#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cmc h HIS -3 N 0.00 0.00 -0.26 -1.40 -0.00 -2.05 -1.62 115.15 109.83 2cmc h HIS -3 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 60.37 60.21 2cmc h HIS -3 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 2cmc h HIS -3 CO 0.00 0.00 -0.48 1.25 -0.00 0.00 0.00 177.93 178.70 2cmc h HIS -2 N 0.00 0.98 -0.39 2.45 -0.00 -2.05 -0.21 115.15 115.93 2cmc h HIS -2 Ca 0.29 -0.35 0.00 0.00 -0.00 0.00 0.00 60.37 60.32 2cmc h HIS -2 Cb 1.28 -0.18 -0.02 0.00 -0.00 0.00 0.00 27.41 28.49 2cmc h HIS -2 CO 0.00 1.15 0.25 0.45 -0.00 0.00 0.00 177.93 179.78 2cmc h HIS -1 N 0.53 0.50 -0.48 5.26 -0.00 -1.74 0.32 115.15 119.53 2cmc h HIS -1 Ca 0.01 0.01 -0.10 0.00 -0.00 0.00 0.00 60.37 60.30 2cmc h HIS -1 Cb 1.08 -0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 28.31 2cmc h HIS -1 CO 0.08 0.33 -0.07 0.45 -0.00 0.00 0.00 177.93 178.72 2cmc h HIS 0 N 0.52 1.00 -0.22 2.45 -0.00 -1.51 -1.20 115.15 116.20 2cmc h HIS 0 Ca 0.14 -0.20 0.03 0.00 -0.00 0.00 0.00 60.37 60.34 2cmc h HIS 0 Cb -0.04 -0.25 -0.03 0.00 -0.00 0.00 0.00 27.41 27.09 2cmc h HIS 0 CO -0.04 0.96 0.05 1.25 -0.00 0.00 0.00 177.93 180.15 2cmc h HIS 1 N 0.76 0.09 -0.26 2.45 -0.00 -0.64 0.76 115.15 118.31 2cmc h HIS 1 Ca 0.13 0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.52 2cmc h HIS 1 Cb 0.61 -0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 27.99 2cmc h HIS 1 CO 0.05 0.03 0.15 0.93 -0.00 0.00 0.00 177.93 179.09 2cmc h GLU 2 N 0.14 0.31 -0.37 5.26 4.39 -0.82 -0.99 114.58 122.51 2cmc h GLU 2 Ca 0.10 -0.02 0.06 0.00 0.34 0.00 0.00 59.36 59.84 2cmc h GLU 2 Cb 0.09 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.61 2cmc h GLU 2 CO -0.12 0.21 0.04 0.52 -1.16 0.00 0.00 179.01 178.49 2cmc h MET 3 N 0.32 0.14 -0.32 2.33 2.86 -0.79 -0.24 114.93 119.24 2cmc h MET 3 Ca 0.10 -0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 2cmc h MET 3 Cb -0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 2cmc h MET 3 CO -0.04 0.10 -0.03 0.93 1.06 0.00 0.00 176.91 178.92 2cmc h GLU 4 N 0.15 0.58 -0.25 1.72 5.08 -0.63 -1.74 114.58 119.49 2cmc h GLU 4 Ca 0.18 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2cmc h GLU 4 Cb 0.23 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2cmc h GLU 4 CO -0.27 0.74 0.11 -0.22 -1.00 0.00 0.00 179.01 178.37 2cmc h LYS 5 N 0.37 0.36 0.13 2.33 3.64 -1.03 0.02 116.57 122.39 2cmc h LYS 5 Ca 0.09 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.43 2cmc h LYS 5 Cb 0.49 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.21 2cmc h LYS 5 CO 0.02 0.38 -0.34 1.49 -2.27 0.00 0.00 179.45 178.74 2cmc h GLU 6 N 0.26 -0.55 -0.55 1.90 4.57 -1.02 0.50 114.58 119.69 2cmc h GLU 6 Ca 0.08 0.04 0.10 0.00 -1.18 0.00 0.00 59.36 58.40 2cmc h GLU 6 Cb 0.15 0.13 -0.08 0.00 -0.16 0.00 0.00 28.75 28.79 2cmc h GLU 6 CO -0.01 -0.37 0.11 0.35 -1.18 0.00 0.00 179.01 177.91 2cmc h PHE 7 N -0.57 0.17 -0.91 0.92 3.57 -1.13 -0.85 116.94 118.14 2cmc h PHE 7 Ca 0.03 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2cmc h PHE 7 Cb 0.60 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 2cmc h PHE 7 CO -0.30 -0.02 0.57 0.93 -2.23 0.00 0.00 178.31 177.26 2cmc h GLU 8 N 0.24 1.23 -0.28 1.11 5.08 -0.04 0.23 114.58 122.16 2cmc h GLU 8 Ca 0.28 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 2cmc h GLU 8 Cb 0.40 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2cmc h GLU 8 CO -0.37 0.84 0.12 1.96 -1.00 0.00 0.00 179.01 180.56 2cmc h GLN 9 N 1.25 0.41 -0.62 2.33 1.08 0.13 0.82 115.11 120.52 2cmc h GLN 9 Ca 0.33 -0.07 -0.09 0.00 -1.45 0.00 0.00 58.65 57.37 2cmc h GLN 9 Cb -0.09 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.25 2cmc h GLN 9 CO -0.07 0.43 0.05 0.82 -0.95 0.00 0.00 178.83 179.11 2cmc h ILE 10 N 0.30 1.26 0.19 2.54 2.04 -1.00 -2.66 117.51 120.19 2cmc h ILE 10 Ca 0.09 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 2cmc h ILE 10 Cb 0.17 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 2cmc h ILE 10 CO -0.01 0.40 -0.09 -0.78 0.00 0.00 0.00 178.15 177.67 2cmc h ASP 11 N 0.97 -0.22 -0.72 1.72 -0.00 -0.74 0.38 116.42 117.81 2cmc h ASP 11 Ca 0.18 -0.30 0.08 0.00 -0.00 0.00 0.00 57.03 56.99 2cmc h ASP 11 Cb 0.50 0.06 -0.05 0.00 -0.00 0.00 0.00 39.33 39.84 2cmc h ASP 11 CO 0.02 0.24 0.48 0.07 -0.00 0.00 0.00 179.24 180.05 2cmc h LYS 12 N -0.75 0.66 -0.07 0.28 2.10 -0.89 0.27 116.57 118.16 2cmc h LYS 12 Ca -0.03 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.58 2cmc h LYS 12 Cb 0.51 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 31.69 2cmc h LYS 12 CO 0.04 0.44 0.00 -1.13 -2.00 0.00 0.00 179.45 176.80 2cmc n SER 13 N -4.49 1.17 -3.79 7.07 3.41 -1.00 -4.93 113.62 111.06 2cmc n SER 13 Ca 0.11 -1.51 -0.31 0.00 -0.26 0.00 0.00 58.87 56.91 2cmc n SER 13 Cb 0.28 -0.04 0.02 0.00 -0.26 0.00 0.00 64.21 64.22 2cmc n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cmc n GLY 14 N 1.08 -0.75 1.19 5.00 0.00 0.93 -4.87 105.19 107.77 2cmc n GLY 14 Ca 0.18 0.35 0.12 0.00 0.00 0.00 0.00 46.02 46.67 2cmc n GLY 14 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cmc n SER 15 N -2.73 3.56 -0.33 1.61 7.64 0.03 -4.49 113.62 118.91 2cmc n SER 15 Ca -0.16 -2.00 -0.04 0.00 1.01 0.00 0.00 58.87 57.69 2cmc n SER 15 Cb 0.62 -0.28 0.10 0.00 -1.01 0.00 0.00 64.21 63.63 2cmc n SER 15 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 2cmc h TRP 16 N 4.50 1.23 -0.31 1.43 4.06 -1.90 -2.89 115.95 122.07 2cmc h TRP 16 Ca 0.00 -0.03 0.06 0.00 2.06 0.00 0.00 58.89 60.99 2cmc h TRP 16 Cb 1.00 -0.39 -0.06 0.00 -1.00 0.00 0.00 29.16 28.70 2cmc h TRP 16 CO 0.28 0.84 -0.11 0.00 -3.56 0.00 0.00 178.44 175.90 2cmc h ALA 17 N 1.29 0.16 -0.24 1.49 0.00 -1.89 -0.30 119.26 119.77 2cmc h ALA 17 Ca 0.32 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.31 2cmc h ALA 17 Cb 0.02 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2cmc h ALA 17 CO -0.05 -0.49 0.00 0.00 0.00 0.00 0.00 179.25 178.71 2cmc h ALA 18 N 1.24 0.33 -0.25 0.00 0.00 -1.87 0.14 119.26 118.84 2cmc h ALA 18 Ca 0.15 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.90 2cmc h ALA 18 Cb 0.28 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2cmc h ALA 18 CO -0.34 0.06 -0.05 0.82 0.00 0.00 0.00 179.25 179.73 2cmc h ILE 19 N 0.20 0.76 -0.96 0.00 1.08 -1.28 0.30 117.51 117.61 2cmc h ILE 19 Ca 0.07 -0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.53 2cmc h ILE 19 Cb 0.41 0.75 -0.05 0.00 -3.07 0.00 0.00 36.82 34.86 2cmc h ILE 19 CO 0.01 0.00 0.60 0.22 -0.69 0.00 0.00 178.15 178.29 2cmc h TYR 20 N 0.01 1.25 -0.81 1.37 3.20 -0.95 -2.09 116.97 118.96 2cmc h TYR 20 Ca 0.12 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 2cmc h TYR 20 Cb 0.18 -0.41 -0.04 0.00 1.54 0.00 0.00 36.73 38.00 2cmc h TYR 20 CO -0.24 0.82 0.37 0.37 -1.64 0.00 0.00 178.16 177.84 2cmc h GLN 21 N 1.32 1.19 -0.59 1.82 5.75 0.45 -1.71 115.11 123.34 2cmc h GLN 21 Ca 0.35 -0.19 -0.08 0.00 -0.15 0.00 0.00 58.65 58.58 2cmc h GLN 21 Cb -0.08 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 28.24 2cmc h GLN 21 CO -0.07 0.93 0.05 -0.44 -2.65 0.00 0.00 178.83 176.65 2cmc h ASP 22 N 1.16 0.95 -0.11 -0.69 3.32 -0.39 0.49 116.42 121.15 2cmc h ASP 22 Ca 0.28 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2cmc