.04 0.76 -0.10 0.00 1.01 0.00 0.00 57.45 59.15 1dwq n PHE 180 Cb 0.41 -2.71 -0.04 0.00 -0.01 0.00 0.00 39.48 37.13 1dwq n PHE 180 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 1dwq h GLN 181 N -1.34 0.19 0.00 -1.08 4.15 -1.93 0.18 115.11 115.27 1dwq h GLN 181 Ca -0.58 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 58.81 1dwq h GLN 181 Cb 1.38 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 29.02 1dwq h GLN 181 CO 0.79 0.12 -0.08 -2.95 -1.93 0.00 0.00 178.83 174.78 1dwq h ASN 182 N 0.19 0.00 0.25 -0.69 -0.00 -1.94 0.14 115.58 113.54 1dwq h ASN 182 Ca 0.05 0.00 -0.34 0.00 -0.00 0.00 0.00 56.30 56.01 1dwq h ASN 182 Cb -0.02 0.00 0.04 0.00 -0.00 0.00 0.00 38.32 38.34 1dwq h ASN 182 CO -0.02 0.08 -1.51 0.58 -0.00 0.00 0.00 177.43 176.57 1dwq h VAL 183 N 0.00 1.26 -0.69 6.14 2.07 -1.49 -2.86 116.25 120.66 1dwq h VAL 183 Ca -0.00 -2.69 0.03 0.00 0.82 0.00 0.00 66.70 64.86 1dwq h VAL 183 Cb 0.17 3.03 -0.04 0.00 -1.52 0.00 0.00 31.29 32.93 1dwq h VAL 183 CO 0.01 0.81 0.43 -0.07 0.02 0.00 0.00 177.57 178.78 1dwq h LEU 184 N 0.14 0.71 -1.76 2.57 3.38 -0.64 0.73 115.31 120.46 1dwq h LEU 184 Ca -0.27 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.77 1dwq h LEU 184 Cb 2.17 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 42.75 1dwq h LEU 184 CO 0.27 0.49 0.29 0.00 0.09 0.00 0.00 178.44 179.58 1dwq h ALA 185 N 1.30 2.02 0.00 1.53 0.00 -0.70 -0.16 119.26 123.24 1dwq h ALA 185 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1dwq h ALA 185 Cb 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1dwq h ALA 185 CO -0.11 -0.10 -0.35 1.04 0.00 0.00 0.00 179.25 179.73 1dwq n GLN 186 N -4.47 0.19 -2.47 0.00 1.13 -0.49 -4.91 117.38 106.35 1dwq n GLN 186 Ca 0.06 0.09 -0.38 0.00 -1.94 0.00 0.00 57.00 54.83 1dwq n GLN 186 Cb 0.28 -1.66 -0.04 0.00 0.11 0.00 0.00 30.24 28.94 1dwq n GLN 186 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1dwq s ARG 187 N -3.10 4.29 0.30 -1.09 3.52 0.13 -5.00 118.95 118.01 1dwq s ARG 187 Ca 0.09 1.67 -0.28 0.00 -0.13 0.00 0.00 55.73 57.09 1dwq s ARG 187 Cb 0.15 -2.78 -0.14 0.00 -1.56 0.00 0.00 34.95 30.62 1dwq s ARG 187 CO 0.66 -0.07 1.07 -0.35 -0.81 0.00 0.00 175.30 175.80 1dwq n PRO 188 N 0.36 1.51 -1.17 5.12 -0.04 -1.26 -4.40 135.00 135.12 1dwq n PRO 188 Ca 0.03 0.53 -0.33 0.00 -0.04 0.00 0.00 63.50 63.69 1dwq n PRO 188 Cb 0.47 -1.95 0.12 0.00 -0.04 0.00 0.00 33.50 32.11 1dwq n PRO 188 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1dwq s LYS 189 N -1.59 1.74 0.35 0.54 1.02 -1.26 -4.64 119.74 115.90 1dwq s LYS 189 Ca 0.58 1.71 -0.28 0.00 0.02 0.00 0.00 55.97 58.01 1dwq s LYS 189 Cb -0.68 -1.79 -0.10 0.00 -0.52 0.00 0.00 37.83 34.75 1dwq s LYS 189 CO 0.60 -2.13 1.25 -0.06 -0.92 0.00 0.00 175.35 174.10 1dwq s PHE 190 N -2.18 3.08 0.56 3.18 0.08 -1.26 -4.97 117.98 116.46 1dwq s PHE 190 Ca 0.72 1.48 -0.14 0.00 0.12 0.00 0.00 56.93 59.11 1dwq s PHE 190 Cb -0.28 -3.58 -0.06 0.00 -0.57 0.00 0.00 43.02 38.54 1dwq s PHE 190 CO 0.50 -1.64 1.01 0.95 -0.10 0.00 0.00 175.22 175.94 1dwq s THR 191 N -1.21 4.58 0.13 0.64 -4.23 -1.26 -4.56 115.64 109.72 1dwq s THR 191 Ca 0.51 1.06 0.02 0.00 -1.18 0.00 0.00 61.69 62.11 1dwq s THR 191 Cb -0.37 -3.77 -0.21 0.00 1.34 0.00 0.00 72.50 69.50 1dwq s THR 191 CO 0.48 -0.87 1.28 -0.33 -0.54 0.00 0.00 174.62 174.64 1dwq h GLU 192 N 0.38 0.14 0.00 3.99 4.39 -1.94 -0.34 114.58 121.19 1dwq h GLU 192 Ca -0.46 -0.20 -0.07 0.00 0.34 0.00 0.00 59.36 58.97 1dwq h GLU 192 Cb 1.19 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.90 1dwq h GLU 192 CO 0.61 1.03 -0.35 1.57 -1.16 0.00 0.00 179.01 180.72 1dwq h LYS 193 N 0.06 0.00 0.00 2.33 2.10 -1.93 -1.85 116.57 117.27 1dwq h LYS 193 Ca -0.06 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.59 1dwq h LYS 193 Cb 1.72 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.05 1dwq h LYS 193 CO 0.15 0.35 0.00 0.41 -2.00 0.00 0.00 179.45 178.36 1dwq n GLY 194 N 0.14 -0.27 0.29 0.07 0.00 -1.22 -4.37 105.19 99.83 1dwq n GLY 194 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1dwq n GLY 194 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1dwq h TYR 195 N 0.00 1.07 -0.20 1.61 3.20 -1.58 -0.96 116.97 120.10 1dwq h TYR 195 Ca 0.00 -0.13 0.05 0.00 3.14 0.00 0.00 58.73 61.80 1dwq h TYR 195 Cb 0.00 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 37.96 1dwq h TYR 195 CO 0.00 0.89 0.15 0.78 -1.64 0.00 0.00 178.16 178.34 1dwq h GLY 196 N 0.93 0.03 1.00 1.82 0.00 -1.04 -3.05 103.07 102.76 1dwq h GLY 196 Ca 0.20 -0.01 -0.13 0.00 0.00 0.00 0.00 47.33 47.39 1dwq h GLY 196 CO 0.00 0.01 -0.30 1.76 0.00 0.00 0.00 176.54 178.01 1dwq h SER 197 N 0.03 0.79 -2.01 0.19 0.02 -0.29 -3.48 113.55 108.80 1dwq h SER 197 Ca 0.10 -0.47 -0.63 0.00 -0.84 0.00 0.00 61.79 59.94 1dwq h SER 197 Cb 0.35 -0.22 0.10 0.00 0.14 0.00 0.00 62.40 62.77 1dwq h SER 197 CO -0.00 1.10 0.02 -0.38 -1.14 0.00 0.00 176.83 176.42 1dwq n ILE 198 N -4.23 1.71 -2.34 3.27 -0.00 -1.16 -4.98 119.36 111.63 1dwq n ILE 198 Ca -0.04 -0.43 -0.37 0.00 -0.00 0.00 0.00 62.75 61.92 1dwq n ILE 198 Cb 0.48 -0.73 -0.02 0.00 -0.00 0.00 0.00 39.64 39.37 1dwq n ILE 198 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 1dwq s LYS 199 N -1.14 3.94 -0.05 0.38 2.20 -1.26 -4.91 119.74 118.89 1dwq s LYS 199 Ca 0.64 1.72 0.01 0.00 -0.36 0.00 0.00 55.97 57.97 1dwq s LYS 199 Cb -0.80 -2.51 0.02 0.00 -1.51 0.00 0.00 37.83 33.04 1dwq s LYS 199 CO 0.57 -0.39 -0.04 0.15 -0.36 0.00 0.00 175.35 175.28 