#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g18 s SER 2 N 0.00 6.46 0.19 4.38 0.15 -1.26 -5.10 113.70 118.52 2g18 s SER 2 Ca 0.00 1.23 0.04 0.00 0.70 0.00 0.00 55.95 57.91 2g18 s SER 2 Cb 0.00 -2.37 -0.05 0.00 -1.71 0.00 0.00 66.02 61.89 2g18 s SER 2 CO 0.00 -0.53 -0.04 -0.76 1.20 0.00 0.00 173.24 173.11 2g18 s LEU 3 N -4.23 2.30 0.03 3.45 1.43 -1.26 -5.16 118.68 115.24 2g18 s LEU 3 Ca 0.53 -1.14 0.02 0.00 -1.03 0.00 0.00 54.13 52.50 2g18 s LEU 3 Cb -0.10 -0.27 -0.02 0.00 0.03 0.00 0.00 46.19 45.83 2g18 s LEU 3 CO 0.37 -0.46 -0.06 -0.89 0.23 0.00 0.00 176.35 175.54 2g18 s THR 4 N -3.42 0.40 -0.22 5.49 2.01 -1.26 -5.13 115.64 113.52 2g18 s THR 4 Ca 0.24 -0.88 -0.12 0.00 0.31 0.00 0.00 61.69 61.24 2g18 s THR 4 Cb 0.05 -0.47 -0.05 0.00 0.01 0.00 0.00 72.50 72.04 2g18 s THR 4 CO 0.05 -0.33 0.22 -0.44 -0.69 0.00 0.00 174.62 173.44 2g18 s SER 5 N -1.29 6.23 0.33 3.53 0.01 -1.26 -5.09 113.70 116.16 2g18 s SER 5 Ca -0.09 0.25 0.09 0.00 1.31 0.00 0.00 55.95 57.52 2g18 s SER 5 Cb -0.09 -2.14 -0.05 0.00 0.21 0.00 0.00 66.02 63.96 2g18 s SER 5 CO -0.00 0.06 -0.01 0.27 0.41 0.00 0.00 173.24 173.96 2g18 s ILE 6 N 0.94 2.70 0.68 1.44 -4.36 -1.26 -5.13 121.20 116.22 2g18 s ILE 6 Ca 0.11 -2.01 -0.17 0.00 -0.26 0.00 0.00 60.65 58.32 2g18 s ILE 6 Cb -0.13 -2.75 -0.06 0.00 1.25 0.00 0.00 42.46 40.76 2g18 s ILE 6 CO 0.04 -0.24 0.41 -2.65 0.24 0.00 0.00 174.94 172.74 2g18 n PRO 7 N -0.91 0.30 -2.84 0.37 -0.02 -1.26 -4.99 135.00 125.66 2g18 n PRO 7 Ca -0.05 0.13 -0.36 0.00 -2.02 0.00 0.00 63.50 61.21 2g18 n PRO 7 Cb 0.62 -1.69 -0.06 0.00 -0.02 0.00 0.00 33.50 32.34 2g18 n PRO 7 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2g18 s SER 8 N -1.35 7.24 0.56 2.55 0.15 -1.26 -4.94 113.70 116.66 2g18 s SER 8 Ca 0.64 1.74 0.26 0.00 0.70 0.00 0.00 55.95 59.30 2g18 s SER 8 Cb -0.37 -2.54 1.52 0.00 -1.71 0.00 0.00 66.02 62.91 2g18 s SER 8 CO 0.59 -0.09 2.06 0.25 1.20 0.00 0.00 173.24 177.25 2g18 h LEU 9 N 3.05 0.00 -2.74 3.45 5.85 -1.98 -2.81 115.31 120.14 2g18 h LEU 9 Ca -0.47 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.25 2g18 h LEU 9 Cb 1.19 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 2g18 h LEU 9 CO 0.65 0.00 -0.01 0.08 -0.34 0.00 0.00 178.44 178.82 2g18 h ARG 10 N 0.00 0.00 0.00 1.25 0.11 -1.96 -0.19 114.38 113.59 2g18 h ARG 10 Ca 0.14 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.17 2g18 h ARG 10 Cb 0.65 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.73 2g18 h ARG 10 CO -0.00 0.01 -0.21 0.93 0.10 0.00 0.00 179.97 180.79 2g18 h GLU 11 N 0.00 0.00 -0.06 0.08 4.39 -1.91 -2.61 114.58 114.46 2g18 h GLU 11 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2g18 h GLU 11 Cb 0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 2g18 h GLU 11 CO 0.00 0.21 0.00 1.04 -1.16 0.00 0.00 179.01 179.10 2g18 n GLN 12 N -3.64 1.89 -3.75 2.33 6.02 -0.09 -4.98 117.38 115.17 2g18 n GLN 12 Ca -0.01 -1.30 -0.21 0.00 -0.01 0.00 0.00 57.00 55.47 2g18 n GLN 12 Cb 0.34 -1.46 -0.03 0.00 1.02 0.00 0.00 30.24 30.11 2g18 n GLN 12 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2g18 s GLN 13 N -1.94 2.82 0.17 -1.09 -0.21 -0.99 -5.05 119.66 113.38 2g18 s GLN 13 Ca 0.35 -1.22 -0.32 0.00 0.02 0.00 0.00 55.36 54.19 2g18 s GLN 13 Cb 0.20 -2.56 -0.16 0.00 1.00 0.00 0.00 33.01 31.49 2g18 s GLN 13 CO 0.31 0.10 0.96 1.58 -2.12 0.00 0.00 175.29 176.13 2g18 n HIS 14 N -1.43 0.75 0.19 0.91 -0.00 -1.26 -4.67 115.22 109.71 2g18 n HIS 14 Ca -0.02 0.81 0.10 0.00 -0.00 0.00 0.00 57.72 58.61 2g18 n HIS 14 Cb 0.59 -2.17 0.63 0.00 -0.00 0.00 0.00 29.99 29.04 2g18 n HIS 14 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2g18 h PRO 15 N 2.50 0.05 -0.37 1.57 0.11 -1.97 -0.41 132.00 133.48 2g18 h PRO 15 Ca -0.40 -0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.57 2g18 h PRO 15 Cb 1.38 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.47 2g18 h PRO 15 CO 0.64 0.03 -0.32 1.25 -0.21 0.00 0.00 178.00 179.40 2g18 h LEU 16 N 0.05 0.85 -0.51 2.35 5.85 -1.99 -0.71 115.31 121.20 2g18 h LEU 16 Ca 0.06 -0.35 -0.04 0.00 0.84 0.00 0.00 57.88 58.39 2g18 h LEU 16 Cb 0.17 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 2g18 h LEU 16 CO -0.00 1.09 0.18 0.40 -0.34 0.00 0.00 178.44 179.77 2g18 h ILE 17 N 0.68 1.22 -0.47 4.05 2.04 -1.44 0.11 117.51 123.70 2g18 h ILE 17 Ca 0.07 -0.72 -0.01 0.00 1.00 0.00 0.00 64.86 65.21 2g18 h ILE 17 Cb 0.86 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 2g18 h ILE 17 CO 0.08 0.27 0.27 -0.09 0.00 0.00 0.00 178.15 178.67 2g18 h ARG 18 N 0.69 0.64 -0.35 2.37 2.43 -1.24 -0.08 114.38 118.84 2g18 h ARG 18 Ca 0.17 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.23 2g18 h ARG 18 Cb 0.24 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 2g18 h ARG 18 CO -0.01 0.49 0.04 0.37 -1.51 0.00 0.00 179.97 179.35 2g18 h GLN 19 N 0.62 0.60 -0.65 0.20 4.15 -0.98 -1.69 115.11 117.35 2g18 h GLN 19 Ca 0.17 -0.17 -0.02 0.00 0.77 0.00 0.00 58.65 59.39 2g18 h GLN 19 Cb 0.02 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 2g18 h GLN 19 CO -0.03 0.68 0.31 1.25 -1.93 0.00 0.00 178.83 179.11 2g18 h LEU 20 N 0.43 0.86 0.11 -2.39 5.85 -0.74 0.43 115.31 119.86 2g18 h LEU 20 Ca 0.11 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 2g18 h LEU 20 Cb 0.38 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.19 2g18 h LEU 20 CO 0.01 0.75 -0.05 0.00 -0.34 0.00 0.00 178.44 178.81 2g18 h ALA 21 N 1.14 -0.15 -0.83 1.25 0.00 -0.87 0.21 119.26 120.00 2g18 h ALA 21 Ca 0.22 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.14 2g18 h ALA 21 Cb 0.12 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 2g18 h ALA 21 CO -0.03 -0.55 0.50 -0.44 0.00 0.00 0.00 179.25 178.73 2g18 h ASP 22 N -0.21 0.77 -0.28 0.00 3.32 -1.04 -2.20 116.42 116.78 2g18 h ASP 22 Ca -0.02 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 2g18 h ASP 22 Cb 0.17 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2g18 h ASP 22 CO 0.03 0.48 -0.19 0.00 -1.72 0.00 0.00 179.24 177.84 2g18 h ILE 24 N 0.36 1.10 -0.21 0.00 2.04 -0.84 -1.54 117.51 118.42 2g18 h ILE 24 Ca 0.06 -0.29 -0.07 0.00 1.00 0.00 0.00 64.86 65.56 2g18 h ILE 24 Cb 0.73 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 2g18 h ILE 24 CO 0.05 0.09 -0.18 -0.33 0.00 0.00 0.00 178.15 177.78 2g18 h GLU 25 N 0.10 0.36 -0.08 2.37 5.08 -1.34 -1.50 114.58 119.57 2g18 h GLU 25 Ca 0.04 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2g18 h GLU 25 Cb 0.09 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2g18 h GLU 25 CO -0.01 0.54 0.03 1.49 -1.00 0.00 0.00 179.01 180.06 2g18 h GLU 26 N 0.33 0.12 -0.31 2.33 4.81 -0.70 -1.84 114.58 119.32 2g18 h GLU 26 Ca 0.06 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2g18 h GLU 26 Cb 0.51 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 2g18 h GLU 26 CO 0.03 0.24 0.14 0.28 -0.73 0.00 0.00 179.01 178.97 2g18 h VAL 27 N -0.03 1.16 -0.74 0.32 2.07 -1.06 -1.09 116.25 116.88 2g18 h VAL 27 Ca 0.03 -0.48 0.12 0.00 0.82 0.00 0.00 66.70 67.18 2g18 h VAL 27 Cb 0.17 0.91 -0.08 0.00 -1.52 0.00 0.00 31.29 30.77 2g18 h VAL 27 CO -0.00 0.17 0.34 -0.50 0.02 0.00 0.00 177.57 177.60 2g18 h TRP 28 N 0.36 0.59 0.00 1.57 6.55 -1.25 -1.27 115.95 122.51 2g18 h TRP 28 Ca 0.11 0.03 -0.10 0.00 0.95 0.00 0.00 58.89 59.88 2g18 h TRP 28 Cb 0.14 -0.15 -0.01 0.00 -0.86 0.00 0.00 29.16 28.28 2g18 h TRP 28 CO -0.01 0.15 -0.46 0.45 -1.05 0.00 0.00 178.44 177.52 2g18 h HIS 29 N 0.53 0.00 0.00 0.49 3.86 -0.91 -1.83 115.15 117.30 2g18 h HIS 29 Ca 0.39 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.40 2g18 h HIS 29 Cb 0.51 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.95 2g18 h HIS 29 CO -0.13 0.46 -1.00 1.96 0.86 0.00 0.00 177.93 180.07 2g18 h GLN 30 N 0.00 0.00 0.00 2.45 4.20 -0.40 -3.40 115.11 117.95 2g18 h GLN 30 Ca -0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 2g18 h GLN 30 Cb 0.93 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.69 2g18 h GLN 30 CO 0.06 0.83 -1.51 0.72 -0.67 0.00 0.00 178.83 178.26 2g18 n HIS 31 N -3.28 0.00 -4.35 2.96 8.25 -0.55 -5.05 115.22 113.20 2g18 n HIS 31 Ca -0.02 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.21 2g18 n HIS 31 Cb 0.91 -0.33 -0.08 0.00 1.12 0.00 0.00 29.99 31.61 2g18 n HIS 31 