h ASP 22 Cb 0.15 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 2cmc h ASP 22 CO -0.03 0.98 0.07 0.40 -1.72 0.00 0.00 179.24 178.94 2cmc h ILE 23 N 0.91 1.04 -0.01 0.35 2.04 -1.16 0.10 117.51 120.79 2cmc h ILE 23 Ca 0.18 -0.09 -0.00 0.00 1.00 0.00 0.00 64.86 65.94 2cmc h ILE 23 Cb 0.47 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2cmc h ILE 23 CO 0.02 0.04 0.00 0.03 0.00 0.00 0.00 178.15 178.24 2cmc h ARG 24 N 0.13 0.02 0.00 2.37 3.08 -1.10 -0.54 114.38 118.34 2cmc h ARG 24 Ca 0.04 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2cmc h ARG 24 Cb 0.00 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 2cmc h ARG 24 CO -0.01 0.14 -0.04 1.25 -1.07 0.00 0.00 179.97 180.25 2cmc h HIS 25 N -0.12 0.00 -0.02 3.04 2.76 -0.72 -2.77 115.15 117.33 2cmc h HIS 25 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2cmc h HIS 25 Cb 0.13 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.09 2cmc h HIS 25 CO -0.03 0.04 -0.29 0.39 -1.30 0.00 0.00 177.93 176.74 2cmc n GLU 26 N -3.47 1.56 -1.72 5.26 1.02 0.34 -5.02 120.64 118.62 2cmc n GLU 26 Ca -0.02 -1.08 -0.39 0.00 -0.02 0.00 0.00 57.16 55.65 2cmc n GLU 26 Cb 0.15 -1.36 0.04 0.00 -0.02 0.00 0.00 31.44 30.25 2cmc n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2cmc n ALA 27 N 0.22 1.33 -1.81 0.62 0.00 -0.23 -4.97 120.51 115.67 2cmc n ALA 27 Ca 0.09 0.15 -0.32 0.00 0.00 0.00 0.00 53.44 53.36 2cmc n ALA 27 Cb 0.41 -2.30 -0.00 0.00 0.00 0.00 0.00 19.45 17.56 2cmc n ALA 27 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2cmc s SER 28 N -0.86 6.26 -0.11 0.00 1.04 -1.26 -5.06 113.70 113.71 2cmc s SER 28 Ca 0.69 1.53 -0.00 0.00 0.48 0.00 0.00 55.95 58.65 2cmc s SER 28 Cb -0.44 -2.49 0.02 0.00 0.10 0.00 0.00 66.02 63.21 2cmc s SER 28 CO 0.51 -0.84 -0.08 -0.62 0.98 0.00 0.00 173.24 173.19 2cmc s ASP 29 N -3.60 2.14 0.32 7.02 2.15 -1.26 -4.91 116.67 118.53 2cmc s ASP 29 Ca 0.58 -0.30 0.10 0.00 0.43 0.00 0.00 52.55 53.36 2cmc s ASP 29 Cb -0.11 -0.83 -0.06 0.00 -0.30 0.00 0.00 42.92 41.62 2cmc s ASP 29 CO 0.44 -0.11 -0.13 -0.36 -0.17 0.00 0.00 175.17 174.84 2cmc s PHE 30 N 1.66 2.34 0.51 -5.34 0.08 -1.26 -5.13 117.98 110.84 2cmc s PHE 30 Ca 0.04 -0.45 -0.20 0.00 0.12 0.00 0.00 56.93 56.44 2cmc s PHE 30 Cb -0.13 -1.23 -0.07 0.00 -0.57 0.00 0.00 43.02 41.02 2cmc s PHE 30 CO -0.08 0.62 1.09 -1.25 -0.10 0.00 0.00 175.22 175.50 2cmc s PRO 31 N -3.58 3.61 -0.35 0.24 0.04 -1.26 -4.87 135.00 128.82 2cmc s PRO 31 Ca 0.31 1.51 0.13 0.00 0.04 0.00 0.00 61.00 62.99 2cmc s PRO 31 Cb -0.00 -2.09 0.45 0.00 0.04 0.00 0.00 34.50 32.90 2cmc s PRO 31 CO 0.16 -0.62 1.06 0.00 0.04 0.00 0.00 177.00 177.64 2cmc h ARG 33 N 2.69 -0.25 -0.07 0.00 3.08 -1.93 -2.31 114.38 115.59 2cmc h ARG 33 Ca 0.10 0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.19 2cmc h ARG 33 Cb 1.15 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.23 2cmc h ARG 33 CO 0.62 -0.17 -0.05 0.28 -1.07 0.00 0.00 179.97 179.58 2cmc h VAL 34 N -0.26 0.86 -1.02 2.04 2.07 -1.93 -2.15 116.25 115.86 2cmc h VAL 34 Ca 0.06 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.83 2cmc h VAL 34 Cb 0.34 0.86 -0.11 0.00 -1.52 0.00 0.00 31.29 30.86 2cmc h VAL 34 CO -0.18 0.00 0.63 0.00 0.02 0.00 0.00 177.57 178.04 2cmc h ALA 35 N 1.02 1.97 -0.02 1.67 0.00 -1.79 0.98 119.26 123.08 2cmc h ALA 35 Ca 0.05 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2cmc h ALA 35 Cb 0.11 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2cmc h ALA 35 CO -0.10 -0.41 0.00 1.63 0.00 0.00 0.00 179.25 180.37 2cmc n LYS 36 N -4.77 1.38 -1.92 0.00 4.76 -0.83 -4.68 118.16 112.10 2cmc n LYS 36 Ca 0.26 -0.56 -0.41 0.00 -2.87 0.00 0.00 58.31 54.73 2cmc n LYS 36 Cb 0.79 -1.46 -0.02 0.00 -1.84 0.00 0.00 35.03 32.50 2cmc n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2cmc s LEU 37 N -1.92 4.37 0.26 -0.35 1.43 0.34 -4.90 118.68 117.91 2cmc s LEU 37 Ca 0.40 2.78 -0.05 0.00 -1.03 0.00 0.00 54.13 56.22 2cmc s LEU 37 Cb 0.20 -3.63 0.49 0.00 0.03 0.00 0.00 46.19 43.29 2cmc s LEU 37 CO 0.33 -0.79 1.62 -0.65 0.23 0.00 0.00 176.35 177.10 2cmc h PRO 38 N 5.02 0.09 -0.11 1.29 0.11 -1.90 0.15 132.00 136.65 2cmc h PRO 38 Ca -0.46 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.67 2cmc h PRO 38 Cb 1.22 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2cmc h PRO 38 CO 0.79 0.06 0.18 1.57 -0.21 0.00 0.00 178.00 180.39 2cmc h LYS 39 N 0.09 0.00 -0.26 1.05 2.10 -1.95 -1.40 116.57 116.21 2cmc h LYS 39 Ca 0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.10 2cmc h LYS 39 Cb 0.81 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.14 2cmc h LYS 39 CO -0.72 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 176.82 2cmc n ASN 40 N -3.50 2.20 0.05 7.07 5.03 0.52 -4.50 115.26 122.13 2cmc n ASN 40 Ca -0.00 -1.83 -0.11 0.00 0.87 0.00 0.00 54.58 53.51 2cmc n ASN 40 Cb 0.28 -0.17 -0.04 0.00 -1.02 0.00 0.00 39.78 38.83 2cmc n ASN 40 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 2cmc h LYS 41 N 2.82 -0.38 -0.56 3.52 3.64 -1.27 -2.09 116.57 122.26 2cmc h LYS 41 Ca 0.00 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2cmc h LYS 41 Cb 0.62 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 2cmc h LYS 41 CO 0.00 -0.25 0.00 0.27 -2.27 0.00 0.00 179.45 177.20 2cmc n ASN 42 N -5.38 1.29 -0.29 4.20 0.23 -1.26 -2.81 115.26 111.24 2cmc n ASN 42 Ca -0.05 -2.09 0.08 0.00 -0.53 0.00 0.00 54.58 52.00 2cmc n ASN 42 Cb 0.29 -0.33 -0.02 0.00 -2.08 0.00 0.00 39.78 37.65 2cmc n ASN 42 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2cmc n ARG 43 N -0.00 1.76 -4.57 -3.83 1.74 -0.79 -4.91 116.66 106.05 2cmc n ARG 43 Ca 0.04 -0.64 -0.33 0.00 -0.77 0.00 0.00 57.85 56.15 2cmc n ARG 43 Cb 0.27 -1.26 -0.14 0.00 -1.02 0.00 0.00 32.46 30.32 2cmc n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2cmc s ASN 44 N -1.99 4.23 0.15 0.55 0.01 -1.12 -4.50 114.94 112.28 2cmc s ASN 44 Ca 0.12 -0.29 -0.06 0.00 -0.71 0.00 0.00 52.86 51.92 2cmc s ASN 44 Cb 0.12 -1.67 -0.00 0.00 0.41 0.00 0.00 41.25 40.12 2cmc s ASN 44 CO 0.44 0.14 1.42 -0.09 -1.51 0.00 0.00 177.10 177.50 2cmc h ARG 45 N 6.89 0.61 -4.71 -0.60 2.43 -1.89 -3.45 114.38 113.65 2cmc h ARG 45 Ca -0.29 -0.45 -0.38 0.00 -0.81 0.00 0.00 59.98 58.05 2cmc h ARG 45 Cb 1.20 0.08 -0.28 0.00 -0.42 0.00 0.00 29.97 30.55 2cmc h ARG 45 CO 0.58 1.07 -0.77 0.71 -1.51 0.00 0.00 179.97 180.05 2cmc s TYR 46 N -3.82 0.79 -0.43 2.20 2.02 -1.26 -5.03 117.35 111.82 2cmc s TYR 46 Ca -0.08 -0.19 0.26 0.00 -0.37 0.00 0.00 57.07 56.69 2cmc s TYR 46 Cb 0.10 -0.50 0.73 0.00 -0.40 0.00 0.00 41.96 41.90 2cmc s TYR 46 CO 0.86 -0.01 1.74 0.07 -1.57 0.00 0.00 175.55 176.64 2cmc h ARG 47 N 5.71 0.00 -0.01 -0.62 0.11 -1.98 -3.11 114.38 114.48 2cmc h ARG 47 Ca -0.31 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.77 2cmc h ARG 47 Cb 1.18 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.26 2cmc h ARG 47 CO 0.48 0.00 -0.16 -0.40 0.10 0.00 0.00 179.97 179.99 2cmc n ASP 48 N -2.76 1.52 -4.02 0.08 5.75 -1.26 -4.72 116.55 111.15 2cmc n ASP 48 Ca 0.04 -1.30 -0.31 0.00 -0.01 0.00 0.00 54.79 53.20 2cmc n ASP 48 Cb 0.43 0.11 -0.15 0.00 -1.03 0.00 0.00 41.12 40.48 2cmc n ASP 48 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2cmc s VAL 49 N -2.26 2.08 0.10 2.12 1.01 -1.17 -5.08 120.40 117.19 2cmc