1dwq s LYS 200 N -2.55 0.86 -0.08 4.03 1.02 -1.26 -0.93 119.74 120.84 1dwq s LYS 200 Ca 0.60 -0.09 0.04 0.00 0.02 0.00 0.00 55.97 56.55 1dwq s LYS 200 Cb -0.27 -0.93 0.00 0.00 -0.52 0.00 0.00 37.83 36.11 1dwq s LYS 200 CO 0.34 -0.13 -0.21 0.08 -0.92 0.00 0.00 175.35 174.51 1dwq s VAL 201 N 1.14 1.81 -0.16 3.17 1.01 -0.77 -0.63 120.40 125.96 1dwq s VAL 201 Ca -0.08 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 61.01 1dwq s VAL 201 Cb -0.14 -1.57 -0.00 0.00 0.00 0.00 0.00 36.38 34.67 1dwq s VAL 201 CO -0.01 0.51 -0.13 -0.47 0.00 0.00 0.00 175.10 174.99 1dwq s TYR 202 N 0.27 2.82 -0.09 5.22 5.04 -0.35 -0.67 117.35 129.59 1dwq s TYR 202 Ca -0.13 -0.99 0.03 0.00 -2.44 0.00 0.00 57.07 53.53 1dwq s TYR 202 Cb -0.16 -1.92 -0.01 0.00 0.35 0.00 0.00 41.96 40.22 1dwq s TYR 202 CO 0.06 -0.46 -0.18 0.42 -1.34 0.00 0.00 175.55 174.05 1dwq s ILE 203 N 0.88 2.63 0.31 3.14 1.01 0.92 -0.44 121.20 129.65 1dwq s ILE 203 Ca -0.04 -0.84 -0.12 0.00 0.00 0.00 0.00 60.65 59.65 1dwq s ILE 203 Cb -0.15 -2.04 0.02 0.00 0.01 0.00 0.00 42.46 40.29 1dwq s ILE 203 CO -0.01 0.55 0.60 -1.66 0.00 0.00 0.00 174.94 174.43 1dwq s TRP 204 N 0.03 0.38 0.01 3.97 1.48 -0.95 -0.79 118.94 123.06 1dwq s TRP 204 Ca -0.07 -0.80 0.02 0.00 -1.06 0.00 0.00 56.10 54.19 1dwq s TRP 204 Cb -0.15 0.38 -0.01 0.00 -1.16 0.00 0.00 33.47 32.53 1dwq s TRP 204 CO 0.05 -1.22 -0.05 -0.08 -4.06 0.00 0.00 176.95 171.59 1dwq s THR 205 N -3.33 0.40 -1.44 0.66 -1.32 -1.26 -0.77 115.64 108.57 1dwq s THR 205 Ca 0.21 -0.40 0.21 0.00 -1.21 0.00 0.00 61.69 60.49 1dwq s THR 205 Cb -0.03 -0.38 0.37 0.00 -1.51 0.00 0.00 72.50 70.96 1dwq s THR 205 CO 0.12 -0.01 1.66 -0.90 -2.21 0.00 0.00 174.62 173.28 1dwq n ASP 206 N 2.61 0.00 -1.27 8.08 3.85 -1.26 -2.39 116.55 126.17 1dwq n ASP 206 Ca -0.15 -0.03 0.08 0.00 -0.71 0.00 0.00 54.79 53.98 1dwq n ASP 206 Cb 0.57 -0.28 0.28 0.00 -1.35 0.00 0.00 41.12 40.35 1dwq n ASP 206 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1dwq n GLN 207 N -1.28 2.96 -2.14 0.11 1.13 -1.26 -4.68 117.38 112.22 1dwq n GLN 207 Ca 0.10 -2.26 -0.42 0.00 -1.94 0.00 0.00 57.00 52.49 1dwq n GLN 207 Cb 0.16 -1.68 -0.03 0.00 0.11 0.00 0.00 30.24 28.81 1dwq n GLN 207 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1dwq s ASP 208 N -0.87 6.80 -0.05 1.08 -1.08 -1.01 -4.44 116.67 117.10 1dwq s ASP 208 Ca 0.41 2.43 0.20 0.00 -0.52 0.00 0.00 52.55 55.07 1dwq s ASP 208 Cb 0.25 -2.60 0.67 0.00 -1.46 0.00 0.00 42.92 39.77 1dwq s ASP 208 CO 0.22 -0.63 1.57 0.29 0.52 0.00 0.00 175.17 177.14 1dwq n LYS 209 N 3.23 3.20 0.00 4.34 4.76 -1.24 -4.40 118.16 128.05 1dwq n LYS 209 Ca 0.09 -2.75 0.00 0.00 -2.87 0.00 0.00 58.31 52.78 1dwq n LYS 209 Cb 0.42 -1.71 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 