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2g18 s LEU 32 N -4.18 2.97 -0.62 2.41 1.43 -0.69 -5.03 118.68 114.97 2g18 s LEU 32 Ca -0.04 -0.85 -0.17 0.00 -1.03 0.00 0.00 54.13 52.05 2g18 s LEU 32 Cb 0.04 -1.45 0.14 0.00 0.03 0.00 0.00 46.19 44.95 2g18 s LEU 32 CO 0.36 -0.06 0.64 -0.62 0.23 0.00 0.00 176.35 176.90 2g18 s ASP 33 N -3.64 6.31 0.09 2.29 2.15 -1.26 -4.75 116.67 117.86 2g18 s ASP 33 Ca 0.32 -1.86 -0.23 0.00 0.43 0.00 0.00 52.55 51.20 2g18 s ASP 33 Cb -0.04 -2.24 -0.07 0.00 -0.30 0.00 0.00 42.92 40.27 2g18 s ASP 33 CO 0.18 -0.89 0.71 -0.76 -0.17 0.00 0.00 175.17 174.25 2g18 s LEU 34 N 1.70 4.51 0.28 -1.34 1.43 -1.26 -4.46 118.68 119.55 2g18 s LEU 34 Ca 0.09 1.45 0.10 0.00 -1.03 0.00 0.00 54.13 54.75 2g18 s LEU 34 Cb -0.24 -3.15 -0.05 0.00 0.03 0.00 0.00 46.19 42.78 2g18 s LEU 34 CO 0.01 0.15 -0.16 -0.44 0.23 0.00 0.00 176.35 176.14 2g18 s SER 35 N -0.67 3.41 0.77 2.29 0.01 0.20 -4.97 113.70 114.74 2g18 s SER 35 Ca 0.35 -1.08 -0.11 0.00 1.31 0.00 0.00 55.95 56.42 2g18 s SER 35 Cb -0.21 -0.28 0.06 0.00 0.21 0.00 0.00 66.02 65.80 2g18 s SER 35 CO 0.23 -0.07 1.08 -2.16 0.41 0.00 0.00 173.24 172.73 2g18 s PRO 36 N -3.57 2.26 -0.14 12.44 0.04 -1.26 -1.01 135.00 143.76 2g18 s PRO 36 Ca 0.29 1.02 -0.04 0.00 0.04 0.00 0.00 61.00 62.32 2g18 s PRO 36 Cb -0.02 -1.91 0.07 0.00 0.04 0.00 0.00 34.50 32.68 2g18 s PRO 36 CO 0.14 -1.60 0.18 -0.47 0.04 0.00 0.00 177.00 175.29 2g18 s TYR 37 N -2.96 -0.18 -0.09 0.56 5.04 -1.20 -4.50 117.35 114.01 2g18 s TYR 37 Ca 0.61 0.36 -0.16 0.00 -2.44 0.00 0.00 57.07 55.44 2g18 s TYR 37 Cb -0.16 -0.34 -0.05 0.00 0.35 0.00 0.00 41.96 41.76 2g18 s TYR 37 CO 0.56 -0.43 0.40 -1.01 -1.34 0.00 0.00 175.55 173.72 2g18 s HIS 38 N 2.29 3.57 0.66 4.97 3.76 -1.26 -4.43 115.29 124.85 2g18 s HIS 38 Ca 0.04 0.83 -0.10 0.00 -0.15 0.00 0.00 55.06 55.69 2g18 s HIS 38 Cb -0.14 -2.40 0.01 0.00 1.11 0.00 0.00 32.58 31.16 2g18 s HIS 38 CO -0.09 0.35 1.03 -0.51 -0.85 0.00 0.00 174.74 174.67 2g18 s LEU 39 N 0.02 3.03 0.21 0.89 1.43 -1.26 -5.04 118.68 117.96 2g18 s LEU 39 Ca 0.22 1.03 -0.30 0.00 -1.03 0.00 0.00 54.13 54.06 2g18 s LEU 39 Cb -0.15 -3.86 -0.16 0.00 0.03 0.00 0.00 46.19 42.05 2g18 s LEU 39 CO 0.09 -1.21 0.91 -2.65 0.23 0.00 0.00 176.35 173.71 2g18 n PRO 40 N -2.86 0.77 0.28 1.29 -0.02 -1.26 -4.84 135.00 128.36 2g18 n PRO 40 Ca 0.06 0.27 0.15 0.00 -2.02 0.00 0.00 63.50 61.96 2g18 n PRO 40 Cb 0.57 -1.57 0.79 0.00 -0.02 0.00 0.00 33.50 33.27 2g18 n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2g18 h ALA 41 N 2.15 1.18 0.00 3.55 0.00 -2.02 0.22 119.26 124.34 2g18 h ALA 41 Ca -0.38 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2g18 h ALA 41 Cb 1.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2g18 h ALA 41 CO 0.62 0.10 0.00 0.39 0.00 0.00 0.00 179.25 180.37 2g18 n GLU 42 N -3.44 0.23 0.00 0.00 1.02 -1.26 -3.51 120.64 113.67 2g18 n GLU 42 Ca -0.02 0.10 0.05 0.00 -0.02 0.00 0.00 57.16 57.28 2g18 n GLU 42 Cb 0.23 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.11 2g18 n GLU 42 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2g18 n LEU 43 N -1.34 0.85 0.06 -4.62 4.77 0.78 -4.43 117.00 113.07 2g18 n LEU 43 Ca 0.09 -0.61 -0.04 0.00 -0.03 0.00 0.00 56.01 55.41 2g18 n LEU 43 Cb 0.19 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.45 2g18 n LEU 43 CO 0.17 0.18 0.59 1.23 -1.33 0.00 0.00 177.39 178.23 2g18 h GLY 44 N 2.49 0.36 -6.83 -0.72 0.00 -1.59 -3.42 103.07 93.36 2g18 h GLY 44 Ca 0.00 -0.37 -0.30 0.00 0.00 0.00 0.00 47.33 46.66 2g18 h GLY 44 CO 0.00 0.33 -0.63 -0.47 0.00 0.00 0.00 176.54 175.78 2g18 s TYR 45 N -4.08 -0.22 -0.07 5.60 5.04 -1.26 -0.63 117.35 121.73 2g18 s TYR 45 Ca -0.05 0.49 0.04 0.00 -2.44 0.00 0.00 57.07 55.11 2g18 s TYR 45 Cb 0.13 -0.29 -0.00 0.00 0.35 0.00 0.00 41.96 42.15 2g18 s TYR 45 CO 0.79 -0.39 -0.21 0.08 -1.34 0.00 0.00 175.55 174.48 2g18 s VAL 46 N 2.31 1.78 -0.01 3.14 1.01 -0.10 -4.92 120.40 123.62 2g18 s VAL 46 Ca 0.04 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.20 2g18 s VAL 46 Cb -0.13 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.69 2g18 s VAL 46 CO -0.08 0.50 -0.24 -1.61 0.00 0.00 0.00 175.10 173.67 2g18 s GLU 47 N 0.16 1.92 0.00 2.72 2.02 -1.26 -0.93 118.70 123.32 2g18 s GLU 47 Ca -0.10 -0.88 0.00 0.00 0.02 0.00 0.00 54.97 54.00 2g18 s GLU 47 Cb -0.15 -1.88 0.00 0.00 0.10 0.00 0.00 34.13 32.20 2g18 s GLU 47 CO 0.05 0.51 0.00 0.41 0.02 0.00 0.00 175.26 176.25 2g18 n GLY 48 N 2.40 2.41 2.92 -1.39 0.00 -0.41 -4.99 105.19 106.13 2g18 n GLY 48 Ca -0.16 -1.01 -0.11 0.00 0.00 0.00 0.00 46.02 44.74 2g18 n GLY 48 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2g18 s ARG 49 N -1.31 0.13 -0.18 1.61 1.81 -1.26 -0.71 118.95 119.04 2g18 s ARG 49 Ca 0.00 -0.23 -0.05 0.00 -1.72 0.00 0.00 55.73 53.72 2g18 s ARG 49 Cb 0.00 0.05 0.09 0.00 -0.45 0.00 0.00 34.95 34.64 2g18 s ARG 49 CO 0.00 -0.02 0.34 -1.17 -0.68 0.00 0.00 175.30 173.76 2g18 s LEU 50 N -0.58 -0.47 -1.48 2.53 2.96 0.06 -4.69 118.68 117.01 2g18 s LEU 50 Ca -0.06 0.62 -0.12 0.00 -0.22 0.00 0.00 54.13 54.35 2g18 s LEU 50 Cb -0.04 0.98 0.07 0.00 0.50 0.00 0.00 46.19 47.71 2g18 s LEU 50 CO -0.00 -0.25 0.82 -0.62 -1.32 0.00 0.00 176.35 174.97 2g18 n GLU 51 N 5.37 -4.93 0.00 1.98 -0.58 -1.26 -0.30 120.64 120.92 2g18 n GLU 51 Ca -0.07 0.61 0.00 0.00 -0.42 0.00 0.00 57.16 57.28 2g18 n GLU 51 Cb 0.50 -5.45 0.00 0.00 -0.57 0.00 0.00 31.44 25.91 2g18 n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2g18 n GLY 52 N -1.55 3.01 3.79 0.62 0.00 -1.26 -5.01 105.19 104.79 2g18 n GLY 52 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 2g18 n GLY 52 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g18 s GLU 53 N -0.04 4.50 0.14 1.61 0.41 0.59 -5.03 118.70 120.88 2g18 s GLU 53 Ca 0.00 1.23 -0.31 0.00 -0.41 0.00 0.00 54.97 55.49 2g18 s GLU 53 Cb 0.00 -2.76 -0.08 0.00 -1.78 0.00 0.00 34.13 29.51 2g18 s GLU 53 CO 0.00 0.27 1.30 0.21 -0.49 0.00 0.00 175.26 176.56 2g18 s LYS 54 N -2.14 4.38 -0.17 1.61 2.20 -1.26 -0.76 119.74 123.60 2g18 s LYS 54 Ca 0.50 1.98 -0.05 0.00 -0.36 0.00 0.00 55.97 58.05 2g18 s LYS 54 Cb -0.17 -3.25 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 2g18 s LYS 54 CO 0.22 -0.30 -0.01 -1.17 -0.36 0.00 0.00 175.35 173.73 2g18 s LEU 55 N 0.55 3.37 -0.02 5.43 0.20 0.11 -0.70 118.68 127.61 2g18 s LEU 55 Ca 0.59 -0.09 0.03 0.00 0.69 0.00 0.00 54.13 55.35 2g18 s LEU 55 Cb -0.35 -1.82 -0.00 0.00 -0.43 0.00 0.00 46.19 43.59 2g18 s LEU 55 CO 0.33 0.16 -0.11 -0.89 -0.29 0.00 0.00 176.35 175.55 2g18 s THR 56 N 0.43 0.94 -0.06 3.68 2.01 0.13 -1.29 115.64 121.48 2g18 s THR 56 Ca -0.02 -0.47 0.02 0.00 0.31 0.00 0.00 61.69 61.53 2g18 s THR 56 Cb -0.14 -0.81 0.02 0.00 0.01 0.00 0.00 72.50 71.58 2g18 s THR 56 CO 0.02 0.28 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.51 2g18 s ILE 57 N 0.01 0.87 -0.14 1.82 1.01 -0.11 -1.26 121.20 123.40 2g18 s ILE 57 Ca -0.01 -0.32 0.02 0.00 0.00 0.00 0.00 60.65 60.35 2g18 s ILE 57 Cb -0.08 -0.83 0.01 0.00 0.01 0.00 0.00 42.46 41.58 2g18 s ILE 57 CO 0.00 0.30 -0.20 -0.70 0.00 0.00 0.00 174.94 174.34 2g18 s GLU 58 N 0.79 2.80 -0.08 2.79 2.12 0.21 -0.92 118.70 126.40 2g18 s GLU 58 Ca -0.13 -0.77 0.05 0.00 0.36 0.00 0.00 54.97 54.48 2g18 s GLU 58 Cb -0.15 -2.32 -0.01 0.00 0.26 0.00 0.00 34.13 31.91 2g18 s GLU 58 CO 0.02 -0.07 -0.23 -0.80 -0.54 0.00 0.00 175.26 173.64 2g18 s ASN 59 N 0.98 3.22 -0.06 -1.70 0.01 0.19 -1.47 114.94 116.11 2g18 s ASN 59 Ca -0.04 -0.49 0.01 0.00 -0.71 0.00 0.00 52.86 51.62 2g18 s ASN 59 Cb -0.15 -1.11 0.02 0.00 0.41 0.00 0.00 41.25 40.43 2g18 s ASN 59 CO -0.04 0.21 -0.05 -0.60 -1.51 0.00 0.00 177.10 175.11 2g18 s ARG 60 N 0.02 1.03 0.05 -0.60 3.52 0.53 -4.78 118.95 118.72 2g18 s ARG 60 Ca -0.09 -0.14 0.04 0.00 -0.13 0.00 0.00 55.73 55.42 2g18 s ARG 60 Cb -0.15 -1.05 -0.02 0.00 -1.56 0.00 0.00 34.95 32.16 2g18 s ARG 60 CO 0.05 -0.12 -0.12 0.00 -0.81 0.00 0.00 175.30 174.30 2g18 s TYR 62 N -1.06 1.76 0.09 0.00 1.51 0.14 -3.21 117.35 116.57 2g18 s TYR 62 Ca -0.02 -1.66 -0.17 0.00 -1.01 0.00 0.00 57.07 54.20 2g18 s TYR 62 Cb -0.09 -0.71 0.04 0.00 -0.11 0.00 0.00 41.96 41.09 2g18 s TYR 62 CO 0.01 -0.88 0.41 1.14 -1.11 0.00 0.00 175.55 175.13 2g18 s GLN 63 N -3.44 1.01 0.30 -0.62 -2.07 -0.18 0.10 119.66 114.75 2g18 s GLN 63 Ca 0.41 -0.54 -0.01 0.00 -1.82 0.00 0.00 55.36 53.40 2g18 s GLN 63 Cb 0.02 0.45 -0.02 0.00 -1.09 0.00 0.00 33.01 32.37 2g18 s GLN 63 CO 0.28 -0.37 0.35 0.95 -1.32 0.00 0.00 175.29 175.18 2g18 s THR 64 N -3.18 0.00 0.56 3.63 -4.23 -0.63 -0.63 115.64 111.16 2g18 s THR 64 Ca -0.01 -1.76 0.25 0.00 -1.18 0.00 0.00 61.69 58.99 2g18 s THR 64 Cb 0.01 -2.52 0.34 0.00 1.34 0.00 0.00 72.50 71.67 2g18 s THR 64 CO -0.07 0.00 2.12 -0.65 -0.54 0.00 0.00 174.62 175.47 2g18 h PRO 65 N 2.24 0.00 0.00 3.99 0.11 -2.01 -2.76 132.00 133.57 2g18 h PRO 65 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2g18 h PRO 65 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2g18 h PRO 65 CO 0.41 0.00 -1.84 1.04 -0.21 0.00 0.00 178.00 177.39 2g18 n GLN 66 N -4.11 0.65 -4.38 1.05 3.00 -1.26 -4.86 117.38 107.47 2g18 n GLN 66 Ca 0.01 -0.15 -0.33 0.00 -0.01 0.00 0.00 57.00 56.52 2g18 n GLN 66 Cb 0.28 -1.57 -0.16 0.00 0.00 0.00 0.00 30.24 28.80 2g18 n GLN 66 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 2g18 s PHE 67 N -3.49 2.78 0.34 1.08 0.40 -1.04 -0.17 117.98 117.87 2g18 s PHE 67 Ca -0.07 -1.23 0.03 0.00 -0.60 0.00 0.00 56.93 55.06 2g18 s PHE 67 Cb 0.13 -1.91 0.61 0.00 0.51 0.00 0.00 43.02 42.36 2g18 s PHE 67 CO 0.89 -0.59 1.94 -0.09 0.70 0.00 0.00 175.22 178.07 2g18 h ARG 68 N 7.56 0.70 -1.49 0.44 2.43 -0.72 -1.67 114.38 121.62 2g18 h ARG 68 Ca -0.37 -0.09 0.12 0.00 -0.81 0.00 0.00 59.98 58.83 2g18 h ARG 68 Cb 1.17 -0.13 -0.26 0.00 -0.42 0.00 0.00 29.97 30.34 2g18 h ARG 68 CO 0.59 0.56 0.30 0.21 -1.51 0.00 0.00 179.97 180.12 2g18 s LYS 69 N -5.36 0.40 -0.20 0.20 2.20 -1.16 -4.68 119.74 111.14 2g18 s LYS 69 Ca -0.09 0.76 0.01 0.00 -0.36 0.00 0.00 55.97 56.29 2g18 s LYS 69 Cb 0.16 0.19 0.04 0.00 -1.51 0.00 0.00 37.83 36.72 2g18 s LYS 69 CO 0.77 -0.10 -0.10 -1.64 -0.36 0.00 0.00 175.35 173.92 2g18 s MET 70 N 1.66 1.98 -0.18 4.03 -1.94 0.11 -0.36 119.30 124.61 2g18 s MET 70 Ca -0.08 -0.87 0.01 0.00 -1.71 0.00 0.00 55.69 53.04 2g18 s MET 70 Cb -0.05 -2.44 0.02 0.00 2.01 0.00 0.00 34.83 34.37 2g18 s MET 70 CO -0.16 -0.45 -0.20 -1.58 -0.01 0.00 0.00 175.02 172.62 2g18 s HIS 71 N 1.39 2.75 -0.21 -0.03 5.04 -0.27 -0.68 115.29 123.28 2g18 s HIS 71 Ca -0.02 -1.62 -0.04 0.00 -1.54 0.00 0.00 55.06 51.83 2g18 s HIS 71 Cb -0.17 -1.90 -0.02 0.00 0.04 0.00 0.00 32.58 30.54 2g18 s HIS 71 CO -0.08 -0.80 -0.03 -1.17 -2.34 0.00 0.00 174.74 170.33 2g18 s LEU 72 N 1.29 3.04 -0.08 8.88 2.96 0.12 -1.74 118.68 133.16 2g18 s LEU 72 Ca 0.05 -0.31 0.05 0.00 -0.22 0.00 0.00 54.13 53.70 2g18 s LEU 72 Cb -0.13 -1.77 -0.00 0.00 0.50 0.00 0.00 46.19 44.78 2g18 s LEU 72 CO -0.13 0.02 -0.24 -0.70 -1.32 0.00 0.00 176.35 173.98 2g18 s GLU 73 N 1.26 2.85 -0.06 1.98 2.12 0.13 -0.35 118.70 126.63 2g18 s GLU 73 Ca 0.03 -0.89 0.04 0.00 0.36 0.00 0.00 54.97 54.52 2g18 s GLU 73 Cb -0.14 -2.25 -0.00 0.00 0.26 0.00 0.00 34.13 32.00 2g18 s GLU 73 CO -0.00 0.26 -0.19 -0.51 -0.54 0.00 0.00 175.26 174.27 2g18 s LEU 74 N 0.13 1.94 0.02 2.70 1.43 -0.54 -0.45 118.68 123.91 2g18 s LEU 74 Ca -0.13 -0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 52.55 2g18 s LEU 74 Cb -0.16 -1.12 -0.02 0.00 0.03 0.00 0.00 46.19 44.92 2g18 s LEU 74 CO 0.07 0.15 -0.02 0.00 0.23 0.00 0.00 176.35 176.79 2g18 s ALA 75 N 0.16 0.11 -0.04 4.21 0.00 0.49 -0.62 121.76 126.06 2g18 s ALA 75 Ca -0.09 -0.60 -0.02 0.00 0.00 0.00 0.00 51.96 51.25 2g18 s ALA 75 Cb -0.14 0.16 0.03 0.00 0.00 0.00 0.00 23.12 23.16 2g18 s ALA 75 CO 0.04 -0.18 0.10 0.21 0.00 0.00 0.00 175.76 175.93 2g18 s LYS 76 N -1.65 0.06 -0.28 0.00 2.20 -0.39 -0.66 119.74 119.02 2g18 s LYS 76 Ca -0.14 0.24 0.02 0.00 -0.36 0.00 0.00 55.97 55.73 2g18 s LYS 76 Cb -0.08 -0.12 0.07 0.00 -1.51 0.00 0.00 37.83 36.18 2g18 s LYS 76 CO -0.01 -0.12 -0.06 0.08 -0.36 0.00 0.00 175.35 174.88 2g18 s VAL 77 N 0.78 2.33 0.00 4.02 1.01 -0.15 -0.69 120.40 127.69 2g18 s VAL 77 Ca -0.06 -1.72 0.00 0.00 0.00 0.00 0.00 61.98 60.20 2g18 s VAL 77 Cb -0.08 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.87 2g18 s VAL 77 CO -0.03 -0.14 0.00 0.61 0.00 0.00 0.00 175.10 175.54 2g18 n GLY 78 N 4.43 1.74 0.54 4.51 0.00 0.12 -1.10 105.19 115.43 2g18 n GLY 78 Ca -0.11 0.17 0.05 0.00 0.00 0.00 0.00 46.02 46.14 2g18 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2g18 n ASN 79 N 1.28 2.92 0.03 1.61 3.02 -1.26 -4.60 115.26 118.26 2g18 n ASN 79 Ca 0.00 -2.26 -0.10 0.00 -0.03 0.00 0.00 54.58 52.19 2g18 n ASN 79 Cb 0.00 -0.26 -0.13 0.00 -0.61 0.00 0.00 39.78 38.77 2g18 n ASN 79 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 2g18 h MET 80 N 1.51 0.06 -2.69 3.52 2.86 -1.50 -3.13 114.93 115.55 2g18 h MET 80 Ca 0.00 -0.09 -0.14 0.00 -2.06 0.00 0.00 59.70 57.41 2g18 h MET 80 Cb 0.85 0.04 -0.28 0.00 0.06 0.00 0.00 31.60 32.26 2g18 h MET 80 CO 0.04 0.82 -0.38 -1.17 1.06 0.00 0.00 176.91 177.29 2g18 s LEU 81 N -6.52 -0.23 -0.04 1.22 2.96 -0.90 -4.43 118.68 110.74 2g18 s LEU 81 Ca -0.04 0.82 0.06 0.00 -0.22 0.00 0.00 54.13 54.76 2g18 s LEU 81 Cb 0.08 1.16 -0.02 0.00 0.50 0.00 0.00 46.19 47.92 2g18 s LEU 81 CO 0.83 -0.21 -0.23 -1.81 -1.32 0.00 0.00 176.35 173.61 2g18 s ASP 82 N 1.92 3.29 -0.01 3.68 1.01 -0.36 -0.98 116.67 125.22 2g18 s ASP 82 Ca -0.05 -0.43 0.01 0.00 0.71 0.00 0.00 52.55 52.79 2g18 s ASP 82 Cb -0.10 -0.68 0.01 0.00 1.01 0.00 0.00 42.92 43.16 2g18 s ASP 82 CO -0.12 0.29 -0.01 -0.63 0.21 0.00 0.00 175.17 174.91 2g18 s ILE 83 N -0.43 0.19 -0.06 0.77 1.01 0.17 -0.81 121.20 122.03 2g18 s ILE 83 Ca 0.04 -0.02 0.05 0.00 0.00 0.00 0.00 60.65 60.72 2g18 s ILE 83 Cb -0.12 -0.22 -0.00 0.00 0.01 0.00 0.00 42.46 42.13 2g18 s ILE 83 CO 0.01 0.10 -0.21 -0.22 0.00 0.00 0.00 174.94 174.62 2g18 s LEU 84 N 0.43 1.97 -0.03 2.97 0.20 0.02 -0.38 118.68 123.86 2g18 s LEU 84 Ca -0.04 -0.44 0.01 0.00 0.69 0.00 0.00 54.13 54.35 2g18 s LEU 84 Cb -0.07 -1.17 0.01 0.00 -0.43 0.00 0.00 46.19 44.53 2g18 s LEU 84 CO -0.01 0.17 -0.04 -2.28 -0.29 0.00 0.00 176.35 173.90 2g18 s HIS 85 N 0.09 0.59 -0.02 5.38 5.65 0.40 -0.36 115.29 127.02 2g18 s HIS 85 Ca -0.08 -0.13 -0.00 0.00 0.25 0.00 0.00 55.06 55.10 2g18 s HIS 85 Cb -0.14 -0.50 0.03 0.00 -1.18 0.00 0.00 32.58 30.79 2g18 s HIS 85 CO 0.04 -0.11 0.03 0.00 -0.65 0.00 0.00 174.74 174.05 2g18 s VAL 87 N 1.22 0.80 -0.21 0.00 1.01 -0.71 -0.90 120.40 121.61 2g18 s VAL 87 Ca -0.07 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 2g18 s VAL 87 Cb -0.13 -0.70 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 2g18 s VAL 87 CO -0.03 0.11 -0.06 -0.04 0.00 0.00 0.00 175.10 175.09 2g18 s MET 88 N -0.53 3.35 -0.35 2.72 -1.94 -0.37 -1.11 119.30 121.06 2g18 s MET 88 Ca 0.02 -0.64 -0.12 0.00 -1.71 0.00 0.00 55.69 53.23 2g18 s MET 88 Cb -0.05 -2.95 -0.00 0.00 2.01 0.00 0.00 34.83 33.84 2g18 s MET 88 CO 0.00 -0.16 0.23 -0.06 -0.01 0.00 0.00 175.02 175.02 2g18 s PHE 89 N 1.36 3.22 0.61 -0.03 0.40 0.51 -3.61 117.98 120.45 2g18 s PHE 89 Ca 0.04 -0.45 -0.16 0.00 -0.60 0.00 0.00 56.93 55.76 2g18 s PHE 89 Cb -0.14 -2.47 -0.02 0.00 0.51 0.00 0.00 43.02 40.89 2g18 s PHE 89 CO -0.03 -0.46 1.10 -2.14 0.70 0.00 0.00 175.22 174.38 2g18 s PRO 90 N 1.67 3.08 0.38 0.24 0.02 -1.26 -0.13 135.00 139.00 2g18 s PRO 90 Ca 0.05 1.40 -0.27 0.00 0.02 0.00 0.00 61.00 62.20 2g18 s PRO 90 Cb -0.18 -1.99 -0.09 0.00 0.02 0.00 0.00 34.50 32.26 2g18 s PRO 90 CO 0.09 -1.03 1.34 1.03 -0.33 0.00 0.00 177.00 178.10 2g18 s ARG 91 N -3.88 4.09 0.00 5.54 0.52 0.76 -4.34 118.95 121.64 2g18 s ARG 91 Ca 0.67 2.25 0.14 0.00 -0.52 0.00 0.00 55.73 58.27 2g18 s ARG 91 Cb -0.20 -2.88 0.72 0.00 0.52 0.00 0.00 34.95 33.12 2g18 s ARG 91 CO 0.36 -0.42 1.32 -0.35 0.02 0.00 0.00 175.30 176.23 2g18 n PRO 92 N 0.36 0.27 0.00 3.54 -0.04 -1.26 -1.86 135.00 136.01 2g18 n PRO 92 Ca 0.02 0.11 0.12 0.00 -0.04 0.00 0.00 63.50 63.71 2g18 n PRO 92 Cb 0.42 -1.50 0.54 0.00 -0.04 0.00 0.00 33.50 32.92 2g18 n PRO 92 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2g18 n GLU 93 N -1.20 0.12 -5.05 0.54 4.71 -1.26 -4.57 120.64 113.94 2g18 n GLU 93 Ca 0.08 0.08 -0.32 0.00 -0.01 0.00 0.00 57.16 56.99 2g18 n GLU 93 Cb 0.09 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 28.87 2g18 n GLU 93 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 2g18 s TYR 94 N -2.85 2.57 -1.38 -0.32 1.51 -0.78 -0.77 117.35 115.34 2g18 s TYR 94 Ca 0.15 -0.35 -0.13 0.00 -1.01 0.00 0.00 57.07 55.73 2g18 s TYR 94 Cb 0.16 -1.61 0.09 0.00 -0.11 0.00 0.00 41.96 40.48 2g18 s TYR 94 CO 0.41 0.04 2.02 -3.47 -1.11 0.00 0.00 175.55 173.43 2g18 n ASP 95 N 2.54 4.42 -4.12 2.29 2.03 -1.26 -4.86 116.55 117.59 2g18 n ASP 95 Ca -0.17 -2.93 -0.23 0.00 0.52 0.00 0.00 54.79 51.98 2g18 n ASP 95 Cb 0.52 -1.62 -0.15 0.00 -0.72 0.00 0.00 41.12 39.14 2g18 n ASP 95 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2g18 s LEU 96 N 1.86 1.98 1.04 -2.67 1.43 -1.26 -4.87 118.68 116.20 2g18 s LEU 96 Ca 0.46 -0.28 -0.14 0.00 -1.03 0.00 0.00 54.13 53.14 2g18 s LEU 96 Cb 0.10 -0.79 0.21 0.00 0.03 0.00 0.00 46.19 45.74 2g18 s LEU 96 CO -0.04 0.17 1.10 -2.16 0.23 0.00 0.00 176.35 175.66 2g18 s PRO 97 N -0.23 0.07 -0.26 1.29 0.04 -1.26 -4.68 135.00 129.97 2g18 s PRO 97 Ca 0.03 0.35 -0.16 0.00 0.04 0.00 0.00 61.00 61.26 2g18 s PRO 97 Cb -0.07 -1.71 -0.03 0.00 0.04 0.00 0.00 34.50 32.72 2g18 s PRO 97 CO -0.00 -2.93 0.42 -1.64 0.04 0.00 0.00 177.00 172.89 2g18 s MET 98 N -5.09 4.05 0.05 4.56 -1.94 -0.30 -4.72 119.30 115.91 2g18 s MET 98 Ca 0.67 0.15 -0.24 0.00 -1.71 0.00 0.00 55.69 54.55 2g18 s MET 98 Cb -0.16 -3.65 -0.06 0.00 2.01 0.00 0.00 34.83 32.97 2g18 s MET 98 CO 0.57 -0.29 0.74 0.12 -0.01 0.00 0.00 175.02 176.15 2g18 s PHE 99 N 2.10 3.75 -0.11 -0.03 5.36 -1.24 -0.30 117.98 127.51 2g18 s PHE 99 Ca 0.17 1.45 -0.09 0.00 -0.96 0.00 0.00 56.93 57.50 2g18 s PHE 99 Cb -0.16 -2.78 0.03 0.00 -0.34 0.00 0.00 43.02 39.78 2g18 s PHE 99 CO 0.09 0.32 0.29 0.20 -1.46 0.00 0.00 175.22 174.67 2g18 s GLY 100 N -0.23 -0.22 -0.03 13.12 0.00 -0.55 -1.24 107.32 118.16 2g18 s GLY 100 Ca 0.37 0.89 -0.12 0.00 0.00 0.00 0.00 44.72 45.86 2g18 s GLY 100 CO 0.23 0.85 0.27 0.00 0.00 0.00 0.00 173.10 174.45 2g18 s ASP 102 N -1.01 0.42 -0.07 0.00 1.01 0.12 -0.14 116.67 117.00 2g18 s ASP 102 Ca -0.11 -0.09 0.02 0.00 0.71 0.00 0.00 52.55 53.08 2g18 s ASP 102 Cb -0.05 -0.04 0.02 0.00 1.01 0.00 0.00 42.92 43.86 2g18 s ASP 102 CO 0.03 0.03 -0.10 -0.22 0.21 0.00 0.00 175.17 175.12 2g18 s LEU 103 N -0.16 1.52 -0.08 1.23 2.96 0.51 -0.96 118.68 123.72 2g18 s LEU 103 Ca 0.01 -0.26 0.03 0.00 -0.22 0.00 0.00 54.13 53.69 2g18 s LEU 103 Cb -0.02 -0.75 0.01 0.00 0.50 0.00 0.00 46.19 45.93 2g18 s LEU 103 CO -0.00 -0.00 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.16 2g18 s VAL 104 N 0.84 1.53 0.26 1.68 1.01 -0.24 -0.80 120.40 124.67 2g18 s VAL 104 Ca -0.12 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.15 2g18 s VAL 104 Cb -0.15 -1.35 -0.00 0.00 0.00 0.00 0.00 36.38 34.88 2g18 s VAL 104 CO 0.02 0.44 0.33 0.61 0.00 0.00 0.00 175.10 176.49 2g18 n GLY 105 N 3.61 2.59 3.31 4.51 0.00 0.01 -1.32 105.19 117.90 2g18 n GLY 105 Ca -0.21 -1.64 0.02 0.00 0.00 0.00 0.00 46.02 44.20 2g18 n GLY 105 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2g18 s GLY 106 N -2.68 0.00 -0.10 -0.02 0.00 -0.09 -1.22 107.32 103.22 2g18 s GLY 106 Ca 0.24 3.30 -0.04 0.00 0.00 0.00 0.00 44.72 48.22 2g18 s GLY 106 CO 0.17 3.30 0.10 -0.96 0.00 0.00 0.00 173.10 175.72 2g18 n ARG 107 N 4.81 -0.29 0.00 2.90 -4.01 -1.19 0.11 116.66 118.99 2g18 n ARG 107 Ca -0.08 0.19 0.00 0.00 -1.04 0.00 0.00 57.85 56.92 2g18 n ARG 107 Cb 0.54 -0.34 0.00 0.00 -3.04 0.00 0.00 32.46 29.62 2g18 n ARG 107 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2g18 n GLY 108 N -0.28 2.68 3.58 2.89 0.00 -1.26 -4.98 105.19 107.81 2g18 n GLY 108 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 2g18 n GLY 108 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2g18 s GLN 109 N 0.00 2.34 -0.31 1.61 -1.52 0.31 -5.07 119.66 117.02 2g18 s GLN 109 Ca 0.00 -0.87 -0.09 0.00 -1.95 0.00 0.00 55.36 52.45 2g18 s GLN 109 Cb 0.00 -2.39 0.00 0.00 -0.22 0.00 0.00 33.01 30.40 2g18 s GLN 109 CO 0.00 0.56 0.14 0.42 -0.25 0.00 0.00 175.29 176.15 2g18 s ILE 110 N -1.08 4.40 -0.14 1.08 1.01 -1.26 -0.92 121.20 124.29 2g18 s ILE 110 Ca 0.19 -0.56 0.16 0.00 0.00 0.00 0.00 60.65 60.44 2g18 s ILE 110 Cb -0.11 -3.28 -0.05 0.00 0.01 0.00 0.00 42.46 39.03 2g18 s ILE 110 CO 0.10 0.03 1.08 0.77 0.00 0.00 0.00 174.94 176.92 2g18 h SER 111 N 8.32 0.00 -3.26 3.58 4.64 -1.56 -3.37 113.55 121.91 2g18 h SER 111 Ca -0.31 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.91 2g18 h SER 111 Cb 1.13 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 62.97 2g18 h SER 111 CO 0.62 0.51 -0.26 0.00 -0.87 0.00 0.00 176.83 176.83 2g18 s ALA 112 N -2.97 -1.12 -0.07 5.18 0.00 -1.03 -4.48 121.76 117.27 2g18 s ALA 112 Ca -0.00 1.58 -0.00 0.00 0.00 0.00 0.00 51.96 53.54 2g18 s ALA 112 Cb 0.08 -0.95 0.02 0.00 0.00 0.00 0.00 23.12 22.27 2g18 s ALA 112 CO 0.78 -0.27 -0.03 0.00 0.00 0.00 0.00 175.76 176.25 2g18 s ALA 113 N 1.33 0.80 -0.01 0.00 0.00 0.14 -1.08 121.76 122.94 2g18 s ALA 113 Ca -0.09 -0.17 0.03 0.00 0.00 0.00 0.00 51.96 51.73 2g18 s ALA 113 Cb -0.08 -0.66 -0.01 0.00 0.00 0.00 0.00 23.12 22.38 2g18 s ALA 113 CO -0.12 -0.29 -0.10 -1.50 0.00 0.00 0.00 175.76 173.75 2g18 s ILE 114 N 1.55 0.77 -0.08 0.00 2.07 -0.13 -1.18 121.20 124.19 2g18 s ILE 114 Ca -0.01 -0.44 -0.08 0.00 -1.41 0.00 0.00 60.65 58.71 2g18 s ILE 114 Cb -0.13 -0.65 0.02 0.00 0.13 0.00 0.00 42.46 41.83 2g18 s ILE 114 CO -0.04 0.20 0.23 0.00 -1.91 0.00 0.00 174.94 173.43 2g18 s ALA 115 N -0.26 -0.58 0.07 1.50 0.00 -0.23 -0.70 121.76 121.55 2g18 s ALA 115 Ca 0.03 0.62 -0.20 0.00 0.00 0.00 0.00 51.96 52.42 2g18 s ALA 115 Cb -0.04 -0.35 0.04 0.00 0.00 0.00 0.00 23.12 22.77 2g18 s ALA 115 CO -0.00 -0.12 0.47 0.34 0.00 0.00 0.00 175.76 176.44 2g18 s ASP 116 N 0.01 -0.35 -0.53 0.00 2.15 0.23 -1.06 116.67 117.11 2g18 s ASP 116 Ca -0.01 -0.00 -0.05 0.00 0.43 0.00 0.00 52.55 52.91 2g18 s ASP 116 Cb -0.02 0.47 0.14 0.00 -0.30 0.00 0.00 42.92 43.21 2g18 s ASP 116 CO 0.01 -0.75 0.37 -0.76 -0.17 0.00 0.00 175.17 173.86 2g18 s LEU 117 N -2.23 5.49 0.08 -1.34 1.43 -1.26 -1.49 118.68 119.37 2g18 s LEU 117 Ca -0.03 -2.34 -0.26 0.00 -1.03 0.00 0.00 54.13 50.48 2g18 s LEU 117 Cb -0.00 -1.92 -0.06 0.00 0.03 0.00 0.00 46.19 44.24 2g18 s LEU 117 CO -0.05 -0.53 0.79 -0.44 0.23 0.00 0.00 176.35 176.36 2g18 s SER 118 N 1.69 7.29 0.46 2.29 0.01 0.59 -4.35 113.70 121.69 2g18 s SER 118 Ca 0.11 1.54 -0.23 0.00 1.31 0.00 0.00 55.95 58.69 2g18 s SER 118 Cb -0.22 -2.49 -0.07 0.00 0.21 0.00 0.00 66.02 63.45 2g18 s SER 118 CO -0.03 0.05 1.18 -2.16 0.41 0.00 0.00 173.24 172.69 2g18 s PRO 119 N -0.33 3.72 0.00 12.44 0.04 -1.26 -1.15 135.00 148.46 2g18 s PRO 119 Ca 0.39 1.82 0.18 0.00 0.04 0.00 0.00 61.00 63.43 2g18 s PRO 119 Cb -0.22 -2.41 -0.10 0.00 0.04 0.00 0.00 34.50 31.82 2g18 s PRO 119 CO 0.25 -0.60 0.86 1.33 0.04 0.00 0.00 177.00 178.88 2g18 n VAL 120 N -0.50 0.00 -2.57 -0.36 0.24 -1.26 -4.84 118.33 109.04 2g18 n VAL 120 Ca 0.07 -0.19 -0.37 0.00 -2.04 0.00 0.00 64.34 61.81 2g18 n VAL 120 Cb 0.48 1.11 -0.04 0.00 -1.47 0.00 0.00 33.84 33.91 2g18 n VAL 120 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 2g18 s HIS 121 N -2.41 3.36 0.41 6.34 3.76 -1.26 -3.80 115.29 121.69 2g18 s HIS 121 Ca 0.11 1.67 0.10 0.00 -0.15 0.00 0.00 55.06 56.79 2g18 s HIS 121 Cb 0.14 -3.12 0.91 0.00 1.11 0.00 0.00 32.58 31.62 2g18 s HIS 121 CO 0.60 -0.51 2.02 -0.07 -0.85 0.00 0.00 174.74 175.93 2g18 h LEU 122 N 2.75 0.45 -1.70 0.89 3.38 -1.92 -2.47 115.31 116.70 2g18 h LEU 122 Ca -0.48 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2g18 h LEU 122 Cb 1.21 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2g18 h LEU 122 CO 0.63 0.31 0.00 -0.90 0.09 0.00 0.00 178.44 178.57 2g18 n ASP 123 N -4.47 2.44 -0.10 -0.43 5.68 -1.26 -4.91 116.55 113.49 2g18 n ASP 123 Ca 0.07 -2.25 -0.01 0.00 -0.50 0.00 0.00 54.79 52.09 2g18 n ASP 123 Cb 0.20 -0.46 -0.01 0.00 -1.14 0.00 0.00 41.12 39.72 2g18 n ASP 123 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2g18 n ARG 124 N 0.27 -1.24 -3.17 0.11 1.74 -0.93 -5.01 116.66 108.43 2g18 n ARG 124 Ca 0.10 0.38 -0.27 0.00 -0.77 0.00 0.00 57.85 57.29 2g18 n ARG 124 Cb 0.50 -4.34 -0.02 0.00 -1.02 0.00 0.00 32.46 27.58 2g18 n ARG 124 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2g18 s THR 125 N -1.47 5.01 0.43 0.55 -4.23 -1.26 -4.74 115.64 109.93 2g18 s THR 125 Ca 0.00 -0.04 0.03 0.00 -1.18 0.00 0.00 61.69 60.50 2g18 s THR 125 Cb 0.00 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 