#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 4.13 0.47 9.51 0.01 -1.26 -5.10 113.70 121.46 2g18 s SER 2 Ca 0.00 -2.92 0.03 0.00 1.31 0.00 0.00 55.95 54.37 2g18 s SER 2 Cb 0.00 -1.47 -0.03 0.00 0.21 0.00 0.00 66.02 64.73 2g18 s SER 2 CO 0.00 -0.24 0.02 -1.48 0.41 0.00 0.00 173.24 171.95 2g18 s LEU 3 N -0.13 2.39 0.01 2.44 0.05 -1.26 -5.16 118.68 117.01 2g18 s LEU 3 Ca 0.17 -1.58 -0.02 0.00 0.05 0.00 0.00 54.13 52.76 2g18 s LEU 3 Cb -0.25 -0.68 -0.01 0.00 -2.05 0.00 0.00 46.19 43.20 2g18 s LEU 3 CO -0.00 -0.76 0.02 -0.89 -0.55 0.00 0.00 176.35 174.17 2g18 s THR 4 N -2.90 0.07 -0.32 5.48 2.01 -1.26 -5.12 115.64 113.61 2g18 s THR 4 Ca 0.16 -0.59 -0.16 0.00 0.31 0.00 0.00 61.69 61.41 2g18 s THR 4 Cb 0.04 -0.22 -0.02 0.00 0.01 0.00 0.00 72.50 72.31 2g18 s THR 4 CO 0.08 -0.32 0.44 -0.94 -0.69 0.00 0.00 174.62 173.19 2g18 s SER 5 N -0.98 6.28 0.14 3.53 1.04 -1.26 -5.06 113.70 117.38 2g18 s SER 5 Ca -0.11 0.06 0.09 0.00 0.48 0.00 0.00 55.95 56.47 2g18 s SER 5 Cb -0.07 -2.24 -0.04 0.00 0.10 0.00 0.00 66.02 63.78 2g18 s SER 5 CO -0.00 -0.35 -0.21 0.27 0.98 0.00 0.00 173.24 173.93 2g18 s ILE 6 N 2.21 1.90 0.47 -1.02 -4.36 -1.26 -5.12 121.20 114.01 2g18 s ILE 6 Ca 0.16 -1.78 -0.24 0.00 -0.26 0.00 0.00 60.65 58.53 2g18 s ILE 6 Cb -0.16 -1.79 -0.07 0.00 1.25 0.00 0.00 42.46 41.68 2g18 s ILE 6 CO 0.12 -0.15 1.38 -2.84 0.24 0.00 0.00 174.94 173.69 2g18 s PRO 7 N -2.38 3.59 0.36 0.37 0.02 -1.26 -4.94 135.00 130.77 2g18 s PRO 7 Ca 0.13 2.32 -0.27 0.00 0.02 0.00 0.00 61.00 63.19 2g18 s PRO 7 Cb -0.08 -2.56 -0.10 0.00 0.02 0.00 0.00 34.50 31.78 2g18 s PRO 7 CO 0.06 -0.86 1.28 0.45 -0.33 0.00 0.00 177.00 177.60 2g18 s SER 8 N -0.68 6.62 0.56 2.53 0.15 -1.26 -4.90 113.70 116.72 2g18 s SER 8 Ca 0.63 2.62 0.29 0.00 0.70 0.00 0.00 55.95 60.20 2g18 s SER 8 Cb -0.42 -2.64 1.46 0.00 -1.71 0.00 0.00 66.02 62.72 2g18 s SER 8 CO 0.52 -0.64 1.91 0.25 1.20 0.00 0.00 173.24 176.48 2g18 h LEU 9 N 3.09 0.00 -2.74 3.45 5.85 -1.98 -2.54 115.31 120.43 2g18 h LEU 9 Ca -0.49 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.23 2g18 h LEU 9 Cb 1.23 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.26 2g18 h LEU 9 CO 0.64 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 0.30 114.38 114.07 2g18 h ARG 10 Ca 0.31 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.35 2g18 h ARG 10 Cb 1.38 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.45 2g18 h ARG 10 CO -0.00 0.01 -0.16 0.93 0.10 0.00 0.00 179.97 180.84 2g18 h GLU 11 N 0.00 0.00 -0.06 0.08 4.39 -1.84 -2.69 114.58 114.46 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 0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2g18 h GLU 11 CO 0.00 0.16 0.00 1.04 -1.16 0.00 0.00 179.01 179.05 2g18 n GLN 12 N -3.37 1.93 -3.63 2.33 6.02 0.09 -4.99 117.38 115.77 2g18 n GLN 12 Ca -0.00 -1.36 -0.20 0.00 -0.01 0.00 0.00 57.00 55.43 2g18 n GLN 12 Cb 0.37 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 30.13 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 -1.95 2.73 0.18 -1.09 -0.21 -1.01 -5.05 119.66 113.26 2g18 s GLN 13 Ca 0.34 -1.32 -0.31 0.00 0.02 0.00 0.00 55.36 54.10 2g18 s GLN 13 Cb 0.20 -2.52 -0.17 0.00 1.00 0.00 0.00 33.01 31.53 2g18 s GLN 13 CO 0.32 -0.02 0.82 1.58 -2.12 0.00 0.00 175.29 175.87 2g18 n HIS 14 N -1.50 0.37 -0.09 0.91 -0.00 -1.26 -4.71 115.22 108.94 2g18 n HIS 14 Ca 0.01 0.88 0.10 0.00 -0.00 0.00 0.00 57.72 58.70 2g18 n HIS 14 Cb 0.60 -2.10 0.47 0.00 -0.00 0.00 0.00 29.99 28.96 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 1.96 0.47 -0.13 1.57 0.11 -1.96 -1.16 132.00 132.85 2g18 h PRO 15 Ca -0.37 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.60 2g18 h PRO 15 Cb 1.40 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 2g18 h PRO 15 CO 0.61 0.31 -0.44 1.25 -0.21 0.00 0.00 178.00 179.53 2g18 h LEU 16 N 0.48 0.34 -0.14 2.35 5.85 -1.99 -0.35 115.31 121.85 2g18 h LEU 16 Ca 0.26 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2g18 h LEU 16 Cb 0.41 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 2g18 h LEU 16 CO -0.08 0.73 -0.01 0.40 -0.34 0.00 0.00 178.44 179.15 2g18 h ILE 17 N 0.26 1.27 -0.40 4.05 2.04 -1.58 0.16 117.51 123.31 2g18 h ILE 17 Ca 0.02 -0.89 0.07 0.00 1.00 0.00 0.00 64.86 65.06 2g18 h ILE 17 Cb 0.88 1.57 -0.06 0.00 -0.74 0.00 0.00 36.82 38.47 2g18 h ILE 17 CO 0.07 0.26 0.02 -0.09 0.00 0.00 0.00 178.15 178.41 2g18 h ARG 18 N -0.02 0.13 -0.48 2.37 1.12 -1.19 -0.12 114.38 116.19 2g18 h ARG 18 Ca 0.04 -0.01 -0.12 0.00 -1.11 0.00 0.00 59.98 58.78 2g18 h ARG 18 Cb 0.40 -0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 30.32 2g18 h ARG 18 CO 0.01 0.08 -0.17 1.96 -3.11 0.00 0.00 179.97 178.74 2g18 h GLN 19 N 0.13 0.97 -0.59 0.20 4.20 -0.88 -1.34 115.11 117.81 2g18 h GLN 19 Ca 0.20 -0.40 -0.04 0.00 0.06 0.00 0.00 58.65 58.47 2g18 h GLN 19 Cb 0.27 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 2g18 h GLN 19 CO -0.31 1.07 0.22 1.25 -0.67 0.00 0.00 178.83 180.38 2g18 h LEU 20 N 0.82 0.82 -0.37 1.46 5.85 -0.45 -0.81 115.31 122.63 2g18 h LEU 20 Ca 0.11 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 2g18 h LEU 20 Cb 0.75 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 2g18 h LEU 20 CO 0.06 0.78 0.15 0.00 -0.34 0.00 0.00 178.44 179.09 2g18 h ALA 21 N 1.07 0.48 -0.75 1.25 0.00 -0.85 0.12 119.26 120.58 2g18 h ALA 21 Ca 0.19 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2g18 h ALA 21 Cb 0.23 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2g18 h ALA 21 CO -0.01 0.07 0.33 -0.44 0.00 0.00 0.00 179.25 179.20 2g18 h ASP 22 N 0.45 1.02 -0.22 0.00 3.32 -1.09 -2.43 116.42 117.46 2g18 h ASP 22 Ca 0.12 -0.16 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 2g18 h ASP 22 Cb 0.18 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2g18 h ASP 22 CO -0.01 0.89 -0.08 0.00 -1.72 0.00 0.00 179.24 178.33 2g18 h ILE 24 N 0.17 0.76 -0.33 0.00 2.04 -0.71 -1.34 117.51 118.10 2g18 h ILE 24 Ca 0.05 -0.01 -0.08 0.00 1.00 0.00 0.00 64.86 65.82 2g18 h ILE 24 Cb 0.55 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 2g18 h ILE 24 CO 0.03 0.01 -0.14 -0.33 0.00 0.00 0.00 178.15 177.71 2g18 h GLU 25 N 0.03 0.58 -0.23 2.37 5.08 -1.28 -1.60 114.58 119.53 2g18 h GLU 25 Ca 0.13 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2g18 h GLU 25 Cb 0.19 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2g18 h GLU 25 CO -0.25 0.70 0.09 1.49 -1.00 0.00 0.00 179.01 180.04 2g18 h GLU 26 N 0.53 0.34 -0.52 2.33 4.81 -0.28 -1.61 114.58 120.19 2g18 h GLU 26 Ca 0.09 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.22 2g18 h GLU 26 Cb 0.55 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 2g18 h GLU 26 CO 0.03 0.40 0.16 0.28 -0.73 0.00 0.00 179.01 179.15 2g18 h VAL 27 N 0.21 1.23 -0.26 0.32 2.07 -1.00 -0.97 116.25 117.86 2g18 h VAL 27 Ca 0.08 -0.78 0.06 0.00 0.82 0.00 0.00 66.70 66.88 2g18 h VAL 27 Cb 0.19 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 30.65 2g18 h VAL 27 CO -0.01 0.29 -0.18 -0.50 0.02 0.00 0.00 177.57 177.19 2g18 h TRP 28 N 0.71 -0.46 -0.23 1.57 6.55 -1.18 -1.05 115.95 121.86 2g18 h TRP 28 Ca 0.17 0.03 -0.08 0.00 0.95 0.00 0.00 58.89 59.96 2g18 h TRP 28 Cb 0.28 0.24 -0.01 0.00 -0.86 0.00 0.00 29.16 28.81 2g18 h TRP 28 CO 0.02 -0.25 -0.21 0.45 -1.05 0.00 0.00 178.44 177.39 2g18 h HIS 29 N -0.17 0.45 -0.13 0.49 3.86 -1.06 0.35 115.15 118.95 2g18 h HIS 29 Ca 0.14 -0.08 -0.22 0.00 -1.16 0.00 0.00 60.37 59.04 2g18 h HIS 29 Cb 0.38 -0.12 0.01 0.00 1.06 0.00 0.00 27.41 28.74 2g18 h HIS 29 CO -0.35 0.60 -0.81 0.37 0.86 0.00 0.00 177.93 178.60 2g18 h GLN 30 N 0.37 0.73 0.00 2.45 4.15 -0.81 -3.38 115.11 118.63 2g18 h GLN 30 Ca 0.06 -0.62 -0.14 0.00 0.77 0.00 0.00 58.65 58.72 2g18 h GLN 30 Cb 0.58 0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.38 2g18 h GLN 30 CO 0.04 1.23 -2.07 0.72 -1.93 0.00 0.00 178.83 176.82 2g18 n HIS 31 N -3.91 0.00 -4.38 3.99 8.25 -0.43 -5.04 115.22 113.71 2g18 n HIS 31 Ca -0.07 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.14 2g18 n HIS 31 Cb 0.76 -0.65 -0.09 0.00 1.12 0.00 0.00 29.99 31.13 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 -4.81 2.93 -0.66 2.41 1.43 0.10 -5.01 118.68 115.08 2g18 s LEU 32 Ca -0.08 -1.04 -0.15 0.00 -1.03 0.00 0.00 54.13 51.83 2g18 s LEU 32 Cb 0.10 -1.28 0.17 0.00 0.03 0.00 0.00 46.19 45.21 2g18 s LEU 32 CO 0.81 -0.24 0.61 -0.62 0.23 0.00 0.00 176.35 177.14 2g18 s ASP 33 N -3.70 6.41 0.17 2.29 2.15 -1.26 -4.68 116.67 118.05 2g18 s ASP 33 Ca 0.34 -2.20 -0.19 0.00 0.43 0.00 0.00 52.55 50.94 2g18 s ASP 33 Cb 0.01 -2.20 -0.08 0.00 -0.30 0.00 0.00 42.92 40.35 2g18 s ASP 33 CO 0.19 -0.72 0.65 -0.76 -0.17 0.00 0.00 175.17 174.35 2g18 s LEU 34 N 0.95 4.40 0.13 -1.34 1.43 -1.26 -4.48 118.68 118.51 2g18 s LEU 34 Ca 0.10 1.31 0.05 0.00 -1.03 0.00 0.00 54.13 54.55 2g18 s LEU 34 Cb -0.21 -3.33 -0.04 0.00 0.03 0.00 0.00 46.19 42.64 2g18 s LEU 34 CO -0.02 0.12 -0.11 -0.44 0.23 0.00 0.00 176.35 176.13 2g18 s SER 35 N -1.51 1.76 0.61 2.29 0.01 -0.33 -4.97 113.70 111.55 2g18 s SER 35 Ca 0.38 -0.93 -0.17 0.00 1.31 0.00 0.00 55.95 56.54 2g18 s SER 35 Cb -0.17 -0.02 -0.03 0.00 0.21 0.00 0.00 66.02 66.01 2g18 s SER 35 CO 0.21 -0.28 1.14 -2.16 0.41 0.00 0.00 173.24 172.56 2g18 s PRO 36 N -3.33 2.99 -0.10 12.44 0.04 -1.26 -0.76 135.00 145.02 2g18 s PRO 36 Ca 0.13 1.58 -0.00 0.00 0.04 0.00 0.00 61.00 62.75 2g18 s PRO 36 Cb -0.00 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.61 2g18 s PRO 36 CO 0.01 -1.13 -0.06 -0.47 0.04 0.00 0.00 177.00 175.39 2g18 s TYR 37 N -1.96 1.24 -0.11 0.56 5.04 -0.96 -4.46 117.35 116.70 2g18 s TYR 37 Ca 0.72 -0.55 -0.10 0.00 -2.44 0.00 0.00 57.07 54.69 2g18 s TYR 37 Cb -0.24 -1.08 -0.05 0.00 0.35 0.00 0.00 41.96 40.94 2g18 s TYR 37 CO 0.35 -0.44 0.22 -1.01 -1.34 0.00 0.00 175.55 173.33 2g18 s HIS 38 N 1.67 3.59 0.84 4.97 3.76 -1.26 -4.28 115.29 124.57 2g18 s HIS 38 Ca 0.03 0.62 -0.12 0.00 -0.15 0.00 0.00 55.06 55.44 2g18 s HIS 38 Cb -0.13 -2.10 0.09 0.00 1.11 0.00 0.00 32.58 31.56 2g18 s HIS 38 CO -0.06 0.60 1.12 -0.51 -0.85 0.00 0.00 174.74 175.04 2g18 s LEU 39 N -0.68 2.38 0.49 0.89 1.43 -1.26 -5.01 118.68 116.92 2g18 s LEU 39 Ca 0.16 1.11 -0.21 0.00 -1.03 0.00 0.00 54.13 54.16 2g18 s LEU 39 Cb -0.13 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.38 2g18 s LEU 39 CO 0.05 -2.15 0.84 -2.65 0.23 0.00 0.00 176.35 172.68 2g18 n PRO 40 N -3.52 0.98 -0.02 1.29 -0.02 -1.26 -4.87 135.00 127.58 2g18 n PRO 40 Ca 0.07 0.36 -0.06 0.00 -2.02 0.00 0.00 63.50 61.85 2g18 n PRO 40 Cb 0.58 -1.93 0.14 0.00 -0.02 0.00 0.00 33.50 32.27 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 0.95 0.97 0.00 3.55 0.00 -2.03 -1.62 119.26 121.07 2g18 h ALA 41 Ca -0.45 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.08 2g18 h ALA 41 Cb 1.36 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2g18 h ALA 41 CO 0.53 0.60 0.00 0.39 0.00 0.00 0.00 179.25 180.77 2g18 n GLU 42 N -4.09 0.76 0.00 0.00 1.02 -1.26 -3.94 120.64 113.13 2g18 n GLU 42 Ca -0.01 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.16 2g18 n GLU 42 Cb 0.44 -1.16 -0.01 0.00 -0.02 0.00 0.00 31.44 30.69 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 -0.66 0.67 -0.07 -4.62 4.77 -0.61 -4.51 117.00 111.97 2g18 n LEU 43 Ca 0.06 -0.70 -0.03 0.00 -0.03 0.00 0.00 56.01 55.31 2g18 n LEU 43 Cb 0.03 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.31 2g18 n LEU 43 CO 0.04 0.15 0.89 1.23 -1.33 0.00 0.00 177.39 178.37 2g18 h GLY 44 N 0.97 0.76 -6.98 -0.72 0.00 -1.71 -3.43 103.07 91.96 2g18 h GLY 44 Ca 0.00 -0.50 -0.31 0.00 0.00 0.00 0.00 47.33 46.52 2g18 h GLY 44 CO 0.00 0.46 -0.66 -0.47 0.00 0.00 0.00 176.54 175.87 2g18 s TYR 45 N -4.95 -0.13 -0.08 5.60 5.04 -1.26 -0.51 117.35 121.05 2g18 s TYR 45 Ca -0.09 0.53 0.03 0.00 -2.44 0.00 0.00 57.07 55.10 2g18 s TYR 45 Cb 0.15 -0.31 0.01 0.00 0.35 0.00 0.00 41.96 42.16 2g18 s TYR 45 CO 0.80 -0.27 -0.17 0.08 -1.34 0.00 0.00 175.55 174.64 2g18 s VAL 46 N 2.27 1.55 -0.07 3.14 1.01 0.31 -4.98 120.40 123.63 2g18 s VAL 46 Ca 0.04 -0.72 0.04 0.00 0.00 0.00 0.00 61.98 61.34 2g18 s VAL 46 Cb -0.12 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 2g18 s VAL 46 CO -0.05 0.45 -0.20 -1.61 0.00 0.00 0.00 175.10 173.68 2g18 s GLU 47 N 0.52 2.71 0.00 2.72 2.02 -1.26 -0.77 118.70 124.64 2g18 s GLU 47 Ca -0.17 -0.81 0.00 0.00 0.02 0.00 0.00 54.97 54.02 2g18 s GLU 47 Cb -0.17 -2.31 0.00 0.00 0.10 0.00 0.00 34.13 31.75 2g18 s GLU 47 CO 0.06 0.41 0.00 0.41 0.02 0.00 0.00 175.26 176.16 2g18 n GLY 48 N 2.90 3.49 2.89 -1.39 0.00 0.26 -4.99 105.19 108.36 2g18 n GLY 48 Ca -0.17 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.06 0.06 -0.20 1.61 1.81 -1.26 -0.72 118.95 120.18 2g18 s ARG 49 Ca 0.00 -0.10 -0.04 0.00 -1.72 0.00 0.00 55.73 53.87 2g18 s ARG 49 Cb 0.00 0.00 0.10 0.00 -0.45 0.00 0.00 34.95 34.61 2g18 s ARG 49 CO 0.00 -0.00 0.35 -1.17 -0.68 0.00 0.00 175.30 173.80 2g18 s LEU 50 N -0.22 -0.52 -1.45 2.53 2.96 -0.03 -4.70 118.68 117.25 2g18 s LEU 50 Ca -0.02 0.46 -0.09 0.00 -0.22 0.00 0.00 54.13 54.26 2g18 s LEU 50 Cb -0.02 1.02 0.05 0.00 0.50 0.00 0.00 46.19 47.75 2g18 s LEU 50 CO -0.00 -0.27 0.89 -0.62 -1.32 0.00 0.00 176.35 175.03 2g18 n GLU 51 N 5.36 -5.37 0.00 1.98 -0.58 -1.26 -1.12 120.64 119.65 2g18 n GLU 51 Ca -0.06 0.61 0.00 0.00 -0.42 0.00 0.00 57.16 57.29 2g18 n GLU 51 Cb 0.50 -5.38 0.00 0.00 -0.57 0.00 0.00 31.44 25.98 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 -1.67 2.99 3.79 0.62 0.00 -1.26 -4.99 105.19 104.67 2g18 n GLY 52 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 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 4.46 0.09 1.61 0.41 -0.28 -5.03 118.70 119.96 2g18 s GLU 53 Ca 0.00 1.21 -0.31 0.00 -0.41 0.00 0.00 54.97 55.46 2g18 s GLU 53 Cb 0.00 -2.69 -0.07 0.00 -1.78 0.00 0.00 34.13 29.60 2g18 s GLU 53 CO 0.00 0.23 1.25 0.21 -0.49 0.00 0.00 175.26 176.47 2g18 s LYS 54 N -2.28 4.41 -0.17 1.61 2.20 -1.26 -0.85 119.74 123.40 2g18 s LYS 54 Ca 0.52 1.87 -0.05 0.00 -0.36 0.00 0.00 55.97 57.95 2g18 s LYS 54 Cb -0.16 -3.31 -0.03 0.00 -1.51 0.00 0.00 37.83 32.82 2g18 s LYS 54 CO 0.21 -0.29 -0.01 -1.17 -0.36 0.00 0.00 175.35 173.73 2g18 s LEU 55 N 0.92 3.35 -0.04 5.43 0.20 0.10 -0.75 118.68 127.89 2g18 s LEU 55 Ca 0.60 -0.11 0.02 0.00 0.69 0.00 0.00 54.13 55.33 2g18 s LEU 55 Cb -0.32 -1.83 0.01 0.00 -0.43 0.00 0.00 46.19 43.62 2g18 s LEU 55 CO 0.30 0.14 -0.10 -0.89 -0.29 0.00 0.00 176.35 175.52 2g18 s THR 56 N 0.52 0.89 -0.08 3.68 2.01 -0.07 -0.57 115.64 122.01 2g18 s THR 56 Ca -0.02 -0.39 0.02 0.00 0.31 0.00 0.00 61.69 61.61 2g18 s THR 56 Cb -0.14 -0.80 0.01 0.00 0.01 0.00 0.00 72.50 71.59 2g18 s THR 56 CO 0.02 0.28 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.48 2g18 s ILE 57 N 0.34 1.23 -0.12 1.82 1.01 0.05 -0.89 121.20 124.64 2g18 s ILE 57 Ca -0.06 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.10 2g18 s ILE 57 Cb -0.11 -1.13 0.01 0.00 0.01 0.00 0.00 42.46 41.24 2g18 s ILE 57 CO 0.01 0.38 -0.20 -0.70 0.00 0.00 0.00 174.94 174.43 2g18 s GLU 58 N 0.82 2.79 -0.03 2.79 2.12 0.37 -0.53 118.70 127.03 2g18 s GLU 58 Ca -0.11 -0.77 0.07 0.00 0.36 0.00 0.00 54.97 54.52 2g18 s GLU 58 Cb -0.15 -2.25 -0.02 0.00 0.26 0.00 0.00 34.13 31.97 2g18 s GLU 58 CO 0.02 0.01 -0.24 -0.80 -0.54 0.00 0.00 175.26 173.70 2g18 s ASN 59 N 0.78 3.22 -0.05 -1.70 0.01 0.33 -0.44 114.94 117.09 2g18 s ASN 59 Ca -0.09 -0.42 -0.02 0.00 -0.71 0.00 0.00 52.86 51.62 2g18 s ASN 59 Cb -0.16 -0.43 0.04 0.00 0.41 0.00 0.00 41.25 41.11 2g18 s ASN 59 CO 0.00 0.32 0.09 -0.60 -1.51 0.00 0.00 177.10 175.41 2g18 s ARG 60 N -0.63 0.01 0.03 -0.60 3.52 0.11 -4.80 118.95 116.59 2g18 s ARG 60 Ca 0.10 0.34 0.04 0.00 -0.13 0.00 0.00 55.73 56.08 2g18 s ARG 60 Cb -0.10 -0.27 -0.02 0.00 -1.56 0.00 0.00 34.95 33.00 2g18 s ARG 60 CO -0.01 -0.21 -0.12 0.00 -0.81 0.00 0.00 175.30 174.15 2g18 s TYR 62 N -0.74 1.51 0.06 0.00 1.51 -0.39 -2.26 117.35 117.04 2g18 s TYR 62 Ca 0.01 -1.41 -0.05 0.00 -1.01 0.00 0.00 57.07 54.60 2g18 s TYR 62 Cb -0.07 -0.76 -0.02 0.00 -0.11 0.00 0.00 41.96 41.00 2g18 s TYR 62 CO 0.01 -0.60 0.08 1.14 -1.11 0.00 0.00 175.55 175.07 2g18 s GLN 63 N -3.85 0.68 0.30 -0.62 -2.07 0.06 0.66 119.66 114.82 2g18 s GLN 63 Ca 0.37 -0.97 0.05 0.00 -1.82 0.00 0.00 55.36 52.99 2g18 s GLN 63 Cb 0.05 0.26 -0.03 0.00 -1.09 0.00 0.00 33.01 32.20 2g18 s GLN 63 CO 0.18 -0.17 0.24 0.95 -1.32 0.00 0.00 175.29 175.16 2g18 s THR 64 N -3.45 0.03 0.56 3.63 -4.23 -0.65 -1.18 115.64 110.35 2g18 s THR 64 Ca 0.02 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.79 2g18 s THR 64 Cb 0.04 -2.50 0.37 0.00 1.34 0.00 0.00 72.50 71.75 2g18 s THR 64 CO -0.08 0.00 2.05 -0.65 -0.54 0.00 0.00 174.62 175.39 2g18 h PRO 65 N 2.24 0.00 0.00 3.99 0.11 -2.02 -2.87 132.00 133.45 2g18 h PRO 65 Ca -0.28 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.69 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 0.41 0.00 -2.12 1.04 -0.21 0.00 0.00 178.00 177.12 2g18 n GLN 66 N -4.10 0.67 -4.05 1.05 3.00 -1.26 -4.86 117.38 107.83 2g18 n GLN 66 Ca 0.05 -0.11 -0.34 0.00 -0.01 0.00 0.00 57.00 56.58 2g18 n GLN 66 Cb 0.44 -1.53 -0.14 0.00 0.00 0.00 0.00 30.24 29.00 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 -3.11 2.91 0.39 1.08 0.40 -1.08 -0.39 117.98 118.17 2g18 s PHE 67 Ca -0.09 -1.02 0.07 0.00 -0.60 0.00 0.00 56.93 55.29 2g18 s PHE 67 Cb 0.11 -2.04 0.79 0.00 0.51 0.00 0.00 43.02 42.39 2g18 s PHE 67 CO 0.88 -0.55 1.99 -0.09 0.70 0.00 0.00 175.22 178.14 2g18 h ARG 68 N 7.90 0.46 -1.83 0.44 2.43 -1.00 -1.74 114.38 121.04 2g18 h ARG 68 Ca -0.40 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 58.76 2g18 h ARG 68 Cb 1.16 -0.09 -0.23 0.00 -0.42 0.00 0.00 29.97 30.39 2g18 h ARG 68 CO 0.61 0.40 0.16 0.21 -1.51 0.00 0.00 179.97 179.83 2g18 s LYS 69 N -5.19 0.59 -0.25 0.20 2.20 -1.11 -4.66 119.74 111.52 2g18 s LYS 69 Ca -0.07 1.01 0.02 0.00 -0.36 0.00 0.00 55.97 56.57 2g18 s LYS 69 Cb 0.16 0.12 0.06 0.00 -1.51 0.00 0.00 37.83 36.67 2g18 s LYS 69 CO 0.74 -0.12 -0.06 -1.64 -0.36 0.00 0.00 175.35 173.90 2g18 s MET 70 N 1.50 1.79 -0.20 4.03 -1.94 0.21 -0.43 119.30 124.25 2g18 s MET 70 Ca -0.09 -1.17 -0.03 0.00 -1.71 0.00 0.00 55.69 52.68 2g18 s MET 70 Cb -0.05 -2.72 -0.00 0.00 2.01 0.00 0.00 34.83 34.07 2g18 s MET 70 CO -0.18 -0.62 -0.08 -1.58 -0.01 0.00 0.00 175.02 172.55 2g18 s HIS 71 N 1.27 2.92 -0.22 -0.03 5.04 -0.15 -1.26 115.29 122.85 2g18 s HIS 71 Ca -0.05 -1.01 -0.03 0.00 -1.54 0.00 0.00 55.06 52.43 2g18 s HIS 71 Cb -0.19 -2.05 -0.00 0.00 0.04 0.00 0.00 32.58 30.38 2g18 s HIS 71 CO -0.06 -0.54 -0.05 -1.17 -2.34 0.00 0.00 174.74 170.57 2g18 s LEU 72 N 1.31 2.88 -0.12 8.88 2.96 0.66 -1.82 118.68 133.44 2g18 s LEU 72 Ca 0.04 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.51 2g18 s LEU 72 Cb -0.14 -1.71 -0.00 0.00 0.50 0.00 0.00 46.19 44.83 2g18 s LEU 72 CO -0.04 -0.03 -0.20 -0.70 -1.32 0.00 0.00 176.35 174.05 2g18 s GLU 73 N 1.45 3.13 -0.06 1.98 2.12 0.15 -0.71 118.70 126.77 2g18 s GLU 73 Ca 0.05 -0.82 0.05 0.00 0.36 0.00 0.00 54.97 54.61 2g18 s GLU 73 Cb -0.14 -2.43 -0.02 0.00 0.26 0.00 0.00 34.13 31.80 2g18 s GLU 73 CO -0.04 0.13 -0.20 -0.51 -0.54 0.00 0.00 175.26 174.10 2g18 s LEU 74 N 0.49 2.36 0.01 2.70 1.43 0.42 -0.87 118.68 125.22 2g18 s LEU 74 Ca -0.14 -0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 52.56 2g18 s LEU 74 Cb -0.17 -1.46 -0.01 0.00 0.03 0.00 0.00 46.19 44.59 2g18 s LEU 74 CO 0.05 0.28 0.04 0.00 0.23 0.00 0.00 176.35 176.95 2g18 s ALA 75 N -0.34 -0.06 -0.02 4.21 0.00 -0.14 -0.48 121.76 124.93 2g18 s ALA 75 Ca 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 51.96 51.64 2g18 s ALA 75 Cb -0.12 0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.12 2g18 s ALA 75 CO 0.02 -0.16 0.04 0.21 0.00 0.00 0.00 175.76 175.87 2g18 s LYS 76 N -1.24 -0.01 -0.33 0.00 2.20 -0.06 -0.21 119.74 120.09 2g18 s LYS 76 Ca -0.13 0.17 0.01 0.00 -0.36 0.00 0.00 55.97 55.65 2g18 s LYS 76 Cb -0.08 -0.17 0.08 0.00 -1.51 0.00 0.00 37.83 36.15 2g18 s LYS 76 CO -0.00 -0.12 0.04 0.08 -0.36 0.00 0.00 175.35 174.98 2g18 s VAL 77 N 0.80 2.65 0.00 4.02 1.01 0.05 -0.90 120.40 128.04 2g18 s VAL 77 Ca -0.07 -1.90 0.00 0.00 0.00 0.00 0.00 61.98 60.01 2g18 s VAL 77 Cb -0.09 -2.74 0.00 0.00 0.00 0.00 0.00 36.38 33.55 2g18 s VAL 77 CO -0.03 -0.38 0.00 0.61 0.00 0.00 0.00 175.10 175.30 2g18 n GLY 78 N 4.45 2.27 1.11 4.51 0.00 0.07 -0.68 105.19 116.93 2g18 n GLY 78 Ca -0.05 0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.11 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 1.05 3.80 0.07 1.61 3.02 -1.26 -4.57 115.26 118.98 2g18 n ASN 79 Ca 0.00 -2.22 -0.13 0.00 -0.03 0.00 0.00 54.58 52.20 2g18 n ASN 79 Cb 0.00 -0.43 -0.13 0.00 -0.61 0.00 0.00 39.78 38.61 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 3.17 0.17 -2.43 3.52 2.86 -1.29 -3.11 114.93 117.83 2g18 h MET 80 Ca 0.00 -0.29 -0.07 0.00 -2.06 0.00 0.00 59.70 57.28 2g18 h MET 80 Cb 1.07 0.11 -0.25 0.00 0.06 0.00 0.00 31.60 32.59 2g18 h MET 80 CO 0.08 1.08 -0.19 -1.17 1.06 0.00 0.00 176.91 177.78 2g18 s LEU 81 N -6.91 -0.37 -0.04 1.22 2.96 -0.98 -4.44 118.68 110.11 2g18 s LEU 81 Ca -0.04 1.10 0.04 0.00 -0.22 0.00 0.00 54.13 55.02 2g18 s LEU 81 Cb 0.08 1.70 -0.00 0.00 0.50 0.00 0.00 46.19 48.46 2g18 s LEU 81 CO 0.85 -0.21 -0.18 -1.81 -1.32 0.00 0.00 176.35 173.69 2g18 s ASP 82 N 1.46 2.21 -0.02 3.68 1.01 -0.80 -0.77 116.67 123.45 2g18 s ASP 82 Ca -0.10 -0.36 0.01 0.00 0.71 0.00 0.00 52.55 52.81 2g18 s ASP 82 Cb -0.07 -0.59 0.01 0.00 1.01 0.00 0.00 42.92 43.28 2g18 s ASP 82 CO -0.15 0.16 -0.03 -0.63 0.21 0.00 0.00 175.17 174.73 2g18 s ILE 83 N -0.00 0.34 -0.06 0.77 1.01 0.71 -0.58 121.20 123.38 2g18 s ILE 83 Ca -0.03 -0.09 0.06 0.00 0.00 0.00 0.00 60.65 60.59 2g18 s ILE 83 Cb -0.11 -0.35 -0.01 0.00 0.01 0.00 0.00 42.46 42.00 2g18 s ILE 83 CO 0.02 0.14 -0.24 -0.22 0.00 0.00 0.00 174.94 174.64 2g18 s LEU 84 N 0.49 2.06 -0.04 2.97 0.20 0.12 -0.96 118.68 123.52 2g18 s LEU 84 Ca -0.05 -0.51 0.01 0.00 0.69 0.00 0.00 54.13 54.26 2g18 s LEU 84 Cb -0.09 -1.35 0.02 0.00 -0.43 0.00 0.00 46.19 44.34 2g18 s LEU 84 CO -0.01 0.22 -0.02 -2.28 -0.29 0.00 0.00 176.35 173.98 2g18 s HIS 85 N -0.06 0.50 -0.03 5.38 5.65 -0.05 -0.19 115.29 126.49 2g18 s HIS 85 Ca -0.06 -0.09 0.00 0.00 0.25 0.00 0.00 55.06 55.16 2g18 s HIS 85 Cb -0.14 -0.52 0.03 0.00 -1.18 0.00 0.00 32.58 30.76 2g18 s HIS 85 CO 0.05 -0.15 -0.00 0.00 -0.65 0.00 0.00 174.74 173.98 2g18 s VAL 87 N 0.98 0.10 -0.21 0.00 1.01 -0.75 -0.82 120.40 120.71 2g18 s VAL 87 Ca -0.10 -0.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.81 2g18 s VAL 87 Cb -0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 36.38 36.13 2g18 s VAL 87 CO -0.02 0.04 -0.04 -0.04 0.00 0.00 0.00 175.10 175.05 2g18 s MET 88 N 0.10 3.45 -0.37 2.72 -1.94 -0.44 -0.98 119.30 121.85 2g18 s MET 88 Ca -0.01 -0.60 -0.10 0.00 -1.71 0.00 0.00 55.69 53.27 2g18 s MET 88 Cb -0.02 -3.00 0.03 0.00 2.01 0.00 0.00 34.83 33.85 2g18 s MET 88 CO -0.00 -0.10 0.19 -0.06 -0.01 0.00 0.00 175.02 175.03 2g18 s PHE 89 N 1.25 3.24 0.54 -0.03 0.40 0.42 -3.46 117.98 120.33 2g18 s PHE 89 Ca 0.03 -0.99 -0.19 0.00 -0.60 0.00 0.00 56.93 55.18 2g18 s PHE 89 Cb -0.14 -2.41 -0.06 0.00 0.51 0.00 0.00 43.02 40.91 2g18 s PHE 89 CO -0.01 -0.64 1.09 -2.14 0.70 0.00 0.00 175.22 174.22 2g18 s PRO 90 N 1.54 3.44 0.32 0.24 0.02 -1.26 -0.50 135.00 138.80 2g18 s PRO 90 Ca 0.02 1.47 -0.29 0.00 0.02 0.00 0.00 61.00 62.21 2g18 s PRO 90 Cb -0.19 -2.03 -0.11 0.00 0.02 0.00 0.00 34.50 32.19 2g18 s PRO 90 CO 0.06 -0.75 1.43 1.03 -0.33 0.00 0.00 177.00 178.45 2g18 s ARG 91 N -3.43 4.23 0.00 5.54 0.52 0.47 -4.41 118.95 121.87 2g18 s ARG 91 Ca 0.69 2.39 0.09 0.00 -0.52 0.00 0.00 55.73 58.39 2g18 s ARG 91 Cb -0.20 -3.04 0.39 0.00 0.52 0.00 0.00 34.95 32.62 2g18 s ARG 91 CO 0.27 -0.41 1.24 -0.35 0.02 0.00 0.00 175.30 176.07 2g18 n PRO 92 N 1.28 0.04 0.04 3.54 -0.04 -1.26 -1.58 135.00 137.01 2g18 n PRO 92 Ca 0.03 0.30 0.09 0.00 -0.04 0.00 0.00 63.50 63.89 2g18 n PRO 92 Cb 0.40 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.75 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 -1.43 0.06 -4.92 0.54 4.71 -1.26 -4.67 120.64 113.67 2g18 n GLU 93 Ca 0.03 0.27 -0.33 0.00 -0.01 0.00 0.00 57.16 57.12 2g18 n GLU 93 Cb 0.09 -1.60 -0.14 0.00 -1.01 0.00 0.00 31.44 28.78 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 -3.08 2.69 -1.38 -0.32 1.51 -0.62 -1.25 117.35 114.91 2g18 s TYR 94 Ca 0.07 -0.37 -0.16 0.00 -1.01 0.00 0.00 57.07 55.61 2g18 s TYR 94 Cb 0.10 -1.68 0.06 0.00 -0.11 0.00 0.00 41.96 40.34 2g18 s TYR 94 CO 0.33 0.02 1.98 -3.47 -1.11 0.00 0.00 175.55 173.30 2g18 n ASP 95 N 2.73 4.43 -4.06 2.29 2.03 -1.26 -4.86 116.55 117.85 2g18 n ASP 95 Ca -0.17 -2.89 -0.22 0.00 0.52 0.00 0.00 54.79 52.02 2g18 n ASP 95 Cb 0.52 -1.69 -0.16 0.00 -0.72 0.00 0.00 41.12 39.08 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 2.95 1.88 1.12 -2.67 1.43 -1.26 -4.90 118.68 117.23 2g18 s LEU 96 Ca 0.50 -0.25 -0.17 0.00 -1.03 0.00 0.00 54.13 53.18 2g18 s LEU 96 Cb 0.09 -0.71 0.25 0.00 0.03 0.00 0.00 46.19 45.85 2g18 s LEU 96 CO -0.01 0.12 1.12 -2.16 0.23 0.00 0.00 176.35 175.64 2g18 s PRO 97 N 0.02 -0.59 -0.27 1.29 0.04 -1.26 -4.69 135.00 129.55 2g18 s PRO 97 Ca -0.01 0.08 -0.16 0.00 0.04 0.00 0.00 61.00 60.95 2g18 s PRO 97 Cb -0.09 -1.66 -0.03 0.00 0.04 0.00 0.00 34.50 32.76 2g18 s PRO 97 CO 0.01 -3.32 0.41 -1.64 0.04 0.00 0.00 177.00 172.50 2g18 s MET 98 N -5.30 4.03 0.03 4.56 -1.94 0.04 -4.70 119.30 116.01 2g18 s MET 98 Ca 0.69 0.11 -0.28 0.00 -1.71 0.00 0.00 55.69 54.50 2g18 s MET 98 Cb -0.12 -3.66 -0.04 0.00 2.01 0.00 0.00 34.83 33.02 2g18 s MET 98 CO 0.56 -0.30 0.90 0.12 -0.01 0.00 0.00 175.02 176.29 2g18 s PHE 99 N 2.13 3.71 -0.04 -0.03 5.36 -1.23 -0.02 117.98 127.86 2g18 s PHE 99 Ca 0.17 1.63 -0.05 0.00 -0.96 0.00 0.00 56.93 57.72 2g18 s PHE 99 Cb -0.16 -3.01 0.01 0.00 -0.34 0.00 0.00 43.02 39.53 2g18 s PHE 99 CO 0.10 0.12 0.12 0.20 -1.46 0.00 0.00 175.22 174.30 2g18 s GLY 100 N 0.50 -0.07 -0.00 13.12 0.00 -0.58 -1.33 107.32 118.96 2g18 s GLY 100 Ca 0.46 0.27 -0.09 0.00 0.00 0.00 0.00 44.72 45.36 2g18 s GLY 100 CO 0.26 0.21 0.19 0.00 0.00 0.00 0.00 173.10 173.77 2g18 s ASP 102 N -1.36 0.13 -0.05 0.00 1.01 0.02 -0.22 116.67 116.19 2g18 s ASP 102 Ca -0.14 -0.18 -0.00 0.00 0.71 0.00 0.00 52.55 52.93 2g18 s ASP 102 Cb -0.07 0.03 0.03 0.00 1.01 0.00 0.00 42.92 43.92 2g18 s ASP 102 CO 0.02 -0.10 -0.02 -0.22 0.21 0.00 0.00 175.17 175.07 2g18 s LEU 103 N -0.53 0.99 -0.08 1.23 2.96 0.73 -1.26 118.68 122.71 2g18 s LEU 103 Ca -0.06 -0.09 0.03 0.00 -0.22 0.00 0.00 54.13 53.80 2g18 s LEU 103 Cb -0.04 -0.39 0.01 0.00 0.50 0.00 0.00 46.19 46.26 2g18 s LEU 103 CO -0.00 -0.12 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.02 2g18 s VAL 104 N 1.37 1.68 0.00 1.68 1.01 -0.14 -0.70 120.40 125.30 2g18 s VAL 104 Ca -0.04 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.14 2g18 s VAL 104 Cb -0.13 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.77 2g18 s VAL 104 CO -0.02 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2g18 n GLY 105 N 3.62 4.37 0.00 4.51 0.00 0.25 -1.28 105.19 116.66 2g18 n GLY 105 Ca -0.21 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 44.97 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 4.69 2.31 -0.02 0.00 -0.81 -1.90 105.19 109.46 2g18 n GLY 106 Ca 0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.19 -3.31 -3.46 1.61 1.74 -1.18 -2.99 116.66 107.89 2g18 n ARG 107 Ca 0.00 0.36 -0.25 0.00 -0.77 0.00 0.00 57.85 57.19 2g18 n ARG 107 Cb 0.00 -3.97 0.01 0.00 -1.02 0.00 0.00 32.46 27.48 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 -1.13 -0.50 3.14 -0.13 0.00 -1.26 -4.97 105.19 100.34 2g18 n GLY 108 Ca -0.03 0.13 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 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 -6.13 0.75 -0.24 1.61 -1.52 -1.16 -5.12 119.66 107.85 2g18 s GLN 109 Ca 0.46 -1.26 0.01 0.00 -1.95 0.00 0.00 55.36 52.62 2g18 s GLN 109 Cb -0.23 -0.09 0.04 0.00 -0.22 0.00 0.00 33.01 32.51 2g18 s GLN 109 CO 0.57 -0.04 -0.12 0.42 -0.25 0.00 0.00 175.29 175.87 2g18 s ILE 110 N -3.54 2.34 -0.01 1.08 1.01 -1.26 -1.91 121.20 118.90 2g18 s ILE 110 Ca 0.09 -1.32 0.11 0.00 0.00 0.00 0.00 60.65 59.54 2g18 s ILE 110 Cb 0.05 -2.24 -0.15 0.00 0.01 0.00 0.00 42.46 40.14 2g18 s ILE 110 CO -0.06 0.16 1.11 0.77 0.00 0.00 0.00 174.94 176.92 2g18 h SER 111 N 7.88 0.00 -3.26 3.58 4.64 -1.54 -3.38 113.55 121.47 2g18 h SER 111 Ca -0.29 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.88 2g18 h SER 111 Cb 1.08 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 62.89 2g18 h SER 111 CO 0.53 0.84 -0.38 0.00 -0.87 0.00 0.00 176.83 176.95 2g18 s ALA 112 N -2.77 -0.83 -0.07 5.18 0.00 -1.01 -4.44 121.76 117.81 2g18 s ALA 112 Ca -0.00 1.30 -0.00 0.00 0.00 0.00 0.00 51.96 53.25 2g18 s ALA 112 Cb 0.09 -0.81 0.02 0.00 0.00 0.00 0.00 23.12 22.42 2g18 s ALA 112 CO 0.80 -0.25 -0.03 0.00 0.00 0.00 0.00 175.76 176.28 2g18 s ALA 113 N 1.38 0.83 0.02 0.00 0.00 -0.07 -0.97 121.76 122.95 2g18 s ALA 113 Ca -0.09 -0.19 0.04 0.00 0.00 0.00 0.00 51.96 51.71 2g18 s ALA 113 Cb -0.09 -0.66 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2g18 s ALA 113 CO -0.11 -0.28 -0.11 -1.50 0.00 0.00 0.00 175.76 173.76 2g18 s ILE 114 N 1.51 0.85 -0.10 0.00 2.07 -0.39 -1.16 121.20 123.98 2g18 s ILE 114 Ca -0.01 -0.71 -0.10 0.00 -1.41 0.00 0.00 60.65 58.42 2g18 s ILE 114 Cb -0.13 -0.76 0.03 0.00 0.13 0.00 0.00 42.46 41.73 2g18 s ILE 114 CO -0.04 0.05 0.28 0.00 -1.91 0.00 0.00 174.94 173.32 2g18 s ALA 115 N -0.61 -0.69 0.11 1.50 0.00 -0.37 -0.80 121.76 120.91 2g18 s ALA 115 Ca 0.01 0.78 -0.17 0.00 0.00 0.00 0.00 51.96 52.57 2g18 s ALA 115 Cb -0.06 -0.45 0.04 0.00 0.00 0.00 0.00 23.12 22.65 2g18 s ALA 115 CO 0.00 -0.13 0.43 0.34 0.00 0.00 0.00 175.76 176.40 2g18 s ASP 116 N 0.14 -0.29 -0.52 0.00 2.15 -0.19 -1.35 116.67 116.61 2g18 s ASP 116 Ca -0.00 -0.21 -0.05 0.00 0.43 0.00 0.00 52.55 52.72 2g18 s ASP 116 Cb -0.02 0.48 0.14 0.00 -0.30 0.00 0.00 42.92 43.22 2g18 s ASP 116 CO 0.00 -0.83 0.35 -0.76 -0.17 0.00 0.00 175.17 173.76 2g18 s LEU 117 N -2.64 5.44 0.03 -1.34 1.43 -1.26 -1.53 118.68 118.82 2g18 s LEU 117 Ca 0.01 -2.31 -0.22 0.00 -1.03 0.00 0.00 54.13 50.58 2g18 s LEU 117 Cb 0.01 -1.90 -0.06 0.00 0.03 0.00 0.00 46.19 44.27 2g18 s LEU 117 CO -0.10 -0.53 0.67 -0.44 0.23 0.00 0.00 176.35 176.19 2g18 s SER 118 N 1.68 7.11 0.56 2.29 0.01 0.97 -4.30 113.70 122.01 2g18 s SER 118 Ca 0.11 1.32 -0.19 0.00 1.31 0.00 0.00 55.95 58.50 2g18 s SER 118 Cb -0.22 -2.41 -0.05 0.00 0.21 0.00 0.00 66.02 63.55 2g18 s SER 118 CO -0.03 0.09 1.16 -2.16 0.41 0.00 0.00 173.24 172.71 2g18 s PRO 119 N -0.30 3.21 0.00 12.44 0.04 -1.26 -0.78 135.00 148.35 2g18 s PRO 119 Ca 0.34 1.68 0.12 0.00 0.04 0.00 0.00 61.00 63.18 2g18 s PRO 119 Cb -0.20 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 2g18 s PRO 119 CO 0.20 -0.98 0.54 1.33 0.04 0.00 0.00 177.00 178.13 2g18 n VAL 120 N -1.43 0.00 -2.36 -0.36 0.24 -1.26 -4.80 118.33 108.35 2g18 n VAL 120 Ca 0.12 -0.27 -0.35 0.00 -2.04 0.00 0.00 64.34 61.81 2g18 n VAL 120 Cb 0.50 1.04 -0.01 0.00 -1.47 0.00 0.00 33.84 33.90 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 -1.94 2.81 0.26 6.34 3.76 -1.26 -3.91 115.29 121.34 2g18 s HIS 121 Ca 0.06 1.56 0.02 0.00 -0.15 0.00 0.00 55.06 56.54 2g18 s HIS 121 Cb 0.09 -3.19 0.33 0.00 1.11 0.00 0.00 32.58 30.91 2g18 s HIS 121 CO 0.43 -1.27 1.65 -0.07 -0.85 0.00 0.00 174.74 174.63 2g18 h LEU 122 N 1.32 0.47 -0.57 0.89 3.38 -1.93 -2.59 115.31 116.28 2g18 h LEU 122 Ca -0.50 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.28 2g18 h LEU 122 Cb 1.24 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2g18 h LEU 122 CO 0.58 0.80 0.00 -0.90 0.09 0.00 0.00 178.44 179.01 2g18 n ASP 123 N -4.05 0.86 0.00 -0.43 5.68 -1.26 -4.93 116.55 112.41 2g18 n ASP 123 Ca -0.01 -1.66 0.00 0.00 -0.50 0.00 0.00 54.79 52.61 2g18 n ASP 123 Cb 0.48 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.39 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 -0.18 0.00 -2.81 0.11 1.74 -0.97 -5.04 116.66 109.51 2g18 n ARG 124 Ca 0.13 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.95 2g18 n ARG 124 Cb 0.19 -2.21 0.00 0.00 -1.02 0.00 0.00 32.46 29.42 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 -2.67 4.73 0.29 0.55 -4.23 -1.26 -4.73 115.64 108.33 2g18 s THR 125 Ca 0.00 -0.04 0.01 0.00 -1.18 0.00 0.00 61.69 60.48 2g18 s THR 125 Cb 0.00 -3.78 -0.04 0.00 1.34 0.00 0.00 72.50 70.02 2g18 s THR 125 CO 0.00 -0.70 0.48 -0.76 -0.54 0.00 0.00 174.62 173.11 2g18 s