#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dwo s ILE -3 N 0.00 -0.21 0.34 4.25 1.01 -1.26 -5.17 121.20 120.15 1dwo s ILE -3 Ca 0.00 0.37 0.01 0.00 0.00 0.00 0.00 60.65 61.03 1dwo s ILE -3 Cb 0.00 -0.26 -0.03 0.00 0.01 0.00 0.00 42.46 42.18 1dwo s ILE -3 CO 0.00 0.15 0.53 -0.44 0.00 0.00 0.00 174.94 175.18 1dwo s SER -2 N 2.25 6.28 -0.01 3.58 0.01 -1.26 -5.13 113.70 119.43 1dwo s SER -2 Ca 0.04 0.40 0.01 0.00 1.31 0.00 0.00 55.95 57.71 1dwo s SER -2 Cb -0.12 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 64.12 1dwo s SER -2 CO -0.05 -0.28 -0.04 -0.75 0.41 0.00 0.00 173.24 172.53 1dwo s LYS -1 N -4.28 0.43 -0.01 12.44 2.20 -1.26 -5.15 119.74 124.11 1dwo s LYS -1 Ca 0.39 -0.14 0.01 0.00 -0.36 0.00 0.00 55.97 55.88 1dwo s LYS -1 Cb -0.10 -0.44 0.00 0.00 -1.51 0.00 0.00 37.83 35.79 1dwo s LYS -1 CO 0.35 0.06 -0.03 1.41 -0.36 0.00 0.00 175.35 176.78 1dwo s MET 1 N 0.12 0.32 0.05 4.03 1.75 -1.26 -4.94 119.30 119.37 1dwo s MET 1 Ca -0.01 -0.10 0.05 0.00 -1.25 0.00 0.00 55.69 54.38 1dwo s MET 1 Cb -0.05 -0.34 -0.02 0.00 2.84 0.00 0.00 34.83 37.26 1dwo s MET 1 CO -0.00 0.04 -0.13 0.08 -0.65 0.00 0.00 175.02 174.35 1dwo s VAL 2 N 0.11 1.06 0.02 10.11 1.01 -1.26 -5.00 120.40 126.46 1dwo s VAL 2 Ca -0.01 -1.11 0.03 0.00 0.00 0.00 0.00 61.98 60.89 1dwo s VAL 2 Cb -0.04 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 1dwo s VAL 2 CO -0.00 -0.11 -0.03 0.42 0.00 0.00 0.00 175.10 175.38 1dwo s THR 3 N -1.04 3.91 0.33 3.92 -4.23 -1.26 -4.62 115.64 112.66 1dwo s THR 3 Ca -0.01 -0.78 0.03 0.00 -1.18 0.00 0.00 61.69 59.76 1dwo s THR 3 Cb -0.09 -2.76 -0.05 0.00 1.34 0.00 0.00 72.50 70.95 1dwo s THR 3 CO 0.02 0.31 0.10 0.00 -0.54 0.00 0.00 174.62 174.51 1dwo s ALA 4 N -1.11 2.34 -0.28 3.99 0.00 -1.26 -5.01 121.76 120.42 1dwo s ALA 4 Ca 0.20 -1.73 -0.02 0.00 0.00 0.00 0.00 51.96 50.41 1dwo s ALA 4 Cb -0.11 0.84 0.04 0.00 0.00 0.00 0.00 23.12 23.88 1dwo s ALA 4 CO 0.11 -0.38 -0.01 -1.58 0.00 0.00 0.00 175.76 173.90 1dwo s HIS 5 N -3.41 3.19 -0.09 0.00 5.65 -1.26 -1.17 115.29 118.20 1dwo s HIS 5 Ca 0.33 -1.68 -0.14 0.00 0.25 0.00 0.00 55.06 53.82 1dwo s HIS 5 Cb 0.06 -2.11 -0.05 0.00 -1.18 0.00 0.00 32.58 29.30 1dwo s HIS 5 CO 0.15 -0.76 0.35 -0.06 -0.65 0.00 0.00 174.74 173.77 1dwo s PHE 6 N 1.30 3.59 -0.26 3.88 0.40 -0.24 -1.43 117.98 125.23 1dwo s PHE 6 Ca -0.03 0.78 -0.04 0.00 -0.60 0.00 0.00 56.93 57.04 1dwo s PHE 6 Cb -0.18 -2.30 0.01 0.00 0.51 0.00 0.00 43.02 41.05 1dwo s PHE 6 CO -0.02 0.44 0.00 0.08 0.70 0.00 0.00 175.22 176.43 1dwo s VAL 7 N -0.28 3.51 -0.22 -0.44 1.01 -0.45 -0.37 120.40 123.16 1dwo s VAL 7 Ca 0.20 -0.70 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 1dwo s VAL 7 Cb -0.15 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.46 1dwo s VAL 7 CO 0.08 0.23 0.20 -0.76 0.00 0.00 0.00 175.10 174.85 1dwo s LEU 8 N 1.45 4.15 -0.23 3.92 1.43 0.43 -0.82 118.68 129.01 1dwo s LEU 8 Ca 0.03 0.22 0.02 0.00 -1.03 0.00 0.00 54.13 53.37 1dwo s LEU 8 Cb -0.16 -2.18 0.05 0.00 0.03 0.00 0.00 46.19 43.93 1dwo s LEU 8 CO -0.01 0.07 -0.11 -0.63 0.23 0.00 0.00 176.35 175.90 1dwo s ILE 9 N 0.91 1.90 1.18 -0.59 -1.09 0.11 -2.62 121.20 121.00 1dwo s ILE 9 Ca 0.10 -1.31 -0.13 0.00 -2.23 0.00 0.00 60.65 57.08 1dwo s ILE 9 Cb -0.13 -1.99 0.29 0.00 -1.58 0.00 0.00 42.46 39.05 1dwo s ILE 9 CO 0.04 0.08 1.02 -1.38 -1.23 0.00 0.00 174.94 173.47 1dwo s HIS 10 N 1.26 1.32 0.59 3.97 -3.43 -1.26 -2.24 115.29 115.49 1dwo s HIS 10 Ca -0.05 1.18 0.03 0.00 -0.80 0.00 0.00 55.06 55.42 1dwo s HIS 10 Cb -0.18 -3.09 0.07 0.00 -1.43 0.00 0.00 32.58 27.94 1dwo s HIS 10 CO -0.07 -3.94 0.82 -0.08 -2.00 0.00 0.00 174.74 169.47 1dwo s THR 11 N -2.45 2.47 0.49 -5.38 -1.32 -1.26 -4.51 115.64 103.68 1dwo s THR 11 Ca 0.69 -0.73 -0.23 0.00 -1.21 0.00 0.00 61.69 60.21 1dwo s THR 11 Cb -0.25 -2.74 -0.08 0.00 -1.51 0.00 0.00 72.50 67.92 1dwo s THR 11 CO 0.65 0.00 1.09 2.30 -2.21 0.00 0.00 174.62 176.45 1dwo n ILE 12 N -2.42 2.98 0.00 5.08 -5.35 -1.26 -1.81 119.36 116.57 1dwo n ILE 12 Ca 0.11 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 62.09 1dwo n ILE 12 Cb 0.60 -1.31 0.00 0.00 -1.74 0.00 0.00 39.64 37.19 1dwo n ILE 12 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1dwo n HIS 14 N -2.00 -0.45 -3.47 0.00 8.25 -0.75 -1.19 115.22 115.60 1dwo n HIS 14 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.41 1dwo n HIS 14 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1dwo n HIS 14 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1dwo n GLY 15 N 5.00 1.89 0.31 -1.41 0.00 -1.26 -2.49 105.19 107.22 1dwo n GLY 15 Ca 0.00 -1.22 0.13 0.00 0.00 0.00 0.00 46.02 44.93 1dwo n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dwo h ALA 16 N 1.91 2.15 -0.74 4.61 0.00 -1.89 -1.96 119.26 123.33 1dwo h ALA 16 Ca -0.14 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 54.98 1dwo h ALA 16 Cb 0.53 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1dwo h ALA 16 CO 0.18 -0.24 0.69 0.11 0.00 0.00 0.00 179.25 179.98 1dwo h TRP 17 N 0.00 0.00 0.00 0.00 5.08 -1.94 -1.20 115.95 117.89 1dwo h TRP 17 Ca 0.09 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.06 1dwo h TRP 17 Cb 0.38 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.54 1dwo h TRP 17 CO 0.00 0.00 0.00 0.82 -1.28 0.00 0.00 178.44 177.98 1dwo h ILE 18 N 0.00 0.00 -0.31 0.12 5.03 -1.78 -1.65 117.51 118.92 1dwo h ILE 18 Ca 0.35 -0.32 0.00 0.00 -0.12 0.00 0.00 64.86 64.77 1dwo h ILE 18 Cb 1.73 1.13 0.00 0.00 -3.03 0.00 0.00 36.82 36.65 1dwo h ILE 18 CO -0.00 0.00 0.00 0.79 -0.68 0.00 0.00 178.15 178.26 1dwo n TRP 19 N -2.43 0.42 0.30 1.37 7.02 -0.45 -4.48 117.44 119.19 1dwo n TRP 19 Ca 0.02 -0.21 0.19 0.00 -1.02 0.00 0.00 57.50 56.48 1dwo n TRP 19 Cb 0.26 0.00 0.94 0.00 -2.42 0.00 0.00 31.31 30.10 1dwo n TRP 19 CO 0.00 0.00 0.00 1.12 -2.02 0.00 0.00 177.69 176.79 1dwo h HIS 20 N 2.07 0.00 0.02 -5.99 2.07 -1.43 -0.27 115.15 111.62 1dwo h HIS 20 Ca 0.00 0.00 -0.37 0.00 -2.85 0.00 0.00 60.37 57.15 1dwo h HIS 20 Cb 0.47 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 30.39 1dwo h HIS 20 CO 0.21 0.00 -2.33 1.63 -3.07 0.00 0.00 177.93 174.37 1dwo n LYS 21 N -2.92 0.68 0.01 5.12 4.76 -1.26 -4.34 118.16 120.20 1dwo n LYS 21 Ca -0.01 0.13 -0.09 0.00 -2.87 0.00 0.00 58.31 55.47 1dwo n LYS 21 Cb 0.14 -1.57 0.05 0.00 -1.84 0.00 0.00 35.03 31.82 1dwo n LYS 21 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1dwo h LEU 22 N 0.01 0.61 0.03 -0.35 5.85 -1.59 -3.03 115.31 116.84 1dwo h LEU 22 Ca -0.53 -0.33 0.01 0.00 0.84 0.00 0.00 57.88 57.87 1dwo h LEU 22 Cb 2.02 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.86 1dwo h LEU 22 CO -0.02 1.04 -0.08 0.50 -0.34 0.00 0.00 178.44 179.54 1dwo h LYS 23 N 0.42 -0.15 -0.73 1.25 3.64 -1.27 -0.09 116.57 119.63 1dwo h LYS 23 Ca 0.01 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1dwo h LYS 23 Cb 1.11 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.92 1dwo h LYS 23 CO 0.10 -0.10 0.45 -1.00 -2.27 0.00 0.00 179.45 176.63 1dwo h PRO 24 N -0.15 0.99 -0.65 1.90 0.13 -1.75 -1.89 132.00 130.58 1dwo h PRO 24 Ca 0.02 -0.08 -0.03 0.00 -0.87 0.00 0.00 66.00 65.04 1dwo h PRO 24 Cb 0.18 -0.21 -0.03 0.00 0.13 0.00 0.00 31.00 31.07 1dwo h PRO 24 CO -0.06 0.69 0.27 0.00 -0.23 0.00 0.00 178.00 178.67 1dwo h ALA 25 N 1.48 0.84 -0.39 -0.56 0.00 -1.21 0.28 119.26 119.70 1dwo h ALA 25 Ca 0.27 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1dwo h ALA 25 Cb -0.05 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1dwo h ALA 25 CO -0.05 0.44 -0.21 -0.07 0.00 0.00 0.00 179.25 179.37 1dwo h LEU 26 N 0.90 0.76 -1.08 0.00 3.38 -0.81 -2.14 115.31 116.33 1dwo h LEU 26 Ca 0.22 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1dwo h LEU 26 Cb 0.19 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1dwo h LEU 26 CO -0.02 0.95 -0.36 -0.33 0.09 0.00 0.00 178.44 178.78 1dwo h GLU 27 N 0.66 0.00 0.00 1.13 5.08 -0.45 -1.53 114.58 119.48 1dwo h GLU 27 Ca 0.10 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 1dwo h GLU 27 Cb 0.