#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 4.60 -0.04 7.28 1.04 -1.26 -5.05 113.70 120.27 2g18 s SER 2 Ca 0.00 2.47 -0.05 0.00 0.48 0.00 0.00 55.95 58.85 2g18 s SER 2 Cb 0.00 -2.60 0.01 0.00 0.10 0.00 0.00 66.02 63.53 2g18 s SER 2 CO 0.00 -2.00 0.13 -1.48 0.98 0.00 0.00 173.24 170.87 2g18 s LEU 3 N -4.57 1.53 0.35 2.42 0.05 -1.26 -5.16 118.68 112.04 2g18 s LEU 3 Ca 0.78 0.18 0.06 0.00 0.05 0.00 0.00 54.13 55.21 2g18 s LEU 3 Cb -0.33 0.47 -0.01 0.00 -2.05 0.00 0.00 46.19 44.27 2g18 s LEU 3 CO 0.40 -0.09 0.50 0.42 -0.55 0.00 0.00 176.35 177.02 2g18 s THR 4 N -0.16 3.95 0.01 5.48 -4.23 -1.26 -5.12 115.64 114.31 2g18 s THR 4 Ca -0.02 -0.96 0.03 0.00 -1.18 0.00 0.00 61.69 59.56 2g18 s THR 4 Cb -0.02 -3.37 -0.03 0.00 1.34 0.00 0.00 72.50 70.42 2g18 s THR 4 CO 0.00 -0.15 -0.06 -0.94 -0.54 0.00 0.00 174.62 172.93 2g18 s SER 5 N -4.20 4.67 0.28 3.99 1.04 -1.26 -5.13 113.70 113.09 2g18 s SER 5 Ca 0.46 -0.14 0.04 0.00 0.48 0.00 0.00 55.95 56.79 2g18 s SER 5 Cb -0.10 -1.09 -0.06 0.00 0.10 0.00 0.00 66.02 64.87 2g18 s SER 5 CO 0.32 0.27 0.03 0.27 0.98 0.00 0.00 173.24 175.12 2g18 s ILE 6 N -1.02 1.10 0.60 -1.02 -4.36 -1.26 -5.13 121.20 110.11 2g18 s ILE 6 Ca 0.18 -2.02 -0.20 0.00 -0.26 0.00 0.00 60.65 58.35 2g18 s ILE 6 Cb -0.11 -2.60 -0.03 0.00 1.25 0.00 0.00 42.46 40.96 2g18 s ILE 6 CO 0.08 -0.13 1.24 -2.65 0.24 0.00 0.00 174.94 173.73 2g18 n PRO 7 N -0.56 1.29 -2.22 0.37 -0.02 -1.26 -4.94 135.00 127.65 2g18 n PRO 7 Ca -0.03 0.49 -0.40 0.00 -2.02 0.00 0.00 63.50 61.54 2g18 n PRO 7 Cb 0.65 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 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 -1.16 6.84 0.56 2.55 0.15 -1.26 -4.92 113.70 116.45 2g18 s SER 8 Ca 0.77 2.55 0.35 0.00 0.70 0.00 0.00 55.95 60.32 2g18 s SER 8 Cb -0.41 -2.64 1.50 0.00 -1.71 0.00 0.00 66.02 62.76 2g18 s SER 8 CO 0.45 -0.47 1.77 0.25 1.20 0.00 0.00 173.24 176.44 2g18 h LEU 9 N 3.36 0.00 -2.54 3.45 5.85 -1.97 -2.55 115.31 120.91 2g18 h LEU 9 Ca -0.48 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.23 2g18 h LEU 9 Cb 1.22 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 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 -1.97 -0.34 114.38 113.44 2g18 h ARG 10 Ca 0.51 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.57 2g18 h ARG 10 Cb 2.19 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 33.26 2g18 h ARG 10 CO -0.01 0.01 -0.10 0.93 0.10 0.00 0.00 179.97 180.90 2g18 h GLU 11 N 0.00 0.00 -0.21 0.08 4.39 -1.85 -2.71 114.58 114.28 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 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 2g18 h GLU 11 CO 0.00 0.10 0.00 1.04 -1.16 0.00 0.00 179.01 179.00 2g18 n GLN 12 N -3.28 2.28 -3.45 2.33 6.02 -0.14 -5.00 117.38 116.14 2g18 n GLN 12 Ca -0.00 -1.90 -0.19 0.00 -0.01 0.00 0.00 57.00 54.90 2g18 n GLN 12 Cb 0.34 -1.48 -0.01 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 -1.75 2.93 0.21 -1.09 -0.21 -1.02 -5.06 119.66 113.67 2g18 s GLN 13 Ca 0.34 -1.16 -0.31 0.00 0.02 0.00 0.00 55.36 54.26 2g18 s GLN 13 Cb 0.21 -2.70 -0.16 0.00 1.00 0.00 0.00 33.01 31.36 2g18 s GLN 13 CO 0.31 -0.02 0.99 1.58 -2.12 0.00 0.00 175.29 176.03 2g18 n HIS 14 N -1.62 0.93 -0.11 0.91 -0.00 -1.26 -4.72 115.22 109.34 2g18 n HIS 14 Ca 0.02 0.76 0.13 0.00 -0.00 0.00 0.00 57.72 58.63 2g18 n HIS 14 Cb 0.59 -2.20 0.50 0.00 -0.00 0.00 0.00 29.99 28.88 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 2.47 0.40 -0.34 1.57 0.11 -1.97 -0.49 132.00 133.75 2g18 h PRO 15 Ca -0.40 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.58 2g18 h PRO 15 Cb 1.36 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2g18 h PRO 15 CO 0.64 0.26 -0.25 1.25 -0.21 0.00 0.00 178.00 179.70 2g18 h LEU 16 N 0.41 0.70 -0.14 2.35 5.85 -1.99 -0.10 115.31 122.39 2g18 h LEU 16 Ca 0.30 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2g18 h LEU 16 Cb 0.62 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 2g18 h LEU 16 CO -0.09 0.92 0.06 0.40 -0.34 0.00 0.00 178.44 179.39 2g18 h ILE 17 N 0.60 1.15 -0.53 4.05 2.04 -1.44 0.20 117.51 123.58 2g18 h ILE 17 Ca 0.08 -0.44 0.03 0.00 1.00 0.00 0.00 64.86 65.53 2g18 h ILE 17 Cb 0.73 1.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.96 2g18 h ILE 17 CO 0.06 0.14 0.31 -0.09 0.00 0.00 0.00 178.15 178.56 2g18 h ARG 18 N 0.07 0.59 -0.39 2.37 2.43 -1.31 0.80 114.38 118.95 2g18 h ARG 18 Ca 0.05 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 2g18 h ARG 18 Cb 0.16 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2g18 h ARG 18 CO -0.00 0.39 0.17 0.37 -1.51 0.00 0.00 179.97 179.39 2g18 h GLN 19 N 0.61 0.57 -0.48 0.20 4.15 -0.81 -0.99 115.11 118.36 2g18 h GLN 19 Ca 0.22 -0.10 -0.04 0.00 0.77 0.00 0.00 58.65 59.51 2g18 h GLN 19 Cb 0.04 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.62 2g18 h GLN 19 CO -0.11 0.53 0.16 1.25 -1.93 0.00 0.00 178.83 178.73 2g18 h LEU 20 N 0.48 0.69 -0.26 -2.39 5.85 -0.68 -0.62 115.31 118.39 2g18 h LEU 20 Ca 0.13 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2g18 h LEU 20 Cb 0.16 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 2g18 h LEU 20 CO -0.01 0.70 0.14 0.00 -0.34 0.00 0.00 178.44 178.93 2g18 h ALA 21 N 1.01 0.33 -0.82 1.25 0.00 -0.61 0.12 119.26 120.55 2g18 h ALA 21 Ca 0.16 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2g18 h ALA 21 Cb 0.25 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2g18 h ALA 21 CO -0.01 -0.14 0.50 -0.44 0.00 0.00 0.00 179.25 179.16 2g18 h ASP 22 N 0.31 0.97 -0.41 0.00 3.32 -1.08 -2.36 116.42 117.17 2g18 h ASP 22 Ca 0.09 -0.06 -0.08 0.00 0.02 0.00 0.00 57.03 57.01 2g18 h ASP 22 Cb 0.05 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2g18 h ASP 22 CO -0.02 0.74 -0.05 0.00 -1.72 0.00 0.00 179.24 178.19 2g18 h ILE 24 N 0.59 1.12 -0.42 0.00 2.04 -0.60 -1.72 117.51 118.53 2g18 h ILE 24 Ca 0.11 -0.35 -0.07 0.00 1.00 0.00 0.00 64.86 65.55 2g18 h ILE 24 Cb 0.56 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 2g18 h ILE 24 CO 0.03 0.12 -0.03 -0.33 0.00 0.00 0.00 178.15 177.94 2g18 h GLU 25 N 0.14 0.70 -0.03 2.37 5.08 -1.32 -1.32 114.58 120.20 2g18 h GLU 25 Ca 0.06 -0.19 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 2g18 h GLU 25 Cb 0.11 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2g18 h GLU 25 CO -0.01 0.74 -0.02 1.49 -1.00 0.00 0.00 179.01 180.21 2g18 h GLU 26 N 0.65 -0.02 -0.53 2.33 4.81 -0.73 -1.23 114.58 119.87 2g18 h GLU 26 Ca 0.13 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 2g18 h GLU 26 Cb 0.45 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 2g18 h GLU 26 CO 0.02 -0.01 0.10 0.28 -0.73 0.00 0.00 179.01 178.67 2g18 h VAL 27 N -0.02 1.25 -0.34 0.32 2.07 -1.00 -1.46 116.25 117.07 2g18 h VAL 27 Ca 0.02 -0.92 0.05 0.00 0.82 0.00 0.00 66.70 66.67 2g18 h VAL 27 Cb 0.05 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 2g18 h VAL 27 CO -0.05 0.33 0.05 -0.50 0.02 0.00 0.00 177.57 177.43 2g18 h TRP 28 N 0.75 0.08 -0.32 1.57 6.55 -0.94 -1.23 115.95 122.40 2g18 h TRP 28 Ca 0.16 0.02 -0.06 0.00 0.95 0.00 0.00 58.89 59.96 2g18 h TRP 28 Cb 0.38 0.02 -0.02 0.00 -0.86 0.00 0.00 29.16 28.68 2g18 h TRP 28 CO 0.03 -0.00 -0.07 0.45 -1.05 0.00 0.00 178.44 177.80 2g18 h HIS 29 N 0.16 0.56 -0.13 0.49 3.86 -1.08 -0.64 115.15 118.37 2g18 h HIS 29 Ca 0.16 -0.07 -0.22 0.00 -1.16 0.00 0.00 60.37 59.07 2g18 h HIS 29 Cb 0.19 -0.16 0.01 0.00 1.06 0.00 0.00 27.41 28.52 2g18 h HIS 29 CO -0.20 0.59 -0.80 0.37 0.86 0.00 0.00 177.93 178.76 2g18 h GLN 30 N 0.50 0.74 0.00 2.45 4.15 -0.61 -3.38 115.11 118.97 2g18 h GLN 30 Ca 0.10 -0.63 -0.08 0.00 0.77 0.00 0.00 58.65 58.81 2g18 h GLN 30 Cb 0.43 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.24 2g18 h GLN 30 CO 0.02 1.23 -1.76 0.72 -1.93 0.00 0.00 178.83 177.11 2g18 n HIS 31 N -3.92 0.00 -4.41 3.99 8.25 -0.53 -5.03 115.22 113.57 2g18 n HIS 31 Ca -0.07 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.13 2g18 n HIS 31 Cb 0.76 -0.45 -0.09 0.00 1.12 0.00 0.00 29.99 31.32 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 -4.35 2.91 -0.68 2.41 1.43 -0.25 -5.01 118.68 115.14 2g18 s LEU 32 Ca -0.06 -1.11 -0.13 0.00 -1.03 0.00 0.00 54.13 51.80 2g18 s LEU 32 Cb 0.08 -1.20 0.17 0.00 0.03 0.00 0.00 46.19 45.27 2g18 s LEU 32 CO 0.59 -0.29 0.61 -0.62 0.23 0.00 0.00 176.35 176.87 2g18 s ASP 33 N -3.70 6.34 0.00 2.29 2.15 -1.26 -4.69 116.67 117.80 2g18 s ASP 33 Ca 0.35 -2.32 -0.23 0.00 0.43 0.00 0.00 52.55 50.78 2g18 s ASP 33 Cb 0.02 -2.16 -0.05 0.00 -0.30 0.00 0.00 42.92 40.43 2g18 s ASP 33 CO 0.19 -0.67 0.69 -0.76 -0.17 0.00 0.00 175.17 174.45 2g18 s LEU 34 N 0.76 4.41 0.21 -1.34 1.43 -1.26 -4.47 118.68 118.42 2g18 s LEU 34 Ca 0.11 1.29 0.09 0.00 -1.03 0.00 0.00 54.13 54.59 2g18 s LEU 34 Cb -0.19 -3.08 -0.05 0.00 0.03 0.00 0.00 46.19 42.90 2g18 s LEU 34 CO -0.04 0.02 -0.17 -0.44 0.23 0.00 0.00 176.35 175.95 2g18 s SER 35 N 0.05 2.88 0.69 2.29 0.01 -0.11 -4.97 113.70 114.56 2g18 s SER 35 Ca 0.35 -0.96 -0.13 0.00 1.31 0.00 0.00 55.95 56.52 2g18 s SER 35 Cb -0.19 -0.19 0.02 0.00 0.21 0.00 0.00 66.02 65.87 2g18 s SER 35 CO 0.20 -0.06 1.09 -2.16 0.41 0.00 0.00 173.24 172.71 2g18 s PRO 36 N -3.29 2.69 -0.20 12.44 0.04 -1.26 -0.76 135.00 144.66 2g18 s PRO 36 Ca 0.22 1.24 -0.04 0.00 0.04 0.00 0.00 61.00 62.45 2g18 s PRO 36 Cb -0.04 -1.95 0.07 0.00 0.04 0.00 0.00 34.50 32.63 2g18 s PRO 36 CO 0.09 -1.32 0.09 -0.47 0.04 0.00 0.00 177.00 175.43 2g18 s TYR 37 N -2.64 0.41 -0.19 0.56 5.04 -1.07 -4.48 117.35 114.99 2g18 s TYR 37 Ca 0.63 -0.57 -0.14 0.00 -2.44 0.00 0.00 57.07 54.56 2g18 s TYR 37 Cb -0.18 -0.83 -0.05 0.00 0.35 0.00 0.00 41.96 41.26 2g18 s TYR 37 CO 0.48 -0.61 0.29 -1.01 -1.34 0.00 0.00 175.55 173.36 2g18 s HIS 38 N 2.07 3.41 0.71 4.97 3.76 -1.26 -4.24 115.29 124.70 2g18 s HIS 38 Ca 0.03 0.52 -0.09 0.00 -0.15 0.00 0.00 55.06 55.37 2g18 s HIS 38 Cb -0.16 -2.37 0.05 0.00 1.11 0.00 0.00 32.58 31.20 2g18 s HIS 38 CO -0.15 0.14 1.06 -0.51 -0.85 0.00 0.00 174.74 174.43 2g18 s LEU 39 N 0.79 2.83 -0.16 0.89 1.02 -1.26 -4.90 118.68 117.89 2g18 s LEU 39 Ca 0.15 0.75 -0.01 0.00 0.02 0.00 0.00 54.13 55.04 2g18 s LEU 39 Cb -0.13 -3.43 -0.05 0.00 0.02 0.00 0.00 46.19 42.59 2g18 s LEU 39 CO 0.05 -1.52 0.88 -2.65 0.02 0.00 0.00 176.35 173.13 2g18 n PRO 40 N -2.99 0.00 -1.02 1.29 -0.02 -1.26 -4.80 135.00 126.20 2g18 n PRO 40 Ca 0.07 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.19 2g18 n PRO 40 Cb 0.59 -0.70 0.04 0.00 -0.02 0.00 0.00 33.50 33.42 2g18 n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2g18 n ALA 41 N 3.31 -4.93 0.00 3.55 0.00 -1.26 0.16 120.51 121.33 2g18 n ALA 41 Ca 0.11 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.95 2g18 n ALA 41 Cb 0.29 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2g18 n ALA 41 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2g18 n GLU 42 N 2.01 0.00 0.00 0.00 1.02 -1.26 -4.72 120.64 117.69 2g18 n GLU 42 Ca 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.19 2g18 n GLU 42 Cb 0.55 -0.56 -0.03 0.00 -0.02 0.00 0.00 31.44 31.37 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 0.00 0.88 0.09 -4.62 4.77 0.42 -4.49 117.00 114.05 2g18 n LEU 43 Ca 0.00 -0.62 -0.06 0.00 -0.03 0.00 0.00 56.01 55.30 2g18 n LEU 43 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2g18 n LEU 43 CO 0.00 0.19 0.24 1.23 -1.33 0.00 0.00 177.39 177.72 2g18 h GLY 44 N 2.54 0.05 -7.26 -0.72 0.00 -1.85 -3.43 103.07 92.40 2g18 h GLY 44 Ca 0.00 -0.10 -0.39 0.00 0.00 0.00 0.00 47.33 46.84 2g18 h GLY 44 CO 0.00 0.09 -0.74 -0.47 0.00 0.00 0.00 176.54 175.42 2g18 s TYR 45 N -3.01 0.08 -0.06 5.60 5.04 -1.26 -0.56 117.35 123.17 2g18 s TYR 45 Ca -0.00 0.16 0.03 0.00 -2.44 0.00 0.00 57.07 54.82 2g18 s TYR 45 Cb 0.11 -0.52 0.00 0.00 0.35 0.00 0.00 41.96 41.90 2g18 s TYR 45 CO 0.81 -0.25 -0.16 0.08 -1.34 0.00 0.00 175.55 174.69 2g18 s VAL 46 N 2.17 1.41 -0.04 3.14 1.01 0.37 -4.77 120.40 123.69 2g18 s VAL 46 Ca 0.04 -0.67 0.06 0.00 0.00 0.00 0.00 61.98 61.42 2g18 s VAL 46 Cb -0.13 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 35.00 2g18 s VAL 46 CO -0.04 0.41 -0.21 -1.61 0.00 0.00 0.00 175.10 173.65 2g18 s GLU 47 N 0.38 2.04 0.00 2.72 2.02 -1.26 -0.69 118.70 123.91 2g18 s GLU 47 Ca -0.12 -0.77 0.00 0.00 0.02 0.00 0.00 54.97 54.10 2g18 s GLU 47 Cb -0.15 -1.82 0.00 0.00 0.10 0.00 0.00 34.13 32.27 2g18 s GLU 47 CO 0.04 0.37 0.00 0.41 0.02 0.00 0.00 175.26 176.10 2g18 n GLY 48 N 2.86 2.88 3.00 -1.39 0.00 -0.24 -4.99 105.19 107.32 2g18 n GLY 48 Ca -0.17 -1.05 -0.11 0.00 0.00 0.00 0.00 46.02 44.69 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 -0.73 0.23 -0.24 1.61 1.81 -1.26 -0.56 118.95 119.80 2g18 s ARG 49 Ca 0.00 -0.11 -0.05 0.00 -1.72 0.00 0.00 55.73 53.85 2g18 s ARG 49 Cb 0.00 0.10 0.13 0.00 -0.45 0.00 0.00 34.95 34.72 2g18 s ARG 49 CO 0.00 -0.04 0.47 -1.17 -0.68 0.00 0.00 175.30 173.88 2g18 s LEU 50 N -0.53 -0.83 -1.53 2.53 2.96 -0.22 -4.68 118.68 116.38 2g18 s LEU 50 Ca -0.06 0.82 -0.12 0.00 -0.22 0.00 0.00 54.13 54.55 2g18 s LEU 50 Cb -0.04 1.55 0.08 0.00 0.50 0.00 0.00 46.19 48.28 2g18 s LEU 50 CO 0.00 -0.26 0.88 -0.62 -1.32 0.00 0.00 176.35 175.04 2g18 n GLU 51 N 5.40 -4.89 0.00 1.98 -0.58 -1.26 -0.48 120.64 120.81 2g18 n GLU 51 Ca -0.06 0.55 0.00 0.00 -0.42 0.00 0.00 57.16 57.22 2g18 n GLU 51 Cb 0.50 -5.32 0.00 0.00 -0.57 0.00 0.00 31.44 26.05 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 -1.65 2.95 3.79 0.62 0.00 -1.26 -5.00 105.19 104.65 2g18 n GLY 52 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 4.54 0.15 1.61 0.41 0.37 -5.02 118.70 120.75 2g18 s GLU 53 Ca 0.00 1.24 -0.31 0.00 -0.41 0.00 0.00 54.97 55.50 2g18 s GLU 53 Cb 0.00 -2.87 -0.08 0.00 -1.78 0.00 0.00 34.13 29.40 2g18 s GLU 53 CO 0.00 0.33 1.35 0.21 -0.49 0.00 0.00 175.26 176.66 2g18 s LYS 54 N -1.94 4.35 -0.16 1.61 2.20 -1.26 -1.05 119.74 123.49 2g18 s LYS 54 Ca 0.48 2.05 -0.04 0.00 -0.36 0.00 0.00 55.97 58.10 2g18 s LYS 54 Cb -0.19 -3.23 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 2g18 s LYS 54 CO 0.24 -0.35 -0.03 -1.17 -0.36 0.00 0.00 175.35 173.68 2g18 s LEU 55 N 0.59 3.32 -0.03 5.43 0.20 0.27 -0.71 118.68 127.76 2g18 s LEU 55 Ca 0.61 -0.10 0.02 0.00 0.69 0.00 0.00 54.13 55.35 2g18 s LEU 55 Cb -0.36 -1.80 0.01 0.00 -0.43 0.00 0.00 46.19 43.60 2g18 s LEU 55 CO 0.33 0.18 -0.08 -0.89 -0.29 0.00 0.00 176.35 175.60 2g18 s THR 56 N 0.32 0.75 -0.09 3.68 2.01 0.16 -1.08 115.64 121.39 2g18 s THR 56 Ca -0.03 -0.32 0.01 0.00 0.31 0.00 0.00 61.69 61.66 2g18 s THR 56 Cb -0.14 -0.68 0.02 0.00 0.01 0.00 0.00 72.50 71.71 2g18 s THR 56 CO 0.03 0.24 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.46 2g18 s ILE 57 N 0.32 1.14 -0.16 1.82 1.01 0.14 -0.86 121.20 124.61 2g18 s ILE 57 Ca -0.05 -0.43 -0.01 0.00 0.00 0.00 0.00 60.65 60.16 2g18 s ILE 57 Cb -0.10 -1.09 -0.01 0.00 0.01 0.00 0.00 42.46 41.28 2g18 s ILE 57 CO 0.01 0.37 -0.13 -0.70 0.00 0.00 0.00 174.94 174.49 2g18 s GLU 58 N 1.11 3.30 -0.06 2.79 2.12 0.50 -0.48 118.70 127.98 2g18 s GLU 58 Ca -0.06 -0.71 0.05 0.00 0.36 0.00 0.00 54.97 54.62 2g18 s GLU 58 Cb -0.14 -2.70 -0.02 0.00 0.26 0.00 0.00 34.13 31.53 2g18 s GLU 58 CO -0.02 0.03 -0.22 -0.80 -0.54 0.00 0.00 175.26 173.71 2g18 s ASN 59 N 0.81 3.34 -0.05 -1.70 0.01 0.27 -1.14 114.94 116.49 2g18 s ASN 59 Ca -0.04 -0.43 -0.01 0.00 -0.71 0.00 0.00 52.86 51.67 2g18 s ASN 59 Cb -0.15 -0.86 0.03 0.00 0.41 0.00 0.00 41.25 40.68 2g18 s ASN 59 CO 0.00 0.27 0.01 -0.60 -1.51 0.00 0.00 177.10 175.27 2g18 s ARG 60 N -0.27 0.38 0.07 -0.60 3.52 0.24 -4.80 118.95 117.49 2g18 s ARG 60 Ca 0.00 0.13 0.06 0.00 -0.13 0.00 0.00 55.73 55.79 2g18 s ARG 60 Cb -0.13 -0.68 -0.03 0.00 -1.56 0.00 0.00 34.95 32.55 2g18 s ARG 60 CO 0.03 -0.22 -0.16 0.00 -0.81 0.00 0.00 175.30 174.14 2g18 s TYR 62 N -1.17 1.64 0.11 0.00 1.51 0.42 -2.59 117.35 117.28 2g18 s TYR 62 Ca 0.01 -1.50 -0.10 0.00 -1.01 0.00 0.00 57.07 54.47 2g18 s TYR 62 Cb -0.10 -0.80 0.00 0.00 -0.11 0.00 0.00 41.96 40.96 2g18 s TYR 62 CO 0.03 -0.67 0.24 1.14 -1.11 0.00 0.00 175.55 175.18 2g18 s GLN 63 N -3.67 0.95 0.27 -0.62 -2.07 0.06 -0.33 119.66 114.25 2g18 s GLN 63 Ca 0.37 -0.97 -0.01 0.00 -1.82 0.00 0.00 55.36 52.93 2g18 s GLN 63 Cb 0.04 0.37 -0.02 0.00 -1.09 0.00 0.00 33.01 32.30 2g18 s GLN 63 CO 0.21 -0.33 0.29 0.95 -1.32 0.00 0.00 175.29 