LEU 126 N -4.66 4.11 0.90 4.79 1.43 -1.26 -4.30 118.68 119.70 2g18 s LEU 126 Ca 0.46 0.39 -0.12 0.00 -1.03 0.00 0.00 54.13 53.84 2g18 s LEU 126 Cb -0.10 -3.22 0.10 0.00 0.03 0.00 0.00 46.19 42.99 2g18 s LEU 126 CO 0.42 -0.20 0.91 -2.65 0.23 0.00 0.00 176.35 175.07 2g18 n PRO 127 N -1.43 -0.28 -0.26 1.29 -0.02 -1.26 -4.72 135.00 128.33 2g18 n PRO 127 Ca -0.05 -0.02 -0.03 0.00 -2.02 0.00 0.00 63.50 61.38 2g18 n PRO 127 Cb 0.56 -2.21 0.13 0.00 -0.02 0.00 0.00 33.50 31.96 2g18 n PRO 127 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2g18 h GLU 128 N -1.57 1.10 -0.59 -0.52 4.39 -1.99 -1.95 114.58 113.44 2g18 h GLU 128 Ca -0.44 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.11 2g18 h GLU 128 Cb 1.28 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 29.70 2g18 h GLU 128 CO 0.40 0.85 0.37 0.66 -1.16 0.00 0.00 179.01 180.13 2g18 h SER 129 N 1.09 0.69 -0.22 1.42 4.64 -2.00 -0.89 113.55 118.28 2g18 h SER 129 Ca 0.26 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.51 2g18 h SER 129 Cb 0.12 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 2g18 h SER 129 CO -0.03 0.52 -0.03 1.88 -0.87 0.00 0.00 176.83 178.29 2g18 h TYR 130 N 0.81 0.46 -0.40 4.77 -1.99 -1.72 -2.39 116.97 116.50 2g18 h TYR 130 Ca 0.22 -0.09 0.07 0.00 2.00 0.00 0.00 58.73 60.93 2g18 h TYR 130 Cb -0.06 -0.11 -0.07 0.00 2.00 0.00 0.00 36.73 38.49 2g18 h TYR 130 CO 0.00 0.63 -0.01 -0.91 -0.00 0.00 0.00 178.16 177.88 2g18 h ASN 131 N 0.15 -0.18 -0.16 3.88 2.35 -0.84 -0.13 115.58 120.65 2g18 h ASN 131 Ca 0.06 0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2g18 h ASN 131 Cb 0.47 0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.01 2g18 h ASN 131 CO 0.02 -0.05 0.06 0.28 -1.65 0.00 0.00 177.43 176.08 2g18 h SER 132 N 0.10 0.22 -0.70 5.81 0.02 -1.17 -1.83 113.55 116.00 2g18 h SER 132 Ca 0.20 -0.17 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2g18 h SER 132 Cb 0.28 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.73 2g18 h SER 132 CO -0.34 0.33 0.45 0.00 -1.14 0.00 0.00 176.83 176.14 2g18 h ALA 133 N 0.90 0.89 0.00 3.77 0.00 -1.17 -3.02 119.26 120.63 2g18 h ALA 133 Ca 0.05 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.75 2g18 h ALA 133 Cb 0.18 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2g18 h ALA 133 CO -0.00 0.28 -0.81 -0.07 0.00 0.00 0.00 179.25 178.65 2g18 h LEU 134 N 0.92 0.01 -0.20 0.00 3.38 -0.81 -3.09 115.31 115.52 2g18 h LEU 134 Ca 0.26 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2g18 h LEU 134 Cb -0.08 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2g18 h LEU 134 CO -0.07 0.81 0.00 0.71 0.09 0.00 0.00 178.44 179.98 2g18 h THR 135 N 0.00 0.00 -0.37 0.22 1.35 -1.22 -3.01 112.91 109.88 2g18 h THR 135 Ca -0.01 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 2g18 h THR 135 Cb 1.43 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 2g18 h THR 135 CO 0.11 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 173.84 2g18 n SER 136 N -2.32 3.03 -4.82 5.36 3.41 -1.15 -4.88 113.62 112.25 2g18 n SER 136 Ca 0.05 -1.93 -0.31 0.00 -0.26 0.00 0.00 58.87 56.42 2g18 n SER 136 Cb 0.39 -0.24 0.07 0.00 -0.26 0.00 0.00 64.21 64.16 2g18 n SER 136 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2g18 s LEU 137 N -1.43 2.92 0.45 1.04 1.43 -1.14 -5.03 118.68 116.92 2g18 s LEU 137 Ca 0.37 1.48 -0.23 0.00 -1.03 0.00 0.00 54.13 54.73 2g18 s LEU 137 Cb 0.21 -4.26 -0.08 0.00 0.03 0.00 0.00 46.19 42.10 2g18 s LEU 137 CO 0.30 -1.64 1.10 0.20 0.23 0.00 0.00 176.35 176.54 2g18 s ASN 138 N -3.86 6.38 0.01 2.29 0.01 -1.26 -4.99 114.94 113.52 2g18 s ASN 138 Ca 0.59 2.13 -0.30 0.00 -0.71 0.00 0.00 52.86 54.56 2g18 s ASN 138 Cb -0.14 -2.59 -0.06 0.00 0.41 0.00 0.00 41.25 38.88 2g18 s ASN 138 CO 0.55 -0.76 1.39 -0.89 -1.51 0.00 0.00 177.10 175.87 2g18 s THR 139 N -1.69 3.69 -0.27 1.60 2.01 -1.26 -5.00 115.64 114.73 2g18 s THR 139 Ca 0.63 1.10 -0.10 0.00 0.31 0.00 0.00 61.69 63.63 2g18 s THR 139 Cb -0.23 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 2g18 s THR 139 CO 0.29 0.01 0.15 -0.76 -0.69 0.00 0.00 174.62 173.61 2g18 s LEU 140 N 2.20 3.82 -0.76 4.42 1.43 -1.26 -5.03 118.68 123.50 2g18 s LEU 140 Ca 0.64 -0.07 -0.20 0.00 -1.03 0.00 0.00 54.13 53.47 2g18 s LEU 140 Cb -0.32 -2.05 0.11 0.00 0.03 0.00 0.00 46.19 43.96 2g18 s LEU 140 CO 0.27 -0.04 0.97 0.20 0.23 0.00 0.00 176.35 177.98 2g18 s ASN 141 N 1.66 6.39 0.05 2.29 -0.87 -1.26 -5.04 114.94 118.16 2g18 s ASN 141 Ca 0.07 -1.60 -0.14 0.00 -1.57 0.00 0.00 52.86 49.62 2g18 s ASN 141 Cb -0.16 -2.38 -0.06 0.00 -0.02 0.00 0.00 41.25 38.64 2g18 s ASN 141 CO 0.08 -1.18 0.45 -0.36 -2.57 0.00 0.00 177.10 173.52 2g18 s PHE 142 N 3.03 3.69 -0.50 2.20 0.40 -1.26 -5.01 117.98 120.53 2g18 s PHE 142 Ca 0.24 0.99 0.24 0.00 -0.60 0.00 0.00 56.93 57.80 2g18 s PHE 142 Cb -0.13 -2.30 0.39 0.00 0.51 0.00 0.00 43.02 41.49 2g18 s PHE 142 CO 0.00 0.58 1.52 0.66 0.70 0.00 0.00 175.22 178.68 2g18 h SER 143 N 4.29 0.00 -2.16 1.36 4.64 -1.96 -3.38 113.55 116.34 2g18 h SER 143 Ca -0.50 -0.02 -0.58 0.00 -0.47 0.00 0.00 61.79 60.21 2g18 h SER 143 Cb 1.21 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.90 2g18 h SER 143 CO 0.63 0.01 -0.89 0.00 -0.87 0.00 0.00 176.83 175.71 2g18 n GLN 144 N -2.72 1.33 -1.19 4.77 6.02 -1.26 -5.11 117.38 119.21 2g18 n GLN 144 Ca 0.04 -3.77 -0.31 0.00 -0.01 0.00 0.00 57.00 52.95 2g18 n GLN 144 Cb 0.50 -1.66 0.11 0.00 1.02 0.00 0.00 30.24 30.21 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 -1.51 1.81 0.15 -1.09 0.04 -1.26 -1.41 135.00 131.73 2g18 s PRO 145 Ca 0.36 1.08 0.08 0.00 0.04 0.00 0.00 61.00 62.56 2g18 s PRO 145 Cb 0.14 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.79 2g18 s PRO 145 CO -0.09 -1.93 -0.18 1.03 0.04 0.00 0.00 177.00 175.87 2g18 s ARG 146 N -4.89 1.23 -0.03 4.56 0.52 0.37 -4.81 118.95 115.90 2g18 s ARG 146 Ca 0.62 -1.35 -0.20 0.00 -0.52 0.00 0.00 55.73 54.28 2g18 s ARG 146 Cb -0.18 -1.30 -0.05 0.00 0.52 0.00 0.00 34.95 33.94 2g18 s ARG 146 CO 0.57 0.27 0.57 -2.00 0.02 0.00 0.00 175.30 174.72 2g18 s GLU 147 N -2.64 4.30 0.45 3.54 2.12 -1.26 -4.78 118.70 120.43 2g18 s GLU 147 Ca 0.14 0.67 -0.23 0.00 0.36 0.00 0.00 54.97 55.90 2g18 s GLU 147 Cb -0.06 -3.36 -0.08 0.00 0.26 0.00 0.00 34.13 30.89 2g18 s GLU 147 CO 0.06 0.33 1.12 -0.51 -0.54 0.00 0.00 175.26 175.72 2g18 s LEU 148 N -0.02 4.02 0.95 2.70 1.43 -1.26 -5.06 118.68 121.44 2g18 s LEU 148 Ca 0.30 2.20 -0.15 0.00 -1.03 0.00 0.00 54.13 55.45 2g18 s LEU 148 Cb -0.17 -4.27 0.18 0.00 0.03 0.00 0.00 46.19 41.96 2g18 s LEU 148 CO 0.16 -0.81 1.26 -2.16 0.23 0.00 0.00 176.35 175.02 2g18 s PRO 149 N -2.72 0.75 0.40 1.29 0.04 -1.26 -4.91 135.00 128.60 2g18 s PRO 149 Ca 0.63 -0.22 0.13 0.00 0.04 0.00 0.00 61.00 61.58 2g18 s PRO 149 Cb -0.26 -1.84 0.83 0.00 0.04 0.00 0.00 34.50 33.27 2g18 s PRO 149 CO 0.31 -2.37 1.90 1.49 0.04 0.00 0.00 177.00 178.37 2g18 h GLU 150 N -1.61 0.02 0.00 4.56 4.81 -2.04 0.88 114.58 121.20 2g18 h GLU 150 Ca -0.45 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2g18 h GLU 150 Cb 1.27 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 2g18 h GLU 150 CO 0.45 0.30 0.00 -2.67 -0.73 0.00 0.00 179.01 176.36 2g18 n TRP 151 N -4.20 0.07 1.63 0.92 4.27 -1.26 -1.80 117.44 117.08 2g18 n TRP 151 Ca -0.02 0.04 0.08 0.00 -3.89 0.00 0.00 57.50 53.71 2g18 n TRP 151 Cb 0.33 -0.56 0.48 0.00 -1.36 0.00 0.00 31.31 30.21 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 -1.02 -0.82 0.00 -1.67 0.00 0.30 -3.38 105.19 98.60 2g18 n GLY 152 Ca 0.01 -0.10 0.06 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.81 0.00 0.04 1.61 0.23 -0.74 -1.61 115.26 113.97 2g18 n ASN 153 Ca 0.12 -0.84 0.13 0.00 -0.53 0.00 0.00 54.58 53.46 2g18 n ASN 153 Cb 0.06 0.00 0.47 0.00 -2.08 0.00 0.00 39.78 38.23 2g18 n ASN 153 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 2g18 n ILE 154 N -0.80 0.20 -3.33 1.53 -5.35 -1.22 -4.85 119.36 105.54 2g18 n ILE 154 Ca 0.09 -0.11 -0.32 0.00 -0.27 0.00 0.00 62.75 62.14 2g18 n ILE 154 Cb 0.04 -0.39 -0.06 0.00 -1.74 0.00 0.00 39.64 37.49 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 -3.04 3.41 0.91 4.28 