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1dwo h GLU 27 CO 0.05 0.36 -0.18 0.00 -1.00 0.00 0.00 179.01 178.23 1dwo h ARG 28 N 0.00 0.00 -0.00 2.33 3.08 0.19 -0.77 114.38 119.21 1dwo h ARG 28 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1dwo h ARG 28 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1dwo h ARG 28 CO 0.05 0.18 -0.01 0.00 -1.07 0.00 0.00 179.97 179.12 1dwo n ALA 29 N -2.47 2.44 -0.06 0.04 0.00 -0.62 -4.91 120.51 114.93 1dwo n ALA 29 Ca -0.02 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1dwo n ALA 29 Cb 0.25 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1dwo n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dwo n GLY 30 N 1.38 0.81 3.84 0.00 0.00 -0.30 -5.01 105.19 105.92 1dwo n GLY 30 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1dwo n GLY 30 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1dwo s HIS 31 N -2.05 3.35 -0.08 1.61 3.76 -0.95 -4.77 115.29 116.17 1dwo s HIS 31 Ca 0.00 1.38 -0.14 0.00 -0.15 0.00 0.00 55.06 56.15 1dwo s HIS 31 Cb 0.00 -2.82 -0.05 0.00 1.11 0.00 0.00 32.58 30.82 1dwo s HIS 31 CO 0.00 -0.89 0.37 0.21 -0.85 0.00 0.00 174.74 173.57 1dwo s LYS 32 N -4.88 4.06 -0.04 1.40 2.36 -0.32 -4.33 119.74 118.00 1dwo s LYS 32 Ca 0.57 0.28 0.03 0.00 -2.55 0.00 0.00 55.97 54.31 1dwo s LYS 32 Cb -0.12 -3.32 0.00 0.00 -1.05 0.00 0.00 37.83 33.34 1dwo s LYS 32 CO 0.50 0.46 -0.12 0.08 1.55 0.00 0.00 175.35 177.81 1dwo s VAL 33 N -0.27 1.06 -0.07 4.02 1.01 -1.26 -1.08 120.40 123.80 1dwo s VAL 33 Ca 0.21 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.75 1dwo s VAL 33 Cb -0.15 -0.93 -0.01 0.00 0.00 0.00 0.00 36.38 35.29 1dwo s VAL 33 CO 0.09 0.32 -0.25 -0.89 0.00 0.00 0.00 175.10 174.37 1dwo s THR 34 N 0.22 2.06 -0.18 3.92 2.01 0.50 -4.97 115.64 119.21 1dwo s THR 34 Ca -0.05 -1.05 -0.00 0.00 0.31 0.00 0.00 61.69 60.90 1dwo s THR 34 Cb -0.11 -1.75 0.04 0.00 0.01 0.00 0.00 72.50 70.69 1dwo s THR 34 CO 0.01 0.57 -0.07 0.00 -0.69 0.00 0.00 174.62 174.45 1dwo s ALA 35 N 0.03 1.65 -0.03 7.40 0.00 -1.26 -0.43 121.76 129.12 1dwo s ALA 35 Ca -0.10 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 50.89 1dwo s ALA 35 Cb -0.15 -1.18 -0.04 0.00 0.00 0.00 0.00 23.12 21.75 1dwo s ALA 35 CO 0.06 -0.82 0.05 -0.51 0.00 0.00 0.00 175.76 174.54 1dwo s LEU 36 N 1.55 3.78 0.03 0.00 1.43 -1.08 -4.86 118.68 119.54 1dwo s LEU 36 Ca -0.00 0.14 -0.22 0.00 -1.03 0.00 0.00 54.13 53.02 1dwo s LEU 36 Cb -0.16 -2.08 -0.06 0.00 0.03 0.00 0.00 46.19 43.92 1dwo s LEU 36 CO -0.08 0.31 0.65 -1.81 0.23 0.00 0.00 176.35 175.65 1dwo s ASP 37 N -1.41 7.08 0.77 2.29 1.01 -1.26 -4.11 116.67 121.03 1dwo s ASP 37 Ca 0.19 1.29 -0.04 0.00 0.71 0.00 0.00 52.55 54.69 1dwo s ASP 37 Cb -0.12 -2.40 0.14 0.00 1.01 0.00 0.00 42.92 41.55 1dwo s ASP 37 CO 0.09 0.12 1.06 -0.04 0.21 0.00 0.00 175.17 176.61 1dwo s MET 38 N -0.37 1.50 0.39 8.23 -1.94 -1.26 -4.73 119.30 121.12 1dwo s MET 38 Ca 0.33 -0.92 -0.26 0.00 -1.71 0.00 0.00 55.69 53.13 1dwo s MET 38 Cb -0.19 -2.22 -0.11 0.00 2.01 0.00 0.00 34.83 34.31 1dwo s MET 38 CO 0.20 -1.63 1.22 0.00 -0.01 0.00 0.00 175.02 174.80 1dwo n ALA 39 N -3.03 1.03 -2.03 3.03 0.00 -0.73 -2.24 120.51 116.54 1dwo n ALA 39 Ca 0.15 0.29 -0.12 0.00 0.00 0.00 0.00 53.44 53.76 1dwo n ALA 39 Cb 0.60 -2.22 -0.02 0.00 0.00 0.00 0.00 19.45 17.81 1dwo n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dwo n ALA 40 N -0.08 -0.55 -2.43 0.00 0.00 -1.25 -4.96 120.51 111.23 1dwo n ALA 40 Ca 0.07 0.14 -0.19 0.00 0.00 0.00 0.00 53.44 53.45 1dwo n ALA 40 Cb 0.38 -1.42 -0.11 0.00 0.00 0.00 0.00 19.45 18.31 1dwo n ALA 40 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1dwo s SER 41 N -2.03 2.33 1.68 0.00 0.01 -0.95 -4.67 113.70 110.06 1dwo s SER 41 Ca 0.00 -0.88 0.00 0.00 1.31 0.00 0.00 55.95 56.38 1dwo s SER 41 Cb 0.00 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.12 1dwo s SER 41 CO 0.00 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.13 1dwo n GLY 42 N 0.22 3.52 1.66 3.44 0.00 -1.04 -1.39 105.19 111.59 1dwo n GLY 42 Ca -0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 1dwo n GLY 42 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1dwo n ILE 43 N 0.00 2.75 -2.08 -0.61 -5.35 -1.26 -4.97 119.36 107.84 1dwo n ILE 43 Ca 0.00 -1.80 -0.41 0.00 -0.27 0.00 0.00 62.75 60.27 1dwo n ILE 43 Cb 0.00 -0.32 -0.02 0.00 -1.74 0.00 0.00 39.64 37.55 1dwo n ILE 43 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1dwo s ASP 44 N -1.38 6.73 0.29 7.28 2.15 -0.49 -4.91 116.67 126.33 1dwo s ASP 44 Ca 0.51 2.63 0.26 0.00 0.43 0.00 0.00 52.55 56.38 1dwo s ASP 44 Cb 0.41 -2.63 0.80 0.00 -0.30 0.00 0.00 42.92 41.20 1dwo s ASP 44 CO 0.11 -0.63 1.75 1.55 -0.17 0.00 0.00 175.17 177.79 1dwo h PRO 45 N 4.63 0.00 -7.24 4.34 0.13 -1.93 -3.40 132.00 128.53 1dwo h PRO 45 Ca -0.47 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.16 1dwo h PRO 45 Cb 1.22 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.44 1dwo h PRO 45 CO 0.74 0.00 0.37 1.03 -0.23 0.00 0.00 178.00 179.91 1dwo s ARG 46 N -3.20 3.01 0.14 0.86 0.52 -1.26 -4.99 118.95 114.02 1dwo s ARG 46 Ca 0.08 1.20 0.03 0.00 -0.52 0.00 0.00 55.73 56.52 1dwo s ARG 46 Cb 0.10 -1.99 -0.04 0.00 0.52 0.00 0.00 34.95 33.54 1dwo s ARG 46 CO 0.57 -1.06 0.21 -0.65 0.02 0.00 0.00 175.30 174.39 1dwo s GLN 47 N -4.34 3.24 0.56 3.54 -1.52 -1.26 -3.77 119.66 116.10 1dwo s GLN 47 Ca 0.63 -0.66 0.25 0.00 -1.95 0.00 0.00 55.36 53.63 1dwo s GLN 47 Cb -0.17 -2.86 1.59 0.00 -0.22 0.00 0.00 33.01 31.35 1dwo s GLN 47 CO 0.43 0.53 2.19 0.97 -0.25 0.00 0.00 175.29 179.16 1dwo h ILE 48 N 1.89 0.68 0.00 1.08 6.09 -1.90 -2.34 117.51 123.02 1dwo h ILE 48 Ca -0.48 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 62.89 1dwo h ILE 48 Cb 1.19 1.07 0.00 0.00 0.47 0.00 0.00 36.82 39.55 1dwo h ILE 48 CO 0.68 0.03 0.00 -0.62 -3.07 0.00 0.00 178.15 175.17 1dwo n GLU 49 N -4.01 0.07 0.00 2.19 4.71 -1.26 -0.96 120.64 121.38 1dwo n GLU 49 Ca -0.03 0.28 0.13 0.00 -0.01 0.00 0.00 57.16 57.54 1dwo n GLU 49 Cb 0.12 -1.62 0.43 0.00 -1.01 0.00 0.00 31.44 29.35 1dwo n GLU 49 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1dwo n GLN 50 N -1.75 1.71 -4.28 3.49 6.02 -0.88 -4.91 117.38 116.78 1dwo n GLN 50 Ca 0.03 -1.11 -0.35 0.00 -0.01 0.00 0.00 57.00 55.57 1dwo n GLN 50 Cb 0.21 -1.48 -0.10 0.00 1.02 0.00 0.00 30.24 29.90 1dwo n GLN 50 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1dwo s ILE 51 N -2.05 4.41 -0.29 5.09 -1.09 -0.13 -5.02 121.20 122.11 1dwo s ILE 51 Ca 0.35 -0.20 0.06 0.00 -2.23 0.00 0.00 60.65 58.63 1dwo s ILE 51 Cb 0.21 -2.90 -0.05 0.00 -1.58 0.00 0.00 42.46 38.14 1dwo s ILE 51 CO 0.35 0.56 0.26 0.59 -1.23 0.00 0.00 174.94 175.47 1dwo n ASN 52 N 2.61 0.34 -3.87 3.58 4.13 -1.26 -4.97 115.26 115.81 1dwo n ASN 52 Ca -0.18 -0.67 -0.08 0.00 1.68 0.00 0.00 54.58 55.33 1dwo n ASN 52 Cb 0.53 0.94 -0.04 0.00 -1.54 0.00 0.00 39.78 39.68 1dwo n ASN 52 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1dwo s SER 53 N -1.46 -0.21 0.39 6.41 1.04 -1.26 -4.89 113.70 113.72 1dwo s SER 53 Ca 0.02 -0.68 0.11 0.00 0.48 0.00 0.00 55.95 55.88 1dwo s SER 53 Cb 0.04 0.64 0.80 0.00 0.10 0.00 0.00 66.02 67.60 1dwo s SER 53 CO 0.22 -1.20 1.90 0.15 0.98 0.00 0.00 173.24 175.28 1dwo h PHE 54 N 2.13 0.13 -0.21 5.02 3.04 -1.89 -0.88 116.94 124.28 1dwo h PHE 54 Ca -0.24 -0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.67 1dwo h PHE 54 Cb 1.25 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 39.72 1dwo h PHE 54 CO 0.40 0.34 0.03 -0.44 -2.02 0.00 0.00 178.31 176.62 1dwo h ASP 55 N 0.11 0.33 -0.71 0.41 5.19 -1.96 -1.63 116.42 118.16 1dwo h ASP 55 Ca 0.02 -0.26 -0.01 0.00 -0.62 0.00 0.00 57.03 56.16 1dwo h ASP 55 Cb 0.46 -0.09 -0.03 0.00 0.18 0.00 0.00 39.33 39.85 1dwo h ASP 55 CO 0.03 0.51 0.40 -0.08 -3.12 0.00 0.00 179.24 176.98 1dwo h GLU 56 N 0.15 0.99 -0.64 3.56 4.81 -1.90 -2.05 114.58 119.48 1dwo h GLU 56 Ca 0.06 -0.11 0.12 0.00 -0.13 0.00 0.00 59.36 59.31 1dwo h GLU 56 Cb 0.32 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 1dwo h GLU 56 CO 0.00 0.73 0.43 -0.92 -0.73 0.00 0.00 179.01 178.53 1dwo h TYR 57 N 0.98 0.40 -0.01 0.92 3.20 -1.04 -1.54 116.97 119.88 1dwo h TYR 57 Ca 0.25 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.13 1dwo h TYR 57 Cb 0.02 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.16 1dwo h TYR 57 CO -0.01 0.18 0.00 0.43 -1.64 0.00 0.00 178.16 177.12 1dwo n SER 58 N -4.46 0.43 -0.26 -2.11 7.64 -0.62 -1.77 113.62 112.46 1dwo n SER 58 Ca 0.11 -1.18 0.07 0.00 1.01 0.00 0.00 58.87 58.88 1dwo n SER 58 Cb 0.45 -0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.85 1dwo n SER 58 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1dwo h GLU 59 N 0.67 0.20 -0.79 1.43 4.22 -1.20 -1.71 114.58 117.40 1dwo h GLU 59 Ca 0.00 -0.01 0.09 0.00 0.08 0.00 0.00 59.36 59.52 1dwo h GLU 59 Cb 0.14 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.29 1dwo h GLU 59 CO 0.00 0.13 0.52 -1.35 -2.18 0.00 0.00 179.01 176.13 1dwo h PRO 60 N 0.21 0.72 -0.24 0.92 0.11 -1.85 -0.58 132.00 131.30 1dwo h PRO 60 Ca 0.45 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.48 1dwo h PRO 60 Cb 0.81 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.75 1dwo h PRO 60 CO -0.59 0.48 -0.01 1.25 -0.21 0.00 0.00 178.00 178.92 1dwo h LEU 61 N 0.74 0.42 -0.37 2.35 5.85 -1.64 -2.24 115.31 120.42 1dwo h LEU 61 Ca 0.36 -0.32 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 1dwo h LEU 61 Cb 0.43 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1dwo h LEU 61 CO -0.14 0.64 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.34 1dwo h LEU 62 N 0.19 0.81 -0.16 2.25 3.38 -1.22 0.68 115.31 121.24 1dwo h LEU 62 Ca 0.07 -0.41 0.03 0.00 0.09 0.00 0.00 57.88 57.66 1dwo h LEU 62 Cb 0.43 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1dwo h LEU 62 CO 0.01 1.04 -0.06 0.74 0.09 0.00 0.00 178.44 180.27 1dwo h THR 63 N 0.58 0.80 -0.11 0.22 2.02 -1.19 0.17 112.91 115.41 1dwo h THR 63 Ca 0.08 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.29 