s VAL 49 Ca 0.29 -1.87 0.04 0.00 0.00 0.00 0.00 61.98 60.44 2cmc s VAL 49 Cb 0.20 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 2cmc s VAL 49 CO 0.43 -0.30 -0.11 -0.44 0.00 0.00 0.00 175.10 174.68 2cmc s SER 50 N 1.08 1.55 0.23 3.32 0.01 -1.26 -4.65 113.70 113.98 2cmc s SER 50 Ca 0.00 -0.78 -0.17 0.00 1.31 0.00 0.00 55.95 56.31 2cmc s SER 50 Cb -0.19 -0.01 -0.08 0.00 0.21 0.00 0.00 66.02 65.94 2cmc s SER 50 CO -0.07 -0.22 0.69 -2.16 0.41 0.00 0.00 173.24 171.89 2cmc s PRO 51 N -2.62 4.14 0.62 12.44 0.04 -1.26 -4.59 135.00 143.78 2cmc s PRO 51 Ca 0.05 0.74 -0.17 0.00 0.04 0.00 0.00 61.00 61.66 2cmc s PRO 51 Cb -0.04 -2.78 -0.02 0.00 0.04 0.00 0.00 34.50 31.70 2cmc s PRO 51 CO 0.01 0.35 1.14 -0.06 0.04 0.00 0.00 177.00 178.49 2cmc s PHE 52 N -1.62 2.52 0.13 0.56 0.08 -1.26 -4.58 117.98 113.80 2cmc s PHE 52 Ca 0.45 1.55 -0.18 0.00 0.12 0.00 0.00 56.93 58.87 2cmc s PHE 52 Cb -0.15 -3.30 -0.03 0.00 -0.57 0.00 0.00 43.02 38.97 2cmc s PHE 52 CO 0.20 -1.87 1.72 -0.44 -0.10 0.00 0.00 175.22 174.74 2cmc h ASP 53 N 0.46 0.38 -0.01 1.36 3.32 -1.10 -2.07 116.42 118.76 2cmc h ASP 53 Ca -0.48 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.48 2cmc h ASP 53 Cb 1.27 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 2cmc h ASP 53 CO 0.54 0.37 0.01 1.12 -1.72 0.00 0.00 179.24 179.56 2cmc h HIS 54 N 0.37 0.00 -0.06 4.55 2.07 -1.92 -2.96 115.15 117.20 2cmc h HIS 54 Ca 0.11 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.63 2cmc h HIS 54 Cb 0.07 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.05 2cmc h HIS 54 CO -0.03 0.00 0.00 -1.13 -3.07 0.00 0.00 177.93 173.70 2cmc n SER 55 N -4.24 1.79 -4.71 3.10 3.41 -1.19 -5.05 113.62 106.73 2cmc n SER 55 Ca -0.03 -1.58 -0.32 0.00 -0.26 0.00 0.00 58.87 56.68 2cmc n SER 55 Cb 0.10 -0.04 0.12 0.00 -0.26 0.00 0.00 64.21 64.13 2cmc n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cmc s ARG 56 N -0.65 1.72 -0.10 4.33 1.70 -0.78 -0.25 118.95 124.92 2cmc s ARG 56 Ca 0.05 1.52 -0.17 0.00 -0.47 0.00 0.00 55.73 56.66 2cmc s ARG 56 Cb 0.03 -1.81 -0.05 0.00 -0.57 0.00 0.00 34.95 32.56 2cmc s ARG 56 CO 0.04 -2.10 0.43 0.42 -1.08 0.00 0.00 175.30 173.02 2cmc s ILE 57 N -2.49 5.18 -0.19 4.99 -1.09 -0.10 -4.71 121.20 122.78 2cmc s ILE 57 Ca 0.68 0.86 -0.08 0.00 -2.23 0.00 0.00 60.65 59.88 2cmc s ILE 57 Cb -0.23 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.84 2cmc s ILE 57 CO 0.53 0.38 0.07 -0.54 -1.23 0.00 0.00 174.94 174.15 2cmc s LYS 58 N 0.29 3.93 0.37 2.79 1.02 -1.26 -4.20 119.74 122.68 2cmc s LYS 58 Ca 0.24 -0.36 -0.27 0.00 0.02 0.00 0.00 55.97 55.60 2cmc s LYS 58 Cb -0.15 -3.25 -0.09 0.00 -0.52 0.00 0.00 37.83 33.82 2cmc s LYS 58 CO 0.10 0.20 1.23 -0.51 -0.92 0.00 0.00 175.35 175.45 2cmc s LEU 59 N 0.58 4.29 0.00 3.17 1.43 -0.17 -4.88 118.68 123.11 2cmc s LEU 59 Ca 0.03 2.51 0.19 0.00 -1.03 0.00 0.00 54.13 55.83 2cmc s LEU 59 Cb -0.13 -3.86 1.05 0.00 0.03 0.00 0.00 46.19 43.28 2cmc s LEU 59 CO 0.01 -0.64 1.53 1.41 0.23 0.00 0.00 176.35 178.89 2cmc n HIS 60 N 0.37 0.00 -1.51 0.29 8.25 -1.26 -4.57 115.22 116.79 2cmc n HIS 60 Ca 0.03 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.18 2cmc n HIS 60 Cb 0.44 -0.10 0.08 0.00 1.12 0.00 0.00 29.99 31.53 2cmc n HIS 60 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 2cmc s GLN 61 N -2.20 2.30 -0.06 -0.41 -2.07 -1.26 -5.00 119.66 110.95 2cmc s GLN 61 Ca 0.24 0.79 0.18 0.00 -1.82 0.00 0.00 55.36 54.76 2cmc s GLN 61 Cb 0.13 -1.93 -0.23 0.00 -1.09 0.00 0.00 33.01 29.89 2cmc s GLN 61 CO 0.24 -1.51 0.47 -0.85 -1.32 0.00 0.00 175.29 172.32 2cmc n GLU 62 N -3.38 0.65 0.47 9.60 0.00 -1.26 -4.29 120.64 122.43 2cmc n GLU 62 Ca 0.07 0.05 -0.18 0.00 0.00 0.00 0.00 57.16 57.09 2cmc n GLU 62 Cb 0.55 -1.64 -0.09 0.00 0.00 0.00 0.00 31.44 30.26 2cmc n GLU 62 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 2cmc h ASP 63 N 0.00 -1.02 -1.05 -1.84 3.58 -1.97 -3.43 116.42 110.68 2cmc h ASP 63 Ca -0.27 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.22 2cmc h ASP 63 Cb 1.70 0.26 -0.21 0.00 1.72 0.00 0.00 39.33 42.80 2cmc h ASP 63 CO 0.03 -0.71 -0.40 0.21 -2.88 0.00 0.00 179.24 175.49 2cmc s ASN 64 N -3.87 -1.47 0.00 2.28 3.84 -1.26 -5.03 114.94 109.43 2cmc s ASN 64 Ca -0.18 0.01 0.00 0.00 0.21 0.00 0.00 52.86 52.91 2cmc s ASN 64 Cb 0.02 1.96 0.00 0.00 -0.55 0.00 0.00 41.25 42.67 2cmc s ASN 64 CO 0.53 -0.29 0.62 -0.90 -2.79 0.00 0.00 177.10 174.26 2cmc n ASP 65 N 5.28 0.55 -4.71 -4.21 5.75 -1.26 -4.85 116.55 113.10 2cmc n ASP 65 Ca 0.06 -1.78 -0.39 0.00 -0.01 0.00 0.00 54.79 52.67 2cmc n ASP 65 Cb 0.54 -0.27 -0.06 0.00 -1.03 0.00 0.00 41.12 40.30 2cmc n ASP 65 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 2cmc s TYR 66 N -1.38 3.51 0.02 2.11 5.04 -1.26 -0.99 117.35 124.38 2cmc s TYR 66 Ca 0.00 1.00 -0.07 0.00 -2.44 0.00 0.00 57.07 55.56 2cmc s TYR 66 Cb 0.00 -2.67 -0.00 0.00 0.35 0.00 0.00 41.96 39.64 2cmc s TYR 66 CO 0.00 0.08 0.14 -1.50 -1.34 0.00 0.00 175.55 172.93 2cmc s ILE 67 N 0.91 0.10 -1.24 3.14 2.07 -1.26 -4.94 121.20 119.97 2cmc s ILE 67 Ca 0.30 -0.80 -0.14 0.00 -1.41 0.00 0.00 60.65 58.60 2cmc s ILE 67 Cb -0.16 -0.60 0.15 0.00 0.13 0.00 0.00 42.46 41.98 2cmc s ILE 67 CO 0.13 -0.44 1.58 -3.20 -1.91 0.00 0.00 174.94 171.09 2cmc n ASN 68 N 1.19 5.12 -3.77 4.50 2.85 -1.26 -4.64 115.26 119.24 2cmc n ASN 68 Ca -0.21 -2.99 -0.13 0.00 -0.11 0.00 0.00 54.58 51.14 2cmc n ASN 68 Cb 0.57 -1.59 -0.11 0.00 1.24 0.00 0.00 39.78 39.89 2cmc n ASN 68 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2cmc s ALA 69 N 1.83 -0.72 0.13 5.20 0.00 -1.26 -2.72 121.76 124.22 2cmc s ALA 69 Ca 0.44 0.73 0.10 0.00 0.00 0.00 0.00 51.96 53.23 2cmc s ALA 69 Cb 0.01 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 2cmc s ALA 69 CO 0.01 -0.16 -0.23 -1.12 0.00 0.00 0.00 175.76 174.26 2cmc s SER 70 N -0.08 2.94 -0.39 0.00 0.01 -0.36 -0.93 113.70 114.90 2cmc s SER 70 Ca -0.02 -0.74 -0.15 0.00 1.31 0.00 0.00 55.95 56.35 2cmc s SER 70 Cb -0.03 -0.18 0.01 0.00 0.21 0.00 0.00 66.02 66.03 2cmc s SER 70 CO 0.01 0.10 0.32 -0.22 0.41 0.00 0.00 173.24 173.86 2cmc s LEU 71 N -2.09 4.88 -0.30 2.44 2.96 0.66 -1.77 118.68 125.46 2cmc s LEU 71 Ca 0.11 -0.70 -0.16 0.00 -0.22 0.00 0.00 54.13 53.17 2cmc s LEU 71 Cb -0.09 -2.22 -0.02 0.00 0.50 0.00 0.00 46.19 44.36 2cmc s LEU 71 CO 0.06 -0.42 0.41 -0.63 -1.32 0.00 0.00 176.35 174.44 2cmc s ILE 72 N 1.81 5.13 -0.23 6.68 1.09 -0.12 -4.85 121.20 130.72 2cmc s ILE 72 Ca 0.07 0.43 0.01 0.00 -1.10 0.00 0.00 60.65 60.06 2cmc s ILE 72 Cb -0.18 -3.79 0.03 0.00 -1.06 0.00 0.00 42.46 37.47 2cmc s ILE 72 CO 0.11 0.02 -0.13 -0.75 -0.10 0.00 0.00 174.94 174.09 2cmc s LYS 73 N 2.14 2.72 -0.44 2.79 2.20 -1.26 -1.33 119.74 126.56 2cmc s LYS 73 Ca 0.15 -1.03 -0.09 0.00 -0.36 0.00 0.00 55.97 54.65 2cmc s LYS 73 Cb -0.16 -2.80 0.10 0.00 -1.51 0.00 0.00 37.83 33.46 2cmc s LYS 73 CO 0.11 -0.38 0.29 -1.64 -0.36 0.00 0.00 175.35 173.37 2cmc s MET 74 N 1.24 2.50 0.07 4.03 -1.94 -0.72 -4.99 119.30 119.50 2cmc s MET 74 Ca -0.01 -1.62 -0.32 0.00 -1.71 0.00 0.00 55.69 52.03 2cmc s MET 74 Cb -0.16 -3.83 -0.19 0.00 2.01 0.00 0.00 34.83 32.67 2cmc s MET 74 CO -0.08 -1.07 1.60 0.93 -0.01 0.00 0.00 175.02 176.39 2cmc h GLU 75 N 8.40 -0.81 -0.40 2.03 4.39 -1.97 -0.08 114.58 126.13 2cmc h GLU 75 Ca -0.21 0.06 0.05 0.00 0.34 0.00 0.00 59.36 59.59 2cmc h GLU 75 Cb 1.08 0.19 -0.05 0.00 -0.10 0.00 0.00 28.75 29.86 2cmc h GLU 75 CO 0.80 -0.53 0.12 1.49 -1.16 0.00 0.00 179.01 179.73 2cmc h GLU 76 N -0.87 0.27 0.00 2.33 4.81 -1.97 -0.49 114.58 118.65 2cmc h GLU 76 Ca -0.09 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2cmc h GLU 76 Cb 0.66 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.98 2cmc h GLU 76 CO 0.14 0.18 0.00 0.00 -0.73 0.00 0.00 179.01 178.60 2cmc h ALA 77 N 1.27 1.00 -5.80 2.92 0.00 -1.92 -3.47 119.26 113.26 2cmc h ALA 77 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.73 2cmc h ALA 77 Cb 0.18 0.00 0.14 0.00 0.00 0.00 0.00 17.79 18.11 2cmc h ALA 77 CO -0.20 0.00 -0.75 1.04 0.00 0.00 0.00 179.25 179.34 2cmc n GLN 78 N -2.41 -6.73 -3.81 0.00 6.02 -0.08 -4.92 117.38 105.45 2cmc n GLN 78 Ca 0.02 0.80 -0.12 0.00 -0.01 0.00 0.00 57.00 57.69 2cmc n GLN 78 Cb 0.28 -5.77 -0.11 0.00 1.02 0.00 0.00 30.24 25.66 2cmc n GLN 78 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2cmc s ARG 79 N -5.78 0.33 0.07 -1.09 3.52 -0.99 -4.92 118.95 110.10 2cmc s ARG 79 Ca 0.20 0.15 0.09 0.00 -0.13 0.00 0.00 55.73 56.04 2cmc s ARG 79 Cb -0.09 0.15 -0.03 0.00 -1.56 0.00 0.00 34.95 33.42 2cmc s ARG 79 CO 0.75 -0.06 -0.25 -1.12 -0.81 0.00 0.00 175.30 173.81 2cmc s SER 80 N -0.26 2.97 0.03 -2.12 0.01 -1.26 -1.75 113.70 111.32 2cmc s SER 80 Ca -0.04 -0.63 0.02 0.00 1.31 0.00 0.00 55.95 56.61 2cmc s SER 80 Cb -0.03 -0.23 -0.02 0.00 0.21 0.00 0.00 66.02 65.95 2cmc s SER 80 CO 0.01 0.19 -0.06 -0.31 0.41 0.00 0.00 173.24 173.48 2cmc s TYR 81 N -0.91 0.53 -0.19 2.43 1.51 -0.44 -3.99 117.35 116.29 2cmc s TYR 81 Ca 0.11 -0.43 -0.07 0.00 -1.01 0.00 0.00 57.07 55.67 2cmc s TYR 81 Cb -0.10 -0.33 -0.04 0.00 -0.11 0.00 0.00 41.96 41.39 2cmc s TYR 81 CO 0.03 -0.09 0.06 0.42 -1.11 0.00 0.00 175.55 174.86 2cmc s ILE 82 N -1.16 4.68 -0.18 2.71 1.01 -0.24 -0.94 121.20 127.08 2cmc s ILE 82 Ca -0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.47 2cmc s ILE 82 Cb -0.08 -3.11 -0.01 0.00 0.01 0.00 0.00 42.46 39.27 2cmc s ILE 82 CO 0.00 0.45 -0.11 -0.76 0.00 0.00 0.00 174.94 174.52 2cmc s LEU 83 N 0.52 2.67 0.23 2.97 1.02 -0.73 -0.40 118.68 124.97 2cmc s LEU 83 Ca 0.03 -0.42 0.01 0.00 0.02 0.00 0.00 54.13 53.78 2cmc s LEU 83 Cb -0.13 -1.64 -0.05 0.00 0.02 0.00 0.00 46.19 44.40 2cmc s LEU 83 CO 0.01 0.06 0.06 0.28 0.02 0.00 0.00 176.35 176.78 2cmc s THR 84 N 0.98 0.60 0.78 5.49 -1.32 -0.16 -1.22 115.64 120.78 2cmc s THR 84 Ca -0.01 -1.99 -0.11 0.00 -1.21 0.00 0.00 61.69 58.36 2cmc s THR 84 Cb -0.15 -2.45 0.07 0.00 -1.51 0.00 0.00 72.50 68.46 2cmc s THR 84 CO -0.01 -0.17 1.14 0.00 -2.21 0.00 0.00 174.62 173.37 2cmc s GLN 85 N -3.99 2.11 0.03 7.08 -2.07 -1.10 -3.75 119.66 117.96 2cmc s GLN 85 Ca 0.33 0.08 -0.30 0.00 -1.82 0.00 0.00 55.36 53.65 2cmc s GLN 85 Cb 0.07 -2.00 -0.06 0.00 -1.09 0.00 0.00 33.01 29.93 2cmc s GLN 85 CO 0.10 -1.46 1.33 0.20 -1.32 0.00 0.00 175.29 174.14 2cmc s GLY 86 N -4.54 2.03 0.43 2.60 0.00 -0.67 -4.81 107.32 102.37 2cmc s GLY 86 Ca 0.61 0.89 -0.23 0.00 0.00 0.00 0.00 44.72 45.99 2cmc s GLY 86 CO 0.48 2.34 0.74 -1.05 0.00 0.00 0.00 173.10 175.62 2cmc n PRO 87 N 4.75 0.86 -2.99 2.90 -0.02 -1.26 -4.75 135.00 134.49 2cmc n PRO 87 Ca 0.12 0.31 -0.24 0.00 -2.02 0.00 0.00 63.50 61.67 2cmc n PRO 87 Cb 0.44 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 2cmc n PRO 87 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2cmc s LEU 88 N 0.66 3.73 0.48 2.45 1.43 -1.26 -1.40 118.68 124.79 2cmc s LEU 88 Ca 0.64 0.52 0.23 0.00 -1.03 0.00 0.00 54.13 54.49 2cmc s LEU 88 Cb -0.58 -3.40 1.28 0.00 0.03 0.00 0.00 46.19 43.52 2cmc s LEU 88 CO 0.57 -0.57 1.92 -0.65 0.23 0.00 0.00 176.35 177.85 2cmc h PRO 89 N 0.43 0.18 -0.01 1.29 0.11 -1.94 -0.65 132.00 131.41 2cmc h PRO 89 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2cmc h PRO 89 Cb 1.23 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2cmc h PRO 89 CO 0.60 0.12 -0.05 0.27 -0.21 0.00 0.00 178.00 178.73 2cmc n ASN 90 N -4.40 1.48 -0.19 -2.05 6.94 -1.26 -4.15 115.26 111.63 2cmc n ASN 90 Ca 0.15 -1.41 0.07 0.00 -0.02 0.00 0.00 54.58 53.37 2cmc n ASN 90 Cb 0.71 0.03 0.12 0.00 -2.36 0.00 0.00 39.78 38.28 2cmc n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2cmc n THR 91 N 0.08 1.67 0.00 5.53 -2.24 -0.26 -4.66 114.28 114.41 2cmc n THR 91 Ca 0.18 -1.84 -0.08 0.00 -2.27 0.00 0.00 64.05 60.04 2cmc n THR 91 Cb 0.36 -0.02 0.08 0.00 -2.10 0.00 0.00 70.33 68.66 2cmc n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cmc h GLY 93 N 1.08 -0.00 0.30 0.00 0.00 -1.89 -1.94 103.07 100.61 2cmc h GLY 93 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.41 2cmc h GLY 93 CO 0.09 -0.00 -0.17 0.45 0.00 0.00 0.00 176.54 176.91 2cmc h HIS 94 N -0.19 -0.42 -0.43 5.60 -0.00 -1.84 0.41 115.15 118.28 2cmc h HIS 94 Ca -0.00 0.03 0.09 0.00 -0.00 0.00 0.00 60.37 60.49 2cmc h HIS 94 Cb 0.19 0.22 -0.09 0.00 -0.00 0.00 0.00 27.41 27.73 2cmc h HIS 94 CO -0.01 -0.24 -0.15 0.35 -0.00 0.00 0.00 177.93 177.87 2cmc h PHE 95 N -0.16 -0.36 -0.06 2.45 3.04 -0.80 0.19 116.94 121.24 2cmc h PHE 95 Ca 0.13 0.04 -0.12 0.00 3.98 0.00 0.00 57.97 62.01 2cmc h PHE 95 Cb 0.36 0.23 -0.01 0.00 2.56 0.00 0.00 35.95 39.08 2cmc h PHE 95 CO -0.33 -0.24 -0.50 -1.49 -2.02 0.00 0.00 178.31 173.73 2cmc h TRP 96 N -0.06 0.20 -0.33 0.41 4.06 -0.76 -1.93 115.95 117.54 2cmc h TRP 96 Ca 0.21 -0.06 -0.00 0.00 2.06 0.00 0.00 58.89 61.09 2cmc h TRP 96 Cb 0.38 -0.04 -0.02 0.00 -1.00 0.00 0.00 29.16 28.49 2cmc h TRP 96 CO -0.42 0.64 0.19 1.49 -3.56 0.00 0.00 178.44 176.79 2cmc h GLU 97 N 0.13 0.45 -0.73 0.49 4.81 0.14 -0.81 114.58 119.05 2cmc h GLU 97 Ca 0.00 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.21 2cmc h GLU 97 Cb 0.94 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 30.19 2cmc h GLU 97 CO 0.07 0.35 0.48 1.98 -0.73 0.00 0.00 179.01 181.16 2cmc h MET 98 N 0.42 0.92 -0.64 1.92 4.05 -0.41 0.14 114.93 121.33 2cmc h MET 98 Ca 0.12 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 2cmc h MET 98 Cb 0.02 -0.21 -0.03 0.00 -0.80 0.00 0.00 31.60 30.58 2cmc h MET 98 CO -0.02 0.61 0.42 0.28 0.23 0.00 0.00 176.91 178.43 2cmc h VAL 99 N 0.95 1.17 0.28 -5.77 2.07 -1.03 0.18 116.25 114.11 2cmc h VAL 99 Ca 0.28 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 2cmc h VAL 99 Cb -0.05 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 2cmc h VAL 99 CO -0.08 0.16 -0.13 -0.25 0.02 0.00 0.00 177.57 177.29 2cmc h TRP 100 N 0.87 -0.35 -0.23 1.57 2.91 -0.52 -1.76 115.95 118.43 2cmc h TRP 100 Ca 0.23 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.23 2cmc h TRP 100 Cb -0.09 0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 28.66 2cmc h TRP 100 CO -0.03 -0.03 0.06 0.93 -1.03 0.00 0.00 178.44 178.34 2cmc h GLU 101 N -0.69 0.32 -0.01 2.65 5.08 -0.63 -1.76 114.58 119.54 2cmc h GLU 101 Ca -0.04 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2cmc h GLU 101 Cb 0.48 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2cmc h GLU 101 CO 0.06 0.29 -0.05 1.04 -1.00 0.00 0.00 179.01 179.36 2cmc n GLN 102 N -4.41 1.27 -2.18 2.33 1.13 0.64 -4.93 117.38 111.23 2cmc n GLN 102 Ca 0.00 -0.60 -0.20 0.00 -1.94 0.00 0.00 57.00 54.27 2cmc n GLN 102 Cb 0.15 