1dwq n LYS 209 CO 0.00 0.00 0.00 1.51 -1.37 0.00 0.00 177.40 177.54 1dwq n ILE 210 N 1.34 0.00 -3.15 -0.18 3.06 -1.24 -4.73 119.36 114.47 1dwq n ILE 210 Ca 0.25 0.00 -0.45 0.00 -2.50 0.00 0.00 62.75 60.04 1dwq n ILE 210 Cb 0.74 -0.10 -0.02 0.00 0.54 0.00 0.00 39.64 40.81 1dwq n ILE 210 CO 0.00 0.00 0.00 -0.36 -2.50 0.00 0.00 176.55 173.69 1dwq s PHE 211 N -1.19 3.55 0.71 9.51 0.40 -1.26 -4.80 117.98 124.90 1dwq s PHE 211 Ca 0.00 -1.85 -0.11 0.00 -0.60 0.00 0.00 56.93 54.37 1dwq s PHE 211 Cb 0.00 -4.04 0.02 0.00 0.51 0.00 0.00 43.02 39.51 1dwq s PHE 211 CO 0.00 -1.21 1.07 -0.51 0.70 0.00 0.00 175.22 175.27 1dwq s LEU 212 N 1.09 3.00 0.22 -0.37 1.43 -1.26 -4.63 118.68 118.15 1dwq s LEU 212 Ca 0.27 1.47 -0.08 0.00 -1.03 0.00 0.00 54.13 54.76 1dwq s LEU 212 Cb -0.07 -4.30 0.32 0.00 0.03 0.00 0.00 46.19 42.16 1dwq s LEU 212 CO -0.08 -1.47 1.77 -0.65 0.23 0.00 0.00 176.35 176.14 1dwq h PRO 213 N -0.74 0.51 0.00 1.29 0.11 -1.83 -0.95 132.00 130.39 1dwq h PRO 213 Ca -0.45 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.54 1dwq h PRO 213 Cb 1.22 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1dwq h PRO 213 CO 0.59 0.34 -0.42 -0.44 -0.21 0.00 0.00 178.00 177.85 1dwq h ASP 214 N 0.53 0.00 -0.12 -2.05 3.45 -1.98 0.12 116.42 116.37 1dwq h ASP 214 Ca 0.33 0.00 -0.18 0.00 0.43 0.00 0.00 57.03 57.61 1dwq h ASP 214 Cb 0.38 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.15 1dwq h ASP 214 CO -0.28 0.42 -0.62 0.15 -1.57 0.00 0.00 179.24 177.34 1dwq h PHE 215 N 0.00 0.86 -0.19 4.55 3.57 -1.58 -1.28 116.94 122.88 1dwq h PHE 215 Ca -0.00 -0.38 -0.02 0.00 3.53 0.00 0.00 57.97 61.09 1dwq h PHE 215 Cb 0.91 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.51 1dwq h PHE 215 CO 0.00 1.19 0.03 1.96 -2.23 0.00 0.00 178.31 179.26 1dwq h GLN 216 N 0.30 0.31 -0.71 1.11 4.20 -1.06 -0.67 115.11 118.58 1dwq h GLN 216 Ca -0.04 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 1dwq h GLN 216 Cb 1.26 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.97 1dwq h GLN 216 CO 0.13 0.46 0.41 0.00 -0.67 0.00 0.00 178.83 179.16 1dwq h ARG 217 N 0.11 0.97 -0.41 1.46 3.08 -0.81 -1.12 114.38 117.65 1dwq h ARG 217 Ca 0.06 -0.09 0.06 0.00 0.07 0.00 0.00 59.98 60.07 1dwq h ARG 217 Cb 0.30 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 30.10 1dwq h ARG 217 CO 0.00 0.70 0.10 2.35 -1.07 0.00 0.00 179.97 182.06 1dwq h TRP 218 N 0.99 0.17 -0.69 3.04 7.01 -0.82 -1.42 115.95 124.23 1dwq h TRP 218 Ca 0.25 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.27 1dwq h TRP 218 Cb -0.01 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.00 1dwq h TRP 218 CO 0.01 0.04 0.39 1.96 -2.79 0.00 0.00 178.44 178.04 1dwq h GLN 219 N 0.24 