70.04 2g18 s THR 125 CO 0.00 -0.52 0.62 -0.76 -0.54 0.00 0.00 174.62 173.43 2g18 s LEU 126 N -4.05 3.67 0.73 4.79 1.43 -1.26 -4.06 118.68 119.93 2g18 s LEU 126 Ca 0.44 0.03 -0.13 0.00 -1.03 0.00 0.00 54.13 53.43 2g18 s LEU 126 Cb -0.10 -2.94 0.04 0.00 0.03 0.00 0.00 46.19 43.21 2g18 s LEU 126 CO 0.35 -0.71 1.13 -2.84 0.23 0.00 0.00 176.35 174.51 2g18 s PRO 127 N -4.47 2.35 0.25 1.29 0.02 -1.26 -4.85 135.00 128.33 2g18 s PRO 127 Ca 0.50 1.43 -0.06 0.00 0.02 0.00 0.00 61.00 62.88 2g18 s PRO 127 Cb -0.10 -1.89 0.26 0.00 0.02 0.00 0.00 34.50 32.79 2g18 s PRO 127 CO 0.36 -1.61 1.91 1.05 -0.33 0.00 0.00 177.00 178.38 2g18 h GLU 128 N -0.52 1.24 -0.10 5.54 9.09 -1.99 -1.40 114.58 126.44 2g18 h GLU 128 Ca -0.46 -0.07 -0.05 0.00 0.05 0.00 0.00 59.36 58.83 2g18 h GLU 128 Cb 1.25 -0.28 -0.01 0.00 -1.65 0.00 0.00 28.75 28.06 2g18 h GLU 128 CO 0.51 0.82 -0.18 0.66 0.05 0.00 0.00 179.01 180.87 2g18 h SER 129 N 1.28 0.15 -0.19 3.06 4.64 -2.00 -1.39 113.55 119.09 2g18 h SER 129 Ca 0.36 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.60 2g18 h SER 129 Cb -0.10 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 2g18 h SER 129 CO -0.09 0.35 -0.07 1.88 -0.87 0.00 0.00 176.83 178.03 2g18 h TYR 130 N 0.15 0.44 -0.11 4.77 -1.99 -1.65 -2.77 116.97 115.81 2g18 h TYR 130 Ca 0.03 -0.10 0.03 0.00 2.00 0.00 0.00 58.73 60.69 2g18 h TYR 130 Cb 0.42 -0.10 -0.03 0.00 2.00 0.00 0.00 36.73 39.01 2g18 h TYR 130 CO 0.00 0.66 -0.10 -0.91 -0.00 0.00 0.00 178.16 177.82 2g18 h ASN 131 N 0.09 -0.30 -0.35 3.88 2.35 -0.73 0.09 115.58 120.61 2g18 h ASN 131 Ca 0.05 0.06 0.03 0.00 -0.55 0.00 0.00 56.30 55.88 2g18 h ASN 131 Cb 0.53 0.15 -0.03 0.00 0.05 0.00 0.00 38.32 39.02 2g18 h ASN 131 CO 0.02 -0.13 0.17 0.28 -1.65 0.00 0.00 177.43 176.12 2g18 h SER 132 N -0.12 0.25 -0.70 5.81 0.02 -1.37 -0.12 113.55 117.32 2g18 h SER 132 Ca 0.07 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 2g18 h SER 132 Cb 0.22 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 2g18 h SER 132 CO -0.18 0.18 0.30 0.00 -1.14 0.00 0.00 176.83 176.00 2g18 h ALA 133 N 1.19 0.91 0.18 3.77 0.00 -1.25 -2.17 119.26 121.89 2g18 h ALA 133 Ca 0.15 -0.17 -0.30 0.00 0.00 0.00 0.00 54.91 54.59 2g18 h ALA 133 Cb 0.07 -0.28 0.02 0.00 0.00 0.00 0.00 17.79 17.60 2g18 h ALA 133 CO -0.11 0.52 -1.35 -0.07 0.00 0.00 0.00 179.25 178.24 2g18 h LEU 134 N 1.00 0.60 -0.84 0.00 3.38 -0.66 -3.16 115.31 115.63 2g18 h LEU 134 Ca 0.24 -0.64 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 2g18 h LEU 134 Cb 0.18 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2g18 h LEU 134 CO -0.02 1.50 -0.10 0.71 0.09 0.00 0.00 178.44 180.62 2g18 h THR 135 N 0.10 0.22 0.00 0.22 1.35 -1.02 -2.28 112.91 111.51 2g18 h THR 135 Ca -0.19 -0.96 0.00 0.00 -0.55 0.00 0.00 66.41 64.72 2g18 h THR 135 Cb 2.06 1.79 0.00 0.00 -1.73 0.00 0.00 68.15 70.27 2g18 h THR 135 CO 0.23 0.10 0.00 0.77 -0.25 0.00 0.00 175.52 176.38 2g18 h SER 136 N 0.00 0.00 -4.12 5.36 4.64 -1.36 -3.45 113.55 114.62 2g18 h SER 136 Ca -0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 2g18 h SER 136 Cb 0.78 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.93 2g18 h SER 136 CO 0.01 0.00 0.39 -0.76 -0.87 0.00 0.00 176.83 175.61 2g18 s LEU 137 N -5.48 3.69 0.77 5.97 1.43 -0.86 -5.02 118.68 119.18 2g18 s LEU 137 Ca 0.04 1.96 -0.12 0.00 -1.03 0.00 0.00 54.13 54.98 2g18 s LEU 137 Cb 0.09 -4.56 0.06 0.00 0.03 0.00 0.00 46.19 41.81 2g18 s LEU 137 CO 0.52 -1.06 1.13 0.20 0.23 0.00 0.00 176.35 177.37 2g18 s ASN 138 N -2.20 4.18 -0.14 2.29 0.01 -1.26 -4.98 114.94 112.82 2g18 s ASN 138 Ca 0.67 2.07 -0.29 0.00 -0.71 0.00 0.00 52.86 54.60 2g18 s ASN 138 Cb -0.18 -2.55 -0.01 0.00 0.41 0.00 0.00 41.25 38.91 2g18 s ASN 138 CO 0.28 -2.26 1.16 -0.89 -1.51 0.00 0.00 177.10 173.88 2g18 s THR 139 N -2.52 4.43 -0.21 1.60 2.01 -1.26 -5.02 115.64 114.66 2g18 s THR 139 Ca 0.67 1.73 -0.14 0.00 0.31 0.00 0.00 61.69 64.26 2g18 s THR 139 Cb -0.22 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.13 2g18 s THR 139 CO 0.51 -0.09 0.31 -0.76 -0.69 0.00 0.00 174.62 173.90 2g18 s LEU 140 N 2.91 4.14 -0.82 4.42 1.43 -1.26 -5.04 118.68 124.47 2g18 s LEU 140 Ca 0.52 0.38 -0.20 0.00 -1.03 0.00 0.00 54.13 53.79 2g18 s LEU 140 Cb -0.20 -2.37 0.11 0.00 0.03 0.00 0.00 46.19 43.75 2g18 s LEU 140 CO 0.15 -0.03 1.05 0.20 0.23 0.00 0.00 176.35 177.95 2g18 s ASN 141 N 1.03 6.45 0.07 2.29 -0.87 -1.26 -5.02 114.94 117.64 2g18 s ASN 141 Ca 0.15 -1.66 -0.21 0.00 -1.57 0.00 0.00 52.86 49.57 2g18 s ASN 141 Cb -0.14 -2.40 -0.07 0.00 -0.02 0.00 0.00 41.25 38.62 2g18 s ASN 141 CO 0.07 -1.19 0.63 -0.36 -2.57 0.00 0.00 177.10 173.67 2g18 s PHE 142 N 3.15 3.80 0.13 2.20 0.40 -1.26 -5.00 117.98 121.40 2g18 s PHE 142 Ca 0.28 1.34 -0.07 0.00 -0.60 0.00 0.00 56.93 57.88 2g18 s PHE 142 Cb -0.10 -2.59 -0.07 0.00 0.51 0.00 0.00 43.02 40.77 2g18 s PHE 142 CO -0.02 0.51 1.34 0.66 0.70 0.00 0.00 175.22 178.40 2g18 h SER 143 N 4.80 0.70 -2.31 1.36 4.64 -1.95 -3.37 113.55 117.43 2g18 h SER 143 Ca -0.48 -0.49 -0.64 0.00 -0.47 0.00 0.00 61.79 59.72 2g18 h SER 143 Cb 1.21 -0.21 -0.39 0.00 -0.31 0.00 0.00 62.40 62.70 2g18 h SER 143 CO 0.66 1.26 -0.34 0.00 -0.87 0.00 0.00 176.83 177.54 2g18 n GLN 144 N -3.86 3.05 -1.18 4.77 6.02 -1.26 -5.07 117.38 119.84 2g18 n GLN 144 Ca -0.06 -4.70 -0.31 0.00 -0.01 0.00 0.00 57.00 51.92 2g18 n GLN 144 Cb 0.76 -2.30 0.11 0.00 1.02 0.00 0.00 30.24 29.83 2g18 n GLN 144 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2g18 s PRO 145 N -2.77 1.93 0.14 -1.09 0.04 -1.26 -1.25 135.00 130.74 2g18 s PRO 145 Ca 0.40 1.15 0.09 0.00 0.04 0.00 0.00 61.00 62.68 2g18 s PRO 145 Cb 0.16 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.80 2g18 s PRO 145 CO -0.02 -1.87 -0.21 1.03 0.04 0.00 0.00 177.00 175.97 2g18 s ARG 146 N -4.88 1.27 0.00 4.56 0.52 0.05 -4.81 118.95 115.67 2g18 s ARG 146 Ca 0.62 -1.33 -0.24 0.00 -0.52 0.00 0.00 55.73 54.26 2g18 s ARG 146 Cb -0.18 -1.50 -0.05 0.00 0.52 0.00 0.00 34.95 33.74 2g18 s ARG 146 CO 0.56 0.33 0.72 -2.00 0.02 0.00 0.00 175.30 174.94 2g18 s GLU 147 N -2.36 4.45 0.35 3.54 2.12 -1.26 -4.78 118.70 120.76 2g18 s GLU 147 Ca 0.13 0.97 -0.28 0.00 0.36 0.00 0.00 54.97 56.15 2g18 s GLU 147 Cb -0.08 -3.39 -0.10 0.00 0.26 0.00 0.00 34.13 30.82 2g18 s GLU 147 CO 0.06 0.23 1.28 -0.51 -0.54 0.00 0.00 175.26 175.78 2g18 s LEU 148 N 0.20 4.38 1.01 2.70 1.43 -1.26 -5.01 118.68 122.12 2g18 s LEU 148 Ca 0.37 2.63 -0.12 0.00 -1.03 0.00 0.00 54.13 55.98 2g18 s LEU 148 Cb -0.19 -3.73 0.20 0.00 0.03 0.00 0.00 46.19 42.50 2g18 s LEU 148 CO 0.21 -0.58 1.08 -2.16 0.23 0.00 0.00 176.35 175.13 2g18 s PRO 149 N -1.90 0.32 0.40 1.29 0.04 -1.26 -4.85 135.00 129.04 2g18 s PRO 149 Ca 0.51 0.67 0.27 0.00 0.04 0.00 0.00 61.00 62.50 2g18 s PRO 149 Cb -0.38 -1.71 0.91 0.00 0.04 0.00 0.00 34.50 33.36 2g18 s PRO 149 CO 0.50 -2.84 1.79 0.93 0.04 0.00 0.00 177.00 177.42 2g18 h GLU 150 N -1.98 0.00 -0.07 4.56 5.08 -2.06 0.11 114.58 120.21 2g18 h GLU 150 Ca -0.55 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 2g18 h GLU 150 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 2g18 h GLU 150 CO 0.55 0.00 0.00 -2.67 -1.00 0.00 0.00 179.01 175.89 2g18 n TRP 151 N -2.77 0.09 0.11 4.33 4.27 -1.26 -4.18 117.44 118.03 2g18 n TRP 151 Ca 0.03 -0.05 0.01 0.00 -3.89 0.00 0.00 57.50 53.60 2g18 n TRP 151 Cb 0.37 0.00 0.17 0.00 -1.36 0.00 0.00 31.31 30.50 2g18 n TRP 151 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2g18 n GLY 152 N 0.76 2.31 0.09 -1.67 0.00 0.37 -3.69 105.19 103.36 2g18 n GLY 152 Ca 0.09 -0.43 0.14 0.00 0.00 0.00 0.00 46.02 45.81 2g18 n GLY 152 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2g18 n ASN 153 N 0.21 0.41 0.08 1.61 6.94 -1.26 -2.83 115.26 120.42 2g18 n ASN 153 Ca 0.15 -0.46 0.10 0.00 -0.02 0.00 0.00 54.58 54.35 2g18 n ASN 153 Cb 0.73 -0.10 0.43 0.00 -2.36 0.00 0.00 39.78 38.48 2g18 n ASN 153 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 2g18 n ILE 154 N -1.04 0.85 -3.56 1.53 -5.35 -1.24 -4.80 119.36 105.75 2g18 n ILE 154 Ca 0.13 0.21 -0.30 0.00 -0.27 0.00 0.00 62.75 62.52 2g18 n ILE 154 Cb 0.28 -1.06 -0.04 0.00 -1.74 0.00 0.00 39.64 37.08 2g18 n ILE 154 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2g18 s PHE 155 N -3.18 3.47 0.84 4.28 0.40 -1.13 -4.09 117.98 118.56 2g18 s PHE 155 Ca 0.06 0.58 -0.12 0.00 -0.60 0.00 0.00 56.93 56.85 2g18 s PHE 155 Cb 0.10 -2.04 0.12 0.00 0.51 0.00 0.00 43.02 41.71 2g18 s PHE 155 CO 0.36 0.34 1.19 -1.54 0.70 0.00 0.00 175.22 176.27 2g18 s SER 156 N -2.73 4.11 0.00 1.36 1.04 -1.26 -4.86 113.70 111.36 2g18 s SER 156 Ca 0.42 0.54 0.10 0.00 0.48 0.00 0.00 55.95 57.49 2g18 s SER 156 Cb -0.11 -0.91 0.43 0.00 0.10 0.00 0.00 66.02 65.53 2g18 s SER 156 CO 0.26 -2.12 1.30 0.47 0.98 0.00 0.00 173.24 174.14 2g18 n ASP 157 N -3.39 0.00 -0.71 7.02 8.00 -1.26 -2.23 116.55 123.98 2g18 n ASP 157 Ca 0.10 0.46 0.12 0.00 0.71 0.00 0.00 54.79 56.18 2g18 n ASP 157 Cb 0.60 -0.47 0.15 0.00 -0.02 0.00 0.00 41.12 41.38 2g18 n ASP 157 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2g18 n PHE 158 N -1.47 0.00 -1.70 1.24 3.01 -1.26 -4.98 117.46 112.30 2g18 n PHE 158 Ca 0.03 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.06 2g18 n PHE 158 Cb 0.11 -0.01 -0.00 0.00 -0.01 0.00 0.00 39.48 39.57 2g18 n PHE 158 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2g18 s ILE 160 N -1.10 2.30 -0.22 0.00 1.01 -0.23 -5.00 121.20 117.96 2g18 s ILE 160 Ca 0.56 -0.88 -0.03 0.00 0.00 0.00 0.00 60.65 60.29 2g18 s ILE 160 Cb -0.56 -1.96 0.07 0.00 0.01 0.00 0.00 42.46 40.02 2g18 s ILE 160 CO 0.62 0.53 0.08 0.12 0.00 0.00 0.00 174.94 176.28 2g18 s PHE 161 N 1.03 0.76 0.14 3.97 5.36 -1.26 -1.07 117.98 126.91 2g18 s PHE 161 Ca -0.01 -0.83 -0.03 0.00 -0.96 0.00 0.00 56.93 55.10 2g18 s PHE 161 Cb -0.14 -1.00 -0.03 0.00 -0.34 0.00 0.00 43.02 41.50 2g18 s PHE 161 CO -0.05 -0.66 0.11 0.14 -1.46 0.00 0.00 175.22 173.30 2g18 s VAL 162 N 1.95 0.09 -0.39 3.12 -7.23 -0.33 -0.77 120.40 116.84 2g18 s VAL 162 Ca 0.03 -1.78 -0.05 0.00 -1.81 0.00 0.00 61.98 58.37 2g18 s VAL 162 Cb -0.17 -1.99 0.09 0.00 0.56 0.00 0.00 36.38 34.87 2g18 s VAL 162 CO -0.16 -0.43 0.18 -0.60 -0.31 0.00 0.00 175.10 173.79 2g18 s ARG 163 N -4.03 2.33 0.08 4.82 3.52 -0.38 -0.68 118.95 124.61 2g18 s ARG 163 Ca 0.22 -1.56 -0.31 0.00 -0.13 0.00 0.00 55.73 53.95 2g18 s ARG 163 Cb 0.06 -3.58 -0.08 0.00 -1.56 0.00 0.00 34.95 29.80 2g18 s ARG 163 CO 0.01 -0.93 1.50 -2.14 -0.81 0.00 0.00 175.30 172.93 2g18 s PRO 164 N 1.28 4.26 -0.13 5.12 0.02 -1.26 -4.35 135.00 139.94 2g18 s PRO 164 Ca 0.03 2.17 0.05 0.00 0.02 0.00 0.00 61.00 63.27 2g18 s PRO 164 Cb -0.22 -3.42 -0.24 0.00 0.02 0.00 0.00 34.50 30.64 2g18 s PRO 164 CO -0.01 -0.59 0.34 -1.13 -0.33 0.00 0.00 177.00 175.28 2g18 n SER 165 N 4.82 1.37 -4.65 2.53 3.41 -1.26 -4.77 113.62 115.06 2g18 n SER 165 Ca 0.14 0.20 -0.26 0.00 -0.26 0.00 0.00 58.87 58.69 2g18 n SER 165 Cb 0.41 -0.25 -0.09 0.00 -0.26 0.00 0.00 64.21 64.02 2g18 n SER 165 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2g18 s SER 166 N -6.41 4.11 0.40 4.04 1.04 -1.26 -5.02 113.70 110.59 2g18 s SER 166 Ca -0.16 -1.17 0.29 0.00 0.48 0.00 0.00 55.95 55.39 2g18 s SER 166 Cb 0.07 -0.45 1.24 0.00 0.10 0.00 0.00 66.02 66.98 2g18 s SER 166 CO 0.77 -0.40 1.85 -0.65 0.98 0.00 0.00 173.24 175.80 2g18 h PRO 167 N 1.70 0.00 -0.55 4.02 0.11 -1.99 -2.35 132.00 132.94 2g18 h PRO 167 Ca -0.43 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.62 2g18 h PRO 167 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 2g18 h PRO 167 CO 0.73 0.00 0.13 1.49 -0.21 0.00 0.00 178.00 180.14 2g18 h GLU 168 N 0.00 0.89 -0.12 1.05 4.81 -1.99 -2.18 114.58 117.04 2g18 h GLU 168 Ca 0.00 -0.22 -0.19 0.00 -0.13 0.00 0.00 59.36 58.82 2g18 h GLU 168 Cb 0.37 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.63 2g18 h GLU 168 CO 0.00 0.83 -0.72 0.93 -0.73 0.00 0.00 179.01 179.32 2g18 h GLU 169 N 0.78 0.54 -0.79 1.92 5.08 -1.91 -0.21 114.58 120.00 2g18 h GLU 169 Ca 0.17 -0.43 0.05 0.00 -1.00 0.00 0.00 59.36 58.15 2g18 h GLU 169 Cb 0.35 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.63 2g18 h GLU 169 CO 0.00 1.06 0.49 0.93 -1.00 0.00 0.00 179.01 180.48 2g18 h GLU 170 N 0.38 0.88 -0.15 2.33 5.08 -1.37 0.72 114.58 122.46 2g18 h GLU 170 Ca -0.03 -0.05 -0.18 0.00 -1.00 0.00 0.00 59.36 58.10 2g18 h GLU 170 Cb 1.31 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 2g18 h GLU 170 CO 0.13 0.58 -0.64 0.00 -1.00 0.00 0.00 179.01 178.09 2g18 h ALA 171 N 1.37 0.61 -0.63 3.43 0.00 -1.08 -1.34 119.26 121.61 2g18 h ALA 171 Ca 0.34 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2g18 h ALA 171 Cb 0.12 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2g18 h ALA 171 CO -0.15 0.71 0.36 0.52 0.00 0.00 0.00 179.25 180.69 2g18 h MET 172 N 0.39 0.87 0.34 0.00 2.86 -0.54 0.13 114.93 118.99 2g18 h MET 172 Ca -0.01 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 2g18 h MET 172 Cb 1.20 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.69 2g18 h MET 172 CO 0.12 0.65 -0.16 0.35 1.06 0.00 0.00 176.91 178.93 2g18 h PHE 173 N 0.86 -0.42 -0.81 -0.22 3.57 -0.73 -1.29 116.94 117.90 2g18 h PHE 173 Ca 0.22 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.81 2g18 h PHE 173 Cb 0.02 0.14 -0.07 0.00 2.79 0.00 0.00 35.95 38.83 2g18 h PHE 173 CO -0.01 -0.21 0.45 1.25 -2.23 0.00 0.00 178.31 177.55 2g18 h LEU 174 N -0.54 0.62 -0.73 0.59 5.85 -1.06 -0.94 115.31 119.10 2g18 h LEU 174 Ca -0.05 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 2g18 h LEU 174 Cb 0.40 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2g18 h LEU 174 CO 0.08 0.35 0.31 1.23 -0.34 0.00 0.00 178.44 180.06 2g18 h GLY 175 N 0.74 1.16 1.24 3.75 0.00 -0.60 -1.45 103.07 107.91 2g18 h GLY 175 Ca 0.40 -0.61 -0.14 0.00 0.00 0.00 0.00 47.33 46.97 2g18 h GLY 175 CO -0.26 0.58 -0.33 -0.09 0.00 0.00 0.00 176.54 176.44 2g18 h ARG 176 N 1.04 0.85 -0.75 4.80 9.65 -0.41 -2.08 114.38 127.48 2g18 h ARG 176 Ca 0.25 -0.41 0.02 0.00 -1.10 0.00 0.00 59.98 58.74 2g18 h ARG 176 Cb 0.18 -0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.71 2g18 h ARG 176 CO -0.02 1.05 0.49 0.28 2.80 0.00 0.00 179.97 184.56 2g18 h VAL 177 N 0.71 1.15 -0.73 0.20 2.07 -0.89 -0.99 116.25 117.78 2g18 h VAL 177 Ca 0.07 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 2g18 h VAL 177 Cb 0.89 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 2g18 h VAL 177 CO 0.08 0.18 0.22 -0.09 0.02 0.00 0.00 177.57 177.98 2g18 h ARG 178 N 0.98 1.13 -0.74 1.57 2.43 -1.10 -1.00 114.38 117.64 2g18 h ARG 178 Ca 0.29 -0.24 -0.05 0.00 -0.81 0.00 0.00 59.98 59.17 2g18 h ARG 178 Cb -0.05 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.30 2g18 h ARG 178 CO -0.09 0.96 0.27 0.93 -1.51 0.00 0.00 179.97 180.54 2g18 h GLU 179 N 1.08 1.12 -0.35 0.20 5.08 -0.93 -1.32 114.58 119.46 2g18 h GLU 179 Ca 0.23 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2g18 h GLU 179 Cb 0.31 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 2g18 h GLU 179 CO -0.01 0.93 0.21 0.74 -1.00 0.00 0.00 179.01 179.88 2g18 h PHE 180 N 1.09 0.47 -0.42 4.33 0.04 -0.54 -1.59 116.94 120.32 2g18 h PHE 180 Ca 0.25 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.97 2g18 h PHE 180 Cb 0.24 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.22 2g18 h PHE 180 CO 0.02 0.34 0.06 -0.07 -0.60 0.00 0.00 178.31 178.06 2g18 h LEU 181 N 0.46 0.60 -0.26 1.54 3.38 -0.92 -0.13 115.31 119.98 2g18 h LEU 181 Ca 0.13 -0.11 -0.20 0.00 0.09 0.00 0.00 57.88 57.79 2g18 h LEU 181 Cb 0.01 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2g18 h LEU 181 CO -0.02 0.63 -0.67 1.56 0.09 0.00 0.00 178.44 180.03 2g18 h GLN 182 N 0.62 0.78 -0.34 1.13 4.20 -0.84 0.15 115.11 120.81 2g18 h GLN 182 Ca 0.14 -0.57 -0.01 0.00 0.06 0.00 0.00 58.65 58.26 2g18 h GLN 182 Cb 0.31 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 2g18 h GLN 182 CO 0.00 1.19 0.17 0.28 -0.67 0.00 0.00 178.83 179.80 2g18 h VAL 183 N 0.57 1.16 -0.57 -0.54 2.07 -1.06 -2.44 116.25 115.44 2g18 h VAL 183 Ca -0.02 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 2g18 h VAL 183 Cb 1.28 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 2g18 h VAL 183 CO 0.14 0.16 0.29 -0.74 0.02 0.00 0.00 177.57 177.45 2g18 h HIS 184 N 0.41 0.80 -0.67 1.57 -0.00 -0.82 0.78 115.15 117.21 2g18 h HIS 184 Ca 0.12 -0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.41 2g18 h HIS 184 Cb 0.11 -0.25 -0.03 0.00 -0.00 0.00 0.00 27.41 27.24 2g18 h HIS 184 CO -0.02 0.60 0.24 0.00 -0.00 0.00 0.00 177.93 178.75 2g18 h GLN 186 N 0.96 0.84 -0.49 0.00 4.20 -1.13 -1.59 115.11 117.91 2g18 h GLN 186 Ca 0.22 -0.11 0.08 0.00 0.06 0.00 0.00 58.65 58.90 2g18 h GLN 186 Cb 0.25 -0.16 -0.07 0.00 0.30 0.00 0.00 27.48 27.81 2g18 h GLN 186 CO -0.01 0.66 0.11 0.78 -0.67 0.00 0.00 178.83 179.70 2g18 h GLY 187 N 0.80 0.61 1.40 3.46 0.00 -0.39 -2.31 103.07 106.65 2g18 h GLY 187 Ca 0.21 -0.04 -0.13 0.00 0.00 0.00 0.00 47.33 47.37 2g18 h GLY 187 CO -0.03 -0.05 -0.34 0.00 0.00 0.00 0.00 176.54 176.12 2g18 h ALA 188 N 1.37 0.84 -0.10 3.60 0.00 -0.31 -2.26 119.26 122.40 2g18 h ALA 188 Ca 0.24 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 2g18 h ALA 188 Cb 0.31 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2g18 h ALA 188 CO -0.30 0.64 -0.48 0.82 0.00 0.00 0.00 179.25 179.92 2g18 h ILE 189 N 0.56 1.34 0.00 0.00 2.04 -1.12 -2.81 117.51 117.52 2g18 h ILE 189 Ca 0.06 -1.69 0.00 0.00 1.00 0.00 0.00 64.86 64.23 2g18 h ILE 189 Cb 0.85 1.