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 28.98 2cmc n GLN 102 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2cmc n LYS 103 N -0.34 -1.52 -1.94 -1.09 5.02 -0.66 -3.72 118.16 113.91 2cmc n LYS 103 Ca 0.18 1.01 -0.38 0.00 -2.02 0.00 0.00 58.31 57.11 2cmc n LYS 103 Cb 0.29 -5.55 0.02 0.00 -0.02 0.00 0.00 35.03 29.78 2cmc n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2cmc s SER 104 N -2.28 5.55 -0.14 4.39 0.01 -0.73 -0.71 113.70 119.80 2cmc s SER 104 Ca 0.00 2.61 0.15 0.00 1.31 0.00 0.00 55.95 60.02 2cmc s SER 104 Cb 0.00 -2.62 -0.21 0.00 0.21 0.00 0.00 66.02 63.39 2cmc s SER 104 CO 0.00 -1.37 0.11 -1.14 0.41 0.00 0.00 173.24 171.25 2cmc n ARG 105 N -0.87 1.22 -4.18 12.44 0.63 -1.26 -4.83 116.66 119.80 2cmc n ARG 105 Ca 0.09 -0.03 -0.18 0.00 -0.92 0.00 0.00 57.85 56.81 2cmc n ARG 105 Cb 0.46 -1.42 -0.12 0.00 0.45 0.00 0.00 32.46 31.83 2cmc n ARG 105 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2cmc s GLY 106 N -4.85 0.90 -0.14 5.14 0.00 -1.26 -1.16 107.32 105.96 2cmc s GLY 106 Ca -0.08 -1.04 -0.00 0.00 0.00 0.00 0.00 44.72 43.60 2cmc s GLY 106 CO 0.68 -1.07 -0.10 0.14 0.00 0.00 0.00 173.10 172.74 2cmc s VAL 107 N -1.39 1.28 -0.35 1.40 1.01 -0.52 -1.66 120.40 120.18 2cmc s VAL 107 Ca -0.00 -0.50 -0.10 0.00 0.00 0.00 0.00 61.98 61.38 2cmc s VAL 107 Cb -0.09 -1.27 0.01 0.00 0.00 0.00 0.00 36.38 35.02 2cmc s VAL 107 CO 0.02 0.37 0.18 -0.69 0.00 0.00 0.00 175.10 174.98 2cmc s VAL 108 N 1.60 4.57 -0.23 2.92 1.01 0.18 -0.53 120.40 129.92 2cmc s VAL 108 Ca 0.04 -0.67 -0.08 0.00 0.00 0.00 0.00 61.98 61.27 2cmc s VAL 108 Cb -0.13 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2cmc s VAL 108 CO -0.09 -0.10 0.10 -0.32 0.00 0.00 0.00 175.10 174.69 2cmc s MET 109 N 1.58 3.87 0.00 2.72 0.00 0.78 -1.50 119.30 126.75 2cmc s MET 109 Ca 0.03 -0.38 0.11 0.00 0.00 0.00 0.00 55.69 55.46 2cmc s MET 109 Cb -0.18 -3.38 0.09 0.00 0.00 0.00 0.00 34.83 31.36 2cmc s MET 109 CO 0.06 -0.00 0.86 1.28 0.00 0.00 0.00 175.02 177.22 2cmc n LEU 110 N 4.40 1.93 0.00 4.11 4.77 0.71 -0.41 117.00 132.51 2cmc n LEU 110 Ca -0.16 -0.99 -0.31 0.00 -0.03 0.00 0.00 56.01 54.52 2cmc n LEU 110 Cb 0.52 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.57 2cmc n LEU 110 CO 0.33 0.37 -0.12 -0.46 -1.33 0.00 0.00 177.39 176.18 2cmc n ASN 111 N 0.62 3.18 -4.61 -1.43 6.94 -1.26 -4.49 115.26 114.22 2cmc n ASN 111 Ca 0.07 -3.13 -0.26 0.00 -0.02 0.00 0.00 54.58 51.23 2cmc n ASN 111 Cb 0.28 0.21 -0.09 0.00 -2.36 0.00 0.00 39.78 37.82 2cmc n ASN 111 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2cmc s ARG 112 N -4.03 2.21 0.26 -3.83 0.52 -1.26 -4.83 118.95 107.98 2cmc s ARG 112 Ca 0.12 -1.21 -0.04 0.00 -0.52 0.00 0.00 55.73 54.09 2cmc s ARG 112 Cb -0.01 -2.24 0.38 0.00 0.52 0.00 0.00 34.95 33.60 2cmc s ARG 112 CO 0.08 0.44 1.87 0.28 0.02 0.00 0.00 175.30 177.98 2cmc h VAL 113 N 2.59 1.06 -3.23 3.52 2.07 -1.93 -3.39 116.25 116.93 2cmc h VAL 113 Ca -0.47 -0.37 -0.67 0.00 0.82 0.00 0.00 66.70 66.02 2cmc h VAL 113 Cb 1.21 -0.11 -0.31 0.00 -1.52 0.00 0.00 31.29 30.55 2cmc h VAL 113 CO 0.56 0.20 -0.81 -0.32 0.02 0.00 0.00 177.57 177.22 2cmc s MET 114 N -6.05 3.17 -0.04 1.57 -2.45 -1.26 -0.27 119.30 113.98 2cmc s MET 114 Ca -0.12 -0.76 0.02 0.00 -1.25 0.00 0.00 55.69 53.57 2cmc s MET 114 Cb 0.19 -2.66 0.01 0.00 1.25 0.00 0.00 34.83 33.63 2cmc s MET 114 CO 0.80 -0.08 -0.07 -1.21 1.05 0.00 0.00 175.02 175.52 2cmc s GLU 115 N 1.05 0.92 -1.85 4.11 2.02 -0.56 -4.80 118.70 119.59 2cmc s GLU 115 Ca -0.01 -0.21 0.00 0.00 0.02 0.00 0.00 54.97 54.77 2cmc s GLU 115 Cb -0.15 -0.87 0.00 0.00 0.10 0.00 0.00 34.13 33.21 2cmc s GLU 115 CO -0.04 0.01 0.00 1.63 0.02 0.00 0.00 175.26 176.88 2cmc n LYS 116 N 3.66 -1.65 -0.21 1.61 4.76 -1.26 -2.47 118.16 122.61 2cmc n LYS 116 Ca -0.22 1.04 0.00 0.00 -2.87 0.00 0.00 58.31 56.27 2cmc n LYS 116 Cb 0.53 -5.64 0.00 0.00 -1.84 0.00 0.00 35.03 28.07 2cmc n LYS 116 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2cmc n GLY 117 N -0.86 0.96 3.28 0.72 0.00 -1.26 -5.05 105.19 102.97 2cmc n GLY 117 Ca -0.23 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.63 2cmc n GLY 117 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cmc s SER 118 N -2.91 1.75 -0.56 1.61 1.04 -1.03 -5.10 113.70 108.51 2cmc s SER 118 Ca 0.00 -1.12 -0.27 0.00 0.48 0.00 0.00 55.95 55.04 2cmc s SER 118 Cb 0.00 0.01 -0.01 0.00 0.10 0.00 0.00 66.02 66.12 2cmc s SER 118 CO 0.00 -0.43 1.73 -0.22 0.98 0.00 0.00 173.24 175.30 2cmc s LEU 119 N -3.23 3.34 0.00 2.42 2.96 -1.26 -1.49 118.68 121.42 2cmc s LEU 119 Ca 0.23 0.46 0.24 0.00 -0.22 0.00 0.00 54.13 54.84 2cmc s LEU 119 Cb 0.04 -2.81 0.44 0.00 0.50 0.00 0.00 46.19 44.36 2cmc s LEU 119 CO 0.04 -2.10 1.40 0.29 -1.32 0.00 0.00 176.35 174.66 2cmc n LYS 120 N 8.96 2.22 -3.23 1.98 4.76 0.63 -4.86 118.16 128.63 2cmc n LYS 120 Ca 0.18 -1.80 0.04 0.00 -2.87 0.00 0.00 58.31 53.86 2cmc n LYS 120 Cb 0.50 -1.47 -0.03 0.00 -1.84 0.00 0.00 35.03 32.19 2cmc n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2cmc s ALA 122 N 2.59 3.27 -0.72 0.00 0.00 -0.49 -4.53 121.76 121.89 2cmc s ALA 122 Ca -0.02 1.32 -0.27 0.00 0.00 0.00 0.00 51.96 52.99 2cmc s ALA 122 Cb -0.07 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.55 2cmc s ALA 122 CO -0.14 -0.94 1.43 -1.14 0.00 0.00 0.00 175.76 174.97 2cmc s GLN 123 N -2.29 3.06 0.00 0.00 0.74 -1.26 -4.75 119.66 115.16 2cmc s GLN 123 Ca 0.58 -0.05 0.22 0.00 0.05 0.00 0.00 55.36 56.16 2cmc s GLN 123 Cb -0.40 -4.26 0.80 0.00 1.10 0.00 0.00 33.01 30.25 2cmc s GLN 123 CO 0.52 -2.30 1.58 2.48 -0.55 0.00 0.00 175.29 177.02 2cmc n TYR 124 N 10.23 0.17 -4.40 1.67 0.18 -1.26 -4.87 117.16 118.88 2cmc n TYR 124 Ca 0.08 -0.09 -0.26 0.00 1.88 0.00 0.00 57.90 59.51 2cmc n TYR 124 Cb 0.50 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.35 2cmc n TYR 124 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 2cmc s TRP 125 N -1.83 2.38 0.52 -3.48 -2.14 -1.26 -5.07 118.94 108.06 2cmc s TRP 125 Ca 0.33 -0.32 -0.14 0.00 2.66 0.00 0.00 56.10 58.63 2cmc s TRP 125 Cb 0.18 -1.14 -0.07 0.00 -3.10 0.00 0.00 33.47 29.35 2cmc s TRP 125 CO 0.28 0.56 0.96 -1.25 -2.66 0.00 0.00 176.95 174.83 2cmc s PRO 126 N -2.94 3.85 0.32 3.25 0.04 -1.26 -5.07 135.00 133.20 2cmc s PRO 126 Ca 0.24 0.83 0.06 0.00 0.04 0.00 0.00 61.00 62.17 2cmc s PRO 126 Cb -0.07 -2.17 -0.01 0.00 0.04 0.00 0.00 34.50 32.29 2cmc s PRO 126 CO 0.12 -0.29 0.45 1.14 0.04 0.00 0.00 177.00 178.47 2cmc s GLN 127 N -4.26 3.15 0.29 4.56 -2.07 -1.26 -4.84 119.66 115.23 2cmc s GLN 127 Ca 0.57 -0.99 0.04 0.00 -1.82 0.00 0.00 55.36 53.15 2cmc s GLN 127 Cb -0.10 -2.82 0.70 0.00 -1.09 0.00 0.00 33.01 29.70 2cmc s GLN 127 CO 0.36 0.10 1.74 1.57 -1.32 0.00 0.00 175.29 177.74 2cmc h LYS 128 N 0.93 0.55 -0.34 9.60 2.10 -1.98 -1.38 116.57 126.06 2cmc h LYS 128 Ca -0.46 -0.03 -0.10 0.00 -2.00 0.00 0.00 60.65 58.05 2cmc h LYS 128 Cb 1.25 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 32.45 2cmc h LYS 128 CO 0.54 0.37 -0.18 0.93 -2.00 0.00 0.00 179.45 179.10 2cmc h GLU 129 N 0.57 0.73 -2.18 0.07 5.08 -2.04 -3.34 114.58 113.47 2cmc h GLU 129 Ca 0.55 -0.32 -0.58 0.00 -1.00 0.00 0.00 59.36 58.00 2cmc h GLU 129 Cb 0.94 -0.02 -0.41 0.00 0.50 0.00 0.00 28.75 29.75 2cmc h GLU 129 CO -0.44 0.93 -0.72 -0.85 -1.00 0.00 0.00 179.01 176.93 