1dwo h THR 63 Cb 0.74 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 1dwo h THR 63 CO 0.06 0.00 -0.06 0.15 0.37 0.00 0.00 175.52 176.04 1dwo h PHE 64 N -0.03 -0.13 -0.67 3.16 3.57 -1.19 -1.54 116.94 120.11 1dwo h PHE 64 Ca 0.08 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.53 1dwo h PHE 64 Cb 0.15 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 1dwo h PHE 64 CO -0.20 -0.09 0.17 -0.07 -2.23 0.00 0.00 178.31 175.89 1dwo h LEU 65 N -0.05 0.98 -1.29 0.59 3.38 -0.51 -1.61 115.31 116.81 1dwo h LEU 65 Ca 0.06 -0.19 0.17 0.00 0.09 0.00 0.00 57.88 58.01 1dwo h LEU 65 Cb 0.14 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 40.56 1dwo h LEU 65 CO -0.14 0.94 0.59 -0.08 0.09 0.00 0.00 178.44 179.84 1dwo h GLU 66 N 1.00 0.61 -0.00 1.13 4.57 -0.44 -0.88 114.58 120.56 1dwo h GLU 66 Ca 0.21 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 1dwo h GLU 66 Cb 0.33 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 1dwo h GLU 66 CO -0.00 0.40 -0.12 1.63 -1.18 0.00 0.00 179.01 179.74 1dwo n LYS 67 N -4.59 0.50 -1.96 1.92 5.02 -0.60 -4.88 118.16 113.57 1dwo n LYS 67 Ca 0.19 -0.16 -0.41 0.00 -2.02 0.00 0.00 58.31 55.91 1dwo n LYS 67 Cb 0.57 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.06 1dwo n LYS 67 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1dwo s LEU 68 N -2.60 4.38 0.62 -0.35 1.43 -0.34 -4.95 118.68 116.87 1dwo s LEU 68 Ca 0.25 2.70 -0.17 0.00 -1.03 0.00 0.00 54.13 55.88 1dwo s LEU 68 Cb 0.20 -3.62 -0.06 0.00 0.03 0.00 0.00 46.19 42.73 1dwo s LEU 68 CO 0.50 -0.76 0.61 -2.65 0.23 0.00 0.00 176.35 174.29 1dwo n PRO 69 N 2.60 0.52 -1.71 1.29 -0.02 -1.26 -4.87 135.00 131.55 1dwo n PRO 69 Ca 0.08 0.21 -0.63 0.00 -2.02 0.00 0.00 63.50 61.14 1dwo n PRO 69 Cb 0.39 -1.83 -0.09 0.00 -0.02 0.00 0.00 33.50 31.96 1dwo n PRO 69 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1dwo n GLN 70 N -0.45 0.47 -1.00 -0.52 -0.06 -1.26 -1.28 117.38 113.28 1dwo n GLN 70 Ca 0.12 0.17 0.00 0.00 -2.00 0.00 0.00 57.00 55.29 1dwo n GLN 70 Cb 0.48 -1.75 0.00 0.00 -4.06 0.00 0.00 30.24 24.92 1dwo n GLN 70 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1dwo n GLY 71 N 3.82 0.30 3.79 1.69 0.00 -1.26 -5.00 105.19 108.53 1dwo n GLY 71 Ca 0.28 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.91 1dwo n GLY 71 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dwo s GLU 72 N -0.82 4.40 0.08 1.61 2.02 -0.40 -5.09 118.70 120.50 1dwo s GLU 72 Ca 0.00 0.96 0.06 0.00 0.02 0.00 0.00 54.97 56.00 1dwo s GLU 72 Cb 0.00 -3.26 -0.03 0.00 0.10 0.00 0.00 34.13 30.93 1dwo s GLU 72 CO 0.00 0.57 -0.15 0.15 0.02 0.00 0.00 175.26 175.85 1dwo s LYS 73 N -0.99 0.89 0.20 1.61 1.02 -1.26 -4.71 119.74 116.49 1dwo s LYS 73 Ca 0.33 -1.03 0.09 0.00 0.02 0.00 0.00 55.97 55.38 1dwo s LYS 73 Cb -0.21 -0.90 -0.04 0.00 -0.52 0.00 0.00 37.83 36.15 1dwo s LYS 73 CO 0.23 0.20 -0.18 0.14 -0.92 0.00 0.00 175.35 174.82 1dwo s VAL 74 N -1.43 1.92 -0.26 3.17 -7.23 0.20 -4.49 120.40 112.29 1dwo s VAL 74 Ca 0.01 -2.08 -0.09 0.00 -1.81 0.00 0.00 61.98 58.00 1dwo s VAL 74 Cb -0.09 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 1dwo s VAL 74 CO 0.03 -0.40 0.13 -0.63 -0.31 0.00 0.00 175.10 173.92 1dwo s ILE 75 N -2.37 4.86 -0.22 -0.62 1.01 -0.51 -0.92 121.20 122.43 1dwo s ILE 75 Ca 0.20 0.02 -0.18 0.00 0.00 0.00 0.00 60.65 60.68 1dwo s ILE 75 Cb -0.04 -3.29 -0.03 0.00 0.01 0.00 0.00 42.46 39.10 1dwo s ILE 75 CO 0.08 0.30 0.52 -0.63 0.00 0.00 0.00 174.94 175.21 1dwo s ILE 76 N 1.62 5.09 -0.25 2.92 1.01 -0.74 -1.34 121.20 129.51 1dwo s ILE 76 Ca 0.07 0.94 -0.06 0.00 0.00 0.00 0.00 60.65 61.60 1dwo s ILE 76 Cb -0.15 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.46 1dwo s ILE 76 CO 0.07 0.15 0.03 -0.69 0.00 0.00 0.00 174.94 174.50 1dwo s VAL 77 N 1.85 3.84 -0.09 2.92 1.01 0.00 -0.26 120.40 129.68 1dwo s VAL 77 Ca 0.23 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.81 1dwo s VAL 77 Cb -0.15 -2.83 0.01 0.00 0.00 0.00 0.00 36.38 33.40 1dwo s VAL 77 CO 0.09 0.30 -0.18 -0.83 0.00 0.00 0.00 175.10 174.48 1dwo s GLY 78 N 1.53 1.10 0.16 4.51 0.00 -0.11 -0.71 107.32 113.80 1dwo s GLY 78 Ca 0.05 -0.74 -0.06 0.00 0.00 0.00 0.00 44.72 43.97 1dwo s GLY 78 CO 0.01 -0.08 0.41 -1.83 0.00 0.00 0.00 173.10 171.60 1dwo s GLU 79 N 0.57 3.65 4.83 2.90 -1.05 -0.95 -1.01 118.70 127.64 1dwo s GLU 79 Ca -0.15 -0.02 0.00 0.00 -0.15 0.00 0.00 54.97 54.65 1dwo s GLU 79 Cb -0.17 -2.82 0.00 0.00 -0.44 0.00 0.00 34.13 30.70 1dwo s GLU 79 CO 0.05 0.44 0.00 0.45 0.95 0.00 0.00 175.26 177.16 1dwo n SER 80 N 0.07 0.00 0.00 0.83 2.88 -0.55 -0.78 113.62 116.07 1dwo n SER 80 Ca -0.02 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.61 1dwo n SER 80 Cb 0.52 0.00 0.46 0.00 -0.75 0.00 0.00 64.21 64.44 1dwo n SER 80 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1dwo n ALA 82 N -1.28 1.63 0.22 0.00 0.00 0.04 -2.20 120.51 118.92 1dwo n ALA 82 Ca 0.09 -0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.59 1dwo n ALA 82 Cb 0.14 -1.20 0.69 0.00 0.00 0.00 0.00 19.45 19.09 1dwo n ALA 82 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1dwo h GLY 83 N 2.04 0.00 1.68 0.00 0.00 -1.68 -0.87 103.07 104.24 1dwo h GLY 83 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 1dwo h GLY 83 CO 0.00 0.00 -0.43 1.41 0.00 0.00 0.00 176.54 177.52 1dwo h LEU 84 N 0.00 0.37 -0.42 3.11 3.38 -1.68 -0.48 115.31 119.59 1dwo h LEU 84 Ca 0.05 -0.16 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 1dwo h LEU 84 Cb 0.20 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1dwo h LEU 84 CO -0.00 0.76 -0.31 0.78 0.09 0.00 0.00 178.44 179.76 1dwo h ASN 85 N 0.29 1.00 -0.14 -0.43 2.35 -1.34 -0.79 115.58 116.52 1dwo h ASN 85 Ca 0.02 -0.44 -0.01 0.00 -0.55 0.00 0.00 56.30 55.33 1dwo h ASN 85 Cb 0.88 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.96 1dwo h ASN 85 CO 0.07 1.22 0.06 0.40 -1.65 0.00 0.00 177.43 177.54 1dwo h ILE 86 N 0.79 1.15 -0.88 2.81 2.04 -1.18 -0.95 117.51 121.29 1dwo h ILE 86 Ca 0.08 -0.44 0.02 0.00 1.00 0.00 0.00 64.86 65.53 1dwo h ILE 86 Cb 0.90 1.18 -0.05 0.00 -0.74 0.00 0.00 36.82 38.11 1dwo h ILE 86 CO 0.08 0.14 0.57 0.00 0.00 0.00 0.00 178.15 178.94 1dwo h ALA 87 N 0.90 1.14 -0.46 1.87 0.00 -0.99 -0.96 119.26 120.76 1dwo h ALA 87 Ca 0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1dwo h ALA 87 Cb 0.16 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1dwo h ALA 87 CO -0.00 0.46 0.24 0.82 0.00 0.00 0.00 179.25 180.77 1dwo h ILE 88 N 1.14 1.17 -0.58 0.00 2.04 -0.92 -2.91 117.51 117.45 1dwo h ILE 88 Ca 0.34 -0.46 -0.11 0.00 1.00 0.00 0.00 64.86 65.63 1dwo h ILE 88 Cb -0.06 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 1dwo h ILE 88 CO -0.10 0.18 -0.06 0.00 0.00 0.00 0.00 178.15 178.18 1dwo h ALA 89 N 1.09 0.80 0.00 1.87 0.00 -0.96 -2.86 119.26 119.21 1dwo h ALA 89 Ca 0.16 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1dwo h ALA 89 Cb 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1dwo h ALA 89 CO -0.02 0.67 -0.23 0.00 0.00 0.00 0.00 179.25 179.67 1dwo h ALA 90 N 0.97 1.01 -0.00 0.00 0.00 -1.13 0.20 119.26 120.32 1dwo h ALA 90 Ca 0.16 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1dwo h ALA 90 Cb 0.63 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1dwo h ALA 90 CO 0.04 0.28 -0.02 -0.25 0.00 0.00 0.00 179.25 179.31 1dwo n ASP 91 N -3.39 0.25 -0.01 0.00 8.00 -1.08 -2.68 116.55 117.64 1dwo n ASP 91 Ca 0.00 -0.85 -0.01 0.00 0.71 0.00 0.00 54.79 54.64 1dwo n ASP 91 Cb 0.43 -0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.45 1dwo n ASP 91 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1dwo n ARG 92 N -0.90 3.31 -2.61 -1.24 0.63 -0.69 -4.85 116.66 110.30 1dwo n ARG 92 Ca 0.20 -0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 57.02 1dwo n ARG 92 Cb 0.19 -1.08 0.03 0.00 0.45 0.00 0.00 32.46 32.05 1dwo n ARG 92 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1dwo n TYR 93 N -2.08 1.72 -0.34 -0.14 4.02 0.64 -4.90 117.16 116.08 1dwo n TYR 93 Ca -0.05 -2.58 0.13 0.00 -0.01 0.00 0.00 57.90 55.39 1dwo n TYR 93 Cb 0.56 -0.28 0.32 0.00 -0.02 0.00 0.00 39.34 39.92 1dwo n TYR 93 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 176.86 175.61 1dwo h VAL 94 N 3.64 0.65 -1.46 -0.72 3.04 -1.71 -0.22 116.25 119.46 1dwo h VAL 94 Ca 0.00 -0.23 0.46 0.00 -1.01 0.00 0.00 66.70 65.93 1dwo h VAL 94 Cb 1.21 -0.07 -0.11 0.00 -2.01 0.00 0.00 31.29 30.30 1dwo h VAL 94 CO 0.49 0.12 0.98 -2.24 -1.01 0.00 0.00 177.57 175.91 1dwo h ASP 95 N 0.66 0.17 -0.26 3.17 2.03 -1.90 -1.82 116.42 118.47 1dwo h ASP 95 Ca 0.57 0.10 0.00 0.00 -0.73 0.00 0.00 57.03 56.97 1dwo h ASP 95 Cb 0.94 0.09 0.00 0.00 -0.83 0.00 0.00 39.33 39.53 1dwo h ASP 95 CO -0.42 -0.13 0.00 0.29 -1.03 0.00 0.00 179.24 177.96 1dwo n LYS 96 N -4.48 2.03 -3.94 4.15 5.02 -0.10 -4.88 118.16 115.96 1dwo n LYS 96 Ca 0.38 -1.89 -0.35 0.00 -2.02 0.00 0.00 58.31 54.43 1dwo n LYS 96 Cb 1.56 -1.36 -0.14 0.00 -0.02 0.00 0.00 35.03 35.07 1dwo n LYS 96 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1dwo