0.40 -0.63 -3.99 117.98 119.31 2g18 s PHE 155 Ca 0.12 0.96 -0.14 0.00 -0.60 0.00 0.00 56.93 57.27 2g18 s PHE 155 Cb 0.16 -2.33 0.15 0.00 0.51 0.00 0.00 43.02 41.51 2g18 s PHE 155 CO 0.59 0.22 1.22 -1.54 0.70 0.00 0.00 175.22 176.40 2g18 s SER 156 N -2.36 3.56 0.17 1.36 1.04 -1.26 -4.86 113.70 111.34 2g18 s SER 156 Ca 0.49 0.63 0.21 0.00 0.48 0.00 0.00 55.95 57.76 2g18 s SER 156 Cb -0.11 -0.96 0.86 0.00 0.10 0.00 0.00 66.02 65.91 2g18 s SER 156 CO 0.20 -2.49 1.63 0.47 0.98 0.00 0.00 173.24 174.04 2g18 n ASP 157 N -3.67 0.44 -0.37 7.02 8.00 -1.26 -2.30 116.55 124.41 2g18 n ASP 157 Ca 0.11 0.61 0.13 0.00 0.71 0.00 0.00 54.79 56.34 2g18 n ASP 157 Cb 0.60 -0.70 0.30 0.00 -0.02 0.00 0.00 41.12 41.30 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 -1.99 0.00 -1.66 1.24 3.01 -1.26 -4.97 117.46 111.82 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 0.21 -0.07 -0.00 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 -1.14 1.92 -0.24 0.00 1.01 -0.46 -5.00 121.20 117.30 2g18 s ILE 160 Ca 0.58 -0.89 -0.04 0.00 0.00 0.00 0.00 60.65 60.30 2g18 s ILE 160 Cb -0.58 -1.72 0.08 0.00 0.01 0.00 0.00 42.46 40.26 2g18 s ILE 160 CO 0.60 0.52 0.11 0.12 0.00 0.00 0.00 174.94 176.30 2g18 s PHE 161 N 0.95 0.31 0.16 3.97 5.36 -1.26 -1.24 117.98 126.24 2g18 s PHE 161 Ca -0.05 -0.68 -0.00 0.00 -0.96 0.00 0.00 56.93 55.24 2g18 s PHE 161 Cb -0.15 -0.84 -0.04 0.00 -0.34 0.00 0.00 43.02 41.65 2g18 s PHE 161 CO -0.04 -0.71 0.06 0.14 -1.46 0.00 0.00 175.22 173.21 2g18 s VAL 162 N 2.10 0.27 -0.35 3.12 -7.23 -0.31 -0.48 120.40 117.52 2g18 s VAL 162 Ca 0.06 -1.95 -0.04 0.00 -1.81 0.00 0.00 61.98 58.24 2g18 s VAL 162 Cb -0.16 -2.17 0.06 0.00 0.56 0.00 0.00 36.38 34.67 2g18 s VAL 162 CO -0.26 -0.37 0.11 -0.60 -0.31 0.00 0.00 175.10 173.68 2g18 s ARG 163 N -4.03 2.41 0.02 4.82 3.52 -0.50 -0.89 118.95 124.31 2g18 s ARG 163 Ca 0.27 -1.38 -0.30 0.00 -0.13 0.00 0.00 55.73 54.19 2g18 s ARG 163 Cb 0.07 -3.43 -0.06 0.00 -1.56 0.00 0.00 34.95 29.97 2g18 s ARG 163 CO 0.05 -0.77 1.49 -2.14 -0.81 0.00 0.00 175.30 173.12 2g18 s PRO 164 N 1.29 4.25 -0.08 5.12 0.02 -1.26 -4.37 135.00 139.97 2g18 s PRO 164 Ca -0.00 2.09 0.06 0.00 0.02 0.00 0.00 61.00 63.17 2g18 s PRO 164 Cb -0.21 -3.59 -0.24 0.00 0.02 0.00 0.00 34.50 30.48 2g18 s PRO 164 CO -0.00 -0.64 0.51 -1.13 -0.33 0.00 0.00 177.00 175.41 2g18 n SER 165 N 5.51 1.31 -4.50 2.53 3.41 -1.26 -4.78 113.62 115.83 2g18 n SER 165 Ca 0.14 0.31 -0.24 0.00 -0.26 0.00 0.00 58.87 58.82 2g18 n SER 165 Cb 0.43 -0.31 -0.10 0.00 -0.26 0.00 0.00 64.21 63.96 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 3.34 0.60 4.04 1.04 -1.26 -5.03 113.70 110.02 2g18 s SER 166 Ca -0.12 -1.21 0.38 0.00 0.48 0.00 0.00 55.95 55.48 2g18 s SER 166 Cb 0.07 -0.28 1.83 0.00 0.10 0.00 0.00 66.02 67.75 2g18 s SER 166 CO 0.80 -0.28 2.16 -0.65 0.98 0.00 0.00 173.24 176.25 2g18 h PRO 167 N 2.11 0.00 -0.13 4.02 0.11 -1.99 -2.15 132.00 133.97 2g18 h PRO 167 Ca -0.41 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.53 2g18 h PRO 167 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2g18 h PRO 167 CO 0.70 0.01 -0.63 0.93 -0.21 0.00 0.00 178.00 178.80 2g18 h GLU 168 N 0.00 0.48 -0.41 1.05 3.07 -1.99 -2.14 114.58 114.64 2g18 h GLU 168 Ca -0.00 -0.34 -0.12 0.00 -0.50 0.00 0.00 59.36 58.40 2g18 h GLU 168 Cb 0.28 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 2g18 h GLU 168 CO 0.00 0.96 -0.24 0.93 -1.40 0.00 0.00 179.01 179.26 2g18 h GLU 169 N 0.35 0.84 -0.99 2.33 5.08 -1.85 -0.19 114.58 120.16 2g18 h GLU 169 Ca -0.01 -0.36 0.02 0.00 -1.00 0.00 0.00 59.36 58.01 2g18 h GLU 169 Cb 1.19 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.35 2g18 h GLU 169 CO 0.11 0.99 0.65 0.93 -1.00 0.00 0.00 179.01 180.70 2g18 h GLU 170 N 0.73 1.27 -0.03 2.33 5.08 -1.33 0.59 114.58 123.22 2g18 h GLU 170 Ca 0.09 -0.08 -0.19 0.00 -1.00 0.00 0.00 59.36 58.19 2g18 h GLU 170 Cb 0.78 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2g18 h GLU 170 CO 0.06 0.84 -0.81 0.00 -1.00 0.00 0.00 179.01 178.11 2g18 h ALA 171 N 1.40 0.56 -0.39 3.43 0.00 -1.13 -1.90 119.26 121.23 2g18 h ALA 171 Ca 0.37 -0.66 0.02 0.00 0.00 0.00 0.00 54.91 54.64 2g18 h ALA 171 Cb -0.10 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2g18 h ALA 171 CO -0.09 0.82 0.22 0.52 0.00 0.00 0.00 179.25 180.72 2g18 h MET 172 N 0.19 0.44 -0.14 0.00 2.86 -0.44 -0.17 114.93 117.67 2g18 h MET 172 Ca -0.04 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2g18 h MET 172 Cb 1.40 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.96 2g18 h MET 172 CO 0.13 0.29 0.06 0.35 1.06 0.00 0.00 176.91 178.80 2g18 h PHE 173 N 0.45 0.21 -0.90 -0.22 3.57 -0.85 -1.39 116.94 117.81 2g18 h PHE 173 Ca 0.16 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.65 2g18 h PHE 173 Cb 0.02 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.65 2g18 h PHE 173 CO -0.08 0.28 0.57 1.25 -2.23 0.00 0.00 178.31 178.10 2g18 h LEU 174 N 0.07 1.05 -0.84 0.59 5.85 -1.17 -1.41 115.31 119.45 2g18 h LEU 174 Ca 0.05 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 2g18 h LEU 174 Cb 0.16 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2g18 h LEU 174 CO -0.00 0.78 -0.03 1.23 -0.34 0.00 0.00 178.44 180.08 2g18 h GLY 175 N 1.23 0.90 0.98 3.75 0.00 -0.70 -2.00 103.07 107.23 2g18 h GLY 175 Ca 0.33 -0.63 -0.13 0.00 0.00 0.00 0.00 47.33 46.90 2g18 h GLY 175 CO -0.07 0.58 -0.31 -0.09 0.00 0.00 0.00 176.54 176.65 2g18 h ARG 176 N 0.77 0.71 -0.51 4.80 9.65 -0.87 -1.91 114.38 127.02 2g18 h ARG 176 Ca 0.14 -0.39 0.04 0.00 -1.10 0.00 0.00 59.98 58.67 2g18 h ARG 176 Cb 0.50 0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 29.06 2g18 h ARG 176 CO 0.03 1.00 0.27 0.28 2.80 0.00 0.00 179.97 184.35 2g18 h VAL 177 N 0.45 0.99 -0.64 0.20 2.07 -1.16 0.43 116.25 118.58 2g18 h VAL 177 Ca 0.04 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.42 2g18 h VAL 177 Cb 0.89 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 2g18 h VAL 177 CO 0.08 0.10 0.38 -0.09 0.02 0.00 0.00 177.57 178.05 2g18 h ARG 178 N 0.54 0.71 -0.84 1.57 2.43 -1.19 -0.16 114.38 117.44 2g18 h ARG 178 Ca 0.22 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.32 2g18 h ARG 178 Cb 0.10 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.45 2g18 h ARG 178 CO -0.14 0.47 0.44 0.93 -1.51 0.00 0.00 179.97 180.16 2g18 h GLU 179 N 0.73 1.19 -0.52 0.20 5.08 -0.47 -0.86 114.58 119.93 2g18 h GLU 179 Ca 0.27 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2g18 h GLU 179 Cb 0.09 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 2g18 h GLU 179 CO -0.14 0.89 0.32 0.74 -1.00 0.00 0.00 179.01 179.83 2g18 h PHE 180 N 1.18 0.67 -0.37 4.33 0.04 -0.18 -1.44 116.94 121.17 2g18 h PHE 180 Ca 0.29 0.01 -0.07 0.00 2.80 0.00 0.00 57.97 60.99 2g18 h PHE 180 Cb 0.07 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 37.98 2g18 h PHE 180 CO 0.01 0.44 -0.08 -0.07 -0.60 0.00 0.00 178.31 178.02 2g18 h LEU 181 N 0.69 0.61 -0.44 1.54 3.38 -0.53 -0.36 115.31 120.20 2g18 h LEU 181 Ca 0.19 -0.16 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 2g18 h LEU 181 Cb -0.04 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2g18 h LEU 181 CO -0.04 0.73 -0.23 1.56 0.09 0.00 0.00 178.44 180.55 2g18 h GLN 182 N 0.58 0.92 -0.44 1.13 4.20 -0.84 0.92 115.11 121.59 2g18 h GLN 182 Ca 0.11 -0.41 -0.04 0.00 0.06 0.00 0.00 58.65 58.37 2g18 h GLN 182 Cb 0.49 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 2g18 h GLN 182 CO 0.03 1.07 0.11 0.28 -0.67 0.00 0.00 178.83 179.65 2g18 h VAL 183 N 0.76 1.23 -0.54 -0.54 2.07 -1.11 -2.11 116.25 116.01 2g18 h VAL 183 Ca 0.09 -0.80 -0.12 0.00 0.82 0.00 0.00 66.70 66.70 2g18 h VAL 183 Cb 0.80 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 2g18 h VAL 183 CO 0.07 0.28 -0.12 -0.74 0.02 0.00 0.00 177.57 177.08 2g18 h HIS 184 N 0.58 1.15 -0.20 1.57 -0.00 -0.82 0.15 115.15 117.57 2g18 h HIS 184 Ca 0.14 -0.24 -0.13 0.00 -0.00 0.00 0.00 60.37 60.14 2g18 h HIS 184 Cb 0.31 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 27.43 2g18 h HIS 184 CO 0.02 1.06 -0.43 0.00 -0.00 0.00 0.00 177.93 178.58 2g18 h GLN 186 N 0.39 0.38 -0.55 0.00 