175.09 2g18 s THR 64 N -3.88 0.00 0.55 3.63 -4.23 -0.53 -0.93 115.64 110.25 2g18 s THR 64 Ca 0.07 -1.83 0.26 0.00 -1.18 0.00 0.00 61.69 59.02 2g18 s THR 64 Cb 0.04 -2.48 0.37 0.00 1.34 0.00 0.00 72.50 71.77 2g18 s THR 64 CO -0.09 0.00 2.03 -0.65 -0.54 0.00 0.00 174.62 175.38 2g18 h PRO 65 N 2.34 0.00 0.00 3.99 0.11 -2.02 -2.64 132.00 133.79 2g18 h PRO 65 Ca -0.30 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.64 2g18 h PRO 65 Cb 1.24 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 2g18 h PRO 65 CO 0.43 0.00 -1.85 1.04 -0.21 0.00 0.00 178.00 177.41 2g18 n GLN 66 N -4.14 0.65 -3.99 1.05 3.00 -1.26 -4.86 117.38 107.83 2g18 n GLN 66 Ca 0.06 0.03 -0.34 0.00 -0.01 0.00 0.00 57.00 56.73 2g18 n GLN 66 Cb 0.47 -1.64 -0.14 0.00 0.00 0.00 0.00 30.24 28.93 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 -2.99 2.91 0.31 1.08 0.40 -0.99 -0.38 117.98 118.32 2g18 s PHE 67 Ca -0.06 -1.10 -0.00 0.00 -0.60 0.00 0.00 56.93 55.17 2g18 s PHE 67 Cb 0.09 -2.05 0.50 0.00 0.51 0.00 0.00 43.02 42.07 2g18 s PHE 67 CO 0.84 -0.60 1.93 -0.09 0.70 0.00 0.00 175.22 178.00 2g18 h ARG 68 N 8.02 0.88 -1.86 0.44 2.43 -0.82 -1.42 114.38 122.06 2g18 h ARG 68 Ca -0.42 -0.10 0.03 0.00 -0.81 0.00 0.00 59.98 58.68 2g18 h ARG 68 Cb 1.16 -0.17 -0.23 0.00 -0.42 0.00 0.00 29.97 30.31 2g18 h ARG 68 CO 0.61 0.67 0.17 0.21 -1.51 0.00 0.00 179.97 180.12 2g18 s LYS 69 N -5.56 0.65 -0.20 0.20 2.20 -1.10 -4.65 119.74 111.29 2g18 s LYS 69 Ca -0.10 0.99 -0.00 0.00 -0.36 0.00 0.00 55.97 56.50 2g18 s LYS 69 Cb 0.17 0.20 0.05 0.00 -1.51 0.00 0.00 37.83 36.74 2g18 s LYS 69 CO 0.78 -0.11 -0.05 -1.64 -0.36 0.00 0.00 175.35 173.97 2g18 s MET 70 N 1.11 1.51 -0.18 4.03 -1.94 0.54 -0.06 119.30 124.32 2g18 s MET 70 Ca -0.06 -0.74 0.01 0.00 -1.71 0.00 0.00 55.69 53.19 2g18 s MET 70 Cb -0.05 -2.30 0.02 0.00 2.01 0.00 0.00 34.83 34.51 2g18 s MET 70 CO -0.12 -0.52 -0.19 -1.58 -0.01 0.00 0.00 175.02 172.60 2g18 s HIS 71 N 1.53 2.69 -0.22 -0.03 5.04 -0.16 -0.44 115.29 123.70 2g18 s HIS 71 Ca -0.02 -1.60 -0.04 0.00 -1.54 0.00 0.00 55.06 51.86 2g18 s HIS 71 Cb -0.17 -1.86 -0.01 0.00 0.04 0.00 0.00 32.58 30.58 2g18 s HIS 71 CO -0.07 -0.79 -0.04 -1.17 -2.34 0.00 0.00 174.74 170.33 2g18 s LEU 72 N 1.32 2.92 -0.10 8.88 2.96 0.35 -1.35 118.68 133.66 2g18 s LEU 72 Ca 0.05 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 53.61 2g18 s LEU 72 Cb -0.13 -1.75 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 2g18 s LEU 72 CO -0.12 -0.01 -0.20 -0.70 -1.32 0.00 0.00 176.35 174.00 2g18 s GLU 73 N 1.45 3.00 -0.08 1.98 2.12 0.54 -0.59 118.70 127.12 2g18 s GLU 73 Ca 0.05 -0.80 0.04 0.00 0.36 0.00 0.00 54.97 54.62 2g18 s GLU 73 Cb -0.14 -2.39 0.00 0.00 0.26 0.00 0.00 34.13 31.86 2g18 s GLU 73 CO -0.03 0.28 -0.19 -0.51 -0.54 0.00 0.00 175.26 174.27 2g18 s LEU 74 N 0.12 1.92 0.03 2.70 1.43 -0.29 -0.73 118.68 123.85 2g18 s LEU 74 Ca -0.10 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.57 2g18 s LEU 74 Cb -0.16 -1.15 -0.02 0.00 0.03 0.00 0.00 46.19 44.89 2g18 s LEU 74 CO 0.06 0.13 -0.04 0.00 0.23 0.00 0.00 176.35 176.73 2g18 s ALA 75 N 0.33 0.22 -0.05 4.21 0.00 -0.19 -0.37 121.76 125.90 2g18 s ALA 75 Ca -0.13 -0.67 -0.04 0.00 0.00 0.00 0.00 51.96 51.12 2g18 s ALA 75 Cb -0.16 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.13 2g18 s ALA 75 CO 0.06 -0.16 0.14 0.21 0.00 0.00 0.00 175.76 176.00 2g18 s LYS 76 N -1.69 0.13 -0.27 0.00 2.20 -0.04 -0.57 119.74 119.50 2g18 s LYS 76 Ca -0.13 0.25 0.02 0.00 -0.36 0.00 0.00 55.97 55.75 2g18 s LYS 76 Cb -0.08 -0.02 0.07 0.00 -1.51 0.00 0.00 37.83 36.28 2g18 s LYS 76 CO -0.02 -0.07 -0.05 0.08 -0.36 0.00 0.00 175.35 174.94 2g18 s VAL 77 N 0.48 1.86 0.00 4.02 1.01 0.05 -0.67 120.40 127.15 2g18 s VAL 77 Ca -0.03 -1.60 0.00 0.00 0.00 0.00 0.00 61.98 60.35 2g18 s VAL 77 Cb -0.05 -2.13 0.00 0.00 0.00 0.00 0.00 36.38 34.20 2g18 s VAL 77 CO -0.02 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.48 2g18 n GLY 78 N 4.52 1.12 0.42 4.51 0.00 0.11 -0.95 105.19 114.93 2g18 n GLY 78 Ca -0.09 0.18 0.05 0.00 0.00 0.00 0.00 46.02 46.17 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 1.12 2.79 0.01 1.61 3.02 -1.26 -4.58 115.26 117.97 2g18 n ASN 79 Ca 0.00 -2.42 -0.10 0.00 -0.03 0.00 0.00 54.58 52.03 2g18 n ASN 79 Cb 0.00 -0.27 -0.14 0.00 -0.61 0.00 0.00 39.78 38.76 2g18 n ASN 79 CO 0.00 0.00 0.00 -0.03 -2.62 0.00 0.00 177.26 174.61 2g18 h MET 80 N 1.06 0.05 -2.58 3.52 1.85 -1.43 -1.93 114.93 115.48 2g18 h MET 80 Ca 0.00 -0.08 -0.10 0.00 -0.61 0.00 0.00 59.70 58.91 2g18 h MET 80 Cb 0.87 0.03 -0.26 0.00 0.43 0.00 0.00 31.60 32.67 2g18 h MET 80 CO 0.05 0.75 -0.29 -1.17 -0.40 0.00 0.00 176.91 175.85 2g18 s LEU 81 N -6.42 -0.25 -0.05 3.39 2.96 -0.92 -4.36 118.68 113.03 2g18 s LEU 81 Ca -0.05 0.96 0.04 0.00 -0.22 0.00 0.00 54.13 54.86 2g18 s LEU 81 Cb 0.08 1.42 -0.00 0.00 0.50 0.00 0.00 46.19 48.19 2g18 s LEU 81 CO 0.82 -0.20 -0.18 -1.81 -1.32 0.00 0.00 176.35 173.66 2g18 s ASP 82 N 1.64 2.27 -0.02 3.68 1.01 -0.64 -0.77 116.67 123.84 2g18 s ASP 82 Ca -0.08 -0.37 0.02 0.00 0.71 0.00 0.00 52.55 52.82 2g18 s ASP 82 Cb -0.09 -0.64 0.00 0.00 1.01 0.00 0.00 42.92 43.21 2g18 s ASP 82 CO -0.13 0.16 -0.05 -0.63 0.21 0.00 0.00 175.17 174.72 2g18 s ILE 83 N 0.03 0.49 -0.07 0.77 1.01 0.27 -0.58 121.20 123.12 2g18 s ILE 83 Ca -0.04 -0.21 0.05 0.00 0.00 0.00 0.00 60.65 60.45 2g18 s ILE 83 Cb -0.12 -0.45 -0.01 0.00 0.01 0.00 0.00 42.46 41.89 2g18 s ILE 83 CO 0.02 0.16 -0.22 -0.22 0.00 0.00 0.00 174.94 174.69 2g18 s LEU 84 N 0.20 2.22 -0.03 2.97 0.20 0.17 -1.02 118.68 123.39 2g18 s LEU 84 Ca -0.02 -0.46 0.01 0.00 0.69 0.00 0.00 54.13 54.34 2g18 s LEU 84 Cb -0.06 -1.43 0.02 0.00 -0.43 0.00 0.00 46.19 44.29 2g18 s LEU 84 CO -0.00 0.23 -0.03 -2.28 -0.29 0.00 0.00 176.35 173.98 2g18 s HIS 85 N -0.09 0.51 -0.02 5.38 5.65 0.09 -0.57 115.29 126.25 2g18 s HIS 85 Ca -0.05 -0.10 0.00 0.00 0.25 0.00 0.00 55.06 55.16 2g18 s HIS 85 Cb -0.14 -0.49 0.02 0.00 -1.18 0.00 0.00 32.58 30.79 2g18 s HIS 85 CO 0.04 -0.13 0.01 0.00 -0.65 0.00 0.00 174.74 174.01 2g18 s VAL 87 N 0.82 0.06 -0.19 0.00 1.01 -0.46 -1.32 120.40 120.32 2g18 s VAL 87 Ca -0.08 -0.01 -0.02 0.00 0.00 0.00 0.00 61.98 61.87 2g18 s VAL 87 Cb -0.11 -0.07 -0.00 0.00 0.00 0.00 0.00 36.38 36.20 2g18 s VAL 87 CO -0.02 0.03 -0.10 -0.04 0.00 0.00 0.00 175.10 174.97 2g18 s MET 88 N 0.10 3.27 -0.36 2.72 -1.94 -0.17 -0.99 119.30 121.93 2g18 s MET 88 Ca -0.01 -0.69 -0.11 0.00 -1.71 0.00 0.00 55.69 53.17 2g18 s MET 88 Cb -0.02 -2.82 0.02 0.00 2.01 0.00 0.00 34.83 34.02 2g18 s MET 88 CO -0.00 -0.13 0.19 -0.06 -0.01 0.00 0.00 175.02 175.01 2g18 s PHE 89 N 1.23 3.23 0.58 -0.03 0.40 0.91 -3.39 117.98 120.90 2g18 s PHE 89 Ca 0.02 -0.86 -0.18 0.00 -0.60 0.00 0.00 56.93 55.31 2g18 s PHE 89 Cb -0.14 -2.41 -0.04 0.00 0.51 0.00 0.00 43.02 40.93 2g18 s PHE 89 CO -0.04 -0.60 1.14 -2.14 0.70 0.00 0.00 175.22 174.28 2g18 s PRO 90 N 1.57 3.14 0.30 0.24 0.02 -1.26 -0.24 135.00 138.76 2g18 s PRO 90 Ca 0.03 1.60 -0.29 0.00 0.02 0.00 0.00 61.00 62.35 2g18 s PRO 90 Cb -0.19 -1.98 -0.10 0.00 0.02 0.00 0.00 34.50 32.25 2g18 s PRO 90 CO 0.06 -1.02 1.42 1.03 -0.33 0.00 0.00 177.00 178.16 2g18 s ARG 91 N -3.49 4.26 0.00 5.54 0.52 0.48 -4.38 118.95 121.88 2g18 s ARG 91 Ca 0.72 2.34 0.09 0.00 -0.52 0.00 0.00 55.73 58.36 2g18 s ARG 91 Cb -0.24 -3.07 0.50 0.00 0.52 0.00 0.00 34.95 32.66 2g18 s ARG 91 CO 0.32 -0.38 1.12 -0.35 0.02 0.00 0.00 175.30 176.03 2g18 n PRO 92 N 1.56 0.19 0.10 3.54 -0.04 -1.26 -1.25 135.00 137.84 2g18 n PRO 92 Ca 0.04 0.13 0.12 0.00 -0.04 0.00 0.00 63.50 63.75 2g18 n PRO 92 Cb 0.40 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.81 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 -1.19 0.20 -4.60 0.54 4.71 -1.26 -4.58 120.64 114.46 2g18 n GLU 93 Ca 0.05 0.27 -0.34 0.00 -0.01 0.00 0.00 57.16 57.14 2g18 n GLU 93 Cb 0.06 -1.79 -0.12 0.00 -1.01 0.00 0.00 31.44 28.58 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 -3.17 2.93 -1.27 -0.32 1.51 -0.38 -0.77 117.35 115.88 2g18 s TYR 94 Ca 0.08 -0.17 -0.17 0.00 -1.01 0.00 0.00 57.07 55.80 2g18 s TYR 94 Cb 0.12 -1.79 -0.01 0.00 -0.11 0.00 0.00 41.96 