2cmc n GLU 130 N -4.31 2.35 0.00 2.33 0.28 -0.90 -4.96 120.64 115.42 2cmc n GLU 130 Ca -0.02 -4.43 0.00 0.00 -0.16 0.00 0.00 57.16 52.54 2cmc n GLU 130 Cb 0.41 -2.07 0.00 0.00 1.43 0.00 0.00 31.44 31.21 2cmc n GLU 130 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2cmc n LYS 131 N 0.61 0.00 -4.07 3.44 5.02 -0.57 -3.98 118.16 118.61 2cmc n LYS 131 Ca 0.29 0.04 -0.25 0.00 -2.02 0.00 0.00 58.31 56.36 2cmc n LYS 131 Cb 0.44 -1.53 -0.17 0.00 -0.02 0.00 0.00 35.03 33.75 2cmc n LYS 131 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2cmc s GLU 132 N -1.71 1.40 -0.01 1.97 2.12 -1.26 -1.05 118.70 120.15 2cmc s GLU 132 Ca 0.00 -0.24 0.06 0.00 0.36 0.00 0.00 54.97 55.15 2cmc s GLU 132 Cb 0.00 -1.41 -0.03 0.00 0.26 0.00 0.00 34.13 32.96 2cmc s GLU 132 CO 0.00 -0.18 -0.19 -1.64 -0.54 0.00 0.00 175.26 172.70 2cmc s MET 133 N 1.42 2.25 -0.17 4.30 -1.94 0.60 -4.99 119.30 120.76 2cmc s MET 133 Ca -0.01 -0.85 0.00 0.00 -1.71 0.00 0.00 55.69 53.12 2cmc s MET 133 Cb -0.13 -2.22 0.01 0.00 2.01 0.00 0.00 34.83 34.50 2cmc s MET 133 CO -0.04 0.58 -0.16 0.42 -0.01 0.00 0.00 175.02 175.80 2cmc s ILE 134 N -0.75 2.46 -0.36 2.53 -1.09 -1.26 -0.75 121.20 121.98 2cmc s ILE 134 Ca 0.12 -0.82 -0.19 0.00 -2.23 0.00 0.00 60.65 57.53 2cmc s ILE 134 Cb -0.10 -2.05 0.00 0.00 -1.58 0.00 0.00 42.46 38.73 2cmc s ILE 134 CO 0.01 0.51 0.53 -0.36 -1.23 0.00 0.00 174.94 174.41 2cmc s PHE 135 N 1.11 3.17 0.00 3.97 0.08 -0.34 -5.02 117.98 120.95 2cmc s PHE 135 Ca 0.00 0.16 0.00 0.00 0.12 0.00 0.00 56.93 57.21 2cmc s PHE 135 Cb -0.14 -2.98 0.00 0.00 -0.57 0.00 0.00 43.02 39.33 2cmc s PHE 135 CO -0.06 -0.58 0.00 -0.85 -0.10 0.00 0.00 175.22 173.63 2cmc n GLU 136 N 5.81 0.00 -0.18 0.44 -0.00 -1.26 -3.07 120.64 122.38 2cmc n GLU 136 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.12 2cmc n GLU 136 Cb 0.49 0.00 0.07 0.00 -0.00 0.00 0.00 31.44 32.00 2cmc n GLU 136 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2cmc n ASP 137 N 0.00 2.12 -0.56 -1.84 8.00 -1.26 -3.31 116.55 119.70 2cmc n ASP 137 Ca 0.00 -2.20 0.07 0.00 0.71 0.00 0.00 54.79 53.37 2cmc n ASP 137 Cb 0.00 -0.54 0.06 0.00 -0.02 0.00 0.00 41.12 40.62 2cmc n ASP 137 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2cmc n THR 138 N 0.13 0.00 -3.95 -3.53 5.66 -1.19 -5.01 114.28 106.39 2cmc n THR 138 Ca 0.06 -0.49 -0.30 0.00 -3.05 0.00 0.00 64.05 60.27 2cmc n THR 138 Cb 0.48 1.29 0.02 0.00 -1.55 0.00 0.00 70.33 70.57 2cmc n THR 138 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2cmc n ASN 139 N 0.75 -4.18 -4.41 1.09 3.02 -1.17 -4.94 115.26 105.42 2cmc n ASN 139 Ca 0.08 -0.82 -0.24 0.00 -0.03 0.00 0.00 54.58 53.57 2cmc n ASN 139 Cb 0.36 -3.71 -0.11 0.00 -0.61 0.00 0.00 39.78 35.71 2cmc n ASN 139 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2cmc s LEU 140 N -7.23 2.50 -0.03 3.41 1.43 -1.23 -2.44 118.68 115.09 2cmc s LEU 140 Ca 0.60 -0.94 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 2cmc s LEU 140 Cb -0.31 -1.01 0.01 0.00 0.03 0.00 0.00 46.19 44.91 2cmc s LEU 140 CO 0.85 0.02 -0.09 -0.75 0.23 0.00 0.00 176.35 176.61 2cmc s LYS 141 N -3.09 1.09 -0.03 1.70 2.20 -0.06 -1.20 119.74 120.35 2cmc s LYS 141 Ca 0.23 -0.31 0.05 0.00 -0.36 0.00 0.00 55.97 55.58 2cmc s LYS 141 Cb -0.06 -0.99 -0.01 0.00 -1.51 0.00 0.00 37.83 35.26 2cmc s LYS 141 CO 0.10 0.08 -0.16 -1.17 -0.36 0.00 0.00 175.35 173.84 2cmc s LEU 142 N 0.35 1.96 0.00 5.43 2.96 0.07 0.25 118.68 129.70 2cmc s LEU 142 Ca -0.06 -0.32 0.02 0.00 -0.22 0.00 0.00 54.13 53.56 2cmc s LEU 142 Cb -0.11 -0.89 -0.01 0.00 0.50 0.00 0.00 46.19 45.69 2cmc s LEU 142 CO 0.01 0.17 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.24 2cmc s THR 143 N -0.17 0.62 -0.31 3.68 2.01 -0.39 -0.29 115.64 120.79 2cmc s THR 143 Ca 0.02 -0.48 -0.23 0.00 0.31 0.00 0.00 61.69 61.31 2cmc s THR 143 Cb -0.09 -0.55 -0.00 0.00 0.01 0.00 0.00 72.50 71.87 2cmc s THR 143 CO 0.01 0.08 0.76 -0.22 -0.69 0.00 0.00 174.62 174.55 2cmc s LEU 144 N -0.45 4.10 -0.16 4.42 2.96 -0.22 -0.53 118.68 128.80 2cmc s LEU 144 Ca 0.01 0.62 -0.16 0.00 -0.22 0.00 0.00 54.13 54.38 2cmc s LEU 144 Cb -0.04 -3.03 -0.23 0.00 0.50 0.00 0.00 46.19 43.39 2cmc s LEU 144 CO -0.00 -0.59 0.34 0.40 -1.32 0.00 0.00 176.35 175.18 2cmc h ILE 145 N 5.59 0.87 -3.25 6.68 1.08 -1.13 -3.48 117.51 123.86 2cmc h ILE 145 Ca -0.25 -2.28 -0.08 0.00 -0.39 0.00 0.00 64.86 61.87 2cmc h ILE 145 Cb 1.10 2.43 -0.16 0.00 -3.07 0.00 0.00 36.82 37.13 2cmc h ILE 145 CO 0.87 0.58 -0.16 -0.94 -0.69 0.00 0.00 178.15 177.81 2cmc s SER 146 N -6.94 -0.19 -0.07 1.72 1.04 -1.08 -4.96 113.70 103.22 2cmc s SER 146 Ca -0.25 -0.17 -0.03 0.00 0.48 0.00 0.00 55.95 55.98 2cmc s SER 146 Cb 0.06 0.41 0.04 0.00 0.10 0.00 0.00 66.02 66.62 2cmc s SER 146 CO 0.68 -0.69 0.13 -0.70 0.98 0.00 0.00 173.24 173.64 2cmc s GLU 147 N -2.87 0.03 -0.32 4.02 2.12 -1.26 -1.40 118.70 119.01 2cmc s GLU 147 Ca -0.03 0.44 0.02 0.00 0.36 0.00 0.00 54.97 55.76 2cmc s GLU 147 Cb 0.00 -0.28 0.09 0.00 0.26 0.00 0.00 34.13 34.21 2cmc s GLU 147 CO -0.05 -0.25 0.05 0.34 -0.54 0.00 0.00 175.26 174.80 2cmc s ASP 148 N 1.81 4.46 -0.28 -1.70 2.15 0.09 -4.99 116.67 118.21 2cmc s ASP 148 Ca -0.02 -1.89 -0.23 0.00 0.43 0.00 0.00 52.55 50.84 2cmc s ASP 148 Cb -0.12 -1.36 -0.00 0.00 -0.30 0.00 0.00 42.92 41.13 2cmc s ASP 148 CO -0.05 -0.37 0.78 -0.63 -0.17 0.00 0.00 175.17 174.73 2cmc s ILE 149 N 1.16 4.83 0.51 4.11 1.01 -1.26 -1.40 121.20 130.15 2cmc s ILE 149 Ca 0.08 1.30 0.02 0.00 0.00 0.00 0.00 60.65 62.06 2cmc s ILE 149 Cb -0.19 -4.11 0.02 0.00 0.01 0.00 0.00 42.46 38.20 2cmc s ILE 149 CO -0.13 -0.15 0.20 0.29 0.00 0.00 0.00 174.94 175.15 2cmc n LYS 150 N 6.07 0.77 0.11 2.79 5.02 -0.10 -5.01 118.16 127.80 2cmc n LYS 150 Ca 0.04 -3.41 -0.12 0.00 -2.02 0.00 0.00 58.31 52.79 2cmc n LYS 150 Cb 0.48 0.64 -0.06 0.00 -0.02 0.00 0.00 35.03 36.07 2cmc n LYS 150 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2cmc h SER 151 N 0.89 -0.44 -0.01 4.39 0.87 -2.02 -3.31 113.55 113.91 2cmc h SER 151 Ca -0.37 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 2cmc h SER 151 Cb 1.22 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.34 2cmc h SER 151 CO 0.59 -0.24 -0.26 -1.22 -0.53 0.00 0.00 176.83 175.18 2cmc n TYR 152 N -5.29 0.00 -3.83 2.24 4.02 -1.26 -4.96 117.16 108.08 2cmc n TYR 152 Ca -0.07 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.76 2cmc n TYR 152 Cb 0.20 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.52 2cmc n TYR 152 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 176.86 177.37 2cmc s TYR 153 N -1.66 -0.11 0.00 -0.72 1.13 -1.25 -2.33 117.35 112.42 2cmc s TYR 153 Ca 0.12 -0.36 0.03 0.00 -1.41 0.00 0.00 57.07 55.45 2cmc s TYR 153 Cb 0.11 0.72 -0.01 0.00 -1.10 0.00 0.00 41.96 41.69 2cmc s TYR 153 CO 0.33 -1.21 -0.08 0.99 -2.51 0.00 0.00 175.55 173.08 2cmc s THR 154 N -3.43 0.64 -0.10 -3.49 2.01 0.43 -0.93 115.64 110.76 2cmc s THR 154 Ca 0.13 -0.44 0.03 0.00 0.31 0.00 0.00 61.69 61.72 2cmc s THR 154 Cb -0.05 -0.55 -0.01 0.00 0.01 0.00 0.00 72.50 71.90 2cmc s THR 154 CO 0.07 0.11 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.21 2cmc s VAL 155 N -0.33 2.37 0.01 3.82 1.01 -0.50 -1.12 120.40 125.67 2cmc s VAL 155 Ca 0.02 -0.91 0.06 0.00 0.00 0.00 0.00 61.98 61.14 2cmc s VAL 155 Cb -0.04 