4.20 -0.96 -1.88 115.11 116.69 2g18 h GLN 186 Ca 0.03 -0.07 0.11 0.00 0.06 0.00 0.00 58.65 58.79 2g18 h GLN 186 Cb 0.92 -0.06 -0.10 0.00 0.30 0.00 0.00 27.48 28.54 2g18 h GLN 186 CO 0.08 0.41 -0.04 0.78 -0.67 0.00 0.00 178.83 179.39 2g18 h GLY 187 N 0.26 0.53 1.00 3.46 0.00 -0.35 -2.02 103.07 105.95 2g18 h GLY 187 Ca 0.08 0.10 -0.10 0.00 0.00 0.00 0.00 47.33 47.42 2g18 h GLY 187 CO -0.01 -0.18 -0.15 0.00 0.00 0.00 0.00 176.54 176.20 2g18 h ALA 188 N 1.52 0.55 0.00 3.60 0.00 -1.01 -2.42 119.26 121.49 2g18 h ALA 188 Ca 0.28 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2g18 h ALA 188 Cb 0.44 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2g18 h ALA 188 CO -0.50 0.46 -0.28 0.82 0.00 0.00 0.00 179.25 179.76 2g18 h ILE 189 N 0.60 1.17 0.00 0.00 2.04 -1.12 -2.93 117.51 117.28 2g18 h ILE 189 Ca 0.09 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 64.99 2g18 h ILE 189 Cb 0.69 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2g18 h ILE 189 CO 0.05 0.27 -0.19 0.00 0.00 0.00 0.00 178.15 178.29 2g18 n ALA 190 N -2.47 2.48 -1.98 1.87 0.00 -0.78 -4.95 120.51 114.68 2g18 n ALA 190 Ca -0.02 -0.09 -0.40 0.00 0.00 0.00 0.00 53.44 52.93 2g18 n ALA 190 Cb 0.33 -1.38 -0.05 0.00 0.00 0.00 0.00 19.45 18.35 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 -3.12 3.33 0.23 0.00 0.00 -0.95 -5.06 121.76 116.19 2g18 s ALA 191 Ca 0.09 0.54 0.09 0.00 0.00 0.00 0.00 51.96 52.68 2g18 s ALA 191 Cb 0.13 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 2g18 s ALA 191 CO 0.63 0.15 0.01 -1.12 0.00 0.00 0.00 175.76 175.43 2g18 s SER 192 N -0.76 4.67 0.30 0.00 0.01 -1.26 -5.05 113.70 111.61 2g18 s SER 192 Ca 0.42 -0.53 -0.30 0.00 1.31 0.00 0.00 55.95 56.84 2g18 s SER 192 Cb -0.24 -0.93 -0.12 0.00 0.21 0.00 0.00 66.02 64.93 2g18 s SER 192 CO 0.30 0.03 1.46 -2.65 0.41 0.00 0.00 173.24 172.79 2g18 n PRO 193 N -0.62 2.37 -2.52 12.44 -0.02 -1.26 -4.59 135.00 140.80 2g18 n PRO 193 Ca -0.08 0.84 -0.24 0.00 -2.02 0.00 0.00 63.50 62.00 2g18 n PRO 193 Cb 0.57 -2.53 0.04 0.00 -0.02 0.00 0.00 33.50 31.57 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 -0.40 2.87 0.91 -1.45 -7.23 -0.38 -5.03 120.40 109.69 2g18 s VAL 194 Ca 0.62 -0.43 -0.11 0.00 -1.81 0.00 0.00 61.98 60.25 2g18 s VAL 194 Cb -0.56 -3.13 0.14 0.00 0.56 0.00 0.00 36.38 33.39 2g18 s VAL 194 CO 0.54 -0.11 1.09 -0.94 -0.31 0.00 0.00 175.10 175.37 2g18 s SER 195 N -4.41 3.29 0.17 4.85 1.04 -1.26 -4.76 113.70 112.62 2g18 s SER 195 Ca 0.56 1.66 -0.15 0.00 0.48 0.00 0.00 55.95 58.51 2g18 s SER 195 Cb -0.10 -2.31 0.11 0.00 0.10 0.00 0.00 66.02 63.82 2g18 s SER 195 CO 0.41 -2.78 1.75 0.00 0.98 0.00 0.00 173.24 173.59 2g18 h ALA 196 N -1.65 0.50 -0.40 5.32 0.00 -1.98 0.11 119.26 121.16 2g18 h ALA 196 Ca -0.49 0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.57 2g18 h ALA 196 Cb 1.28 0.04 -0.09 0.00 0.00 0.00 0.00 17.79 19.02 2g18 h ALA 196 CO 0.51 -0.25 -0.19 1.49 0.00 0.00 0.00 179.25 180.81 2g18 h GLU 197 N 0.30 -0.12 -0.45 0.00 4.81 -2.00 -1.24 114.58 115.88 2g18 h GLU 197 Ca 0.20 0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.30 2g18 h GLU 197 Cb 0.20 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 2g18 h GLU 197 CO -0.21 -0.08 -0.28 1.96 -0.73 0.00 0.00 179.01 179.67 2g18 h GLN 198 N -0.12 0.97 -0.55 1.92 4.20 -1.77 -3.04 115.11 116.73 2g18 h GLN 198 Ca 0.20 -0.45 0.10 0.00 0.06 0.00 0.00 58.65 58.56 2g18 h GLN 198 Cb 0.42 -0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.11 2g18 h GLN 198 CO -0.48 1.12 0.07 -0.22 -0.67 0.00 0.00 178.83 178.65 2g18 h LYS 199 N 0.82 0.19 -0.57 1.46 3.64 -0.31 -1.73 116.57 120.05 2g18 h LYS 199 Ca 0.09 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.53 2g18 h LYS 199 Cb 0.86 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.58 2g18 h LYS 199 CO 0.08 0.12 0.26 1.96 -2.27 0.00 0.00 179.45 179.60 2g18 h GLN 200 N 0.19 0.47 -0.04 1.90 4.20 -1.13 0.29 115.11 121.00 2g18 h GLN 200 Ca 0.28 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.96 2g18 h GLN 200 Cb 0.42 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 2g18 h GLN 200 CO -0.40 0.31 -0.00 1.96 -0.67 0.00 0.00 178.83 180.03 2g18 h GLN 201 N 0.48 0.07 -0.55 1.46 4.20 -1.42 -2.38 115.11 116.97 2g18 h GLN 201 Ca 0.27 -0.02 0.08 0.00 0.06 0.00 0.00 58.65 59.04 2g18 h GLN 201 Cb 0.25 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 27.96 2g18 h GLN 201 CO -0.23 0.36 0.21 0.82 -0.67 0.00 0.00 178.83 179.31 2g18 h ILE 202 N -0.23 0.81 -0.61 2.54 2.04 -1.07 0.13 117.51 121.13 2g18 h ILE 202 Ca 0.01 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.64 2g18 h ILE 202 Cb 0.33 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 2g18 h ILE 202 CO 0.00 0.07 0.01 0.25 0.00 0.00 0.00 178.15 178.49 2g18 h LEU 203 N 0.39 1.04 -1.05 1.44 5.85 -0.95 -0.52 115.31 121.49 2g18 h LEU 203 Ca 0.27 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 2g18 h LEU 203 Cb 0.30 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2g18 h LEU 203 CO -0.27 1.08 0.16 0.00 -0.34 0.00 0.00 178.44 179.07 2g18 h ALA 204 N 0.99 1.24 0.03 1.25 0.00 -0.83 -1.28 119.26 120.66 2g18 h ALA 204 Ca 0.17 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2g18 h ALA 204 Cb 0.54 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2g18 h ALA 204 CO 0.03 0.53 -0.01 0.78 0.00 0.00 0.00 179.25 180.58 2g18 h GLY 205 N 0.96 -0.04 0.96 0.00 0.00 0.04 0.58 103.07 105.58 2g18 h GLY 205 Ca 0.18 0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.54 2g18 h GLY 205 CO -0.01 -0.01 0.25 1.46 0.00 0.00 0.00 176.54 178.23 2g18 h GLN 206 N -0.08 0.50 -0.40 4.80 4.20 -1.02 -1.47 115.11 121.64 2g18 h GLN 206 Ca -0.00 -0.03 0.05 0.00 0.06 0.00 0.00 58.65 58.73 2g18 h GLN 206 Cb 0.07 -0.11 -0.05 0.00 0.30 0.00 0.00 27.48 27.69 2g18 h GLN 206 CO 0.01 0.33 0.13 1.25 -0.67 0.00 0.00 178.83 179.87 2g18 h HIS 207 N 0.52 0.22 -0.30 2.96 2.76 -0.96 0.38 115.15 120.73 2g18 h HIS 207 Ca 0.15 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.39 2g18 h HIS 207 Cb -0.03 -0.04 -0.04 0.00 1.55 0.00 0.00 27.41 28.84 2g18 h HIS 207 CO -0.06 0.07 0.03 -0.97 -1.30 0.00 0.00 177.93 175.71 2g18 h ASN 208 N 0.28 -0.05 -0.22 3.26 -0.73 -0.71 -1.12 115.58 116.28 2g18 h ASN 208 Ca 0.19 0.06 0.04 0.00 1.87 0.00 0.00 56.30 58.46 2g18 h ASN 208 Cb 0.19 0.09 -0.04 0.00 0.27 0.00 0.00 38.32 38.83 2g18 h ASN 208 CO -0.21 0.01 -0.05 0.22 -0.37 0.00 0.00 177.43 177.03 2g18 h TYR 209 N 0.13 -0.11 -0.26 0.67 3.20 -0.63 -1.61 116.97 118.35 2g18 h TYR 209 Ca 0.14 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.92 2g18 h TYR 209 Cb 0.17 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 2g18 h TYR 209 CO -0.20 -0.09 -0.32 0.00 -1.64 0.00 0.00 178.16 175.91 2g18 h SER 211 N 0.47 0.63 -0.63 0.00 4.64 -0.97 -0.70 113.55 116.99 2g18 h SER 211 Ca 0.05 -0.42 0.01 0.00 -0.47 0.00 0.00 61.79 60.97 2g18 h SER 211 Cb 0.79 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.67 2g18 h SER 211 CO 0.06 0.91 0.41 0.11 -0.87 0.00 0.00 176.83 177.46 2g18 h LYS 212 N 0.35 0.81 -0.42 4.77 1.79 -1.29 -0.26 116.57 122.30 2g18 h LYS 212 Ca 0.06 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.47 2g18 h LYS 212 Cb 0.69 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 31.14 2g18 h LYS 212 CO 0.05 0.53 0.21 1.96 -1.08 0.00 0.00 179.45 181.12 2g18 h GLN 213 N 0.83 0.61 -0.24 3.15 1.08 -1.35 -2.06 115.11 117.12 2g18 h GLN 213 Ca 0.24 -0.09 0.04 0.00 -1.45 0.00 0.00 58.65 57.38 2g18 h GLN 213 Cb -0.07 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.21 2g18 h GLN 213 CO -0.06 0.53 0.02 1.96 -0.95 0.00 0.00 178.83 180.32 2g18 h GLN 214 N 0.55 0.10 -0.01 1.46 4.20 -0.80 0.22 115.11 120.83 2g18 h GLN 214 Ca 0.15 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.85 2g18 h GLN 214 Cb 0.12 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 2g18 h GLN 214 CO -0.02 0.07 0.01 1.96 -0.67 0.00 0.00 178.83 180.18 2g18 h GLN 215 N 0.10 0.00 0.00 1.46 4.20 -0.81 -3.36 115.11 116.70 2g18 h GLN 215 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2g18 h GLN 215 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 