s ILE 97 N -1.20 3.03 -0.00 -0.18 1.01 -0.68 -0.63 121.20 122.54 1dwo s ILE 97 Ca 0.27 -0.90 -0.22 0.00 0.00 0.00 0.00 60.65 59.80 1dwo s ILE 97 Cb 0.16 -2.50 -0.20 0.00 0.01 0.00 0.00 42.46 39.93 1dwo s ILE 97 CO 0.22 0.24 1.18 0.00 0.00 0.00 0.00 174.94 176.58 1dwo h ALA 98 N 8.05 0.12 -2.90 9.38 0.00 -1.33 -3.47 119.26 129.11 1dwo h ALA 98 Ca -0.35 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.11 1dwo h ALA 98 Cb 1.12 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.78 1dwo h ALA 98 CO 0.59 0.13 0.09 0.00 0.00 0.00 0.00 179.25 180.06 1dwo s ALA 99 N -3.66 -1.28 -0.14 0.00 0.00 -1.25 -4.30 121.76 111.12 1dwo s ALA 99 Ca -0.15 0.21 -0.03 0.00 0.00 0.00 0.00 51.96 51.99 1dwo s ALA 99 Cb 0.03 0.81 -0.03 0.00 0.00 0.00 0.00 23.12 23.94 1dwo s ALA 99 CO 0.76 -0.73 -0.04 0.20 0.00 0.00 0.00 175.76 175.95 1dwo s GLY 100 N -2.78 1.72 -0.15 0.00 0.00 -0.04 -1.79 107.32 104.27 1dwo s GLY 100 Ca 0.03 -0.82 -0.01 0.00 0.00 0.00 0.00 44.72 43.91 1dwo s GLY 100 CO -0.11 -0.14 -0.11 0.14 0.00 0.00 0.00 173.10 172.88 1dwo s VAL 101 N 0.21 3.16 -0.27 1.40 1.01 0.64 -1.54 120.40 125.01 1dwo s VAL 101 Ca -0.02 -0.61 -0.08 0.00 0.00 0.00 0.00 61.98 61.27 1dwo s VAL 101 Cb -0.14 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 1dwo s VAL 101 CO 0.03 0.50 0.09 -0.36 0.00 0.00 0.00 175.10 175.36 1dwo s PHE 102 N 0.58 3.11 -0.53 5.22 0.40 0.06 -0.93 117.98 125.89 1dwo s PHE 102 Ca -0.07 -0.49 -0.03 0.00 -0.60 0.00 0.00 56.93 55.73 1dwo s PHE 102 Cb -0.15 -2.27 0.14 0.00 0.51 0.00 0.00 43.02 41.25 1dwo s PHE 102 CO 0.03 -0.40 0.35 -1.58 0.70 0.00 0.00 175.22 174.32 1dwo s HIS 103 N 1.61 3.49 -1.34 0.36 2.46 -0.18 -0.42 115.29 121.26 1dwo s HIS 103 Ca 0.06 -2.53 -0.00 0.00 0.47 0.00 0.00 55.06 53.05 1dwo s HIS 103 Cb -0.16 -3.24 0.00 0.00 -0.13 0.00 0.00 32.58 29.05 1dwo s HIS 103 CO 0.04 -0.91 0.62 0.09 -2.47 0.00 0.00 174.74 172.12 1dwo n ASN 104 N 4.02 -0.96 -4.36 9.88 3.02 -0.23 -2.47 115.26 124.16 1dwo n ASN 104 Ca 0.03 -0.87 -0.24 0.00 -0.03 0.00 0.00 54.58 53.47 1dwo n ASN 104 Cb 0.40 -3.78 -0.11 0.00 -0.61 0.00 0.00 39.78 35.67 1dwo n ASN 104 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1dwo s SER 105 N -4.35 2.91 0.24 6.41 0.15 -1.26 -1.49 113.70 116.31 1dwo s SER 105 Ca 0.01 -0.85 -0.31 0.00 0.70 0.00 0.00 55.95 55.50 1dwo s SER 105 Cb -0.01 -0.19 -0.13 0.00 -1.71 0.00 0.00 66.02 63.99 1dwo s SER 105 CO 0.83 0.02 1.48 0.18 1.20 0.00 0.00 173.24 176.96 1dwo n LEU 106 N 0.36 3.42 -3.96 3.45 4.32 0.02 -4.88 117.00 119.73 1dwo n LEU 106 Ca -0.14 1.13 -0.30 0.00 -0.02 0.00 0.00 56.01 56.68 1dwo n LEU 106 Cb 0.56 -1.47 -0.12 0.00 -1.62 0.00 0.00 43.42 40.77 1dwo n LEU 106 CO 0.29 -0.30 -0.07 -0.22 -1.22 0.00 0.00 177.39 175.87 1dwo s LEU 107 N 0.09 4.68 0.97 2.23 2.96 -1.26 -3.97 118.68 124.38 1dwo s LEU 107 Ca 0.69 -3.34 -0.12 0.00 -0.22 0.00 0.00 54.13 51.14 1dwo s LEU 107 Cb -0.61 -1.68 0.11 0.00 0.50 0.00 0.00 46.19 44.51 1dwo s LEU 107 CO 0.47 -0.19 0.76 -2.65 -1.32 0.00 0.00 176.35 173.42 1dwo n PRO 108 N 2.70 -0.67 -3.64 0.98 -0.02 -1.26 -4.92 135.00 128.16 1dwo n PRO 108 Ca 0.11 -0.15 -0.17 0.00 -2.02 0.00 0.00 63.50 61.27 1dwo n PRO 108 Cb 0.34 -2.10 -0.05 0.00 -0.02 0.00 0.00 33.50 31.67 1dwo n PRO 108 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1dwo n ASP 109 N -2.98 1.21 -0.01 2.55 5.68 -1.26 -5.02 116.55 116.73 1dwo n ASP 109 Ca 0.08 -2.48 0.07 0.00 -0.50 0.00 0.00 54.79 51.96 1dwo n ASP 109 Cb 0.54 0.68 -0.11 0.00 -1.14 0.00 0.00 41.12 41.09 1dwo n ASP 109 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1dwo n THR 110 N -0.63 0.00 0.13 2.12 -2.24 -1.26 -4.31 114.28 108.09 1dwo n THR 110 Ca -0.04 -0.30 0.01 0.00 -2.27 0.00 0.00 64.05 61.45 1dwo n THR 110 Cb 0.42 0.31 0.05 0.00 -2.10 0.00 0.00 70.33 69.01 1dwo n THR 110 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1dwo h VAL 111 N 0.00 1.01 -5.11 2.28 3.04 -1.98 -3.40 116.25 112.09 1dwo h VAL 111 Ca 0.00 -2.30 -0.49 0.00 -1.01 0.00 0.00 66.70 62.90 1dwo h VAL 111 Cb 0.61 2.41 -0.07 0.00 -2.01 0.00 0.00 31.29 32.23 1dwo h VAL 111 CO 0.00 0.55 -0.30 1.41 -1.01 0.00 0.00 177.57 178.22 1dwo n HIS 112 N -3.30 0.16 -1.86 3.17 8.25 -1.26 -5.10 115.22 115.28 1dwo n HIS 112 Ca 0.01 -1.90 -0.37 0.00 -0.26 0.00 0.00 57.72 55.20 1dwo n HIS 112 Cb 0.73 -0.30 0.05 0.00 1.12 0.00 0.00 29.99 31.59 1dwo n HIS 112 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1dwo s SER 113 N -3.34 4.98 0.51 0.41 0.15 -1.26 -4.64 113.70 110.52 1dwo s SER 113 Ca 0.11 2.57 0.29 0.00 0.70 0.00 0.00 55.95 59.61 1dwo s SER 113 Cb -0.01 -2.62 1.40 0.00 -1.71 0.00 0.00 66.02 63.09 1dwo s SER 113 CO 0.07 -1.75 1.88 -0.65 1.20 0.00 0.00 173.24 173.99 1dwo h PRO 114 N 0.90 0.08 0.00 5.44 0.11 -1.80 -2.02 132.00 134.70 1dwo h PRO 114 Ca -0.51 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1dwo h PRO 114 Cb 1.31 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1dwo h PRO 114 CO 0.55 0.05 0.00 -1.13 -0.21 0.00 0.00 178.00 177.26 1dwo n SER 115 N -4.32 0.00 -0.19 -2.05 3.41 -1.25 -4.30 113.62 104.91 1dwo n SER 115 Ca 0.19 -0.05 -0.03 0.00 -0.26 0.00 0.00 58.87 58.72 1dwo n SER 115 Cb 0.92 -0.31 0.07 0.00 -0.26 0.00 0.00 64.21 64.63 1dwo n SER 115 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1dwo h TYR 116 N 0.00 0.54 0.00 7.33 3.20 -1.72 -0.67 116.97 125.65 1dwo h TYR 116 Ca 0.00 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1dwo h TYR 116 Cb 0.28 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 1dwo h TYR 116 CO 0.00 0.26 -0.12 1.79 -1.64 0.00 0.00 178.16 178.45 1dwo h THR 117 N 0.56 0.23 -0.08 1.81 1.35 -1.81 -2.30 112.91 112.67 1dwo h THR 117 Ca 0.25 -1.10 -0.03 0.00 -0.55 0.00 0.00 66.41 64.98 1dwo h THR 117 Cb 0.15 1.92 -0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1dwo h THR 117 CO -0.17 0.12 -0.05 0.58 -0.25 0.00 0.00 175.52 175.75 1dwo h VAL 118 N 0.00 1.33 -0.32 6.82 2.07 -1.52 0.75 116.25 125.39 1dwo h VAL 118 Ca -0.00 -1.10 0.07 0.00 0.82 0.00 0.00 66.70 66.49 1dwo h VAL 118 Cb 0.91 1.89 -0.08 0.00 -1.52 0.00 0.00 31.29 32.49 1dwo h VAL 118 CO 0.02 0.31 -0.29 -0.33 0.02 0.00 0.00 177.57 177.29 1dwo h GLU 119 N -0.20 -0.25 -0.63 1.57 5.08 -1.04 0.25 114.58 119.37 1dwo h GLU 119 Ca 0.02 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1dwo h GLU 119 Cb 0.52 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 1dwo h GLU 119 CO 0.01 -0.17 0.35 0.87 -1.00 0.00 0.00 179.01 179.08 1dwo h LYS 120 N -0.26 0.85 -0.33 2.33 1.79 -1.38 0.52 116.57 120.08 1dwo h LYS 120 Ca 0.15 -0.08 -0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1dwo h LYS 120 Cb 0.51 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 30.97 1dwo h LYS 120 CO -0.47 0.62 0.20 1.25 -1.08 0.00 0.00 179.45 179.97 1dwo h LEU 121 N 0.86 0.40 -0.62 2.94 5.85 -0.30 -1.15 115.31 123.30 1dwo h LEU 121 Ca 0.22 -0.05 -0.14 0.00 0.84 0.00 0.00 57.88 58.75 1dwo h LEU 121 Cb 0.00 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1dwo h LEU 121 CO -0.04 0.33 -0.67 -0.07 -0.34 0.00 0.00 178.44 177.65 1dwo h LEU 122 N 0.43 0.00 -0.37 2.25 3.38 0.20 0.13 115.31 121.32 1dwo h LEU 122 Ca 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1dwo h LEU 122 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1dwo h LEU 122 CO -0.02 0.67 0.23 -0.33 0.09 0.00 0.00 178.44 179.08 1dwo h GLU 123 N 0.00 0.51 -0.35 1.13 5.08 -0.72 -2.26 114.58 117.97 1dwo h GLU 123 Ca -0.01 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 1dwo h GLU 123 Cb 1.21 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1dwo h GLU 123 CO 0.09 0.37 -0.06 1.03 -1.00 0.00 0.00 179.01 179.44 1dwo h SER 124 N 0.49 0.67 -3.25 1.42 0.87 -0.74 -3.39 113.55 109.62 1dwo h SER 124 Ca 0.14 -0.35 -0.61 0.00 -1.23 0.00 0.00 61.79 59.74 1dwo h SER 124 Cb -0.01 -0.18 -0.40 0.00 -0.44 0.00 0.00 62.40 61.37 1dwo h SER 124 CO -0.03 0.86 -0.74 0.12 -0.53 0.00 0.00 176.83 176.52 1dwo s PHE 125 N -4.84 2.25 -0.53 2.24 5.36 0.40 -4.96 117.98 117.90 1dwo s PHE 125 Ca -0.13 -2.66 0.24 0.00 -0.96 0.00 0.00 56.93 53.42 1dwo s PHE 125 Cb 0.09 -1.95 0.24 0.00 -0.34 0.00 0.00 43.02 41.06 1dwo s PHE 125 CO 0.79 -0.73 1.25 -1.00 -1.46 0.00 0.00 175.22 174.07 1dwo h PRO 126 N 6.22 0.00 -4.89 10.12 0.13 -1.62 -3.41 132.00 138.55 1dwo h PRO 126 Ca 0.07 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.53 1dwo h PRO 126 Cb 0.88 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.70 1dwo h PRO 126 CO 0.53 0.00 -0.73 0.34 -0.23 0.00 0.00 178.00 177.90 1dwo s ASP 127 N -4.57 4.40 -0.49 1.44 3.68 -1.26 -4.94 116.67 114.94 1dwo s ASP 127 Ca 0.04 -0.87 0.02 0.00 2.13 0.00 0.00 52.55 53.88 1dwo s ASP 127 Cb 0.12 -1.68 0.57 0.00 -1.45 0.00 0.00 42.92 40.48 1dwo s ASP 127 CO 0.74 -0.14 1.92 0.79 0.13 0.00 0.00 175.17 178.61 1dwo n TRP 128 N 4.68 2.94 0.00 -5.34 7.02 -1.26 -5.00 117.44 120.49 1dwo n TRP 128 Ca -0.16 -2.12 0.00 0.00 -1.02 0.00 0.00 57.50 54.20 1dwo n TRP 128 Cb 0.47 -1.06 0.00 0.00 -2.42 0.00 0.00 31.31 28.30 1dwo n TRP 128 