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 2g18 h ILE 189 CO 0.07 0.50 -0.17 0.00 0.00 0.00 0.00 178.15 178.55 2g18 n ALA 190 N -2.47 2.70 -1.88 1.87 0.00 -0.88 -4.94 120.51 114.90 2g18 n ALA 190 Ca -0.02 -0.17 -0.40 0.00 0.00 0.00 0.00 53.44 52.85 2g18 n ALA 190 Cb 0.53 -1.36 -0.05 0.00 0.00 0.00 0.00 19.45 18.57 2g18 n ALA 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g18 s ALA 191 N -3.02 3.34 0.20 0.00 0.00 -0.89 -5.06 121.76 116.34 2g18 s ALA 191 Ca 0.12 0.70 0.07 0.00 0.00 0.00 0.00 51.96 52.86 2g18 s ALA 191 Cb 0.18 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 2g18 s ALA 191 CO 0.59 0.04 0.06 -1.12 0.00 0.00 0.00 175.76 175.33 2g18 s SER 192 N -0.78 5.02 0.49 0.00 0.01 -1.26 -5.05 113.70 112.12 2g18 s SER 192 Ca 0.44 -0.36 -0.24 0.00 1.31 0.00 0.00 55.95 57.10 2g18 s SER 192 Cb -0.27 -1.14 -0.07 0.00 0.21 0.00 0.00 66.02 64.75 2g18 s SER 192 CO 0.34 0.05 1.41 -2.84 0.41 0.00 0.00 173.24 172.61 2g18 s PRO 193 N -3.26 3.46 0.69 12.44 0.02 -1.26 -4.62 135.00 142.46 2g18 s PRO 193 Ca 0.30 2.37 0.03 0.00 0.02 0.00 0.00 61.00 63.73 2g18 s PRO 193 Cb -0.09 -2.50 0.13 0.00 0.02 0.00 0.00 34.50 32.06 2g18 s PRO 193 CO 0.21 -0.98 0.95 0.14 -0.33 0.00 0.00 177.00 176.98 2g18 s VAL 194 N -1.23 2.04 0.78 3.83 -7.23 0.05 -5.02 120.40 113.62 2g18 s VAL 194 Ca 0.65 -0.76 -0.11 0.00 -1.81 0.00 0.00 61.98 59.95 2g18 s VAL 194 Cb -0.43 -2.28 0.07 0.00 0.56 0.00 0.00 36.38 34.30 2g18 s VAL 194 CO 0.54 0.00 1.15 -0.94 -0.31 0.00 0.00 175.10 175.54 2g18 s SER 195 N -4.76 4.65 0.30 4.85 1.04 -1.26 -4.81 113.70 113.71 2g18 s SER 195 Ca 0.66 0.79 0.01 0.00 0.48 0.00 0.00 55.95 57.88 2g18 s SER 195 Cb -0.05 -1.33 0.47 0.00 0.10 0.00 0.00 66.02 65.21 2g18 s SER 195 CO 0.43 -1.80 1.83 0.00 0.98 0.00 0.00 173.24 174.68 2g18 h ALA 196 N -0.96 1.25 0.37 5.32 0.00 -1.99 0.92 119.26 124.18 2g18 h ALA 196 Ca -0.46 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.22 2g18 h ALA 196 Cb 1.32 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2g18 h ALA 196 CO 0.65 0.51 -0.18 1.49 0.00 0.00 0.00 179.25 181.72 2g18 h GLU 197 N 0.66 -0.48 -0.83 0.00 4.81 -2.00 -1.98 114.58 114.77 2g18 h GLU 197 Ca 0.14 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.37 2g18 h GLU 197 Cb 0.35 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.80 2g18 h GLU 197 CO 0.01 -0.27 0.39 1.96 -0.73 0.00 0.00 179.01 180.37 2g18 h GLN 198 N -0.57 1.20 -0.90 1.92 4.20 -1.81 -1.32 115.11 117.82 2g18 h GLN 198 Ca -0.05 -0.18 0.07 0.00 0.06 0.00 0.00 58.65 58.55 2g18 h GLN 198 Cb 0.42 -0.21 -0.06 0.00 0.30 0.00 0.00 27.48 27.93 2g18 h GLN 198 CO 0.08 0.92 0.56 -0.22 -0.67 0.00 0.00 178.83 179.51 2g18 h LYS 199 N 1.18 0.99 -0.54 1.46 3.64 -0.75 0.55 116.57 123.10 2g18 h LYS 199 Ca 0.28 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.57 2g18 h LYS 199 Cb 0.12 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.70 2g18 h LYS 199 CO -0.03 0.65 0.21 1.96 -2.27 0.00 0.00 179.45 179.97 2g18 h GLN 200 N 1.02 0.79 -0.07 1.90 1.08 -0.46 -0.54 115.11 118.82 2g18 h GLN 200 Ca 0.39 -0.12 -0.03 0.00 -1.45 0.00 0.00 58.65 57.45 2g18 h GLN 200 Cb 0.19 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 27.48 2g18 h GLN 200 CO -0.18 0.65 -0.07 0.37 -0.95 0.00 0.00 178.83 178.66 2g18 h GLN 201 N 0.78 0.18 -0.26 1.46 4.15 -0.87 -2.02 115.11 118.52 2g18 h GLN 201 Ca 0.18 -0.09 -0.00 0.00 0.77 0.00 0.00 58.65 59.51 2g18 h GLN 201 Cb 0.17 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 2g18 h GLN 201 CO -0.02 0.60 0.15 0.82 -1.93 0.00 0.00 178.83 178.46 2g18 h ILE 202 N -0.24 1.10 -0.56 2.39 2.04 -0.55 0.18 117.51 121.87 2g18 h ILE 202 Ca 0.01 -0.25 0.08 0.00 1.00 0.00 0.00 64.86 65.70 2g18 h ILE 202 Cb 0.56 0.80 -0.06 0.00 -0.74 0.00 0.00 36.82 37.38 2g18 h ILE 202 CO 0.02 0.10 0.21 0.25 0.00 0.00 0.00 178.15 178.73 2g18 h LEU 203 N 0.32 0.22 -1.11 1.44 5.85 -1.18 0.11 115.31 120.97 2g18 h LEU 203 Ca 0.09 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.93 2g18 h LEU 203 Cb 0.03 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.05 2g18 h LEU 203 CO -0.02 0.14 0.61 0.00 -0.34 0.00 0.00 178.44 178.83 2g18 h ALA 204 N 1.37 1.44 -0.36 1.25 0.00 -0.47 0.13 119.26 122.61 2g18 h ALA 204 Ca 0.27 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2g18 h ALA 204 Cb 0.30 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2g18 h ALA 204 CO -0.27 0.46 0.07 0.78 0.00 0.00 0.00 179.25 180.29 2g18 h GLY 205 N 1.13 0.63 1.01 0.00 0.00 0.43 0.11 103.07 106.38 2g18 h GLY 205 Ca 0.38 -0.42 -0.06 0.00 0.00 0.00 0.00 47.33 47.23 2g18 h GLY 205 CO -0.13 0.39 0.13 1.46 0.00 0.00 0.00 176.54 178.39 2g18 h GLN 206 N 0.43 0.93 -0.45 4.80 4.20 -0.45 -1.86 115.11 122.71 2g18 h GLN 206 Ca 0.11 -0.23 0.02 0.00 0.06 0.00 0.00 58.65 58.61 2g18 h GLN 206 Cb 0.34 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 2g18 h GLN 206 CO 0.01 0.87 0.28 1.25 -0.67 0.00 0.00 178.83 180.56 2g18 h HIS 207 N 0.83 0.52 -0.83 2.96 2.76 -0.32 0.14 115.15 121.22 2g18 h HIS 207 Ca 0.18 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.33 2g18 h HIS 207 Cb 0.37 -0.17 -0.04 0.00 1.55 0.00 0.00 27.41 29.12 2g18 h HIS 207 CO 0.03 0.31 0.37 -0.97 -1.30 0.00 0.00 177.93 176.37 2g18 h ASN 208 N 0.56 1.11 -0.28 3.26 -0.73 -0.59 -0.33 115.58 118.57 2g18 h ASN 208 Ca 0.18 -0.15 -0.02 0.00 1.87 0.00 0.00 56.30 58.17 2g18 h ASN 208 Cb -0.01 -0.29 -0.01 0.00 0.27 0.00 0.00 38.32 38.29 2g18 h ASN 208 CO -0.07 0.95 0.08 0.22 -0.37 0.00 0.00 177.43 178.24 2g18 h TYR 209 N 1.19 0.45 -0.46 0.67 3.20 -0.62 -2.08 116.97 119.32 2g18 h TYR 209 Ca 0.28 -0.05 -0.06 0.00 3.14 0.00 0.00 58.73 62.04 2g18 h TYR 209 Cb 0.16 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 2g18 h TYR 209 CO 0.02 0.49 0.05 0.00 -1.64 0.00 0.00 178.16 177.07 2g18 h SER 211 N 0.64 0.61 -0.75 0.00 4.64 -1.03 0.72 113.55 118.38 2g18 h SER 211 Ca 0.14 -0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2g18 h SER 211 Cb 0.43 -0.16 -0.04 0.00 -0.31 0.00 0.00 62.40 62.32 2g18 h SER 211 CO 0.01 0.66 0.47 0.11 -0.87 0.00 0.00 176.83 177.21 2g18 h LYS 212 N 0.53 1.02 -0.44 4.77 1.79 -1.39 0.42 116.57 123.27 2g18 h LYS 212 Ca 0.13 -0.09 -0.04 0.00 -2.18 0.00 0.00 60.65 58.48 2g18 h LYS 212 Cb 0.27 -0.22 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 2g18 h LYS 212 CO -0.00 0.71 0.11 1.96 -1.08 0.00 0.00 179.45 181.14 2g18 h GLN 213 N 1.03 0.71 -0.14 3.15 1.08 -1.16 -2.15 115.11 117.62 2g18 h GLN 213 Ca 0.27 -0.17 0.04 0.00 -1.45 0.00 0.00 58.65 57.34 2g18 h GLN 213 Cb -0.05 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.25 2g18 h GLN 213 CO -0.05 0.71 -0.09 1.96 -0.95 0.00 0.00 178.83 180.41 2g18 h GLN 214 N 0.58 -0.08 -0.11 1.46 4.20 -0.48 0.13 115.11 120.80 2g18 h GLN 214 Ca 0.14 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.89 2g18 h GLN 214 Cb 0.32 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 2g18 h GLN 214 CO 0.00 -0.05 0.11 1.96 -0.67 0.00 0.00 178.83 180.17 2g18 h GLN 215 N -0.08 0.00 0.00 1.46 4.20 -0.68 -3.35 115.11 116.66 2g18 h GLN 215 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 2g18 h GLN 215 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 2g18 h GLN 215 CO -0.19 0.00 -0.52 0.09 -0.67 0.00 0.00 178.83 177.53 2g18 n ASN 216 N -4.05 2.61 -4.73 1.46 3.02 -0.83 -5.04 115.26 107.69 2g18 n