40.16 2g18 s TYR 94 CO 0.50 0.14 2.11 -3.47 -1.11 0.00 0.00 175.55 173.72 2g18 n ASP 95 N 2.78 3.61 -4.18 2.29 2.03 -1.26 -4.84 116.55 116.97 2g18 n ASP 95 Ca -0.18 -2.80 -0.27 0.00 0.52 0.00 0.00 54.79 52.06 2g18 n ASP 95 Cb 0.53 -1.54 -0.16 0.00 -0.72 0.00 0.00 41.12 39.23 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 2.37 2.00 1.12 -2.67 1.43 -1.26 -4.89 118.68 116.78 2g18 s LEU 96 Ca 0.51 -0.37 -0.16 0.00 -1.03 0.00 0.00 54.13 53.08 2g18 s LEU 96 Cb 0.13 -1.02 0.25 0.00 0.03 0.00 0.00 46.19 45.58 2g18 s LEU 96 CO -0.02 0.21 1.08 -2.16 0.23 0.00 0.00 176.35 175.69 2g18 s PRO 97 N -0.26 -0.59 -0.24 1.29 0.04 -1.26 -4.65 135.00 129.33 2g18 s PRO 97 Ca 0.03 0.28 -0.17 0.00 0.04 0.00 0.00 61.00 61.18 2g18 s PRO 97 Cb -0.09 -1.64 -0.03 0.00 0.04 0.00 0.00 34.50 32.77 2g18 s PRO 97 CO 0.01 -3.37 0.44 -1.64 0.04 0.00 0.00 177.00 172.48 2g18 s MET 98 N -5.09 4.11 -0.03 4.56 -1.94 0.33 -4.72 119.30 116.51 2g18 s MET 98 Ca 0.68 0.23 -0.24 0.00 -1.71 0.00 0.00 55.69 54.65 2g18 s MET 98 Cb -0.16 -3.60 -0.04 0.00 2.01 0.00 0.00 34.83 33.04 2g18 s MET 98 CO 0.58 -0.21 0.72 0.12 -0.01 0.00 0.00 175.02 176.22 2g18 s PHE 99 N 1.84 3.63 -0.04 -0.03 5.36 -1.22 -0.04 117.98 127.49 2g18 s PHE 99 Ca 0.19 1.32 -0.05 0.00 -0.96 0.00 0.00 56.93 57.43 2g18 s PHE 99 Cb -0.15 -2.80 0.01 0.00 -0.34 0.00 0.00 43.02 39.73 2g18 s PHE 99 CO 0.09 0.16 0.12 0.20 -1.46 0.00 0.00 175.22 174.33 2g18 s GLY 100 N 0.50 -0.05 0.01 13.12 0.00 -0.71 -1.00 107.32 119.18 2g18 s GLY 100 Ca 0.38 0.22 -0.10 0.00 0.00 0.00 0.00 44.72 45.22 2g18 s GLY 100 CO 0.20 0.16 0.19 0.00 0.00 0.00 0.00 173.10 173.64 2g18 s ASP 102 N -1.60 0.01 -0.06 0.00 1.01 -0.17 -0.66 116.67 115.20 2g18 s ASP 102 Ca -0.11 -0.03 0.01 0.00 0.71 0.00 0.00 52.55 53.13 2g18 s ASP 102 Cb -0.05 0.05 0.02 0.00 1.01 0.00 0.00 42.92 43.95 2g18 s ASP 102 CO 0.00 -0.04 -0.06 -0.22 0.21 0.00 0.00 175.17 175.06 2g18 s LEU 103 N -0.18 1.32 -0.10 1.23 2.96 0.26 -1.22 118.68 122.96 2g18 s LEU 103 Ca -0.02 -0.19 0.02 0.00 -0.22 0.00 0.00 54.13 53.72 2g18 s LEU 103 Cb -0.01 -0.60 0.01 0.00 0.50 0.00 0.00 46.19 46.09 2g18 s LEU 103 CO -0.00 -0.05 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.14 2g18 s VAL 104 N 1.06 1.41 0.00 1.68 1.01 -0.35 -0.66 120.40 124.55 2g18 s VAL 104 Ca -0.08 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.29 2g18 s VAL 104 Cb -0.14 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 34.95 2g18 s VAL 104 CO -0.01 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.13 2g18 n GLY 105 N 4.07 4.42 0.00 4.51 0.00 0.26 -1.35 105.19 117.09 2g18 n GLY 105 Ca -0.20 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2g18 n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g18 n GLY 106 N 0.00 4.39 2.42 -0.02 0.00 -0.51 -1.61 105.19 109.86 2g18 n GLY 106 Ca 0.00 -0.70 -0.19 0.00 0.00 0.00 0.00 46.02 45.13 2g18 n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g18 n ARG 107 N -1.52 -1.44 -0.87 1.61 1.74 -0.73 -0.95 116.66 114.51 2g18 n ARG 107 Ca 0.00 0.99 0.00 0.00 -0.77 0.00 0.00 57.85 58.07 2g18 n ARG 107 Cb 0.00 -5.45 0.00 0.00 -1.02 0.00 0.00 32.46 25.99 2g18 n ARG 107 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2g18 n GLY 108 N -0.91 0.47 3.28 -0.13 0.00 -1.26 -5.07 105.19 101.57 2g18 n GLY 108 Ca -0.21 -0.85 -0.15 0.00 0.00 0.00 0.00 46.02 44.81 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 -1.55 1.14 -0.26 1.61 -1.52 -0.12 -5.07 119.66 113.88 2g18 s GLN 109 Ca 0.00 -1.50 -0.01 0.00 -1.95 0.00 0.00 55.36 51.91 2g18 s GLN 109 Cb 0.00 -0.72 0.04 0.00 -0.22 0.00 0.00 33.01 32.11 2g18 s GLN 109 CO 0.00 0.08 -0.06 0.42 -0.25 0.00 0.00 175.29 175.48 2g18 s ILE 110 N -3.27 2.71 -0.02 1.08 1.01 -1.26 -1.42 121.20 120.03 2g18 s ILE 110 Ca 0.19 -1.28 0.12 0.00 0.00 0.00 0.00 60.65 59.68 2g18 s ILE 110 Cb 0.02 -2.47 -0.13 0.00 0.01 0.00 0.00 42.46 39.89 2g18 s ILE 110 CO 0.02 0.07 1.14 0.77 0.00 0.00 0.00 174.94 176.94 2g18 h SER 111 N 7.95 0.00 -3.25 3.58 4.64 -1.56 -3.38 113.55 121.53 2g18 h SER 111 Ca -0.27 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.93 2g18 h SER 111 Cb 1.08 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 62.90 2g18 h SER 111 CO 0.54 0.80 -0.31 0.00 -0.87 0.00 0.00 176.83 176.99 2g18 s ALA 112 N -2.79 -1.02 -0.07 5.18 0.00 -1.04 -4.43 121.76 117.59 2g18 s ALA 112 Ca 0.00 1.49 0.01 0.00 0.00 0.00 0.00 51.96 53.46 2g18 s ALA 112 Cb 0.09 -0.90 0.02 0.00 0.00 0.00 0.00 23.12 22.32 2g18 s ALA 112 CO 0.80 -0.26 -0.08 0.00 0.00 0.00 0.00 175.76 176.22 2g18 s ALA 113 N 1.36 1.07 0.02 0.00 0.00 0.26 -1.21 121.76 123.26 2g18 s ALA 113 Ca -0.09 -0.33 0.03 0.00 0.00 0.00 0.00 51.96 51.57 2g18 s ALA 113 Cb -0.08 -0.64 -0.01 0.00 0.00 0.00 0.00 23.12 22.38 2g18 s ALA 113 CO -0.12 -0.13 -0.10 -1.50 0.00 0.00 0.00 175.76 173.91 2g18 s ILE 114 N 1.15 0.81 -0.13 0.00 2.07 -0.36 -1.42 121.20 123.33 2g18 s ILE 114 Ca -0.06 -0.69 -0.11 0.00 -1.41 0.00 0.00 60.65 58.37 2g18 s ILE 114 Cb -0.14 -0.73 0.03 0.00 0.13 0.00 0.00 42.46 41.75 2g18 s ILE 114 CO -0.01 0.05 0.34 0.00 -1.91 0.00 0.00 174.94 173.40 2g18 s ALA 115 N -0.60 -0.83 0.12 1.50 0.00 -0.12 -0.99 121.76 120.84 2g18 s ALA 115 Ca 0.01 0.97 -0.12 0.00 0.00 0.00 0.00 51.96 52.82 2g18 s ALA 115 Cb -0.06 -0.57 0.01 0.00 0.00 0.00 0.00 23.12 22.51 2g18 s ALA 115 CO 0.00 -0.16 0.30 0.34 0.00 0.00 0.00 175.76 176.24 2g18 s ASP 116 N 0.25 -0.04 -0.62 0.00 2.15 -0.06 -1.28 116.67 117.09 2g18 s ASP 116 Ca -0.01 -0.56 -0.02 0.00 0.43 0.00 0.00 52.55 52.39 2g18 s ASP 116 Cb -0.03 0.42 0.16 0.00 -0.30 0.00 0.00 42.92 43.17 2g18 s ASP 116 CO -0.00 -0.82 0.42 -0.76 -0.17 0.00 0.00 175.17 173.84 2g18 s LEU 117 N -2.86 5.16 0.11 -1.34 1.43 -1.26 -1.74 118.68 118.18 2g18 s LEU 117 Ca 0.07 -2.87 -0.29 0.00 -1.03 0.00 0.00 54.13 50.00 2g18 s LEU 117 Cb 0.03 -1.83 -0.06 0.00 0.03 0.00 0.00 46.19 44.36 2g18 s LEU 117 CO -0.09 -0.35 0.93 -0.44 0.23 0.00 0.00 176.35 176.63 2g18 s SER 118 N 0.59 7.47 0.54 2.29 0.01 0.95 -4.41 113.70 121.13 2g18 s SER 118 Ca 0.17 1.75 -0.20 0.00 1.31 0.00 0.00 55.95 58.98 2g18 s SER 118 Cb -0.21 -2.57 -0.06 0.00 0.21 0.00 0.00 66.02 63.40 2g18 s SER 118 CO -0.03 -0.04 1.16 -2.16 0.41 0.00 0.00 173.24 172.59 2g18 s PRO 119 N -0.11 3.33 -0.00 12.44 0.04 -1.26 -0.51 135.00 148.93 2g18 s PRO 119 Ca 0.45 1.71 0.15 0.00 0.04 0.00 0.00 61.00 63.35 2g18 s PRO 119 Cb -0.23 -2.06 -0.16 0.00 0.04 0.00 0.00 34.50 32.08 2g18 s PRO 119 CO 0.29 -0.89 0.61 1.33 0.04 0.00 0.00 177.00 178.38 2g18 n VAL 120 N -1.22 0.00 -2.53 -0.36 0.24 -1.26 -4.78 118.33 108.43 2g18 n VAL 120 Ca 0.11 -0.16 -0.41 0.00 -2.04 0.00 0.00 64.34 61.84 2g18 n VAL 120 Cb 0.50 0.95 -0.04 0.00 -1.47 0.00 0.00 33.84 33.78 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 -2.43 3.61 0.47 6.34 3.76 -1.26 -3.80 115.29 121.99 2g18 s HIS 121 Ca 0.05 1.61 0.32 0.00 -0.15 0.00 0.00 55.06 56.89 2g18 s HIS 121 Cb 0.11 -3.26 1.71 0.00 1.11 0.00 0.00 32.58 32.25 2g18 s HIS 121 CO 0.61 -0.55 2.16 -0.07 -0.85 0.00 0.00 174.74 176.04 2g18 h LEU 122 N 5.15 0.00 0.00 0.89 3.38 -1.92 -1.57 115.31 121.25 2g18 h LEU 122 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2g18 h LEU 122 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2g18 h LEU 122 CO 0.72 0.06 0.00 -0.90 0.09 0.00 0.00 178.44 178.41 2g18 n ASP 123 N -3.53 0.00 -0.10 -0.43 5.68 -1.26 -4.87 116.55 112.04 2g18 n ASP 123 Ca -0.02 -0.72 -0.01 0.00 -0.50 0.00 0.00 54.79 53.54 2g18 n ASP 123 Cb 0.18 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.15 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 -0.83 -0.30 -3.81 0.11 1.74 -0.59 -5.02 116.66 107.96 2g18 n ARG 124 Ca 0.08 0.28 -0.30 0.00 -0.77 0.00 0.00 57.85 57.15 2g18 n ARG 124 Cb 0.04 -3.68 -0.04 0.00 -1.02 0.00 0.00 32.46 27.76 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 -1.94 5.28 0.52 0.55 -4.23 -1.26 -4.82 115.64 109.74 2g18 s THR 125 Ca 0.00 -0.28 0.04 0.00 -1.18 0.00 0.00 61.69 60.27 2g18 s THR 125 Cb 0.00 -3.65 0.03 0.00 1.34 0.00 0.00 72.50 70.22 2g18 s THR 125 CO 0.00 0.04 0.72 -0.76 -0.54 0.00 0.00 174.62 174.08 2g18 s LEU 126 N -2.76 3.37 0.64 4.79 