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1dwo n ARG 129 N -0.97 0.00 -0.13 -0.99 1.74 -1.26 -1.15 116.66 113.90 1dwo n ARG 129 Ca 0.57 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.67 1dwo n ARG 129 Cb 1.32 0.00 0.07 0.00 -1.02 0.00 0.00 32.46 32.83 1dwo n ARG 129 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1dwo n ASP 130 N 8.36 1.40 -4.77 0.55 5.75 -1.26 -4.93 116.55 121.65 1dwo n ASP 130 Ca 0.00 -2.10 -0.41 0.00 -0.01 0.00 0.00 54.79 52.27 1dwo n ASP 130 Cb 0.00 -0.34 -0.01 0.00 -1.03 0.00 0.00 41.12 39.73 1dwo n ASP 130 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1dwo s THR 131 N -1.54 2.49 0.01 2.12 2.01 -0.30 -4.11 115.64 116.32 1dwo s THR 131 Ca 0.10 0.49 0.01 0.00 0.31 0.00 0.00 61.69 62.60 1dwo s THR 131 Cb 0.07 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 1dwo s THR 131 CO 0.05 0.11 0.05 -1.61 -0.69 0.00 0.00 174.62 172.53 1dwo s GLU 132 N -1.94 2.92 0.10 4.92 2.02 -0.49 -4.87 118.70 121.36 1dwo s GLU 132 Ca 0.51 -0.57 0.10 0.00 0.02 0.00 0.00 54.97 55.03 1dwo s GLU 132 Cb -0.42 -2.76 -0.04 0.00 0.10 0.00 0.00 34.13 31.02 1dwo s GLU 132 CO 0.56 0.62 -0.25 0.71 0.02 0.00 0.00 175.26 176.92 1dwo s TYR 133 N -1.18 2.37 0.18 1.61 1.51 -1.26 -0.80 117.35 119.77 1dwo s TYR 133 Ca 0.23 -0.36 -0.06 0.00 -1.01 0.00 0.00 57.07 55.87 1dwo s TYR 133 Cb -0.12 -1.32 -0.02 0.00 -0.11 0.00 0.00 41.96 40.38 1dwo s TYR 133 CO 0.14 0.28 0.22 -0.06 -1.11 0.00 0.00 175.55 175.02 1dwo s PHE 134 N -0.99 0.71 0.10 2.71 0.40 0.25 -4.96 117.98 116.20 1dwo s PHE 134 Ca 0.14 -1.03 -0.00 0.00 -0.60 0.00 0.00 56.93 55.43 1dwo s PHE 134 Cb -0.10 -0.25 -0.04 0.00 0.51 0.00 0.00 43.02 43.14 1dwo s PHE 134 CO 0.05 -0.70 0.00 0.95 0.70 0.00 0.00 175.22 176.22 1dwo s THR 135 N -4.05 0.28 0.14 0.64 -4.23 -1.26 -0.65 115.64 106.51 1dwo s THR 135 Ca 0.26 -1.88 -0.09 0.00 -1.18 0.00 0.00 61.69 58.80 1dwo s THR 135 Cb 0.05 -1.79 -0.01 0.00 1.34 0.00 0.00 72.50 72.08 1dwo s THR 135 CO 0.05 -0.73 0.24 0.72 -0.54 0.00 0.00 174.62 174.36 1dwo s PHE 136 N -3.91 0.33 -0.23 3.99 -0.12 -0.85 -4.97 117.98 112.22 1dwo s PHE 136 Ca 0.16 -0.72 -0.10 0.00 -0.05 0.00 0.00 56.93 56.22 1dwo s PHE 136 Cb 0.07 -0.07 -0.05 0.00 -0.63 0.00 0.00 43.02 42.34 1dwo s PHE 136 CO -0.04 -0.65 0.14 0.99 -0.05 0.00 0.00 175.22 175.61 1dwo s THR 137 N -3.93 5.25 0.37 -4.49 2.01 -1.26 -0.69 115.64 112.90 1dwo s THR 137 Ca 0.13 0.14 -0.05 0.00 0.31 0.00 0.00 61.69 62.22 1dwo s THR 137 Cb 0.04 -3.44 0.08 0.00 0.01 0.00 0.00 72.50 69.19 1dwo s THR 137 CO -0.04 0.36 0.50 -0.46 -0.69 0.00 0.00 174.62 174.30 1dwo n ASN 138 N 4.18 0.17 0.29 3.53 2.04 -0.16 -4.87 115.26 120.44 1dwo n ASN 138 Ca -0.15 -1.26 0.19 0.00 -0.44 0.00 0.00 54.58 52.92 1dwo n ASN 138 Cb 0.52 -0.37 1.04 0.00 -2.53 0.00 0.00 39.78 38.44 1dwo n ASN 138 CO 0.00 0.00 0.00 -0.29 -0.44 0.00 0.00 177.26 176.53 1dwo h ILE 139 N -1.09 0.00 0.00 1.53 2.10 -1.90 0.11 117.51 118.26 1dwo h ILE 139 Ca -0.16 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.78 1dwo h ILE 139 Cb 0.48 0.84 0.00 0.00 -1.09 0.00 0.00 36.82 37.05 1dwo h ILE 139 CO 0.13 0.00 -0.09 0.35 -1.08 0.00 0.00 178.15 177.46 1dwo n THR 140 N -2.85 1.48 -0.44 2.19 -2.24 -1.26 -4.98 114.28 106.18 1dwo n THR 140 Ca -0.03 -1.77 0.00 0.00 -2.27 0.00 0.00 64.05 59.99 1dwo n THR 140 Cb 0.08 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 1dwo n THR 140 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dwo n GLY 141 N -1.11 0.74 3.77 3.38 0.00 0.38 -5.06 105.19 107.28 1dwo n GLY 141 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 1dwo n GLY 141 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dwo s GLU 142 N -0.56 4.37 -0.15 1.61 0.41 -1.26 -4.71 118.70 118.41 1dwo s GLU 142 Ca 0.00 1.98 -0.29 0.00 -0.41 0.00 0.00 54.97 56.26 1dwo s GLU 142 Cb 0.00 -3.00 -0.01 0.00 -1.78 0.00 0.00 34.13 29.34 1dwo s GLU 142 CO 0.00 -0.09 0.99 0.99 -0.49 0.00 0.00 175.26 176.66 1dwo s THR 143 N -1.22 4.77 -0.13 3.63 2.01 -1.26 -0.99 115.64 122.45 1dwo s THR 143 Ca 0.50 1.97 -0.01 0.00 0.31 0.00 0.00 61.69 64.45 1dwo s THR 143 Cb -0.35 -4.28 -0.02 0.00 0.01 0.00 0.00 72.50 67.86 1dwo s THR 143 CO 0.45 -0.05 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.63 1dwo s ILE 144 N 2.39 3.55 -0.23 1.82 -1.09 0.13 -4.90 121.20 122.87 1dwo s ILE 144 Ca 0.45 -0.49 -0.10 0.00 -2.23 0.00 0.00 60.65 58.28 1dwo s ILE 144 Cb -0.17 -2.51 -0.05 0.00 -1.58 0.00 0.00 42.46 38.15 1dwo s ILE 144 CO 0.13 0.53 0.15 -0.89 -1.23 0.00 0.00 174.94 173.63 1dwo s THR 145 N 0.08 5.35 0.34 2.92 2.01 -1.26 -2.00 115.64 123.07 1dwo s THR 145 Ca -0.03 0.17 0.09 0.00 0.31 0.00 0.00 61.69 62.24 1dwo s THR 145 Cb -0.14 -3.48 -0.05 0.00 0.01 0.00 0.00 72.50 68.84 1dwo s THR 145 CO 0.03 0.36 0.05 0.42 -0.69 0.00 0.00 174.62 174.80 1dwo s THR 146 N 0.93 2.81 0.03 -0.82 -4.23 0.18 -4.30 115.64 110.22 1dwo s THR 146 Ca 0.07 -1.88 -0.07 0.00 -1.18 0.00 0.00 61.69 58.64 1dwo s THR 146 Cb -0.13 -2.86 -0.00 0.00 1.34 0.00 0.00 72.50 70.85 1dwo s THR 146 CO 0.03 -0.21 0.13 0.00 -0.54 0.00 0.00 174.62 174.04 1dwo s MET 147 N -3.76 0.57 -0.29 3.99 0.23 -0.26 -0.59 119.30 119.21 1dwo s MET 147 Ca 0.35 -0.60 0.03 0.00 -1.03 0.00 0.00 55.69 54.45 1dwo s MET 147 Cb -0.01 0.23 0.07 0.00 -1.53 0.00 0.00 34.83 33.59 1dwo s MET 147 CO 0.20 -0.14 -0.06 0.21 -2.03 0.00 0.00 175.02 173.20 1dwo s LYS 148 N -2.14 1.98 0.31 3.16 2.47 0.02 -1.74 119.74 123.80 1dwo s LYS 148 Ca -0.09 -1.52 -0.30 0.00 -1.56 0.00 0.00 55.97 52.51 1dwo s LYS 148 Cb -0.04 -2.99 -0.11 0.00 -1.46 0.00 0.00 37.83 33.23 1dwo s LYS 148 CO -0.02 -0.69 1.57 1.28 0.16 0.00 0.00 175.35 177.65 1dwo n LEU 149 N 4.38 4.46 -4.82 5.43 4.77 -1.26 -1.39 117.00 128.57 1dwo n LEU 149 Ca -0.08 1.17 -0.33 0.00 -0.03 0.00 0.00 56.01 56.74 1dwo n LEU 149 Cb 0.42 -1.60 -0.03 0.00 -2.33 0.00 0.00 43.42 39.88 1dwo n LEU 149 CO 0.21 0.16 0.69 -0.83 -1.33 0.00 0.00 177.39 176.29 1dwo s GLY 150 N 0.36 2.25 0.37 -0.72 0.00 -1.26 -4.86 107.32 103.47 1dwo s GLY 150 Ca 0.62 0.38 0.16 0.00 0.00 0.00 0.00 44.72 45.87 1dwo s GLY 150 CO 0.52 0.68 1.79 0.74 0.00 0.00 0.00 173.10 176.83 1dwo h PHE 151 N 1.14 0.00 -0.11 1.90 0.04 -1.93 0.70 116.94 118.68 1dwo h PHE 151 Ca -0.48 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.18 1dwo h PHE 151 Cb 1.20 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.35 1dwo h PHE 151 CO 0.60 0.38 -0.37 0.28 -0.60 0.00 0.00 178.31 178.60 1dwo h VAL 152 N 0.00 1.38 -0.67 -0.55 2.07 -1.94 -0.87 116.25 115.67 1dwo h VAL 152 Ca -0.00 -1.70 0.03 0.00 0.82 0.00 0.00 66.70 65.85 1dwo h VAL 152 Cb 0.77 2.15 -0.04 0.00 -1.52 0.00 0.00 31.29 32.65 1dwo h VAL 152 CO 0.05 0.50 0.42 0.25 0.02 0.00 0.00 177.57 178.81 1dwo h LEU 153 N 0.03 0.69 0.02 2.57 5.85 -1.78 0.74 115.31 123.43 1dwo h LEU 153 Ca -0.01 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1dwo h LEU 153 Cb 1.00 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 1dwo h LEU 153 CO 0.08 0.48 -0.06 -0.07 -0.34 0.00 0.00 178.44 178.52 1dwo h LEU 154 N 0.82 -0.17 -0.06 2.25 4.07 -0.83 0.83 115.31 122.22 1dwo h LEU 154 Ca 0.27 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 58.25 1dwo h LEU 154 Cb 0.02 0.07 -0.00 0.00 1.08 0.00 0.00 40.66 41.83 1dwo h LEU 154 CO -0.11 -0.09 0.02 -0.09 -1.08 0.00 0.00 178.44 177.09 1dwo h ARG 155 N -0.12 0.09 0.02 1.13 9.65 -0.33 0.15 114.38 124.97 1dwo h ARG 155 Ca 0.02 -0.02 -0.33 0.00 -1.10 0.00 0.00 59.98 58.55 1dwo h ARG 155 Cb 0.14 -0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 28.65 1dwo h ARG 155 CO -0.05 0.23 -2.00 0.39 2.80 0.00 0.00 179.97 181.34 1dwo n GLU 156 N -4.95 0.67 -0.10 0.20 1.02 0.18 -2.40 120.64 115.25 1dwo n GLU 156 Ca -0.06 0.19 -0.13 0.00 -0.02 0.00 0.00 57.16 57.14 1dwo n GLU 156 Cb 0.11 -1.68 -0.12 0.00 -0.02 0.00 0.00 31.44 29.73 1dwo n GLU 156 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1dwo n ASN 157 N -3.03 1.57 -0.12 1.62 4.13 0.25 -4.28 115.26 115.40 1dwo n ASN 157 Ca -0.26 -0.07 -0.21 0.00 1.68 0.00 0.00 54.58 55.72 1dwo n ASN 157 Cb 1.08 0.20 -0.12 0.00 -1.54 0.00 0.00 39.78 39.40 1dwo n ASN 157 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1dwo n LEU 158 N -2.94 2.68 -1.77 3.41 4.32 -0.99 -3.26 117.00 118.45 1dwo n LEU 158 Ca -0.35 0.01 -0.19 0.00 -0.02 0.00 0.00 56.01 55.47 1dwo n LEU 158 Cb 0.99 -0.90 0.12 0.00 -1.62 0.00 0.00 43.42 42.01 1dwo n LEU 158 CO 0.29 0.83 0.77 0.49 -1.22 0.00 0.00 177.39 178.54 1dwo n PHE 159 N -3.55 2.22 -0.28 -1.77 3.01 0.52 -3.32 117.46 114.30 1dwo n PHE 159 Ca -0.47 -2.15 -0.01 0.00 1.01 0.00 0.00 57.45 55.83 1dwo n PHE 159 Cb 0.96 -0.71 0.05 0.00 -0.01 0.00 0.00 39.48 39.77 1dwo n PHE 159 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1dwo h THR 160 N 1.34 0.14 -0.40 4.37 2.02 -1.66 -0.75 112.91 117.97 1dwo h THR 160 Ca 0.39 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.57 1dwo h THR 160 Cb 1.51 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 1dwo h THR 160 CO 0.84 0.00 0.00 0.29 0.37 0.00 0.00 175.52 177.02 1dwo n LYS 161 