ASN 216 Ca -0.00 -0.01 -0.42 0.00 -0.03 0.00 0.00 54.58 54.11 2g18 n ASN 216 Cb 0.22 0.55 -0.01 0.00 -0.61 0.00 0.00 39.78 39.92 2g18 n ASN 216 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2g18 n ASP 217 N -0.81 3.42 -0.03 6.41 -0.08 0.43 -4.89 116.55 120.99 2g18 n ASP 217 Ca 0.00 1.17 0.13 0.00 -1.51 0.00 0.00 54.79 54.58 2g18 n ASP 217 Cb 0.00 -1.54 0.40 0.00 2.34 0.00 0.00 41.12 42.31 2g18 n ASP 217 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2g18 n LYS 218 N 1.49 0.15 0.26 -0.67 5.02 -1.26 -3.60 118.16 119.55 2g18 n LYS 218 Ca 0.07 -0.07 0.14 0.00 -2.02 0.00 0.00 58.31 56.43 2g18 n LYS 218 Cb 0.36 -1.50 0.62 0.00 -0.02 0.00 0.00 35.03 34.49 2g18 n LYS 218 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 2g18 h THR 219 N 0.17 0.27 -0.81 -0.18 1.35 -1.98 -2.91 112.91 108.81 2g18 h THR 219 Ca 0.00 -0.74 0.14 0.00 -0.55 0.00 0.00 66.41 65.27 2g18 h THR 219 Cb 0.48 1.58 -0.15 0.00 -1.73 0.00 0.00 68.15 68.34 2g18 h THR 219 CO 0.00 0.10 -0.31 -0.09 -0.25 0.00 0.00 175.52 174.97 2g18 h ARG 220 N 0.00 -0.05 -0.77 4.72 2.43 -1.95 -0.88 114.38 117.88 2g18 h ARG 220 Ca -0.00 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 2g18 h ARG 220 Cb 0.57 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.09 2g18 h ARG 220 CO 0.01 -0.03 0.50 -0.09 -1.51 0.00 0.00 179.97 178.85 2g18 h ARG 221 N -0.05 0.98 -0.52 0.20 9.65 -1.79 0.36 114.38 123.20 2g18 h ARG 221 Ca 0.33 -0.06 -0.02 0.00 -1.10 0.00 0.00 59.98 59.13 2g18 h ARG 221 Cb 0.59 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 28.93 2g18 h ARG 221 CO -0.85 0.65 0.25 0.28 2.80 0.00 0.00 179.97 183.10 2g18 h VAL 222 N 1.01 1.20 -0.55 0.20 2.07 -1.57 -2.07 116.25 116.53 2g18 h VAL 222 Ca 0.29 -0.56 -0.11 0.00 0.82 0.00 0.00 66.70 67.15 2g18 h VAL 222 Cb -0.07 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 2g18 h VAL 222 CO -0.08 0.22 -0.08 -0.07 0.02 0.00 0.00 177.57 177.58 2g18 h LEU 223 N 0.70 1.01 -0.62 2.57 3.38 0.16 -2.39 115.31 120.12 2g18 h LEU 223 Ca 0.18 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 57.86 2g18 h LEU 223 Cb 0.12 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 2g18 h LEU 223 CO -0.02 1.11 0.34 -0.33 0.09 0.00 0.00 178.44 179.63 2g18 h GLU 224 N 0.89 0.62 0.00 1.13 5.08 -0.17 0.31 114.58 122.45 2g18 h GLU 224 Ca 0.14 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.40 2g18 h GLU 224 Cb 0.64 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2g18 h GLU 224 CO 0.04 0.41 -0.30 0.87 -1.00 0.00 0.00 179.01 179.03 2g18 h LYS 225 N 0.64 0.00 0.12 2.33 1.57 -1.25 0.38 116.57 120.35 2g18 h LYS 225 Ca 0.28 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.73 2g18 h LYS 225 Cb 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2g18 h LYS 225 CO -0.17 0.30 -1.70 0.00 -0.57 0.00 0.00 179.45 177.31 2g18 h ALA 226 N 1.70 0.36 0.00 3.86 0.00 -0.84 -3.43 119.26 120.90 2g18 h ALA 226 Ca -0.00 -1.23 0.00 0.00 0.00 0.00 0.00 54.91 53.68 2g18 h ALA 226 Cb 0.68 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2g18 h ALA 226 CO 0.04 1.22 0.00 1.19 0.00 0.00 0.00 179.25 181.70 2g18 n PHE 227 N -3.43 0.00 0.00 0.00 3.01 0.03 -4.69 117.46 112.38 2g18 n PHE 227 Ca -0.21 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.25 2g18 n PHE 227 Cb 1.05 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.52 2g18 n PHE 227 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2g18 n GLY 228 N 0.10 1.77 0.23 1.37 0.00 0.13 -4.61 105.19 104.18 2g18 n GLY 228 Ca 0.00 -1.97 -0.11 0.00 0.00 0.00 0.00 46.02 43.94 2g18 n GLY 228 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2g18 h VAL 229 N 0.00 1.27 -0.11 1.61 2.07 -1.90 -2.72 116.25 116.48 2g18 h VAL 229 Ca 0.00 -1.18 -0.22 0.00 0.82 0.00 0.00 66.70 66.11 2g18 h VAL 229 Cb 0.00 1.20 0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2g18 h VAL 229 CO 0.00 0.40 -0.81 0.44 0.02 0.00 0.00 177.57 177.62 2g18 h ASP 230 N 0.60 0.90 -0.43 0.57 5.19 -1.96 0.62 116.42 121.90 2g18 h ASP 230 Ca 0.10 -0.66 0.03 0.00 -0.62 0.00 0.00 57.03 55.89 2g18 h ASP 230 Cb 0.62 -0.27 -0.04 0.00 0.18 0.00 0.00 39.33 39.82 2g18 h ASP 230 CO 0.04 1.42 0.21 -0.25 -3.12 0.00 0.00 179.24 177.54 2g18 h TRP 231 N 0.44 0.39 -0.40 4.55 7.01 -1.82 0.13 115.95 126.26 2g18 h TRP 231 Ca -0.07 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 60.95 2g18 h TRP 231 Cb 1.45 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 28.38 2g18 h TRP 231 CO 0.10 0.20 0.24 0.00 -2.79 0.00 0.00 178.44 176.19 2g18 h ALA 232 N 1.23 0.51 -0.59 2.65 0.00 -1.39 -0.56 119.26 121.10 2g18 h ALA 232 Ca 0.18 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.07 2g18 h ALA 232 Cb 0.09 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2g18 h ALA 232 CO -0.13 -0.00 0.36 1.49 0.00 0.00 0.00 179.25 180.96 2g18 h GLU 233 N 0.52 0.68 -0.42 0.00 4.57 -0.31 -1.68 114.58 117.95 2g18 h GLU 233 Ca 0.14 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.21 2g18 h GLU 233 Cb -0.00 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.42 2g18 h GLU 233 CO -0.03 0.45 -0.06 -0.97 -1.18 0.00 0.00 179.01 177.23 2g18 h ASN 234 N 0.70 0.68 -0.35 1.04 -0.73 -0.50 -2.21 115.58 114.21 2g18 h ASN 234 Ca 0.24 -0.17 -0.13 0.00 1.87 0.00 0.00 56.30 58.11 2g18 h ASN 234 Cb 0.04 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.44 2g18 h ASN 234 CO -0.11 0.79 -0.29 0.22 -0.37 0.00 0.00 177.43 177.66 2g18 h TYR 235 N 0.65 0.97 -0.66 0.67 3.20 -0.75 -1.47 116.97 119.58 2g18 h TYR 235 Ca 0.12 -0.28 -0.01 0.00 3.14 0.00 0.00 58.73 61.70 2g18 h TYR 235 Cb 0.49 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.52 2g18 h TYR 235 CO 0.02 1.06 0.37 0.52 -1.64 0.00 0.00 178.16 178.49 2g18 h MET 236 N 0.60 0.92 0.00 1.82 2.86 -1.15 -0.66 114.93 119.32 2g18 h MET 236 Ca 0.06 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2g18 h MET 236 Cb 0.87 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.35 2g18 h MET 236 CO 0.08 0.69 -0.70 0.25 1.06 0.00 0.00 176.91 178.29 2g18 n THR 237 N -4.53 0.24 0.00 2.22 -2.24 -0.85 -1.13 114.28 107.99 2g18 n THR 237 Ca 0.05 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 2g18 n THR 237 Cb 0.08 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 2g18 n THR 237 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2g18 n THR 238 N -1.95 0.00 -0.06 4.28 -2.24 -0.56 -3.64 114.28 110.11 2g18 n THR 238 Ca 0.03 -0.17 -0.12 0.00 -2.27 0.00 0.00 64.05 61.52 2g18 n THR 238 Cb 0.42 0.65 -0.04 0.00 -2.10 0.00 0.00 70.33 69.26 2g18 n THR 238 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2g18 n VAL 239 N -1.11 0.76 -0.04 2.28 0.31 -0.32 -4.68 118.33 115.54 2g18 n VAL 239 Ca 0.00 -0.12 -0.20 0.00 -0.01 0.00 0.00 64.34 64.01 2g18 n VAL 239 Cb 0.00 -1.70 -0.13 0.00 -0.91 0.00 0.00 33.84 31.10 2g18 n VAL 239 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2g18 h LEU 240 N -0.45 0.18 -5.36 7.52 3.38 -1.46 -3.41 115.31 115.70 2g18 h LEU 240 Ca -0.28 -0.78 -0.46 0.00 0.09 0.00 0.00 57.88 56.44 2g18 h LEU 240 Cb 1.18 -0.06 -0.40 0.00 0.09 0.00 0.00 40.66 41.47 2g18 h LEU 240 CO -0.17 1.44 -1.08 0.49 0.09 0.00 0.00 178.44 179.21 2g18 n PHE 241 N -4.23 1.41 -2.04 1.13 3.72 -0.28 -5.01 117.46 112.15 2g18 n PHE 241 Ca -0.24 -3.38 -0.41 0.00 -0.05 0.00 0.00 57.45 53.38 2g18 n PHE 241 Cb 0.74 -0.37 -0.02 0.00 -0.94 0.00 0.00 39.48 38.88 2g18 n PHE 241 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2g18 s ASP 242 N -2.95 6.69 0.23 4.37 -4.77 -1.24 -4.72 116.67 114.28 2g18 s ASP 242 Ca 0.37 2.66 -0.30 0.00 -3.30 0.00 0.00 52.55 51.98 2g18 s ASP 242 Cb 0.39 -2.63 -0.10 0.00 -1.09 0.00 0.00 42.92 39.49 2g18 s ASP 242 CO -0.06 -0.66 1.45 -0.76 0.70 0.00 0.00 175.17 175.84 2g18 s LEU 243 N -0.63 4.38 0.33 2.11 1.43 -1.26 -4.90 118.68 120.15 2g18 s LEU 243 Ca 0.57 2.63 0.11 0.00 -1.03 0.00 0.00 54.13 56.42 2g18 s LEU 243 Cb -0.41 -3.62 0.99 0.00 0.03 0.00 0.00 46.19 43.18 2g18 s LEU 243 CO 0.45 -0.71 1.66 1.55 0.23 0.00 0.00 176.35 179.52 2g18 h PRO 244 N 5.41 0.28 0.00 1.29 0.13 -1.92 -3.52 132.00 133.68 2g18 h PRO 244 Ca -0.45 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2g18 h PRO 244 Cb 1.21 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2g18 h PRO 244 CO 0.80 0.19 0.00 0.39 -0.23 0.00 0.00 178.00 179.15