1.43 -1.26 -4.06 118.68 120.83 2g18 s LEU 126 Ca 0.37 -0.19 -0.15 0.00 -1.03 0.00 0.00 54.13 53.14 2g18 s LEU 126 Cb -0.12 -2.72 -0.01 0.00 0.03 0.00 0.00 46.19 43.37 2g18 s LEU 126 CO 0.27 -1.07 1.09 -2.84 0.23 0.00 0.00 176.35 174.03 2g18 s PRO 127 N -4.65 3.00 0.18 1.29 0.02 -1.26 -4.89 135.00 128.69 2g18 s PRO 127 Ca 0.57 1.31 -0.15 0.00 0.02 0.00 0.00 61.00 62.75 2g18 s PRO 127 Cb -0.10 -1.98 0.16 0.00 0.02 0.00 0.00 34.50 32.59 2g18 s PRO 127 CO 0.37 -1.08 1.65 1.05 -0.33 0.00 0.00 177.00 178.66 2g18 h GLU 128 N 0.16 0.00 -0.54 5.54 9.09 -1.99 -1.44 114.58 125.40 2g18 h GLU 128 Ca -0.47 -0.00 0.03 0.00 0.05 0.00 0.00 59.36 58.97 2g18 h GLU 128 Cb 1.24 -0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.31 2g18 h GLU 128 CO 0.55 0.00 0.36 0.66 0.05 0.00 0.00 179.01 180.64 2g18 h SER 129 N 0.00 0.56 -0.15 3.06 4.64 -2.00 -0.73 113.55 118.94 2g18 h SER 129 Ca 0.24 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.52 2g18 h SER 129 Cb 0.36 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2g18 h SER 129 CO -0.51 0.39 -0.02 1.88 -0.87 0.00 0.00 176.83 177.70 2g18 h TYR 130 N 0.65 0.30 -0.30 4.77 -1.99 -1.67 -2.62 116.97 116.11 2g18 h TYR 130 Ca 0.21 -0.06 0.06 0.00 2.00 0.00 0.00 58.73 60.94 2g18 h TYR 130 Cb 0.06 -0.08 -0.06 0.00 2.00 0.00 0.00 36.73 38.66 2g18 h TYR 130 CO -0.00 0.53 -0.06 -0.91 -0.00 0.00 0.00 178.16 177.72 2g18 h ASN 131 N -0.01 -0.26 -0.38 3.88 2.35 -0.70 0.21 115.58 120.67 2g18 h ASN 131 Ca 0.04 0.09 0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2g18 h ASN 131 Cb 0.43 0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 2g18 h ASN 131 CO 0.01 -0.09 0.24 0.28 -1.65 0.00 0.00 177.43 176.22 2g18 h SER 132 N 0.01 0.40 -0.60 5.81 0.02 -1.20 -0.04 113.55 117.96 2g18 h SER 132 Ca 0.15 -0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.01 2g18 h SER 132 Cb 0.22 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 2g18 h SER 132 CO -0.30 0.29 0.07 0.00 -1.14 0.00 0.00 176.83 175.74 2g18 h ALA 133 N 1.16 0.80 0.05 3.77 0.00 -1.10 -2.70 119.26 121.23 2g18 h ALA 133 Ca 0.15 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 2g18 h ALA 133 Cb -0.02 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2g18 h ALA 133 CO -0.05 0.58 -0.55 -0.07 0.00 0.00 0.00 179.25 179.16 2g18 h LEU 134 N 0.91 0.15 -1.98 0.00 3.38 -0.73 -3.24 115.31 113.80 2g18 h LEU 134 Ca 0.18 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.25 2g18 h LEU 134 Cb 0.47 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2g18 h LEU 134 CO 0.02 1.24 0.00 0.71 0.09 0.00 0.00 178.44 180.50 2g18 h THR 135 N -0.78 0.00 -0.11 0.22 1.35 -1.10 -1.04 112.91 111.46 2g18 h THR 135 Ca -0.12 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 2g18 h THR 135 Cb 1.28 0.72 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 2g18 h THR 135 CO 0.01 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 174.08 2g18 n SER 136 N -2.58 1.17 -4.89 5.36 7.64 -1.02 -4.89 113.62 114.41 2g18 n SER 136 Ca -0.02 -1.60 -0.33 0.00 1.01 0.00 0.00 58.87 57.93 2g18 n SER 136 Cb 0.06 -0.07 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 2g18 n SER 136 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2g18 s LEU 137 N -1.61 4.34 -0.03 -3.43 1.43 -0.40 -5.06 118.68 113.92 2g18 s LEU 137 Ca 0.32 0.53 -0.13 0.00 -1.03 0.00 0.00 54.13 53.82 2g18 s LEU 137 Cb 0.16 -2.93 -0.06 0.00 0.03 0.00 0.00 46.19 43.39 2g18 s LEU 137 CO 0.26 0.17 0.37 0.59 0.23 0.00 0.00 176.35 177.97 2g18 n ASN 138 N 0.65 0.08 -4.52 2.29 3.02 -1.26 -4.88 115.26 110.65 2g18 n ASN 138 Ca -0.07 0.36 -0.42 0.00 -0.03 0.00 0.00 54.58 54.42 2g18 n ASN 138 Cb 0.52 -0.29 -0.03 0.00 -0.61 0.00 0.00 39.78 39.37 2g18 n ASN 138 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2g18 s THR 139 N 0.21 3.97 0.09 3.41 2.01 -1.26 -4.99 115.64 119.07 2g18 s THR 139 Ca 0.29 -0.03 -0.30 0.00 0.31 0.00 0.00 61.69 61.97 2g18 s THR 139 Cb -0.41 -4.85 -0.06 0.00 0.01 0.00 0.00 72.50 67.19 2g18 s THR 139 CO 0.20 -1.73 1.08 -0.76 -0.69 0.00 0.00 174.62 172.71 2g18 s LEU 140 N 5.01 4.43 -0.81 4.42 1.43 -1.26 -4.99 118.68 126.91 2g18 s LEU 140 Ca 0.32 1.91 -0.24 0.00 -1.03 0.00 0.00 54.13 55.09 2g18 s LEU 140 Cb -0.10 -3.59 0.06 0.00 0.03 0.00 0.00 46.19 42.59 2g18 s LEU 140 CO 0.10 -0.28 1.23 0.20 0.23 0.00 0.00 176.35 177.83 2g18 s ASN 141 N 0.54 6.29 -0.18 2.29 -0.87 -1.26 -5.02 114.94 116.73 2g18 s ASN 141 Ca 0.52 -0.98 -0.08 0.00 -1.57 0.00 0.00 52.86 50.75 2g18 s ASN 141 Cb -0.26 -2.51 -0.04 0.00 -0.02 0.00 0.00 41.25 38.41 2g18 s ASN 141 CO 0.31 -1.58 0.09 -0.36 -2.57 0.00 0.00 177.10 172.98 2g18 s PHE 142 N 4.84 3.33 0.24 2.20 0.40 -1.26 -4.99 117.98 122.73 2g18 s PHE 142 Ca 0.34 0.20 0.00 0.00 -0.60 0.00 0.00 56.93 56.88 2g18 s PHE 142 Cb -0.08 -2.08 0.27 0.00 0.51 0.00 0.00 43.02 41.65 2g18 s PHE 142 CO 0.05 0.27 1.62 0.66 0.70 0.00 0.00 175.22 178.52 2g18 h SER 143 N 6.45 0.53 -2.25 1.36 4.64 -1.95 -3.33 113.55 119.00 2g18 h SER 143 Ca -0.40 -0.23 -0.59 0.00 -0.47 0.00 0.00 61.79 60.09 2g18 h SER 143 Cb 1.17 -0.15 -0.42 0.00 -0.31 0.00 0.00 62.40 62.69 2g18 h SER 143 CO 0.70 0.86 -0.62 0.00 -0.87 0.00 0.00 176.83 176.91 2g18 n GLN 144 N -4.04 2.95 -1.25 4.77 1.13 -1.26 -5.07 117.38 114.61 2g18 n GLN 144 Ca -0.01 -4.79 -0.31 0.00 -1.94 0.00 0.00 57.00 49.95 2g18 n GLN 144 Cb 0.50 -2.25 0.10 0.00 0.11 0.00 0.00 30.24 28.70 2g18 n GLN 144 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2g18 s PRO 145 N -3.06 2.02 0.12 -1.09 0.04 -1.25 -1.15 135.00 130.62 2g18 s PRO 145 Ca 0.45 1.08 0.08 0.00 0.04 0.00 0.00 61.00 62.64 2g18 s PRO 145 Cb 0.23 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.85 2g18 s PRO 145 CO -0.09 -1.78 -0.19 1.03 0.04 0.00 0.00 177.00 176.01 2g18 s ARG 146 N -4.92 1.12 0.01 4.56 0.52 0.40 -4.80 118.95 115.84 2g18 s ARG 146 Ca 0.62 -1.21 -0.22 0.00 -0.52 0.00 0.00 55.73 54.39 2g18 s ARG 146 Cb -0.17 -1.28 -0.05 0.00 0.52 0.00 0.00 34.95 33.97 2g18 s ARG 146 CO 0.56 0.28 0.66 -2.00 0.02 0.00 0.00 175.30 174.83 2g18 s GLU 147 N -2.18 4.39 0.47 3.54 2.12 -1.26 -4.78 118.70 120.99 2g18 s GLU 147 Ca 0.08 0.86 -0.22 0.00 0.36 0.00 0.00 54.97 56.06 2g18 s GLU 147 Cb -0.08 -3.35 -0.08 0.00 0.26 0.00 0.00 34.13 30.87 2g18 s GLU 147 CO 0.05 0.33 1.08 -0.51 -0.54 0.00 0.00 175.26 175.66 2g18 s LEU 148 N -0.11 3.93 1.00 2.70 1.43 -1.26 -5.06 118.68 121.31 2g18 s LEU 148 Ca 0.34 2.06 -0.17 0.00 -1.03 0.00 0.00 54.13 55.33 2g18 s LEU 148 Cb -0.19 -4.41 0.23 0.00 0.03 0.00 0.00 46.19 41.85 2g18 s LEU 148 CO 0.19 -0.80 1.36 -2.16 0.23 0.00 0.00 176.35 175.17 2g18 s PRO 149 N -2.96 0.29 0.42 1.29 0.05 -1.26 -4.90 135.00 127.93 2g18 s PRO 149 Ca 0.65 -0.54 0.27 0.00 0.05 0.00 0.00 61.00 61.44 2g18 s PRO 149 Cb -0.21 -1.82 0.86 0.00 0.05 0.00 0.00 34.50 33.38 2g18 s PRO 149 CO 0.25 -2.63 1.78 0.93 0.05 0.00 0.00 177.00 177.38 2g18 h GLU 150 N -1.80 0.00 -0.01 4.56 5.08 -2.05 0.23 114.58 120.59 2g18 h GLU 150 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 2g18 h GLU 150 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2g18 h GLU 150 CO 0.31 0.00 0.00 -2.67 -1.00 0.00 0.00 179.01 175.65 2g18 n TRP 151 N -2.85 0.01 1.59 4.33 4.27 -1.26 -3.76 117.44 119.77 2g18 n TRP 151 Ca 0.03 -0.01 0.13 0.00 -3.89 0.00 0.00 57.50 53.76 2g18 n TRP 151 Cb 0.40 0.00 0.56 0.00 -1.36 0.00 0.00 31.31 30.91 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 0.67 -0.27 0.00 -1.67 0.00 0.07 -3.71 105.19 100.28 2g18 n GLY 152 Ca 0.08 -0.34 0.02 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.16 0.00 0.09 1.61 6.94 -1.25 -1.31 115.26 121.18 2g18 n ASN 153 Ca 0.18 -1.42 0.12 0.00 -0.02 0.00 0.00 54.58 53.45 2g18 n ASN 153 Cb 0.25 0.00 0.24 0.00 -2.36 0.00 0.00 39.78 37.91 2g18 n ASN 153 CO 0.00 0.00 0.00 0.16 -1.03 0.00 0.00 177.26 176.39 2g18 h ILE 154 N 0.00 0.00 -3.55 1.53 3.07 -1.91 -3.47 117.51 113.18 2g18 h ILE 154 Ca 0.00 -0.57 -0.52 0.00 1.55 0.00 0.00 64.86 65.32 2g18 h ILE 154 Cb 0.00 1.32 -0.03 0.00 -0.27 0.00 0.00 36.82 37.85 2g18 h ILE 154 CO 0.00 0.00 -0.02 -0.36 -1.05 0.00 0.00 178.15 176.72 2g18 s PHE 155 N -3.16 3.42 0.91 0.16 0.40 -0.43 -3.99 117.98 115.29 2g18 s PHE 155 Ca 0.07 1.04 -0.15 0.00 -0.60 0.00 0.00 56.93 57.30 2g18 s PHE 155 Cb 0.12 -2.39 0.16 0.00 0.51 0.00 0.00 43.02 41.42 2g18 s PHE 155 CO 0.68 0.21 1.26 -1.54 0.70 0.00 0.00 175.22 176.53 2g18 s SER 156 N -2.26 3.56 0.02 1.36 1.04 -1.26 -4.87 113.70 111.28 2g18 s SER 156 Ca 0.49 0.49 0.16 0.00 0.48 0.00 0.00 55.95 57.57 2g18 s SER 156 Cb -0.11 -0.71 0.66 0.00 0.10 0.00 0.00 66.02 65.96 2g18 s SER 156 CO 0.19 -2.48 1.50 0.47 0.98 0.00 0.00 173.24 173.90 2g18 n ASP 157 N -3.64 0.06 -0.47 7.02 8.00 -1.26 -2.49 116.55 123.77 2g18 n ASP 157 Ca 0.12 0.51 0.11 0.00 0.71 0.00 0.00 54.79 56.25 2g18 n ASP 157 Cb 0.60 -0.53 0.04 0.00 -0.02 0.00 0.00 41.12 41.22 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 -1.57 0.00 -1.66 1.24 3.01 -1.26 -4.97 117.46 112.25 2g18 n PHE 158 Ca 0.03 0.00 -0.45 0.00 1.01 0.00 0.00 57.45 58.05 2g18 n PHE 158 Cb 0.18 -0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 39.61 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 -0.30 2.94 -0.25 0.00 1.01 -0.40 -5.00 121.20 119.20 2g18 s ILE 160 Ca 0.66 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 60.61 2g18 s ILE 160 Cb -0.66 -2.28 0.09 0.00 0.01 0.00 0.00 42.46 39.61 2g18 s ILE 160 CO 0.53 0.49 0.10 0.12 0.00 0.00 0.00 174.94 176.17 2g18 s PHE 161 N 1.04 0.62 0.13 3.97 5.36 -1.26 -0.94 117.98 126.90 2g18 s PHE 161 Ca -0.01 -0.90 0.00 0.00 -0.96 0.00 0.00 56.93 55.07 2g18 s PHE 161 Cb -0.15 -1.01 -0.04 0.00 -0.34 0.00 0.00 43.02 41.48 2g18 s PHE 161 CO -0.02 -0.74 0.01 0.14 -1.46 0.00 0.00 175.22 173.15 2g18 s VAL 162 N 1.99 0.36 -0.37 3.12 -7.23 -0.51 -0.45 120.40 117.31 2g18 s VAL 162 Ca 0.06 -1.92 -0.07 0.00 -1.81 0.00 0.00 61.98 58.24 2g18 s VAL 162 Cb -0.16 -1.95 0.06 0.00 0.56 0.00 0.00 36.38 34.88 2g18 s VAL 162 CO -0.25 -0.59 0.16 -0.60 -0.31 0.00 0.00 175.10 173.51 2g18 s ARG 163 N -3.97 2.57 -0.00 4.82 3.52 -0.30 -0.57 118.95 125.02 2g18 s ARG 163 Ca 0.20 -1.30 -0.30 0.00 -0.13 0.00 0.00 55.73 54.20 2g18 s ARG 163 Cb 0.07 -3.56 -0.06 0.00 -1.56 0.00 0.00 34.95 29.83 2g18 s ARG 163 CO -0.00 -0.78 1.55 -2.14 -0.81 0.00 0.00 175.30 173.12 2g18 s PRO 164 N 1.39 4.22 -0.06 5.12 0.02 -1.26 -4.37 135.00 140.07 2g18 s PRO 164 Ca 0.00 2.13 -0.03 0.00 0.02 0.00 0.00 61.00 63.12 2g18 s PRO 164 Cb -0.21 -3.71 -0.27 0.00 0.02 0.00 0.00 34.50 30.33 2g18 s PRO 164 CO 0.02 -0.71 0.60 0.66 -0.33 0.00 0.00 177.00 177.25 2g18 h SER 165 N 8.50 0.38 -1.83 2.53 4.64 -1.95 -3.45 113.55 122.38 2g18 h SER 165 Ca -0.39 -0.69 -0.61 0.00 -0.47 0.00 0.00 61.79 59.63 2g18 h SER 165 Cb 1.18 -0.12 -0.12 0.00 -0.31 0.00 0.00 62.40 63.02 2g18 h SER 165 CO 0.93 1.60 -0.63 -0.94 -0.87 0.00 0.00 176.83 176.92 2g18 s SER 166 N -6.92 3.93 0.32 4.97 1.04 -1.26 -5.03 113.70 110.75 2g18 s SER 166 Ca -0.15 -1.19 0.26 0.00 0.48 0.00 0.00 55.95 55.35 2g18 s SER 166 Cb 0.07 -0.41 1.09 0.00 0.10 0.00 0.00 66.02 66.86 2g18 s SER 166 CO 0.82 -0.31 1.77 -0.65 0.98 0.00 0.00 173.24 175.85 2g18 h PRO 167 N 1.86 0.00 -0.09 4.02 0.11 -1.99 -2.30 132.00 133.61 2g18 h PRO 167 Ca -0.43 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.51 2g18 h PRO 167 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2g18 h PRO 167 CO 0.73 0.00 -0.69 1.05 -0.21 0.00 0.00 178.00 178.88 2g18 h GLU 168 N 0.00 0.41 -0.45 1.05 9.09 -1.99 -2.42 114.58 120.26 2g18 h GLU 168 Ca 0.00 -0.31 -0.13 0.00 0.05 0.00 0.00 59.36 58.97 2g18 h GLU 168 Cb 0.37 0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.51 2g18 h GLU 168 CO 0.00 0.94 -0.22 0.93 0.05 0.00 0.00 179.01 180.71 2g18 h GLU 169 N 0.28 0.94 -0.88 1.06 5.08 -1.90 -0.16 114.58 119.00 2g18 h GLU 169 Ca -0.02 -0.41 0.10 0.00 -1.00 0.00 0.00 59.36 58.03 2g18 h GLU 169 Cb 1.25 -0.03 -0.08 0.00 0.50 0.00 0.00 28.75 30.40 2g18 h GLU 169 CO 0.12 1.08 0.52 0.93 -1.00 0.00 0.00 179.01 180.66 2g18 h GLU 170 N 0.78 0.84 0.00 2.33 5.08 -1.42 0.14 114.58 122.33 2g18 h GLU 170 Ca 0.10 -0.05 -0.20 0.00 -1.00 0.00 0.00 59.36 58.21 2g18 h GLU 170 Cb 0.79 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2g18 h GLU 170 CO 0.07 0.56 -0.88 0.00 -1.00 0.00 0.00 179.01 177.76 2g18 h ALA 171 N 1.48 0.51 -0.43 3.43 0.00 -1.21 -1.81 119.26 121.23 2g18 h ALA 171 Ca 0.43 -0.72 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2g18 h ALA 171 Cb 0.39 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2g18 h ALA 171 CO -0.25 0.91 0.24 0.52 0.00 0.00 0.00 179.25 180.68 2g18 h MET 172 N 0.11 0.60 -0.26 0.00 2.86 -0.34 -0.76 114.93 117.15 2g18 h MET 172 Ca -0.04 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 2g18 h MET 172 Cb 1.51 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 33.04 2g18 h MET 172 CO 0.13 0.47 0.10 0.35 1.06 0.00 0.00 176.91 179.03 2g18 h PHE 173 N 0.56 0.39 -0.84 -0.22 3.57 -0.67 -1.41 116.94 118.32 2g18 h PHE 173 Ca 0.15 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 2g18 h PHE 173 Cb 0.04 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 2g18 h PHE 173 CO -0.02 0.41 0.40 1.25 -2.23 0.00 0.00 178.31 178.11 2g18 h LEU 174 N 0.26 1.11 -1.06 0.59 5.85 -1.28 -1.27 115.31 119.51 2g18 h LEU 174 Ca 0.08 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 2g18 h LEU 174 Cb 0.18 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2g18 h LEU 174 CO -0.01 0.94 0.18 1.23 -0.34 0.00 0.00 178.44 180.44 2g18 h GLY 175 N 1.21 0.91 1.11 3.75 0.00 -0.92 -1.48 103.07 107.65 2g18 h GLY 175 Ca 0.29 -0.50 -0.21 0.00 0.00 0.00 0.00 47.33 46.92 2g18 h GLY 175 CO -0.04 0.47 -0.73 -0.09 0.00 0.00 0.00 176.54 176.15 2g18 h ARG 176 N 0.83 0.74 -0.54 4.80 9.65 -0.87 -2.13 114.38 126.86 2g18 h ARG 176 Ca 0.19 -0.61 0.05 0.00 -1.10 0.00 0.00 59.98 58.51 2g18 h ARG 176 Cb 0.24 0.13 -0.05 0.00 -1.39 0.00 0.00 29.97 28.90 2g18 h ARG 176 CO -0.01 1.22 0.28 0.28 2.80 0.00 0.00 179.97 184.54 2g18 h VAL 177 N 0.45 0.95 -0.65 0.20 2.07 -1.05 -0.90 116.25 117.32 2g18 h VAL 177 Ca -0.05 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.32 2g18 h VAL 177 Cb 1.37 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 2g18 h VAL 177 CO 0.15 0.10 0.39 -0.09 0.02 0.00 0.00 177.57 178.14 2g18 h ARG 178 N 0.53 0.74 -0.64 1.57 2.43 -1.19 -0.58 114.38 117.26 2g18 h ARG 178 Ca 0.24 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.38 2g18 h ARG 178 Cb 0.15 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 29.49 2g18 h ARG 178 CO -0.17 0.49 0.41 0.93 -1.51 0.00 0.00 179.97 180.13 2g18 h GLU 179 N 0.77 0.80 -0.40 0.20 5.08 -0.72 -0.42 114.58 119.89 2g18 h GLU 179 Ca 0.27 -0.05 0.05 0.00 -1.00 0.00 0.00 59.36 58.63 2g18 h GLU 179 Cb 0.05 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.07 2g18 h GLU 179 CO -0.12 0.53 0.14 0.74 -1.00 0.00 0.00 179.01 179.30 2g18 h PHE 180 N 0.83 0.24 -0.81 4.33 -1.00 -0.29 -1.08 116.94 119.17 2g18 h PHE 180 Ca 0.24 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 61.01 2g18 h PHE 180 Cb -0.05 -0.05 -0.04 0.00 3.61 0.00 0.00 35.95 39.42 2g18 h PHE 180 CO -0.04 0.09 0.39 -0.07 -1.61 0.00 0.00 178.31 177.07 2g18 h LEU 181 N 0.30 1.06 -0.42 1.54 3.38 -0.66 -0.37 115.31 120.13 2g18 h LEU 181 Ca 0.18 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 2g18 h LEU 181 Cb 0.17 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2g18 h LEU 181 CO -0.19 0.90 -0.11 1.56 0.09 0.00 0.00 178.44 180.68 2g18 h GLN 182 N 1.14 0.82 -0.77 1.13 4.20 -0.59 0.83 115.11 121.86 2g18 h GLN 182 Ca 0.28 -0.32 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 2g18 h GLN 182 Cb 0.12 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.82 2g18 h GLN 182 CO -0.03 0.94 0.39 0.28 -0.67 0.00 0.00 178.83 179.74 2g18 h VAL 183 N 0.64 1.24 -0.28 -0.54 2.07 -1.09 -2.26 116.25 116.02 2g18 h VAL 183 Ca 0.10 -0.64 -0.15 0.00 0.82 0.00 0.00 66.70 66.84 2g18 h VAL 183 Cb 0.65 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2g18 h VAL 183 CO 0.04 0.28 -0.42 -0.74 0.02 0.00 0.00 177.57 176.75 2g18 h HIS 184 N 1.08 0.83 -0.24 1.57 -0.00 -0.65 -0.47 115.15 117.27 2g18 h HIS 184 Ca 0.27 -0.25 -0.15 0.00 -0.00 0.00 0.00 60.37 60.23 2g18 h HIS 184 Cb 0.08 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 