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 2cmc s VAL 155 CO -0.00 0.55 -0.18 -0.13 0.00 0.00 0.00 175.10 175.34 2cmc s ARG 156 N 0.27 1.37 -0.22 2.72 0.52 0.02 -0.73 118.95 122.90 2cmc s ARG 156 Ca -0.15 -0.73 -0.09 0.00 -0.52 0.00 0.00 55.73 54.25 2cmc s ARG 156 Cb -0.17 -1.37 -0.04 0.00 0.52 0.00 0.00 34.95 33.89 2cmc s ARG 156 CO 0.07 0.37 0.11 -0.65 0.02 0.00 0.00 175.30 175.22 2cmc s GLN 157 N -0.69 3.98 0.15 3.54 -0.21 -0.49 -0.46 119.66 125.49 2cmc s GLN 157 Ca 0.06 -0.32 0.09 0.00 0.02 0.00 0.00 55.36 55.21 2cmc s GLN 157 Cb -0.07 -3.40 -0.04 0.00 1.00 0.00 0.00 33.01 30.49 2cmc s GLN 157 CO 0.00 0.10 -0.20 -0.51 -2.12 0.00 0.00 175.29 172.56 2cmc s LEU 158 N 0.90 2.41 -0.21 2.90 1.43 0.75 -0.50 118.68 126.36 2cmc s LEU 158 Ca 0.06 -0.82 0.00 0.00 -1.03 0.00 0.00 54.13 52.34 2cmc s LEU 158 Cb -0.13 -0.89 0.03 0.00 0.03 0.00 0.00 46.19 45.22 2cmc s LEU 158 CO 0.03 0.01 -0.14 -0.70 0.23 0.00 0.00 176.35 175.78 2cmc s GLU 159 N -2.58 2.83 -0.20 1.70 2.12 0.31 -0.28 118.70 122.60 2cmc s GLU 159 Ca 0.14 -0.95 -0.09 0.00 0.36 0.00 0.00 54.97 54.43 2cmc s GLU 159 Cb -0.07 -2.76 -0.04 0.00 0.26 0.00 0.00 34.13 31.52 2cmc s GLU 159 CO 0.07 -0.32 0.10 -1.17 -0.54 0.00 0.00 175.26 173.39 2cmc s LEU 160 N 1.27 3.97 -0.04 2.70 2.96 0.23 -1.26 118.68 128.50 2cmc s LEU 160 Ca 0.01 0.12 0.04 0.00 -0.22 0.00 0.00 54.13 54.08 2cmc s LEU 160 Cb -0.15 -2.03 -0.00 0.00 0.50 0.00 0.00 46.19 44.51 2cmc s LEU 160 CO -0.09 0.14 -0.16 -0.70 -1.32 0.00 0.00 176.35 174.23 2cmc s GLU 161 N 0.56 1.66 -0.54 1.98 2.12 0.14 -0.13 118.70 124.49 2cmc s GLU 161 Ca 0.05 -0.56 -0.25 0.00 0.36 0.00 0.00 54.97 54.58 2cmc s GLU 161 Cb -0.12 -1.45 0.04 0.00 0.26 0.00 0.00 34.13 32.85 2cmc s GLU 161 CO 0.01 0.21 0.98 1.21 -0.54 0.00 0.00 175.26 177.13 2cmc s ASN 162 N 0.09 6.39 0.50 -1.70 3.84 -0.34 -0.88 114.94 122.84 2cmc s ASN 162 Ca -0.04 -0.19 0.19 0.00 0.21 0.00 0.00 52.86 53.03 2cmc s ASN 162 Cb -0.11 -2.46 1.26 0.00 -0.55 0.00 0.00 41.25 39.39 2cmc s ASN 162 CO 0.02 -1.24 2.06 -0.07 -2.79 0.00 0.00 177.10 175.07 2cmc h LEU 163 N 11.07 0.09 -0.03 3.21 3.38 -1.78 0.52 115.31 131.76 2cmc h LEU 163 Ca -0.26 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 2cmc h LEU 163 Cb 1.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2cmc h LEU 163 CO 1.09 0.05 -0.19 0.74 0.09 0.00 0.00 178.44 180.23 2cmc h THR 164 N 0.10 1.48 0.00 0.22 2.02 -1.91 -3.34 112.91 111.48 2cmc h THR 164 Ca 0.16 -1.70 0.00 0.00 0.77 0.00 0.00 66.41 65.64 2cmc h THR 164 Cb 0.49 2.49 0.00 0.00 -1.74 0.00 0.00 68.15 69.39 2cmc h THR 164 CO -0.02 0.47 -1.01 0.35 0.37 0.00 0.00 175.52 175.68 2cmc n THR 165 N -4.56 0.33 -0.91 3.16 -2.24 -1.10 -4.95 114.28 104.01 2cmc n THR 165 Ca -0.09 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 2cmc n THR 165 Cb 0.44 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 2cmc n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cmc n GLN 166 N -2.23 -0.16 -2.07 -0.78 6.02 0.18 -5.01 117.38 113.34 2cmc n GLN 166 Ca 0.01 0.04 -0.39 0.00 -0.01 0.00 0.00 57.00 56.65 2cmc n GLN 166 Cb 0.48 -3.17 -0.00 0.00 1.02 0.00 0.00 30.24 28.57 2cmc n GLN 166 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2cmc s GLU 167 N -0.34 3.85 0.16 -1.09 2.12 -1.23 -4.79 118.70 117.37 2cmc s GLU 167 Ca 0.00 2.08 0.07 0.00 0.36 0.00 0.00 54.97 57.49 2cmc s GLU 167 Cb 0.00 -2.64 -0.04 0.00 0.26 0.00 0.00 34.13 31.71 2cmc s GLU 167 CO 0.00 -0.57 -0.16 0.95 -0.54 0.00 0.00 175.26 174.94 2cmc s THR 168 N -1.32 1.63 0.03 -1.70 -4.23 -1.26 -1.20 115.64 107.59 2cmc s THR 168 Ca 0.60 -1.90 -0.04 0.00 -1.18 0.00 0.00 61.69 59.17 2cmc s THR 168 Cb -0.36 -1.77 -0.01 0.00 1.34 0.00 0.00 72.50 71.69 2cmc s THR 168 CO 0.46 -0.40 0.06 -0.13 -0.54 0.00 0.00 174.62 174.07 2cmc s ARG 169 N -2.91 0.50 -0.17 3.99 0.52 0.81 -4.97 118.95 116.73 2cmc s ARG 169 Ca 0.15 -0.69 -0.19 0.00 -0.52 0.00 0.00 55.73 54.48 2cmc s ARG 169 Cb -0.04 0.19 -0.03 0.00 0.52 0.00 0.00 34.95 35.58 2cmc s ARG 169 CO 0.05 -0.11 0.51 -2.00 0.02 0.00 0.00 175.30 173.77 2cmc s GLU 170 N -2.19 4.24 -0.14 3.54 2.12 -1.26 -0.60 118.70 124.40 2cmc s GLU 170 Ca -0.09 0.44 0.01 0.00 0.36 0.00 0.00 54.97 55.70 2cmc s GLU 170 Cb -0.04 -3.52 -0.00 0.00 0.26 0.00 0.00 34.13 30.83 2cmc s GLU 170 CO -0.03 -0.06 -0.17 0.42 -0.54 0.00 0.00 175.26 174.88 2cmc s ILE 171 N 1.33 2.54 -0.27 -3.70 -1.09 0.62 -4.83 121.20 115.80 2cmc s ILE 171 Ca 0.25 -0.83 -0.12 0.00 -2.23 0.00 0.00 60.65 57.72 2cmc s ILE 171 Cb -0.15 -2.05 -0.05 0.00 -1.58 0.00 0.00 42.46 38.63 2cmc s ILE 171 CO 0.10 0.53 0.24 -0.76 -1.23 0.00 0.00 174.94 173.82 2cmc s LEU 172 N 0.65 4.05 -0.22 2.97 1.43 -0.30 -0.18 118.68 127.07 2cmc s LEU 172 Ca -0.09 0.11 -0.09 0.00 -1.03 0.00 0.00 54.13 53.03 2cmc s LEU 172 Cb -0.16 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.81 2cmc s LEU 172 CO 0.02 -0.06 0.11 -2.28 0.23 0.00 0.00 176.35 174.38 2cmc s HIS 173 N 1.67 3.25 -0.36 0.29 2.46 0.39 -1.44 115.29 121.56 2cmc s HIS 173 Ca 0.10 0.06 0.02 0.00 0.47 0.00 0.00 55.06 55.71 2cmc s HIS 173 Cb -0.15 -2.21 0.10 0.00 -0.13 0.00 0.00 32.58 30.19 2cmc s HIS 173 CO 0.09 0.01 0.09 -0.06 -2.47 0.00 0.00 174.74 172.40 2cmc s PHE 174 N 0.96 3.69 -0.43 3.88 0.08 0.31 -0.80 117.98 125.67 2cmc s PHE 174 Ca 0.06 -2.78 -0.16 0.00 0.12 0.00 0.00 56.93 54.17 2cmc s PHE 174 Cb -0.14 -2.96 0.03 0.00 -0.57 0.00 0.00 43.02 39.39 2cmc s PHE 174 CO 0.03 -0.95 0.37 -1.58 -0.10 0.00 0.00 175.22 172.99 2cmc s HIS 175 N 0.99 3.22 -0.53 0.36 2.46 -0.27 -0.16 115.29 121.35 2cmc s HIS 175 Ca 0.09 -0.61 -0.24 0.00 0.47 0.00 0.00 55.06 54.77 2cmc s HIS 175 Cb -0.20 -2.83 0.04 0.00 -0.13 0.00 0.00 32.58 29.46 2cmc s HIS 175 CO -0.07 -0.68 0.89 -0.47 -2.47 0.00 0.00 174.74 171.95 2cmc s TYR 176 N 1.82 2.85 -1.76 3.88 6.14 0.45 -0.43 117.35 130.30 2cmc s TYR 176 Ca 0.07 -0.03 0.08 0.00 0.64 0.00 0.00 57.07 57.83 2cmc s TYR 176 Cb -0.20 -3.97 0.26 0.00 0.42 0.00 0.00 41.96 38.47 2cmc s TYR 176 CO 0.10 -1.27 1.16 0.25 0.64 0.00 0.00 175.55 176.44 2cmc n THR 177 N 6.15 0.51 -2.93 4.34 -2.24 -0.98 -4.34 114.28 114.78 2cmc n THR 177 Ca 0.01 -0.41 -0.13 0.00 -2.27 0.00 0.00 64.05 61.25 2cmc n THR 177 Cb 0.47 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 2cmc n THR 177 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2cmc n THR 178 N 0.31 0.36 -3.68 4.28 5.66 -1.25 -4.96 114.28 115.00 2cmc n THR 178 Ca 0.10 -3.76 -0.30 0.00 -3.05 0.00 0.00 64.05 57.04 2cmc n THR 178 Cb 0.31 0.23 -0.14 0.00 -1.55 0.00 0.00 70.33 69.18 2cmc n THR 178 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 2cmc s TRP 179 N -2.62 1.66 0.60 1.09 -0.11 -1.26 -3.79 118.94 114.51 2cmc s TRP 179 Ca 0.33 -1.98 -0.20 0.00 1.22 0.00 0.00 56.10 55.47 2cmc s TRP 179 Cb 0.40 -1.66 -0.03 0.00 -1.50 0.00 0.00 33.47 30.68 2cmc s TRP 179 CO -0.03 -0.83 1.30 -0.35 -4.62 0.00 0.00 176.95 172.43 2cmc n PRO 180 N 4.22 1.35 -1.91 5.86 -0.04 -1.26 -4.70 135.00 138.52 2cmc n PRO 180 Ca 0.04 0.51 -0.41 0.00 -0.04 0.00 0.00 63.50 63.60 2cmc n PRO 180 Cb 0.38 -2.53 -0.01 0.00 -0.04 0.00 0.00 33.50 31.30 2cmc n PRO 180 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2cmc s ASP 181 N -1.17 6.50 -0.86 3.54 1.47 -1.26 -1.42 116.67 123.47 2cmc s ASP 181 Ca 0.78 2.88 0.00 0.00 1.18 0.00 0.00 