0.96 -0.58 2.65 4.20 0.10 0.35 115.11 123.03 1dwq h GLN 219 Ca 0.20 -0.11 -0.06 0.00 0.06 0.00 0.00 58.65 58.74 1dwq h GLN 219 Cb 0.23 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 1dwq h GLN 219 CO -0.24 0.71 0.11 0.82 -0.67 0.00 0.00 178.83 179.56 1dwq h ILE 220 N 0.95 1.24 0.00 2.54 2.04 -1.20 -1.06 117.51 122.02 1dwq h ILE 220 Ca 0.24 -0.93 -0.08 0.00 1.00 0.00 0.00 64.86 65.10 1dwq h ILE 220 Cb 0.02 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1dwq h ILE 220 CO -0.04 0.34 -0.36 0.00 0.00 0.00 0.00 178.15 178.10 1dwq h ALA 221 N 1.23 0.85 0.00 1.87 0.00 -0.17 -2.80 119.26 120.24 1dwq h ALA 221 Ca 0.18 -0.33 -0.18 0.00 0.00 0.00 0.00 54.91 54.59 1dwq h ALA 221 Cb 0.37 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1dwq h ALA 221 CO 0.01 0.45 -0.87 -0.97 0.00 0.00 0.00 179.25 177.86 1dwq h ASN 222 N 0.00 0.00 -1.38 0.00 -1.24 0.68 -3.41 115.58 110.23 1dwq h ASN 222 Ca -0.00 0.00 -0.20 0.00 0.71 0.00 0.00 56.30 56.80 1dwq h ASN 222 Cb 1.08 0.00 -0.23 0.00 0.73 0.00 0.00 38.32 39.90 1dwq h ASN 222 CO 0.05 0.87 -0.56 -0.47 -1.29 0.00 0.00 177.43 176.03 1dwq s TYR 223 N -2.88 -1.10 0.03 0.67 5.04 -0.50 -5.07 117.35 113.54 1dwq s TYR 223 Ca 0.01 -0.36 -0.30 0.00 -2.44 0.00 0.00 57.07 53.98 1dwq s TYR 223 Cb 0.10 0.02 -0.08 0.00 0.35 0.00 0.00 41.96 42.34 1dwq s TYR 223 CO 0.80 -1.11 1.85 0.15 -1.34 0.00 0.00 175.55 175.90 1dwq s LYS 224 N 1.47 4.16 0.99 4.97 3.01 -1.06 -4.61 119.74 128.66 1dwq s LYS 224 Ca 0.19 2.49 -0.15 0.00 -1.01 0.00 0.00 55.97 57.48 1dwq s LYS 224 Cb -0.07 -3.99 0.19 0.00 -1.01 0.00 0.00 37.83 32.96 1dwq s LYS 224 CO -0.06 -0.89 1.21 -1.25 0.51 0.00 0.00 175.35 174.87 1dwq s PRO 225 N 3.94 0.43 0.20 -1.68 0.04 -1.26 -5.00 135.00 131.67 1dwq s PRO 225 Ca 0.82 -0.09 -0.03 0.00 0.04 0.00 0.00 61.00 61.75 1dwq s PRO 225 Cb -0.41 -1.79 0.13 0.00 0.04 0.00 0.00 34.50 32.48 1dwq s PRO 225 CO 0.37 -2.61 1.53 -0.44 0.04 0.00 0.00 177.00 175.89 1dwq h ASP 226 N -1.79 0.62 -4.14 6.66 3.32 -1.25 -3.45 116.42 116.39 1dwq h ASP 226 Ca -0.46 -0.32 -0.17 0.00 0.02 0.00 0.00 57.03 56.10 1dwq h ASP 226 Cb 1.28 -0.18 -0.25 0.00 0.22 0.00 0.00 39.33 40.41 1dwq h ASP 226 CO 0.46 1.02 -0.50 -0.54 -1.72 0.00 0.00 179.24 177.96 1dwq s LYS 227 N -4.07 0.29 -0.09 3.56 1.02 -1.16 -5.05 119.74 114.24 1dwq s LYS 227 Ca -0.07 0.06 0.01 0.00 0.02 0.00 0.00 55.97 55.99 1dwq s LYS 227 Cb 0.12 0.13 0.02 0.00 -0.52 0.00 0.00 37.83 37.58 1dwq s LYS 227 CO 0.84 -0.05 -0.09 0.08 -0.92 0.00 0.00 175.35 175.21 1dwq s VAL 228 N -0.33 1.00 -0.20 3.17 1.01 -1.26 -1.21 120.40 122.58 1dwq s VAL 228 Ca -0.04 -0.33 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 1dwq s VAL 228 Cb -0.03 -0.98 -0.01 0.00 0.00 0.00 0.00 36.38 35.36 