N -5.48 3.23 -2.53 6.66 4.76 -1.26 -4.93 118.16 118.61 1dwo n LYS 161 Ca 0.09 -2.64 -0.31 0.00 -2.87 0.00 0.00 58.31 52.58 1dwo n LYS 161 Cb 0.39 -1.71 -0.03 0.00 -1.84 0.00 0.00 35.03 31.85 1dwo n LYS 161 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1dwo n THR 163 N -1.65 3.44 -0.32 0.00 -1.04 -1.26 -4.79 114.28 108.65 1dwo n THR 163 Ca 0.04 -0.46 0.04 0.00 -2.04 0.00 0.00 64.05 61.64 1dwo n THR 163 Cb 0.54 -1.11 0.19 0.00 -1.82 0.00 0.00 70.33 68.14 1dwo n THR 163 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1dwo h ASP 164 N 0.20 0.79 0.33 8.00 3.45 -1.98 -0.28 116.42 126.94 1dwo h ASP 164 Ca -0.48 0.05 -0.06 0.00 0.43 0.00 0.00 57.03 56.97 1dwo h ASP 164 Cb 1.36 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 40.01 1dwo h ASP 164 CO 0.49 0.44 -0.27 1.23 -1.57 0.00 0.00 179.24 179.57 1dwo h GLY 165 N 0.89 0.00 0.96 2.75 0.00 -1.98 -0.16 103.07 105.54 1dwo h GLY 165 Ca 0.44 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.51 1dwo h GLY 165 CO -0.25 0.00 -1.13 0.83 0.00 0.00 0.00 176.54 175.99 1dwo h GLU 166 N 0.00 0.43 -0.45 4.80 4.39 -1.53 -1.55 114.58 120.67 1dwo h GLU 166 Ca -0.00 -0.71 -0.03 0.00 0.34 0.00 0.00 59.36 58.95 1dwo h GLU 166 Cb 0.50 0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 29.40 1dwo h GLU 166 CO 0.03 1.34 0.15 -0.92 -1.16 0.00 0.00 179.01 178.45 1dwo h TYR 167 N -0.11 0.72 -0.65 4.33 3.20 -1.03 -1.51 116.97 121.92 1dwo h TYR 167 Ca -0.19 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 61.59 1dwo h TYR 167 Cb 1.89 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 39.92 1dwo h TYR 167 CO 0.16 0.64 0.35 1.49 -1.64 0.00 0.00 178.16 179.16 1dwo h GLU 168 N 0.59 0.91 -0.59 1.82 4.57 -1.09 -2.03 114.58 118.75 1dwo h GLU 168 Ca 0.15 -0.11 0.10 0.00 -1.18 0.00 0.00 59.36 58.32 1dwo h GLU 168 Cb 0.26 -0.18 -0.08 0.00 -0.16 0.00 0.00 28.75 28.59 1dwo h GLU 168 CO -0.01 0.70 0.16 1.25 -1.18 0.00 0.00 179.01 179.93 1dwo h LEU 169 N 0.89 0.08 -0.79 1.64 6.46 -1.05 -1.68 115.31 120.85 1dwo h LEU 169 Ca 0.23 0.10 0.03 0.00 -0.12 0.00 0.00 57.88 58.11 1dwo h LEU 169 Cb 0.06 0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 40.06 1dwo h LEU 169 CO -0.03 0.05 0.51 0.00 -0.62 0.00 0.00 178.44 178.35 1dwo h ALA 170 N 1.45 1.03 -0.22 1.25 0.00 -0.74 -1.32 119.26 120.71 1dwo h ALA 170 Ca 0.31 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 1dwo h ALA 170 Cb 0.43 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1dwo h ALA 170 CO -0.36 0.35 -0.17 0.87 0.00 0.00 0.00 179.25 179.94 1dwo h LYS 171 N 1.01 0.38 0.00 0.00 1.57 -0.77 -1.53 116.57 117.23 1dwo h LYS 171 Ca 0.31 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 1dwo h LYS 171 Cb -0.02 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 1dwo h LYS 171 CO -0.10 0.55 -0.16 0.52 -0.57 0.00 0.00 179.45 179.69 1dwo h MET 172 N 0.35 0.00 0.00 3.15 2.86 -0.35 -3.35 114.93 117.59 1dwo h MET 172 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1dwo h MET 172 Cb 0.51 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.17 1dwo h MET 172 CO 0.03 0.16 0.00 1.33 1.06 0.00 0.00 176.91 179.49 1dwo n VAL 173 N -3.29 0.26 -2.25 -2.22 0.24 -0.96 -5.07 118.33 105.04 1dwo n VAL 173 Ca 0.01 -0.40 -0.41 0.00 -2.04 0.00 0.00 64.34 61.50 1dwo n VAL 173 Cb 0.41 1.10 -0.03 0.00 -1.47 0.00 0.00 33.84 33.85 1dwo n VAL 173 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 1dwo s MET 174 N -0.26 4.46 0.42 7.34 0.00 -0.58 -4.70 119.30 125.97 1dwo s MET 174 Ca 0.00 2.05 0.03 0.00 0.00 0.00 0.00 55.69 57.78 1dwo s MET 174 Cb 0.00 -3.13 -0.02 0.00 0.00 0.00 0.00 34.83 31.68 1dwo s MET 174 CO 0.00 -0.06 0.11 1.03 0.00 0.00 0.00 175.02 176.10 1dwo s ARG 175 N -1.44 1.97 0.59 4.11 0.52 -0.33 -5.03 118.95 119.34 1dwo s ARG 175 Ca 0.48 -2.21 -0.15 0.00 -0.52 0.00 0.00 55.73 53.33 1dwo s ARG 175 Cb -0.37 -0.78 -0.04 0.00 0.52 0.00 0.00 34.95 34.29 1dwo s ARG 175 CO 0.47 -0.45 1.05 0.15 0.02 0.00 0.00 175.30 176.54 1dwo s LYS 176 N -3.74 3.35 0.31 3.54 1.02 -1.26 -4.40 119.74 118.56 1dwo s LYS 176 Ca 0.21 1.17 -0.10 0.00 0.02 0.00 0.00 55.97 57.27 1dwo s LYS 176 Cb 0.03 -2.04 0.01 0.00 -0.52 0.00 0.00 37.83 35.31 1dwo s LYS 176 CO 0.13 -0.78 0.53 0.20 -0.92 0.00 0.00 175.35 174.51 1dwo s GLY 177 N -2.88 0.86 -0.13 -3.33 0.00 -0.71 -4.20 107.32 96.92 1dwo s GLY 177 Ca 0.63 -1.09 -0.21 0.00 0.00 0.00 0.00 44.72 44.05 1dwo s GLY 177 CO 0.38 -0.71 0.52 -0.45 0.00 0.00 0.00 173.10 172.84 1dwo s SER 178 N -3.11 -0.51 0.36 1.64 0.15 -1.26 -1.10 113.70 109.87 1dwo s SER 178 Ca 0.24 0.81 0.24 0.00 0.70 0.00 0.00 55.95 57.94 1dwo s SER 178 Cb -0.01 0.83 0.44 0.00 -1.71 0.00 0.00 66.02 65.56 1dwo s SER 178 CO 0.14 -0.33 1.61 -0.07 1.20 0.00 0.00 173.24 175.79 1dwo h LEU 179 N 4.53 0.00 -0.80 3.45 3.38 -2.00 -3.47 115.31 120.40 1dwo h LEU 179 Ca -0.28 -0.01 -0.53 0.00 0.09 0.00 0.00 57.88 57.16 1dwo h LEU 179 Cb 1.17 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.69 1dwo h LEU 179 CO 0.26 0.00 -0.78 0.49 0.09 0.00 0.00 178.44 178.50 1dwo n PHE 180 N -2.84 -1.64 -0.21 1.13 3.01 -1.26 -4.84 117.46 110.82 1dwo n PHE 180 Ca 0.04 0.71 -0.07 0.00 1.01 0.00 0.00 57.45 59.13 1dwo n PHE 180 Cb 0.50 -2.63 0.03 0.00 -0.01 0.00 0.00 39.48 37.37 1dwo n PHE 180 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 1dwo h GLN 181 N -1.24 0.86 0.00 -1.08 4.15 -1.92 0.87 115.11 116.74 1dwo h GLN 181 Ca -0.55 -0.15 -0.08 0.00 0.77 0.00 0.00 58.65 58.64 1dwo h GLN 181 Cb 1.36 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.89 1dwo h GLN 181 CO 0.75 0.72 -0.38 -2.95 -1.93 0.00 0.00 178.83 175.04 1dwo h ASN 182 N 0.80 0.00 0.99 -0.69 -0.00 -1.90 0.38 115.58 115.16 1dwo h ASN 182 Ca 0.20 0.00 -0.19 0.00 -0.00 0.00 0.00 56.30 56.31 1dwo h ASN 182 Cb 0.17 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 38.47 1dwo h ASN 182 CO -0.02 0.38 -0.88 0.58 -0.00 0.00 0.00 177.43 177.49 1dwo h VAL 183 N 0.00 1.58 -0.47 6.14 2.07 -1.53 -2.87 116.25 121.17 1dwo h VAL 183 Ca -0.00 -3.08 -0.10 0.00 0.82 0.00 0.00 66.70 64.33 1dwo h VAL 183 Cb 0.77 2.69 -0.01 0.00 -1.52 0.00 0.00 31.29 33.22 1dwo h VAL 183 CO 0.05 0.86 -0.12 -0.07 0.02 0.00 0.00 177.57 178.32 1dwo h LEU 184 N 0.00 0.91 -1.41 2.57 3.38 -0.50 -2.66 115.31 117.61 1dwo h LEU 184 Ca -0.01 -0.36 0.10 0.00 0.09 0.00 0.00 57.88 57.70 1dwo h LEU 184 Cb 1.62 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 42.07 1dwo h LEU 184 CO 0.11 1.07 0.50 0.00 0.09 0.00 0.00 178.44 180.21 1dwo h ALA 185 N 0.88 1.83 -0.00 1.53 0.00 -0.87 -0.31 119.26 122.31 1dwo h ALA 185 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1dwo h ALA 185 Cb 0.67 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1dwo h ALA 185 CO 0.05 0.01 -0.01 1.04 0.00 0.00 0.00 179.25 180.33 1dwo n GLN 186 N -4.50 0.99 -3.26 0.00 6.02 -1.03 -4.93 117.38 110.68 1dwo n GLN 186 Ca 0.13 -0.16 -0.36 0.00 -0.01 0.00 0.00 57.00 56.60 1dwo n GLN 186 Cb 0.35 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.06 1dwo n GLN 186 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1dwo s ARG 187 N -2.12 4.09 0.21 -1.09 3.52 -0.13 -5.03 118.95 118.41 1dwo s ARG 187 Ca 0.42 0.64 -0.31 0.00 -0.13 0.00 0.00 55.73 56.35 1dwo s ARG 187 Cb 0.21 -2.93 -0.15 0.00 -1.56 0.00 0.00 34.95 30.52 1dwo s ARG 187 CO 0.39 0.46 1.11 -2.30 -0.81 0.00 0.00 175.30 174.14 1dwo n PRO 188 N 0.83 1.23 -0.72 5.12 -0.02 -1.26 -4.56 135.00 135.62 1dwo n PRO 188 Ca -0.05 0.44 -0.31 0.00 -2.02 0.00 0.00 63.50 61.56 1dwo n PRO 188 Cb 0.51 -1.88 0.16 0.00 -0.02 0.00 0.00 33.50 32.27 1dwo n PRO 188 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1dwo n LYS 189 N 1.42 -0.40 -2.46 -0.52 5.02 -1.26 -4.71 118.16 115.24 1dwo n LYS 189 Ca 0.13 -0.05 -0.35 0.00 -2.02 0.00 0.00 58.31 56.02 1dwo n LYS 189 Cb 0.27 -2.31 -0.03 0.00 -0.02 0.00 0.00 35.03 32.95 1dwo n LYS 189 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1dwo s PHE 190 N -2.57 2.97 0.45 2.13 0.08 -1.26 -4.98 117.98 114.79 1dwo s PHE 190 Ca 0.66 1.58 -0.04 0.00 0.12 0.00 0.00 56.93 59.25 1dwo s PHE 190 Cb -0.23 -3.15 -0.04 0.00 -0.57 0.00 0.00 43.02 39.03 1dwo s PHE 190 CO 0.59 -1.00 0.73 0.95 -0.10 0.00 0.00 175.22 176.40 1dwo s THR 191 N -1.84 4.95 0.12 0.64 -4.23 -1.26 -4.51 115.64 109.51 1dwo s THR 191 Ca 0.66 0.08 -0.11 0.00 -1.18 0.00 0.00 61.69 61.14 1dwo s THR 191 Cb -0.20 -3.86 -0.13 0.00 1.34 0.00 0.00 72.50 69.65 1dwo s THR 191 CO 0.24 -0.77 1.35 -0.08 -0.54 0.00 0.00 174.62 174.82 1dwo h GLU 192 N 0.39 0.79 -0.21 3.99 4.57 -1.93 0.28 114.58 122.46 1dwo h GLU 192 Ca -0.48 -0.60 -0.18 0.00 -1.18 0.00 0.00 59.36 56.92 1dwo h GLU 192 Cb 1.21 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.91 1dwo h GLU 192 CO 0.62 1.21 -0.59 -0.22 -1.18 0.00 0.00 179.01 178.85 1dwo h LYS 193 N 0.57 0.76 0.00 1.92 3.11 -1.93 -2.15 116.57 118.85 1dwo h LYS 193 Ca -0.03 -0.55 0.00 0.00 -2.81 0.00 0.00 60.65 57.26 1dwo h LYS 193 Cb 1.32 0.09 0.00 0.00 -1.00 0.00 0.00 32.23 32.64 1dwo h LYS 193 CO 0.15 1.17 0.00 0.41 -2.81 0.00 0.00 179.45 178.36 