2g18 h GLN 215 CO -0.18 0.00 -0.56 0.09 -0.67 0.00 0.00 178.83 177.52 2g18 n ASN 216 N -3.83 2.79 -4.69 1.46 3.02 -0.80 -5.04 115.26 108.18 2g18 n ASN 216 Ca -0.03 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.09 2g18 n ASN 216 Cb 0.09 0.51 -0.02 0.00 -0.61 0.00 0.00 39.78 39.76 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 -0.92 2.80 -0.01 6.41 -0.08 0.73 -4.89 116.55 120.58 2g18 n ASP 217 Ca 0.00 1.18 0.13 0.00 -1.51 0.00 0.00 54.79 54.58 2g18 n ASP 217 Cb 0.05 -1.46 0.40 0.00 2.34 0.00 0.00 41.12 42.44 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 1.30 0.06 0.26 -0.67 5.02 -1.26 -3.65 118.16 119.22 2g18 n LYS 218 Ca 0.08 -0.03 0.13 0.00 -2.02 0.00 0.00 58.31 56.48 2g18 n LYS 218 Cb 0.34 -1.50 0.65 0.00 -0.02 0.00 0.00 35.03 34.50 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 0.06 0.40 -0.74 -0.18 1.35 -1.98 -2.88 112.91 108.94 2g18 h THR 219 Ca 0.00 -0.71 0.13 0.00 -0.55 0.00 0.00 66.41 65.28 2g18 h THR 219 Cb 0.49 1.51 -0.14 0.00 -1.73 0.00 0.00 68.15 68.29 2g18 h THR 219 CO 0.00 0.12 -0.30 -0.09 -0.25 0.00 0.00 175.52 175.00 2g18 h ARG 220 N 0.00 -0.07 -0.45 4.72 2.43 -1.95 -0.86 114.38 118.19 2g18 h ARG 220 Ca -0.00 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.23 2g18 h ARG 220 Cb 0.50 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.02 2g18 h ARG 220 CO 0.02 -0.05 0.15 -0.09 -1.51 0.00 0.00 179.97 178.48 2g18 h ARG 221 N -0.08 0.30 -0.59 0.20 2.43 -1.79 0.17 114.38 115.02 2g18 h ARG 221 Ca 0.30 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.47 2g18 h ARG 221 Cb 0.57 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 2g18 h ARG 221 CO -0.79 0.20 0.38 0.28 -1.51 0.00 0.00 179.97 178.53 2g18 h VAL 222 N 0.31 1.11 -0.31 0.20 2.07 -1.53 -2.24 116.25 115.86 2g18 h VAL 222 Ca 0.21 -0.26 -0.17 0.00 0.82 0.00 0.00 66.70 67.31 2g18 h VAL 222 Cb 0.22 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2g18 h VAL 222 CO -0.23 0.14 -0.47 -0.07 0.02 0.00 0.00 177.57 176.96 2g18 h LEU 223 N 0.76 0.90 -0.31 2.57 3.38 -0.10 -1.83 115.31 120.68 2g18 h LEU 223 Ca 0.23 -0.45 0.02 0.00 0.09 0.00 0.00 57.88 57.77 2g18 h LEU 223 Cb -0.03 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 2g18 h LEU 223 CO -0.08 1.23 0.14 -0.33 0.09 0.00 0.00 178.44 179.49 2g18 h GLU 224 N 0.65 0.29 0.00 1.13 5.08 -0.57 0.53 114.58 121.70 2g18 h GLU 224 Ca 0.03 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 2g18 h GLU 224 Cb 1.06 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 2g18 h GLU 224 CO 0.11 0.19 -0.23 0.87 -1.00 0.00 0.00 179.01 178.95 2g18 h LYS 225 N 0.30 0.00 0.18 2.33 1.57 -1.26 0.45 116.57 120.15 2g18 h LYS 225 Ca 0.13 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.66 2g18 h LYS 225 Cb 0.06 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.39 2g18 h LYS 225 CO -0.10 0.23 -1.14 0.00 -0.57 0.00 0.00 179.45 177.88 2g18 h ALA 226 N 1.77 -0.09 0.00 3.86 0.00 -0.84 -3.43 119.26 120.53 2g18 h ALA 226 Ca -0.00 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.10 2g18 h ALA 226 Cb 0.47 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2g18 h ALA 226 CO 0.03 0.55 0.00 1.19 0.00 0.00 0.00 179.25 181.02 2g18 n PHE 227 N -3.95 0.00 0.00 0.00 3.01 0.13 -4.72 117.46 111.94 2g18 n PHE 227 Ca -0.16 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.30 2g18 n PHE 227 Cb 0.94 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.41 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 0.15 0.77 0.24 1.37 0.00 0.16 -4.57 105.19 103.31 2g18 n GLY 228 Ca 0.00 -1.88 -0.13 0.00 0.00 0.00 0.00 46.02 44.01 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 1.28 -0.16 1.61 2.07 -1.90 -2.64 116.25 116.51 2g18 h VAL 229 Ca 0.00 -1.44 -0.22 0.00 0.82 0.00 0.00 66.70 65.86 2g18 h VAL 229 Cb 0.00 1.40 0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2g18 h VAL 229 CO 0.00 0.48 -0.76 0.44 0.02 0.00 0.00 177.57 177.74 2g18 h ASP 230 N 0.63 0.95 -0.29 0.57 5.19 -1.97 -0.36 116.42 121.15 2g18 h ASP 230 Ca 0.07 -0.63 0.02 0.00 -0.62 0.00 0.00 57.03 55.88 2g18 h ASP 230 Cb 0.86 -0.28 -0.03 0.00 0.18 0.00 0.00 39.33 40.06 2g18 h ASP 230 CO 0.07 1.42 0.12 -0.25 -3.12 0.00 0.00 179.24 177.49 2g18 h TRP 231 N 0.54 0.23 -0.70 4.55 7.01 -1.80 0.17 115.95 125.95 2g18 h TRP 231 Ca -0.05 0.01 -0.05 0.00 2.11 0.00 0.00 58.89 60.91 2g18 h TRP 231 Cb 1.39 -0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 28.36 2g18 h TRP 231 CO 0.09 0.12 0.23 0.00 -2.79 0.00 0.00 178.44 176.09 2g18 h ALA 232 N 1.16 0.91 -0.30 2.65 0.00 -1.33 -0.68 119.26 121.68 2g18 h ALA 232 Ca 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2g18 h ALA 232 Cb 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2g18 h ALA 232 CO -0.10 0.58 0.16 1.49 0.00 0.00 0.00 179.25 181.38 2g18 h GLU 233 N 1.02 0.42 -0.62 0.00 4.57 -0.78 -1.41 114.58 117.77 2g18 h GLU 233 Ca 0.23 -0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.37 2g18 h GLU 233 Cb 0.28 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 2g18 h GLU 233 CO -0.01 0.37 0.41 -0.97 -1.18 0.00 0.00 179.01 177.63 2g18 h ASN 234 N 0.36 0.68 -0.16 1.04 -0.73 -0.70 -2.00 115.58 114.08 2g18 h ASN 234 Ca 0.10 -0.01 -0.15 0.00 1.87 0.00 0.00 56.30 58.11 2g18 h ASN 234 Cb 0.07 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 38.51 2g18 h ASN 234 CO -0.02 0.48 -0.51 0.22 -0.37 0.00 0.00 177.43 177.24 2g18 h TYR 235 N 0.79 0.81 -0.73 0.67 3.20 -0.64 -0.95 116.97 120.13 2g18 h TYR 235 Ca 0.24 -0.33 -0.01 0.00 3.14 0.00 0.00 58.73 61.77 2g18 h TYR 235 Cb -0.01 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.09 2g18 h TYR 235 CO -0.00 1.11 0.41 0.52 -1.64 0.00 0.00 178.16 178.56 2g18 h MET 236 N 0.28 1.01 0.00 1.82 2.86 -1.09 0.92 114.93 120.72 2g18 h MET 236 Ca -0.02 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 2g18 h MET 236 Cb 1.13 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.59 2g18 h MET 236 CO 0.11 0.74 -1.05 0.25 1.06 0.00 0.00 176.91 178.02 2g18 n THR 237 N -4.48 0.41 0.12 2.22 -2.24 -0.77 -0.98 114.28 108.56 2g18 n THR 237 Ca 0.06 -0.43 0.02 0.00 -2.27 0.00 0.00 64.05 61.43 2g18 n THR 237 Cb 0.08 -0.15 -0.03 0.00 -2.10 0.00 0.00 70.33 68.13 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 -2.38 0.00 -0.04 4.28 -2.24 -0.36 -3.83 114.28 109.71 2g18 n THR 238 Ca 0.01 -0.26 -0.08 0.00 -2.27 0.00 0.00 64.05 61.44 2g18 n THR 238 Cb 0.51 0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 69.44 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 -1.36 0.59 -0.07 2.28 0.31 0.25 -4.71 118.33 115.63 2g18 n VAL 239 Ca 0.00 -0.06 -0.14 0.00 -0.01 0.00 0.00 64.34 64.13 2g18 n VAL 239 Cb 0.09 -1.65 -0.12 0.00 -0.91 0.00 0.00 33.84 31.25 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 -0.31 0.00 -5.85 7.52 3.38 -1.45 -3.41 115.31 115.18 2g18 h LEU 240 Ca -0.19 -0.93 -0.52 0.00 0.09 0.00 0.00 57.88 56.33 2g18 h LEU 240 Cb 1.08 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.42 2g18 h LEU 240 CO -0.12 1.02 -1.03 0.49 0.09 0.00 0.00 178.44 178.89 2g18 n PHE 241 N -4.60 1.16 -2.42 1.13 3.72 -0.15 -5.01 117.46 111.28 2g18 n PHE 241 Ca -0.11 -3.84 -0.41 0.00 -0.05 0.00 0.00 57.45 53.04 2g18 n PHE 241 Cb 0.48 -0.43 -0.04 0.00 -0.94 0.00 0.00 39.48 38.55 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 -2.49 7.18 0.34 4.37 -4.77 -1.25 -4.66 116.67 115.38 2g18 s ASP 242 Ca 0.41 2.27 -0.29 0.00 -3.30 0.00 0.00 52.55 51.64 2g18 s ASP 242 Cb 0.30 -2.62 -0.11 0.00 -1.09 0.00 0.00 42.92 39.40 2g18 s ASP 242 CO -0.09 -0.25 1.44 -0.76 0.70 0.00 0.00 175.17 176.20 2g18 s LEU 243 N -0.98 4.36 0.66 2.11 1.43 -1.26 -4.89 118.68 120.11 2g18 s LEU 243 Ca 0.48 2.89 0.29 0.00 -1.03 0.00 0.00 54.13 56.76 2g18 s LEU 243 Cb -0.32 -3.65 1.58 0.00 0.03 0.00 0.00 46.19 43.82 2g18 s LEU 243 CO 0.40 -0.75 1.89 1.55 0.23 0.00 0.00 176.35 179.66 2g18 h PRO 244 N 3.49 0.00 0.00 1.29 0.13 -1.91 -3.52 132.00 131.47 2g18 h PRO 244 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2g18 h PRO 244 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2g18 h PRO 244 CO 0.67 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.83