1dwq s VAL 228 CO 0.01 0.35 -0.06 -0.31 0.00 0.00 0.00 175.10 175.09 1dwq s TYR 229 N 1.24 2.94 -0.22 5.22 1.51 0.41 -4.96 117.35 123.50 1dwq s TYR 229 Ca -0.04 -0.84 -0.05 0.00 -1.01 0.00 0.00 57.07 55.13 1dwq s TYR 229 Cb -0.14 -2.05 -0.02 0.00 -0.11 0.00 0.00 41.96 39.64 1dwq s TYR 229 CO -0.03 -0.45 0.01 -1.14 -1.11 0.00 0.00 175.55 172.83 1dwq s GLN 230 N 1.21 3.56 0.05 -0.62 0.74 -1.26 -2.24 119.66 121.09 1dwq s GLN 230 Ca 0.02 -0.54 -0.18 0.00 0.05 0.00 0.00 55.36 54.72 1dwq s GLN 230 Cb -0.14 -3.13 -0.06 0.00 1.10 0.00 0.00 33.01 30.77 1dwq s GLN 230 CO -0.01 -0.11 0.51 0.08 -0.55 0.00 0.00 175.29 175.20 1dwq s VAL 231 N 1.32 4.85 0.00 1.34 1.01 0.05 -4.98 120.40 124.00 1dwq s VAL 231 Ca 0.04 1.07 -0.22 0.00 0.00 0.00 0.00 61.98 62.88 1dwq s VAL 231 Cb -0.15 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 1dwq s VAL 231 CO 0.01 0.56 0.64 -1.10 0.00 0.00 0.00 175.10 175.21 1dwq s GLN 232 N -1.10 4.37 2.15 2.72 1.11 -1.26 -4.40 119.66 123.25 1dwq s GLN 232 Ca 0.27 0.82 0.00 0.00 0.01 0.00 0.00 55.36 56.46 1dwq s GLN 232 Cb -0.18 -3.35 0.00 0.00 -1.01 0.00 0.00 33.01 28.46 1dwq s GLN 232 CO 0.17 0.33 0.00 0.41 0.01 0.00 0.00 175.29 176.21 1dwq n GLY 233 N 2.47 -0.33 7.00 3.09 0.00 -1.26 -5.03 105.19 111.13 1dwq n GLY 233 Ca -0.05 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1dwq n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dwq n GLY 234 N 0.00 -0.32 0.00 -0.02 0.00 -1.26 -4.55 105.19 99.04 1dwq n GLY 234 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.96 1dwq n GLY 234 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1dwq n ASP 235 N -0.94 0.00 -0.02 1.61 5.75 -1.26 -4.74 116.55 116.95 1dwq n ASP 235 Ca 0.00 -0.32 0.06 0.00 -0.01 0.00 0.00 54.79 54.52 1dwq n ASP 235 Cb 0.00 0.00 0.45 0.00 -1.03 0.00 0.00 41.12 40.54 1dwq n ASP 235 CO 0.00 0.00 0.00 -0.74 -0.11 0.00 0.00 177.20 176.35 1dwq h HIS 236 N 0.32 0.49 -2.14 2.11 -0.00 -1.76 -3.24 115.15 110.92 1dwq h HIS 236 Ca 0.00 0.01 -0.78 0.00 -0.00 0.00 0.00 60.37 59.60 1dwq h HIS 236 Cb 0.00 -0.16 -0.21 0.00 -0.00 0.00 0.00 27.41 27.03 1dwq h HIS 236 CO 0.00 0.29 1.41 1.63 -0.00 0.00 0.00 177.93 181.26 1dwq n LYS 237 N -4.48 4.03 0.26 5.26 4.76 -1.19 -4.79 118.16 122.01 1dwq n LYS 237 Ca 0.05 -4.03 0.14 0.00 -2.87 0.00 0.00 58.31 51.60 1dwq n LYS 237 Cb 0.14 -2.73 0.83 0.00 -1.84 0.00 0.00 35.03 31.43 1dwq n LYS 237 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1dwq h LEU 238 N 6.73 0.00 0.00 -0.35 3.38 -1.93 0.54 115.31 123.68 1dwq h LEU 238 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1dwq h LEU 238 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1dwq h LEU 238 CO 1.48 0.00 0.00 0.00 0.09 0.00 0.00 178.44 180.01 1dwq