27.31 2g18 h HIS 184 CO 0.01 1.00 -0.48 0.00 -0.00 0.00 0.00 177.93 178.46 2g18 h GLN 186 N 0.51 0.71 -0.50 0.00 4.20 -1.27 -1.94 115.11 116.82 2g18 h GLN 186 Ca 0.03 -0.12 0.06 0.00 0.06 0.00 0.00 58.65 58.68 2g18 h GLN 186 Cb 1.02 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 28.63 2g18 h GLN 186 CO 0.10 0.62 0.21 0.78 -0.67 0.00 0.00 178.83 179.87 2g18 h GLY 187 N 0.64 0.68 0.98 3.46 0.00 -0.83 -1.83 103.07 106.17 2g18 h GLY 187 Ca 0.16 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 2g18 h GLY 187 CO -0.02 0.06 0.27 0.00 0.00 0.00 0.00 176.54 176.85 2g18 h ALA 188 N 1.30 0.71 0.00 3.60 0.00 -0.82 -2.29 119.26 121.76 2g18 h ALA 188 Ca 0.23 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 2g18 h ALA 188 Cb 0.19 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2g18 h ALA 188 CO -0.20 0.28 -0.63 0.82 0.00 0.00 0.00 179.25 179.52 2g18 h ILE 189 N 0.75 1.44 0.00 0.00 2.04 -1.12 -2.87 117.51 117.75 2g18 h ILE 189 Ca 0.19 -2.17 0.00 0.00 1.00 0.00 0.00 64.86 63.88 2g18 h ILE 189 Cb 0.12 2.17 0.00 0.00 -0.74 0.00 0.00 36.82 38.37 2g18 h ILE 189 CO -0.02 0.62 -0.10 0.00 0.00 0.00 0.00 178.15 178.65 2g18 n ALA 190 N -2.41 2.45 -1.86 1.87 0.00 -0.71 -4.95 120.51 114.90 2g18 n ALA 190 Ca -0.01 -0.10 -0.40 0.00 0.00 0.00 0.00 53.44 52.93 2g18 n ALA 190 Cb 0.63 -1.42 -0.05 0.00 0.00 0.00 0.00 19.45 18.62 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 -3.06 3.37 0.09 0.00 0.00 -0.88 -5.05 121.76 116.23 2g18 s ALA 191 Ca 0.12 0.78 0.03 0.00 0.00 0.00 0.00 51.96 52.89 2g18 s ALA 191 Cb 0.15 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 2g18 s ALA 191 CO 0.59 -0.06 0.11 -1.12 0.00 0.00 0.00 175.76 175.27 2g18 s SER 192 N -0.73 5.65 0.35 0.00 0.01 -1.26 -5.05 113.70 112.66 2g18 s SER 192 Ca 0.45 0.01 -0.28 0.00 1.31 0.00 0.00 55.95 57.44 2g18 s SER 192 Cb -0.29 -1.55 -0.12 0.00 0.21 0.00 0.00 66.02 64.27 2g18 s SER 192 CO 0.36 0.16 1.32 -2.65 0.41 0.00 0.00 173.24 172.84 2g18 n PRO 193 N 0.32 2.20 -2.65 12.44 -0.02 -1.26 -4.63 135.00 141.40 2g18 n PRO 193 Ca -0.08 0.77 -0.23 0.00 -2.02 0.00 0.00 63.50 61.95 2g18 n PRO 193 Cb 0.52 -2.38 0.03 0.00 -0.02 0.00 0.00 33.50 31.65 2g18 n PRO 193 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2g18 s VAL 194 N -1.10 3.03 0.79 -1.45 -7.23 0.05 -5.04 120.40 109.45 2g18 s VAL 194 Ca 0.55 -0.52 -0.12 0.00 -1.81 0.00 0.00 61.98 60.09 2g18 s VAL 194 Cb -0.55 -3.16 0.07 0.00 0.56 0.00 0.00 36.38 33.30 2g18 s VAL 194 CO 0.62 -0.12 1.12 -0.94 -0.31 0.00 0.00 175.10 175.47 2g18 s SER 195 N -4.38 4.17 0.28 4.85 1.04 -1.26 -4.82 113.70 113.58 2g18 s SER 195 Ca 0.55 2.00 0.01 0.00 0.48 0.00 0.00 55.95 58.99 2g18 s SER 195 Cb -0.10 -2.54 0.67 0.00 0.10 0.00 0.00 66.02 64.15 2g18 s SER 195 CO 0.40 -2.26 1.66 0.00 0.98 0.00 0.00 173.24 174.01 2g18 h ALA 196 N -1.04 1.25 0.77 5.32 0.00 -1.99 -0.51 119.26 123.06 2g18 h ALA 196 Ca -0.44 0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 2g18 h ALA 196 Cb 1.25 0.28 0.01 0.00 0.00 0.00 0.00 17.79 19.32 2g18 h ALA 196 CO 0.49 -0.43 -0.37 0.93 0.00 0.00 0.00 179.25 179.88 2g18 h GLU 197 N 0.25 -0.99 -0.67 0.00 5.08 -2.00 -1.53 114.58 114.72 2g18 h GLU 197 Ca 0.53 0.07 0.12 0.00 -1.00 0.00 0.00 59.36 59.08 2g18 h GLU 197 Cb 1.04 0.23 -0.09 0.00 0.50 0.00 0.00 28.75 30.43 2g18 h GLU 197 CO -0.61 -0.66 0.21 1.96 -1.00 0.00 0.00 179.01 178.91 2g18 h GLN 198 N -1.05 0.34 -0.30 2.33 4.20 -1.86 -1.96 115.11 116.82 2g18 h GLN 198 Ca -0.11 -0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.64 2g18 h GLN 198 Cb 0.79 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 28.44 2g18 h GLN 198 CO 0.17 0.23 -0.06 -0.22 -0.67 0.00 0.00 178.83 178.28 2g18 h LYS 199 N 0.35 0.01 -0.74 1.46 3.64 -0.73 0.59 116.57 121.16 2g18 h LYS 199 Ca 0.36 -0.00 0.15 0.00 -1.27 0.00 0.00 60.65 59.89 2g18 h LYS 199 Cb 0.53 -0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.21 2g18 h LYS 199 CO -0.40 0.01 -0.18 1.96 -2.27 0.00 0.00 179.45 178.57 2g18 h GLN 200 N 0.01 0.00 -0.55 1.90 1.08 -0.54 0.26 115.11 117.27 2g18 h GLN 200 Ca 0.14 -0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.27 2g18 h GLN 200 Cb 0.21 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 2g18 h GLN 200 CO -0.30 0.00 0.07 1.96 -0.95 0.00 0.00 178.83 179.61 2g18 h GLN 201 N 0.00 0.90 -0.10 1.46 4.20 -0.52 -2.41 115.11 118.64 2g18 h GLN 201 Ca 0.35 -0.23 -0.12 0.00 0.06 0.00 0.00 58.65 58.72 2g18 h GLN 201 Cb 0.54 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.21 2g18 h GLN 201 CO -0.76 0.85 -0.39 0.82 -0.67 0.00 0.00 178.83 178.69 2g18 h ILE 202 N 0.85 1.39 -0.33 2.54 2.04 0.13 -1.20 117.51 122.93 2g18 h ILE 202 Ca 0.17 -1.73 0.07 0.00 1.00 0.00 0.00 64.86 64.37 2g18 h ILE 202 Cb 0.41 2.20 -0.07 0.00 -0.74 0.00 0.00 36.82 38.62 2g18 h ILE 202 CO 0.01 0.51 -0.15 0.25 0.00 0.00 0.00 178.15 178.78 2g18 h LEU 203 N 0.01 -0.50 -0.31 1.44 5.85 -0.55 -0.89 115.31 120.36 2g18 h LEU 203 Ca -0.02 0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.87 2g18 h LEU 203 Cb 1.02 0.28 -0.04 0.00 0.37 0.00 0.00 40.66 42.29 2g18 h LEU 203 CO 0.08 -0.18 0.05 0.00 -0.34 0.00 0.00 178.44 178.05 2g18 h ALA 204 N 1.18 0.32 -0.32 1.25 0.00 -1.31 0.11 119.26 120.48 2g18 h ALA 204 Ca 0.17 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.19 2g18 h ALA 204 Cb 0.35 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2g18 h ALA 204 CO -0.39 -0.36 0.06 0.78 0.00 0.00 0.00 179.25 179.34 2g18 h GLY 205 N 0.16 0.36 1.00 0.00 0.00 -0.66 0.74 103.07 104.67 2g18 h GLY 205 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2g18 h GLY 205 CO -0.20 -0.02 0.38 1.46 0.00 0.00 0.00 176.54 178.16 2g18 h GLN 206 N 0.17 0.80 -0.36 4.80 4.20 -0.93 -1.59 115.11 122.19 2g18 h GLN 206 Ca 0.15 -0.06 0.06 0.00 0.06 0.00 0.00 58.65 58.86 2g18 h GLN 206 Cb 0.17 -0.17 -0.05 0.00 0.30 0.00 0.00 27.48 27.72 2g18 h GLN 206 CO -0.21 0.55 0.03 1.25 -0.67 0.00 0.00 178.83 179.79 2g18 h HIS 207 N 0.81 0.04 -0.82 2.96 2.76 -0.24 0.62 115.15 121.29 2g18 h HIS 207 Ca 0.22 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.37 2g18 h HIS 207 Cb -0.06 0.03 -0.04 0.00 1.55 0.00 0.00 27.41 28.90 2g18 h HIS 207 CO -0.03 -0.03 0.34 -0.97 -1.30 0.00 0.00 177.93 175.95 2g18 h ASN 208 N 0.14 1.11 -0.37 3.26 -0.73 -0.61 -0.64 115.58 117.74 2g18 h ASN 208 Ca 0.17 -0.16 -0.05 0.00 1.87 0.00 0.00 56.30 58.13 2g18 h ASN 208 Cb 0.22 -0.29 -0.01 0.00 0.27 0.00 0.00 38.32 38.51 2g18 h ASN 208 CO -0.26 0.97 0.05 0.22 -0.37 0.00 0.00 177.43 178.04 2g18 h TYR 209 N 1.18 0.67 -0.39 0.67 3.20 -0.58 -2.17 116.97 119.55 2g18 h TYR 209 Ca 0.27 -0.10 -0.13 0.00 3.14 0.00 0.00 58.73 61.92 2g18 h TYR 209 Cb 0.19 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 2g18 h TYR 209 CO 0.02 0.68 -0.25 0.00 -1.64 0.00 0.00 178.16 176.96 2g18 h SER 211 N 0.66 0.76 -0.88 0.00 4.64 -1.07 -0.39 113.55 117.27 2g18 h SER 211 Ca 0.08 -0.32 -0.01 0.00 -0.47 0.00 0.00 61.79 61.06 2g18 h SER 211 Cb 0.83 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.67 2g18 h SER 211 CO 0.07 0.90 0.50 0.11 -0.87 0.00 0.00 176.83 177.54 2g18 h LYS 212 N 0.60 1.21 -0.40 4.77 1.79 -1.41 0.01 116.57 123.13 2g18 h LYS 212 Ca 0.12 -0.13 -0.13 0.00 -2.18 0.00 0.00 60.65 58.33 2g18 h LYS 212 Cb 0.53 -0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 30.92 2g18 h LYS 212 CO 0.03 0.87 -0.27 1.96 -1.08 0.00 0.00 179.45 180.96 2g18 h GLN 213 N 1.22 0.84 -0.19 3.15 1.08 -1.18 -2.31 115.11 117.73 2g18 h GLN 213 Ca 0.31 -0.37 -0.01 0.00 -1.45 0.00 0.00 58.65 57.13 2g18 h GLN 213 Cb -0.00 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 2g18 h GLN 213 CO -0.05 1.01 0.08 1.96 -0.95 0.00 0.00 178.83 180.88 2g18 h GLN 214 N 0.72 0.28 0.00 1.46 4.20 -0.53 0.23 115.11 121.47 2g18 h GLN 214 Ca 0.09 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 2g18 h GLN 214 Cb 0.81 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.55 2g18 h GLN 214 CO 0.07 0.34 -0.01 1.96 -0.67 0.00 0.00 178.83 180.51 2g18 h GLN 215 N 0.16 0.00 0.00 1.46 4.20 -0.86 -3.36 115.11 116.70 2g18 h GLN 215 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2g18 