1dwo n GLY 194 N 0.53 1.55 0.33 5.01 0.00 -1.23 -4.13 105.19 107.25 1dwo n GLY 194 Ca -0.06 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.91 1dwo n GLY 194 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1dwo h TYR 195 N 0.00 1.14 0.00 1.61 3.20 -1.51 -1.50 116.97 119.91 1dwo h TYR 195 Ca 0.00 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.82 1dwo h TYR 195 Cb 0.00 -0.35 -0.00 0.00 1.54 0.00 0.00 36.73 37.92 1dwo h TYR 195 CO 0.00 0.82 -0.00 0.78 -1.64 0.00 0.00 178.16 178.12 1dwo h GLY 196 N 1.12 0.00 0.84 1.82 0.00 -0.33 -2.71 103.07 103.81 1dwo h GLY 196 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1dwo h GLY 196 CO -0.04 0.00 -0.67 -1.14 0.00 0.00 0.00 176.54 174.70 1dwo n SER 197 N -3.60 0.60 -4.77 0.19 3.41 -0.57 -4.92 113.62 103.97 1dwo n SER 197 Ca -0.03 -0.27 -0.40 0.00 -0.26 0.00 0.00 58.87 57.91 1dwo n SER 197 Cb 0.08 0.42 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 1dwo n SER 197 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1dwo s ILE 198 N -3.06 2.65 0.46 -1.33 1.09 -1.02 -5.00 121.20 114.98 1dwo s ILE 198 Ca 0.09 0.60 -0.23 0.00 -1.10 0.00 0.00 60.65 60.00 1dwo s ILE 198 Cb 0.16 -3.36 -0.07 0.00 -1.06 0.00 0.00 42.46 38.13 1dwo s ILE 198 CO 0.74 0.10 1.22 -0.54 -0.10 0.00 0.00 174.94 176.36 1dwo s LYS 199 N -2.15 3.73 -0.05 2.79 -0.14 -1.26 -4.90 119.74 117.76 1dwo s LYS 199 Ca 0.55 1.91 -0.02 0.00 -1.36 0.00 0.00 55.97 57.06 1dwo s LYS 199 Cb -0.38 -2.47 0.03 0.00 -1.68 0.00 0.00 37.83 33.32 1dwo s LYS 199 CO 0.49 -0.61 0.04 0.15 -0.76 0.00 0.00 175.35 174.66 1dwo s LYS 200 N -2.61 0.18 -0.06 1.68 1.02 -1.26 -0.86 119.74 117.84 1dwo s LYS 200 Ca 0.63 0.26 0.05 0.00 0.02 0.00 0.00 55.97 56.93 1dwo s LYS 200 Cb -0.32 -0.66 -0.02 0.00 -0.52 0.00 0.00 37.83 36.31 1dwo s LYS 200 CO 0.39 -0.31 -0.19 0.08 -0.92 0.00 0.00 175.35 174.41 1dwo s VAL 201 N 2.01 2.60 -0.23 3.17 1.01 -0.59 -0.48 120.40 127.89 1dwo s VAL 201 Ca 0.04 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.15 1dwo s VAL 201 Cb -0.12 -1.99 0.04 0.00 0.00 0.00 0.00 36.38 34.31 1dwo s VAL 201 CO -0.04 0.57 -0.14 -0.47 0.00 0.00 0.00 175.10 175.03 1dwo s TYR 202 N -0.41 3.04 -0.10 5.22 5.04 -0.13 -0.76 117.35 129.25 1dwo s TYR 202 Ca 0.04 -1.95 -0.02 0.00 -2.44 0.00 0.00 57.07 52.70 1dwo s TYR 202 Cb -0.12 -1.94 -0.03 0.00 0.35 0.00 0.00 41.96 40.22 1dwo s TYR 202 CO 0.02 -0.83 -0.02 0.42 -1.34 0.00 0.00 175.55 173.79 1dwo s ILE 203 N 1.21 4.09 0.22 3.14 1.01 0.44 -0.29 121.20 131.02 1dwo s ILE 203 Ca -0.02 -0.32 -0.21 0.00 0.00 0.00 0.00 60.65 60.10 1dwo s ILE 203 Cb -0.17 -2.73 0.04 0.00 0.01 0.00 0.00 42.46 39.61 1dwo s ILE 203 CO -0.08 0.57 0.64 -1.66 0.00 0.00 0.00 174.94 174.41 1dwo s TRP 204 N -0.50 -0.28 0.03 3.97 1.48 -0.69 -1.07 118.94 121.87 1dwo s TRP 204 Ca 0.08 -0.07 0.05 0.00 -1.06 0.00 0.00 56.10 55.10 1dwo s TRP 204 Cb -0.12 0.59 -0.02 0.00 -1.16 0.00 0.00 33.47 32.76 1dwo s TRP 204 CO 0.02 -1.05 -0.14 -0.08 -4.06 0.00 0.00 176.95 171.64 1dwo s THR 205 N -3.86 1.10 -1.47 0.66 -1.32 -1.26 -0.42 115.64 109.07 1dwo s THR 205 Ca 0.08 -0.92 0.29 0.00 -1.21 0.00 0.00 61.69 59.92 1dwo s THR 205 Cb -0.03 -0.98 0.53 0.00 -1.51 0.00 0.00 72.50 70.50 1dwo s THR 205 CO -0.01 0.06 2.02 -0.90 -2.21 0.00 0.00 174.62 173.57 1dwo n ASP 206 N 2.05 0.00 -0.67 8.08 3.85 -1.26 -2.92 116.55 125.67 1dwo n ASP 206 Ca -0.17 -0.18 0.05 0.00 -0.71 0.00 0.00 54.79 53.77 1dwo n ASP 206 Cb 0.55 -0.27 0.14 0.00 -1.35 0.00 0.00 41.12 40.20 1dwo n ASP 206 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1dwo n GLN 207 N -1.27 1.90 -2.35 0.11 1.13 -1.26 -4.64 117.38 111.00 1dwo n GLN 207 Ca 0.14 -1.16 -0.42 0.00 -1.94 0.00 0.00 57.00 53.62 1dwo n GLN 207 Cb 0.22 -1.35 -0.03 0.00 0.11 0.00 0.00 30.24 29.19 1dwo n GLN 207 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1dwo s ASP 208 N -0.87 6.94 -0.03 1.08 -1.08 -1.15 -4.52 116.67 117.04 1dwo s ASP 208 Ca 0.21 1.90 0.12 0.00 -0.52 0.00 0.00 52.55 54.25 1dwo s ASP 208 Cb 0.12 -2.55 0.38 0.00 -1.46 0.00 0.00 42.92 39.41 1dwo s ASP 208 CO 0.13 -0.69 1.28 0.29 0.52 0.00 0.00 175.17 176.69 1dwo n LYS 209 N 5.75 2.21 0.00 4.34 4.76 -1.25 -4.22 118.16 129.74 1dwo n LYS 209 Ca 0.13 -1.53 0.00 0.00 -2.87 0.00 0.00 58.31 54.04 1dwo n LYS 209 Cb 0.45 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.19 1dwo n LYS 209 CO 0.00 0.00 0.00 1.51 -1.37 0.00 0.00 177.40 177.54 1dwo n ILE 210 N 0.62 0.00 -3.15 -0.18 3.06 -1.20 -4.71 119.36 113.80 1dwo n ILE 210 Ca 0.14 0.00 -0.45 0.00 -2.50 0.00 0.00 62.75 59.94 1dwo n ILE 210 Cb 0.44 -0.49 -0.02 0.00 0.54 0.00 0.00 39.64 40.11 1dwo n ILE 210 CO 0.00 0.00 0.00 -0.36 -2.50 0.00 0.00 176.55 173.69 1dwo s PHE 211 N -1.68 3.57 0.63 9.51 0.40 -1.26 -4.80 117.98 124.35 1dwo s PHE 211 Ca 0.00 -1.87 -0.15 0.00 -0.60 0.00 0.00 56.93 54.31 1dwo s PHE 211 Cb 0.00 -4.04 -0.02 0.00 0.51 0.00 0.00 43.02 39.48 1dwo s PHE 211 CO 0.00 -1.20 1.08 -0.51 0.70 0.00 0.00 175.22 175.29 1dwo s LEU 212 N 1.04 3.43 0.29 -0.37 1.43 -1.26 -4.61 118.68 118.63 1dwo s LEU 212 Ca 0.27 1.90 0.02 0.00 -1.03 0.00 0.00 54.13 55.29 1dwo s LEU 212 Cb -0.07 -4.54 0.59 0.00 0.03 0.00 0.00 46.19 42.19 1dwo s LEU 212 CO -0.08 -1.41 1.82 -0.65 0.23 0.00 0.00 176.35 176.26 1dwo h PRO 213 N 0.19 0.92 -0.90 1.29 0.11 -1.82 0.40 132.00 132.18 1dwo h PRO 213 Ca -0.47 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1dwo h PRO 213 Cb 1.23 -0.21 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 1dwo h PRO 213 CO 0.56 0.61 0.58 0.38 -0.21 0.00 0.00 178.00 179.91 1dwo h ASP 214 N 0.94 1.05 -0.21 -2.05 2.03 -1.98 0.12 116.42 116.33 1dwo h ASP 214 Ca 0.51 -0.04 -0.15 0.00 -0.73 0.00 0.00 57.03 56.62 1dwo h ASP 214 Cb 0.57 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 38.81 1dwo h ASP 214 CO -0.29 0.77 -0.47 0.15 -1.03 0.00 0.00 179.24 178.37 1dwo h PHE 215 N 1.22 0.87 -0.29 4.15 3.57 -0.64 -1.78 116.94 124.04 1dwo h PHE 215 Ca 0.33 -0.33 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 1dwo h PHE 215 Cb -0.11 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.46 1dwo h PHE 215 CO -0.01 1.11 -0.06 1.96 -2.23 0.00 0.00 178.31 179.09 1dwo h GLN 216 N 0.38 0.55 -0.27 1.11 4.20 -0.46 0.32 115.11 120.94 1dwo h GLN 216 Ca 0.00 -0.21 -0.11 0.00 0.06 0.00 0.00 58.65 58.40 1dwo h GLN 216 Cb 1.08 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.81 1dwo h GLN 216 CO 0.10 0.74 -0.28 0.00 -0.67 0.00 0.00 178.83 178.72 1dwo h ARG 217 N 0.32 0.56 -0.23 1.46 3.08 -0.85 -1.29 114.38 117.42 1dwo h ARG 217 Ca 0.08 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 1dwo h ARG 217 Cb 0.53 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1dwo h ARG 217 CO 0.03 0.78 0.15 2.35 -1.07 0.00 0.00 179.97 182.21 1dwo h TRP 218 N 0.48 0.30 -0.69 3.04 7.01 -0.68 -0.16 115.95 125.25 1dwo h TRP 218 Ca 0.06 0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.10 1dwo h TRP 218 Cb 0.74 -0.10 -0.05 0.00 -2.10 0.00 0.00 29.16 27.65 1dwo h TRP 218 CO 0.03 0.22 0.42 1.96 -2.79 0.00 0.00 178.44 178.28 1dwo h GLN 219 N 0.30 0.80 -0.70 2.65 4.20 0.12 0.27 115.11 122.74 1dwo h GLN 219 Ca 0.08 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1dwo h GLN 219 Cb 0.00 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 27.57 1dwo h GLN 219 CO -0.02 0.53 0.40 0.82 -0.67 0.00 0.00 178.83 179.89 1dwo h ILE 220 N 0.82 1.21 -0.20 2.54 2.04 -0.99 -0.84 117.51 122.09 1dwo h ILE 220 Ca 0.28 -0.51 -0.12 0.00 1.00 0.00 0.00 64.86 65.52 1dwo h ILE 220 Cb 0.06 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1dwo h ILE 220 CO -0.12 0.23 -0.39 0.00 0.00 0.00 0.00 178.15 177.87 1dwo h ALA 221 N 1.20 0.96 -0.02 1.87 0.00 0.06 -3.14 119.26 120.20 1dwo h ALA 221 Ca 0.25 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 1dwo h ALA 221 Cb 0.02 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1dwo h ALA 221 CO -0.04 0.62 -0.61 -0.97 0.00 0.00 0.00 179.25 178.24 1dwo h ASN 222 N 0.37 0.07 -1.84 0.00 -1.24 0.25 -3.40 115.58 109.79 1dwo h ASN 222 Ca 0.04 -0.04 -0.25 0.00 0.71 0.00 0.00 56.30 56.76 1dwo h ASN 222 Cb 0.85 -0.02 -0.30 0.00 0.73 0.00 0.00 38.32 39.58 1dwo h ASN 222 CO 0.07 0.66 -0.59 -0.47 -1.29 0.00 0.00 177.43 175.82 1dwo s TYR 223 N -3.65 -0.77 0.06 0.67 5.04 -0.39 -5.08 117.35 113.23 1dwo s TYR 223 Ca -0.02 -0.01 -0.30 0.00 -2.44 0.00 0.00 57.07 54.30 1dwo s TYR 223 Cb 0.12 -0.26 -0.09 0.00 0.35 0.00 0.00 41.96 42.08 1dwo s TYR 223 CO 0.77 -0.97 1.95 1.17 -1.34 0.00 0.00 175.55 177.12 1dwo n LYS 224 N 5.13 2.87 -1.69 4.97 4.81 -1.20 -4.59 118.16 128.46 1dwo n LYS 224 Ca 0.02 1.05 -0.33 0.00 -0.87 0.00 0.00 58.31 58.19 1dwo n LYS 224 Cb 0.48 -3.00 0.05 0.00 0.02 0.00 0.00 35.03 32.59 1dwo n LYS 224 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1dwo s PRO 225 N 4.02 2.76 0.21 1.64 0.02 -1.26 -4.97 135.00 137.42 1dwo s PRO 225 Ca 0.87 1.32 -0.05 0.00 0.02 0.00 0.00 61.00 63.17 1dwo s PRO 225 Cb -0.44 -1.95 0.17 0.00 0.02 0.00 0.00 34.50 32.30 1dwo s PRO 225 CO 0.41 -1.27 1.62 -0.44 -0.33 0.00 0.00 