n GLN 239 N -4.02 0.05 -0.06 1.13 0.00 -1.26 -0.08 117.38 113.14 1dwq n GLN 239 Ca -0.02 0.21 -0.12 0.00 0.00 0.00 0.00 57.00 57.07 1dwq n GLN 239 Cb 0.15 -1.50 -0.05 0.00 0.00 0.00 0.00 30.24 28.84 1dwq n GLN 239 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1dwq n LEU 240 N -1.45 1.41 0.17 2.61 4.77 0.03 -4.03 117.00 120.50 1dwq n LEU 240 Ca 0.05 0.10 0.12 0.00 -0.03 0.00 0.00 56.01 56.25 1dwq n LEU 240 Cb 0.17 -0.38 0.23 0.00 -2.33 0.00 0.00 43.42 41.10 1dwq n LEU 240 CO 0.14 0.37 0.74 0.71 -1.33 0.00 0.00 177.39 178.02 1dwq h THR 241 N -0.34 0.00 -0.67 -5.08 1.35 -1.09 -3.37 112.91 103.70 1dwq h THR 241 Ca -0.31 -0.81 -0.31 0.00 -0.55 0.00 0.00 66.41 64.43 1dwq h THR 241 Cb 1.31 1.74 -0.40 0.00 -1.73 0.00 0.00 68.15 69.07 1dwq h THR 241 CO -0.16 0.00 -1.11 0.29 -0.25 0.00 0.00 175.52 174.29 1dwq n LYS 242 N -2.75 1.71 -0.22 4.72 4.76 0.89 -4.79 118.16 122.48 1dwq n LYS 242 Ca 0.04 -3.50 0.01 0.00 -2.87 0.00 0.00 58.31 51.99 1dwq n LYS 242 Cb 0.50 -1.55 0.13 0.00 -1.84 0.00 0.00 35.03 32.26 1dwq n LYS 242 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1dwq h THR 243 N 4.44 0.74 -0.02 -0.18 2.02 -1.66 -0.91 112.91 117.34 1dwq h THR 243 Ca -0.08 -0.14 -0.14 0.00 0.77 0.00 0.00 66.41 66.82 1dwq h THR 243 Cb 1.24 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 1dwq h THR 243 CO 0.34 0.08 -0.62 -0.33 0.37 0.00 0.00 175.52 175.36 1dwq h GLU 244 N 0.42 0.07 -0.73 6.66 4.39 -1.92 -0.16 114.58 123.32 1dwq h GLU 244 Ca 0.34 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.95 1dwq h GLU 244 Cb 0.44 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 1dwq h GLU 244 CO -0.34 0.67 0.34 0.93 -1.16 0.00 0.00 179.01 179.46 1dwq h GLU 245 N 0.05 1.05 -0.15 2.33 3.07 -1.58 0.54 114.58 119.90 1dwq h GLU 245 Ca -0.01 -0.16 -0.19 0.00 -0.50 0.00 0.00 59.36 58.51 1dwq h GLU 245 Cb 1.11 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 28.83 1dwq h GLU 245 CO 0.09 0.83 -0.67 0.28 -1.40 0.00 0.00 179.01 178.13 1dwq h VAL 246 N 1.02 1.33 -0.20 3.13 2.07 -0.77 -1.31 116.25 121.51 1dwq h VAL 246 Ca 0.25 -1.96 -0.03 0.00 0.82 0.00 0.00 66.70 65.78 1dwq h VAL 246 Cb 0.13 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 1dwq h VAL 246 CO -0.03 0.61 -0.01 0.00 0.02 0.00 0.00 177.57 178.16 1dwq h ALA 247 N 0.83 1.61 -0.10 1.67 0.00 -0.19 0.21 119.26 123.29 1dwq h ALA 247 Ca -0.02 -0.14 -0.22 0.00 0.00 0.00 0.00 54.91 54.54 1dwq h ALA 247 Cb 1.25 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.96 1dwq h ALA 247 CO 0.13 0.29 -0.79 1.25 0.00 0.00 0.00 179.25 180.13 1dwq h HIS 248 N 0.29 0.99 -0.63 0.00 6.17 -0.42 -2.10 115.15 119.44 1dwq h HIS 248 Ca 0.07 -0.46 -0.09 0.00 0.71 0.00 0.00 60.37 60.60 1dwq h HIS 248 Cb 