h GLN 215 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 2g18 h GLN 215 CO -0.01 0.01 -0.44 0.09 -0.67 0.00 0.00 178.83 177.81 2g18 n ASN 216 N -3.98 2.21 -4.72 1.46 3.02 -0.88 -5.05 115.26 107.33 2g18 n ASN 216 Ca -0.03 -0.05 -0.43 0.00 -0.03 0.00 0.00 54.58 54.04 2g18 n ASN 216 Cb 0.10 0.55 -0.02 0.00 -0.61 0.00 0.00 39.78 39.80 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 -0.77 3.52 0.01 6.41 -0.08 0.76 -4.90 116.55 121.50 2g18 n ASP 217 Ca 0.00 1.13 0.13 0.00 -1.51 0.00 0.00 54.79 54.54 2g18 n ASP 217 Cb 0.00 -1.54 0.39 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 2.35 0.03 0.28 -0.67 5.02 -1.26 -3.44 118.16 120.46 2g18 n LYS 218 Ca 0.10 0.01 0.15 0.00 -2.02 0.00 0.00 58.31 56.55 2g18 n LYS 218 Cb 0.35 -1.52 0.82 0.00 -0.02 0.00 0.00 35.03 34.65 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 0.00 0.45 -0.73 -0.18 1.35 -1.99 -2.86 112.91 108.97 2g18 h THR 219 Ca 0.00 -0.37 0.15 0.00 -0.55 0.00 0.00 66.41 65.64 2g18 h THR 219 Cb 0.53 1.25 -0.13 0.00 -1.73 0.00 0.00 68.15 68.07 2g18 h THR 219 CO 0.00 0.07 -0.12 -0.09 -0.25 0.00 0.00 175.52 175.13 2g18 h ARG 220 N 0.00 0.03 -0.45 4.72 2.43 -1.95 -0.48 114.38 118.68 2g18 h ARG 220 Ca -0.00 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2g18 h ARG 220 Cb 0.25 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 2g18 h ARG 220 CO 0.01 0.02 0.18 -0.09 -1.51 0.00 0.00 179.97 178.58 2g18 h ARG 221 N 0.03 0.68 -0.49 0.20 2.43 -1.78 0.14 114.38 115.58 2g18 h ARG 221 Ca 0.36 -0.12 0.07 0.00 -0.81 0.00 0.00 59.98 59.48 2g18 h ARG 221 Cb 0.59 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 29.97 2g18 h ARG 221 CO -0.71 0.62 0.16 0.28 -1.51 0.00 0.00 179.97 178.80 2g18 h VAL 222 N 0.59 0.80 -0.25 0.20 2.07 -1.54 -2.20 116.25 115.91 2g18 h VAL 222 Ca 0.15 -0.11 -0.12 0.00 0.82 0.00 0.00 66.70 67.44 2g18 h VAL 222 Cb 0.20 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2g18 h VAL 222 CO -0.01 0.06 -0.33 -0.07 0.02 0.00 0.00 177.57 177.23 2g18 h LEU 223 N 0.32 0.56 -0.48 2.57 3.38 -0.16 -2.15 115.31 119.35 2g18 h LEU 223 Ca 0.24 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2g18 h LEU 223 Cb 0.27 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2g18 h LEU 223 CO -0.26 0.85 0.14 -0.33 0.09 0.00 0.00 178.44 178.93 2g18 h GLU 224 N 0.46 0.76 0.00 1.13 5.08 -0.54 -0.46 114.58 121.01 2g18 h GLU 224 Ca 0.05 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.17 2g18 h GLU 224 Cb 0.80 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 2g18 h GLU 224 CO 0.07 0.73 -0.33 0.87 -1.00 0.00 0.00 179.01 179.34 2g18 h LYS 225 N 0.65 0.00 0.23 2.33 1.57 -1.15 0.24 116.57 120.43 2g18 h LYS 225 Ca 0.15 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.63 2g18 h LYS 225 Cb 0.29 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.64 2g18 h LYS 225 CO -0.00 0.33 -1.37 0.00 -0.57 0.00 0.00 179.45 177.84 2g18 h ALA 226 N 1.67 -0.13 0.00 3.86 0.00 -1.11 -3.43 119.26 120.12 2g18 h ALA 226 Ca -0.00 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.06 2g18 h ALA 226 Cb 0.61 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2g18 h ALA 226 CO 0.04 0.65 0.00 1.19 0.00 0.00 0.00 179.25 181.13 2g18 n PHE 227 N -3.80 0.00 0.00 0.00 3.01 -0.20 -4.73 117.46 111.74 2g18 n PHE 227 Ca -0.17 -0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.29 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 -0.00 1.24 0.17 1.37 0.00 0.82 -4.51 105.19 104.27 2g18 n GLY 228 Ca 0.00 -1.90 -0.12 0.00 0.00 0.00 0.00 46.02 44.00 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 1.30 -0.47 1.61 2.07 -1.90 -2.49 116.25 116.37 2g18 h VAL 229 Ca 0.00 -1.16 -0.13 0.00 0.82 0.00 0.00 66.70 66.23 2g18 h VAL 229 Cb 0.00 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2g18 h VAL 229 CO 0.00 0.36 -0.22 0.44 0.02 0.00 0.00 177.57 178.17 2g18 h ASP 230 N 0.22 1.00 -0.31 0.57 5.19 -1.97 0.62 116.42 121.75 2g18 h ASP 230 Ca 0.06 -0.40 0.00 0.00 -0.62 0.00 0.00 57.03 56.07 2g18 h ASP 230 Cb 0.59 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.81 2g18 h ASP 230 CO 0.03 1.18 0.20 -0.25 -3.12 0.00 0.00 179.24 177.28 2g18 h TRP 231 N 0.82 0.40 -0.79 4.55 7.01 -1.78 0.85 115.95 127.01 2g18 h TRP 231 Ca 0.11 0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.07 2g18 h TRP 231 Cb 0.80 -0.13 -0.04 0.00 -2.10 0.00 0.00 29.16 27.69 2g18 h TRP 231 CO 0.05 0.26 0.34 0.00 -2.79 0.00 0.00 178.44 176.31 2g18 h ALA 232 N 1.10 1.10 -0.11 2.65 0.00 -1.21 -0.82 119.26 121.97 2g18 h ALA 232 Ca 0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2g18 h ALA 232 Cb -0.03 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 2g18 h ALA 232 CO -0.02 0.65 0.04 1.49 0.00 0.00 0.00 179.25 181.41 2g18 h GLU 233 N 1.14 0.17 -0.97 0.00 4.57 -0.22 -1.37 114.58 117.90 2g18 h GLU 233 Ca 0.27 -0.03 0.04 0.00 -1.18 0.00 0.00 59.36 58.45 2g18 h GLU 233 Cb 0.18 -0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 28.69 2g18 h GLU 233 CO -0.03 0.28 0.63 -0.97 -1.18 0.00 0.00 179.01 177.75 2g18 h ASN 234 N 0.03 1.05 -0.18 1.04 -0.73 -0.66 -1.94 115.58 114.19 2g18 h ASN 234 Ca 0.04 -0.01 -0.03 0.00 1.87 0.00 0.00 56.30 58.16 2g18 h ASN 234 Cb 0.17 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.51 2g18 h ASN 234 CO -0.00 0.72 -0.02 0.22 -0.37 0.00 0.00 177.43 177.98 2g18 h TYR 235 N 1.22 0.36 -0.71 0.67 3.20 -0.89 -0.79 116.97 120.03 2g18 h TYR 235 Ca 0.39 -0.07 0.08 0.00 3.14 0.00 0.00 58.73 62.26 2g18 h TYR 235 Cb 0.01 -0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.13 2g18 h TYR 235 CO -0.00 0.56 0.38 0.52 -1.64 0.00 0.00 178.16 177.97 2g18 h MET 236 N 0.05 0.65 0.00 1.82 2.86 -1.00 -0.27 114.93 119.04 2g18 h MET 236 Ca 0.05 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2g18 h MET 236 Cb 0.43 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.94 2g18 h MET 236 CO 0.01 0.43 -0.77 1.79 1.06 0.00 0.00 176.91 179.43 2g18 h THR 237 N 0.67 0.00 0.00 2.22 1.35 -1.25 -0.62 112.91 115.29 2g18 h THR 237 Ca 0.33 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 2g18 h THR 237 Cb 0.27 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.14 2g18 h THR 237 CO -0.22 0.00 -0.96 0.35 -0.25 0.00 0.00 175.52 174.44 2g18 n THR 238 N -2.58 0.00 -0.06 6.82 -2.24 -0.31 -3.65 114.28 112.26 2g18 n THR 238 Ca 0.01 -0.09 -0.12 0.00 -2.27 0.00 0.00 64.05 61.58 2g18 n THR 238 Cb 0.52 0.52 -0.05 0.00 -2.10 0.00 0.00 70.33 69.23 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 -1.50 0.66 -0.09 2.28 0.31 -0.16 -4.68 118.33 115.16 2g18 n VAL 239 Ca -0.00 -0.19 -0.18 0.00 -0.01 0.00 0.00 64.34 63.97 2g18 n VAL 239 Cb 0.04 -1.51 -0.12 0.00 -0.91 0.00 0.00 33.84 31.34 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 -0.35 0.00 -5.57 7.52 3.38 -1.52 -3.43 115.31 115.34 2g18 h LEU 240 Ca -0.30 -0.70 -0.50 0.00 0.09 0.00 0.00 57.88 56.47 2g18 h LEU 240 Cb 1.29 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.64 2g18 h LEU 240 CO -0.16 1.24 -1.02 0.49 0.09 0.00 0.00 178.44 179.09 2g18 n PHE 241 N -4.52 1.58 -2.36 1.13 3.72 -0.24 -5.01 117.46 111.76 2g18 n PHE 241 Ca -0.21 -3.68 -0.41 0.00 -0.05 0.00 0.00 57.45 53.10 2g18 n PHE 241 Cb 0.57 -0.41 -0.03 0.00 -0.94 0.00 0.00 39.48 38.67 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 -2.88 7.09 0.31 4.37 -4.77 -1.24 -4.72 116.67 114.82 2g18 s ASP 242 Ca 0.41 2.33 -0.29 0.00 -3.30 0.00 0.00 52.55 51.70 2g18 s ASP 242 Cb 0.35 -2.62 -0.10 0.00 -1.09 0.00 0.00 42.92 39.46 2g18 s ASP 242 CO -0.09 -0.33 1.39 -0.76 0.70 0.00 0.00 175.17 176.09 2g18 s LEU 243 N -0.89 4.39 0.33 2.11 1.43 -1.26 -4.91 118.68 119.88 2g18 s LEU 243 Ca 0.50 2.75 0.08 0.00 -1.03 0.00 0.00 54.13 56.42 2g18 s LEU 243 Cb -0.34 -3.64 0.79 0.00 0.03 0.00 0.00 46.19 43.03 2g18 s LEU 243 CO 0.41 -0.66 1.81 1.55 0.23 0.00 0.00 176.35 179.69 2g18 h PRO 244 N 3.95 0.70 0.00 1.29 0.13 -1.92 -3.52 132.00 132.63 2g18 h PRO 244 Ca -0.48 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2g18 h PRO 244 Cb 1.22 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2g18 h PRO 244 CO 0.70 0.46 0.00 -1.91 -0.23 0.00 0.00 178.00 177.02