177.00 176.98 1dwo h ASP 226 N -0.15 0.80 -4.67 2.53 3.32 -1.16 -3.44 116.42 113.65 1dwo h ASP 226 Ca -0.46 -0.29 -0.18 0.00 0.02 0.00 0.00 57.03 56.12 1dwo h ASP 226 Cb 1.24 -0.22 -0.23 0.00 0.22 0.00 0.00 39.33 40.35 1dwo h ASP 226 CO 0.54 1.00 -0.65 -0.54 -1.72 0.00 0.00 179.24 177.87 1dwo s LYS 227 N -4.58 0.28 -0.04 3.56 1.02 -1.06 -5.02 119.74 113.89 1dwo s LYS 227 Ca -0.09 -0.40 0.06 0.00 0.02 0.00 0.00 55.97 55.56 1dwo s LYS 227 Cb 0.13 0.10 -0.01 0.00 -0.52 0.00 0.00 37.83 37.53 1dwo s LYS 227 CO 0.84 -0.05 -0.23 0.08 -0.92 0.00 0.00 175.35 175.07 1dwo s VAL 228 N -1.07 1.83 -0.14 3.17 1.01 -1.26 -0.95 120.40 122.99 1dwo s VAL 228 Ca -0.12 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 60.89 1dwo s VAL 228 Cb -0.07 -1.54 0.04 0.00 0.00 0.00 0.00 36.38 34.80 1dwo s VAL 228 CO -0.00 0.52 -0.04 -0.31 0.00 0.00 0.00 175.10 175.26 1dwo s TYR 229 N -0.27 1.44 -0.22 5.22 1.51 0.60 -4.92 117.35 120.72 1dwo s TYR 229 Ca 0.01 -0.84 -0.09 0.00 -1.01 0.00 0.00 57.07 55.14 1dwo s TYR 229 Cb -0.11 -1.20 -0.04 0.00 -0.11 0.00 0.00 41.96 40.50 1dwo s TYR 229 CO 0.02 -0.55 0.10 -1.14 -1.11 0.00 0.00 175.55 172.87 1dwo s GLN 230 N 1.72 3.95 -0.12 -0.62 0.74 -1.26 -1.70 119.66 122.37 1dwo s GLN 230 Ca 0.02 -0.34 -0.10 0.00 0.05 0.00 0.00 55.36 55.00 1dwo s GLN 230 Cb -0.14 -3.36 -0.05 0.00 1.10 0.00 0.00 33.01 30.56 1dwo s GLN 230 CO -0.08 0.11 0.20 0.08 -0.55 0.00 0.00 175.29 175.06 1dwo s VAL 231 N 0.86 5.38 0.21 1.34 1.01 0.44 -4.95 120.40 124.70 1dwo s VAL 231 Ca 0.05 0.36 -0.27 0.00 0.00 0.00 0.00 61.98 62.12 1dwo s VAL 231 Cb -0.13 -3.50 -0.09 0.00 0.00 0.00 0.00 36.38 32.66 1dwo s VAL 231 CO 0.03 0.54 0.85 -1.10 0.00 0.00 0.00 175.10 175.42 1dwo s GLN 232 N -0.54 4.68 2.90 2.72 -1.52 -1.26 -4.37 119.66 122.26 1dwo s GLN 232 Ca 0.15 1.29 0.00 0.00 -1.95 0.00 0.00 55.36 54.86 1dwo s GLN 232 Cb -0.13 -3.22 0.00 0.00 -0.22 0.00 0.00 33.01 29.44 1dwo s GLN 232 CO 0.04 0.52 0.00 0.41 -0.25 0.00 0.00 175.29 176.02 1dwo n GLY 233 N 1.44 -0.25 7.00 3.09 0.00 -1.26 -5.02 105.19 110.19 1dwo n GLY 233 Ca -0.03 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.95 1dwo n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dwo n GLY 234 N 0.00 0.25 0.00 -0.02 0.00 -1.26 -4.57 105.19 99.59 1dwo n GLY 234 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1dwo n GLY 234 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1dwo n ASP 235 N -1.72 0.00 0.03 1.61 5.68 -1.26 -4.79 116.55 116.10 1dwo n ASP 235 Ca 0.00 -0.24 0.04 0.00 -0.50 0.00 0.00 54.79 54.10 1dwo n ASP 235 Cb 0.00 0.00 0.44 0.00 -1.14 0.00 0.00 41.12 40.42 1dwo n ASP 235 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1dwo h HIS 236 N 0.24 0.45 -2.61 2.11 -0.00 -1.79 -3.11 115.15 110.44 1dwo h HIS 236 Ca 0.00 0.01 -0.80 0.00 -0.00 0.00 0.00 60.37 59.57 1dwo h HIS 236 Cb 0.00 -0.15 -0.27 0.00 -0.00 0.00 0.00 27.41 26.99 1dwo h HIS 236 CO 0.00 0.30 0.97 1.63 -0.00 0.00 0.00 177.93 180.83 1dwo n LYS 237 N -4.47 4.66 0.32 5.26 4.76 -1.21 -4.80 118.16 122.68 1dwo n LYS 237 Ca 0.02 -4.49 0.20 0.00 -2.87 0.00 0.00 58.31 51.18 1dwo n LYS 237 Cb 0.08 -2.53 1.08 0.00 -1.84 0.00 0.00 35.03 31.81 1dwo n LYS 237 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1dwo h LEU 238 N 5.32 0.00 0.00 -0.35 3.38 -1.91 0.61 115.31 122.35 1dwo h LEU 238 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1dwo h LEU 238 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1dwo h LEU 238 CO 1.33 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.86 1dwo n GLN 239 N -3.28 0.29 -0.08 1.13 0.00 -1.26 -0.26 117.38 113.91 1dwo n GLN 239 Ca -0.02 0.04 -0.16 0.00 0.00 0.00 0.00 57.00 56.85 1dwo n GLN 239 Cb 0.13 -1.50 -0.05 0.00 0.00 0.00 0.00 30.24 28.82 1dwo n GLN 239 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1dwo n LEU 240 N -1.34 1.18 0.15 2.61 4.77 -0.25 -3.99 117.00 120.13 1dwo n LEU 240 Ca 0.11 0.20 0.03 0.00 -0.03 0.00 0.00 56.01 56.32 1dwo n LEU 240 Cb 0.23 -0.48 0.07 0.00 -2.33 0.00 0.00 43.42 40.90 1dwo n LEU 240 CO 0.21 0.26 0.50 0.71 -1.33 0.00 0.00 177.39 177.74 1dwo h THR 241 N -0.58 0.87 -0.70 -5.08 1.35 -0.97 -3.36 112.91 104.44 1dwo h THR 241 Ca -0.38 -2.13 -0.41 0.00 -0.55 0.00 0.00 66.41 62.94 1dwo h THR 241 Cb 1.29 2.36 -0.42 0.00 -1.73 0.00 0.00 68.15 69.66 1dwo h THR 241 CO -0.23 0.48 -0.96 0.29 -0.25 0.00 0.00 175.52 174.85 1dwo n LYS 242 N -3.26 2.67 -0.21 4.72 4.76 0.64 -4.86 118.16 122.62 1dwo n LYS 242 Ca 0.02 -3.87 0.02 0.00 -2.87 0.00 0.00 58.31 51.61 1dwo n LYS 242 Cb 0.71 -1.93 0.12 0.00 -1.84 0.00 0.00 35.03 32.08 1dwo n LYS 242 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1dwo h THR 243 N 3.65 0.51 -0.35 -0.18 2.02 -1.65 0.07 112.91 116.98 1dwo h THR 243 Ca 0.13 -0.06 -0.11 0.00 0.77 0.00 0.00 66.41 67.14 1dwo h THR 243 Cb 1.36 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1dwo h THR 243 CO 0.51 0.03 -0.20 -0.33 0.37 0.00 0.00 175.52 175.90 1dwo h GLU 244 N 0.16 0.76 -0.09 6.66 4.39 -1.93 -1.20 114.58 123.33 1dwo h GLU 244 Ca 0.34 -0.35 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1dwo h GLU 244 Cb 0.55 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.18 1dwo h GLU 244 CO -0.51 0.96 0.05 1.49 -1.16 0.00 0.00 179.01 179.85 1dwo h GLU 245 N 0.55 0.13 -0.68 2.33 4.81 -1.84 0.84 114.58 120.72 1dwo h GLU 245 Ca 0.08 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1dwo h GLU 245 Cb 0.75 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 1dwo h GLU 245 CO 0.06 0.15 0.36 0.28 -0.73 0.00 0.00 179.01 179.12 1dwo h VAL 246 N 0.08 1.21 -0.67 0.32 2.07 -0.92 -1.30 116.25 117.03 1dwo h VAL 246 Ca 0.03 -0.54 -0.05 0.00 0.82 0.00 0.00 66.70 66.96 1dwo h VAL 246 Cb 0.05 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.10 1dwo h VAL 246 CO -0.01 0.24 0.20 0.00 0.02 0.00 0.00 177.57 178.02 1dwo h ALA 247 N 1.45 1.09 -0.30 1.67 0.00 -0.72 -0.16 119.26 122.30 1dwo h ALA 247 Ca 0.24 -0.22 -0.17 0.00 0.00 0.00 0.00 54.91 54.76 1dwo h ALA 247 Cb 0.05 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1dwo h ALA 247 CO -0.04 0.62 -0.49 0.45 0.00 0.00 0.00 179.25 179.79 1dwo h HIS 248 N 0.99 1.01 -0.73 0.00 -0.00 0.11 -0.65 115.15 115.88 1dwo h HIS 248 Ca 0.22 -0.34 -0.07 0.00 -0.00 0.00 0.00 60.37 60.18 1dwo h HIS 248 Cb 0.30 -0.20 -0.03 0.00 -0.00 0.00 0.00 27.41 27.48 1dwo h HIS 248 CO 0.02 1.14 0.20 0.82 -0.00 0.00 0.00 177.93 180.11 1dwo h ILE 249 N 0.64 1.26 0.00 2.45 2.04 -1.03 -2.08 117.51 120.80 1dwo h ILE 249 Ca 0.03 -0.95 -0.09 0.00 1.00 0.00 0.00 64.86 64.85 1dwo h ILE 249 Cb 1.08 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1dwo h ILE 249 CO 0.11 0.37 -0.43 -0.07 0.00 0.00 0.00 178.15 178.13 1dwo h LEU 250 N 1.09 0.00 -0.47 1.44 3.38 -0.64 -1.56 115.31 118.56 1dwo h LEU 250 Ca 0.23 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.23 1dwo h LEU 250 Cb 0.35 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1dwo h LEU 250 CO -0.00 0.43 0.27 -0.61 0.09 0.00 0.00 178.44 178.62 1dwo h GLN 251 N 0.00 0.52 -0.81 1.13 5.75 -0.44 -1.99 115.11 119.26 1dwo h GLN 251 Ca -0.00 -0.03 0.10 0.00 -0.15 0.00 0.00 58.65 58.57 1dwo h GLN 251 Cb 0.77 -0.12 -0.08 0.00 1.07 0.00 0.00 27.48 29.13 1dwo h GLN 251 CO 0.06 0.34 0.45 0.93 -2.65 0.00 0.00 178.83 177.96 1dwo h GLU 252 N 0.53 0.71 -0.75 1.69 5.08 -1.01 0.65 114.58 121.49 1dwo h GLU 252 Ca 0.19 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.45 1dwo h GLU 252 Cb 0.04 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1dwo h GLU 252 CO -0.10 0.47 0.24 0.28 -1.00 0.00 0.00 179.01 178.90 1dwo h VAL 253 N 0.74 1.26 -0.22 3.13 2.07 -0.96 -1.12 116.25 121.15 1dwo h VAL 253 Ca 0.40 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.97 1dwo h VAL 253 Cb 0.42 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1dwo h VAL 253 CO -0.27 0.36 -0.04 0.00 0.02 0.00 0.00 177.57 177.64 1dwo h ALA 254 N 1.12 0.31 -0.92 1.67 0.00 -0.44 0.74 119.26 121.74 1dwo h ALA 254 Ca 0.24 -0.25 0.11 0.00 0.00 0.00 0.00 54.91 55.02 1dwo h ALA 254 Cb 0.31 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 17.93 1dwo h ALA 254 CO -0.01 0.08 0.56 -0.44 0.00 0.00 0.00 179.25 179.44 1dwo h ASP 255 N 0.16 0.80 0.86 0.00 3.32 -0.71 0.11 116.42 120.96 1dwo h ASP 255 Ca 0.06 0.05 -0.23 0.00 0.02 0.00 0.00 57.03 56.93 1dwo h ASP 255 Cb 0.49 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 1dwo h ASP 255 CO 0.02 0.43 -1.14 0.00 -1.72 0.00 0.00 179.24 176.83 1dwo h ALA 256 N 1.51 0.35 0.00 3.45 0.00 -0.80 -3.42 119.26 120.35 1dwo h ALA 256 Ca 0.46 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1dwo h ALA 256 Cb 0.46 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1dwo h ALA 256 CO -0.27 1.24 -0.00 0.66 0.00 0.00 0.00 179.25 180.87 1dwo n TYR 257 N -3.35 0.00 0.69 0.00 0.53 0.22 -5.09 117.16 110.15 1dwo n TYR 257 Ca -0.04 0.00 0.08 0.00 -1.02 0.00 0.00 57.90 56.92 1dwo n TYR 257 Cb 0.97 0.00 0.07 0.00 -1.03 0.00 0.00 39.34 39.35 1dwo n TYR 257 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84