0.22 -0.14 -0.02 0.00 2.52 0.00 0.00 27.41 29.98 1dwq h HIS 248 CO 0.00 1.29 0.05 0.82 0.71 0.00 0.00 177.93 180.81 1dwq h ILE 249 N 0.40 1.26 0.00 6.26 2.04 -0.55 -2.41 117.51 124.51 1dwq h ILE 249 Ca -0.07 -1.10 -0.03 0.00 1.00 0.00 0.00 64.86 64.66 1dwq h ILE 249 Cb 1.43 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1dwq h ILE 249 CO 0.16 0.40 -0.15 -0.07 0.00 0.00 0.00 178.15 178.49 1dwq h LEU 250 N 0.99 0.00 -0.57 1.44 4.07 -0.49 0.04 115.31 120.78 1dwq h LEU 250 Ca 0.19 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 58.02 1dwq h LEU 250 Cb 0.50 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.23 1dwq h LEU 250 CO 0.02 0.15 -0.24 -0.61 -1.08 0.00 0.00 178.44 176.69 1dwq h GLN 251 N 0.00 0.89 -0.44 1.13 5.75 -0.90 -1.28 115.11 120.26 1dwq h GLN 251 Ca -0.00 -0.38 -0.10 0.00 -0.15 0.00 0.00 58.65 58.01 1dwq h GLN 251 Cb 0.37 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 1dwq h GLN 251 CO 0.02 1.03 -0.14 0.93 -2.65 0.00 0.00 178.83 178.02 1dwq h GLU 252 N 0.77 0.81 -0.36 1.69 5.08 -0.62 -0.63 114.58 121.32 1dwq h GLU 252 Ca 0.10 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 1dwq h GLU 252 Cb 0.79 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1dwq h GLU 252 CO 0.07 0.91 0.03 0.28 -1.00 0.00 0.00 179.01 179.30 1dwq h VAL 253 N 0.73 1.25 -0.28 3.13 2.07 -1.23 -0.32 116.25 121.60 1dwq h VAL 253 Ca 0.12 -0.90 0.03 0.00 0.82 0.00 0.00 66.70 66.77 1dwq h VAL 253 Cb 0.64 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 1dwq h VAL 253 CO 0.04 0.30 0.09 0.00 0.02 0.00 0.00 177.57 178.03 1dwq h ALA 254 N 0.89 0.31 -0.48 1.67 0.00 -0.93 0.23 119.26 120.95 1dwq h ALA 254 Ca 0.11 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1dwq h ALA 254 Cb 0.40 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 1dwq h ALA 254 CO 0.01 -0.32 0.19 -0.44 0.00 0.00 0.00 179.25 178.69 1dwq h ASP 255 N 0.21 0.22 0.70 0.00 3.32 -0.98 0.42 116.42 120.30 1dwq h ASP 255 Ca 0.12 0.05 -0.20 0.00 0.02 0.00 0.00 57.03 57.02 1dwq h ASP 255 Cb 0.10 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1dwq h ASP 255 CO -0.13 0.16 -0.93 0.00 -1.72 0.00 0.00 179.24 176.61 1dwq h ALA 256 N 1.30 0.46 0.00 3.45 0.00 -0.80 -3.36 119.26 120.31 1dwq h ALA 256 Ca 0.22 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1dwq h ALA 256 Cb 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1dwq h ALA 256 CO -0.21 0.99 0.00 0.66 0.00 0.00 0.00 179.25 180.69 1dwq n TYR 257 N -3.58 0.00 -0.50 0.00 0.53 0.80 -5.06 117.16 109.35 1dwq n TYR 257 Ca -0.03 -0.36 0.00 0.00 -1.02 0.00 0.00 57.90 56.49 1dwq n TYR 257 Cb 0.85 -0.04 0.00 0.00 -1.03 0.00 0.00 39.34 39.13 1dwq n TYR 257 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84