52.55 57.39 2cmc s ASP 181 Cb -0.40 -2.65 0.00 0.00 -0.34 0.00 0.00 42.92 39.53 2cmc s ASP 181 CO 0.44 -0.77 0.00 0.49 0.68 0.00 0.00 175.17 176.01 2cmc n PHE 182 N 1.16 0.00 -3.73 2.11 3.72 -1.26 -4.97 117.46 114.49 2cmc n PHE 182 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 2cmc n PHE 182 Cb 0.40 -2.37 0.00 0.00 -0.94 0.00 0.00 39.48 36.57 2cmc n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2cmc n GLY 183 N -0.02 4.26 3.72 1.37 0.00 -0.51 -4.89 105.19 109.11 2cmc n GLY 183 Ca -0.08 -2.18 -0.23 0.00 0.00 0.00 0.00 46.02 43.53 2cmc n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2cmc s VAL 184 N -0.49 2.91 0.99 1.61 -7.23 -1.26 -4.82 120.40 112.12 2cmc s VAL 184 Ca 0.00 -1.73 -0.12 0.00 -1.81 0.00 0.00 61.98 58.32 2cmc s VAL 184 Cb 0.00 -2.95 0.18 0.00 0.56 0.00 0.00 36.38 34.17 2cmc s VAL 184 CO 0.00 -0.17 1.09 -2.84 -0.31 0.00 0.00 175.10 172.87 2cmc s PRO 185 N -3.83 0.52 0.24 4.82 0.02 -1.26 -4.43 135.00 131.07 2cmc s PRO 185 Ca 0.38 0.53 -0.08 0.00 0.02 0.00 0.00 61.00 61.85 2cmc s PRO 185 Cb -0.02 -1.75 0.40 0.00 0.02 0.00 0.00 34.50 33.16 2cmc s PRO 185 CO 0.22 -2.68 1.63 1.49 -0.33 0.00 0.00 177.00 177.34 2cmc h GLU 186 N -1.85 0.08 -2.07 5.54 4.57 -1.99 -3.45 114.58 115.42 2cmc h GLU 186 Ca -0.54 -0.01 0.18 0.00 -1.18 0.00 0.00 59.36 57.82 2cmc h GLU 186 Cb 1.33 -0.02 -0.13 0.00 -0.16 0.00 0.00 28.75 29.77 2cmc h GLU 186 CO 0.57 0.06 0.58 -1.54 -1.18 0.00 0.00 179.01 177.50 2cmc s SER 187 N -5.20 -0.23 0.37 1.04 1.04 -1.26 -5.01 113.70 104.45 2cmc s SER 187 Ca -0.14 -0.14 0.04 0.00 0.48 0.00 0.00 55.95 56.19 2cmc s SER 187 Cb 0.22 0.35 0.70 0.00 0.10 0.00 0.00 66.02 67.39 2cmc s SER 187 CO 0.75 -0.61 2.02 -0.65 0.98 0.00 0.00 173.24 175.73 2cmc h PRO 188 N 2.00 0.73 -0.22 4.02 0.11 -1.96 -2.50 132.00 134.18 2cmc h PRO 188 Ca -0.22 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 65.65 2cmc h PRO 188 Cb 1.22 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2cmc h PRO 188 CO 0.28 0.49 -0.63 0.00 -0.21 0.00 0.00 178.00 177.93 2cmc h ALA 189 N 1.64 0.46 -0.25 -0.75 0.00 -1.99 -0.78 119.26 117.59 2cmc h ALA 189 Ca 0.20 -0.55 -0.14 0.00 0.00 0.00 0.00 54.91 54.42 2cmc h ALA 189 Cb -0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2cmc h ALA 189 CO -0.04 0.69 -0.41 0.66 0.00 0.00 0.00 179.25 180.15 2cmc h SER 190 N 0.57 0.65 0.16 0.00 4.64 -1.92 -0.77 113.55 116.88 2cmc h SER 190 Ca -0.01 -0.29 -0.01 0.00 -0.47 0.00 0.00 61.79 61.01 2cmc h SER 190 Cb 1.24 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2cmc h SER 190 CO 0.13 0.98 -0.08 0.15 -0.87 0.00 0.00 176.83 177.15 2cmc h PHE 191 N 0.50 -0.20 -0.37 4.77 3.57 -1.39 -0.89 116.94 122.93 2cmc h PHE 191 Ca 0.04 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 2cmc h PHE 191 Cb 0.93 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.71 2cmc h PHE 191 CO 0.04 -0.01 0.20 -0.07 -2.23 0.00 0.00 178.31 176.24 2cmc h LEU 192 N -0.36 0.47 -1.15 0.59 3.38 -1.11 0.18 115.31 117.31 2cmc h LEU 192 Ca -0.02 -0.10 0.14 0.00 0.09 0.00 0.00 57.88 57.98 2cmc h LEU 192 Cb 0.28 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 2cmc h LEU 192 CO 0.04 0.44 0.60 -1.13 0.09 0.00 0.00 178.44 178.47 2cmc h ASN 193 N 0.47 0.78 0.03 -0.43 -1.24 -1.07 0.27 115.58 114.39 2cmc h ASN 193 Ca 0.13 0.05 -0.00 0.00 0.71 0.00 0.00 56.30 57.18 2cmc h ASN 193 Cb 0.08 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 39.02 2cmc h ASN 193 CO -0.02 0.40 -0.01 0.15 -1.29 0.00 0.00 177.43 176.65 2cmc h PHE 194 N 0.83 -0.03 -0.73 0.67 3.57 -0.26 -2.19 116.94 118.80 2cmc h PHE 194 Ca 0.48 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 62.01 2cmc h PHE 194 Cb 0.63 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.34 2cmc h PHE 194 CO -0.00 0.44 0.46 1.25 -2.23 0.00 0.00 178.31 178.23 2cmc h LEU 195 N -0.53 0.74 -1.07 0.59 5.85 0.21 -1.42 115.31 119.69 2cmc h LEU 195 Ca -0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 2cmc h LEU 195 Cb 0.49 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2cmc h LEU 195 CO 0.01 0.51 -0.42 -0.26 -0.34 0.00 0.00 178.44 177.94 2cmc h PHE 196 N 0.88 0.00 -0.59 1.25 0.05 -0.55 -1.14 116.94 116.85 2cmc h PHE 196 Ca 0.30 0.00 -0.10 0.00 3.82 0.00 0.00 57.97 61.98 2cmc h PHE 196 Cb 0.04 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 37.97 2cmc h PHE 196 CO -0.04 0.42 -0.04 -0.22 -0.18 0.00 0.00 178.31 178.25 2cmc h LYS 197 N 0.00 1.07 -0.31 1.51 1.63 -0.62 0.13 116.57 119.97 2cmc h LYS 197 Ca -0.00 -0.36 -0.11 0.00 -0.85 0.00 0.00 60.65 59.33 2cmc h LYS 197 Cb 0.83 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 32.36 2cmc h LYS 197 CO 0.05 1.06 -0.26 0.28 -3.45 0.00 0.00 179.45 177.14 2cmc h VAL 198 N 0.97 1.27 -0.11 2.00 2.07 -0.77 -3.03 116.25 118.65 2cmc h VAL 198 Ca 0.16 -1.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 2cmc h VAL 198 Cb 0.61 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 2cmc h VAL 198 CO 0.04 0.43 -0.04 0.03 0.02 0.00 0.00 177.57 178.05 2cmc h ARG 199 N 0.54 0.22 0.00 1.57 3.08 -0.79 -3.08 114.38 115.92 2cmc h ARG 199 Ca 0.07 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2cmc h ARG 199 Cb 0.72 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.76 2cmc h ARG 199 CO 0.06 0.54 0.00 0.93 -1.07 0.00 0.00 179.97 180.43 2cmc h GLU 200 N -0.11 0.00 0.00 0.04 5.08 -0.99 -2.36 114.58 116.24 2cmc h GLU 200 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2cmc h GLU 200 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2cmc h GLU 200 CO 0.01 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.68 2cmc h SER 201 N 0.00 0.00 0.00 1.42 4.64 -1.43 -3.47 113.55 114.71 2cmc h SER 201 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2cmc h SER 201 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2cmc h SER 201 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2cmc n GLY 202 N 0.63 0.60 0.09 -0.77 0.00 -0.89 -4.95 105.19 99.90 2cmc n GLY 202 Ca 0.03 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.89 2cmc n GLY 202 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cmc n SER 203 N 0.52 0.69 -0.61 1.61 7.64 -1.25 -3.70 113.62 118.53 2cmc n SER 203 Ca 0.00 0.52 0.09 0.00 1.01 0.00 0.00 58.87 60.49 2cmc n SER 203 Cb 0.00 -0.67 0.05 0.00 -1.01 0.00 0.00 64.21 62.58 2cmc n SER 203 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2cmc n LEU 204 N -2.14 2.24 -4.77 -3.43 4.77 -1.26 -4.31 117.00 108.09 2cmc n LEU 204 Ca 0.06 -0.92 -0.34 0.00 -0.03 0.00 0.00 56.01 54.77 2cmc n LEU 204 Cb 0.42 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.53 2cmc n LEU 204 CO 0.30 0.40 0.76 -0.55 -1.33 0.00 0.00 177.39 176.98 2cmc s SER 205 N -1.66 5.50 0.00 -1.43 0.15 -1.24 -4.92 113.70 110.10 2cmc s SER 205 Ca 0.19 2.08 0.14 0.00 0.70 0.00 0.00 55.95 59.07 2cmc s SER 205 Cb 0.15 -2.57 0.75 0.00 -1.71 0.00 0.00 66.02 62.64 2cmc s SER 205 CO 0.29 -1.36 1.37 -0.81 1.20 0.00 0.00 173.24 173.93 2cmc n PRO 206 N -1.76 0.25 0.09 5.44 -0.04 -1.26 -2.42 135.00 135.31 2cmc n PRO 206 Ca 0.11 0.13 0.12 0.00 -0.04 0.00 0.00 63.50 63.82 2cmc n PRO 206 Cb 0.51 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.93 2cmc n PRO 206 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2cmc n GLU 207 N -1.24 0.19 -4.50 0.54 1.02 -1.26 -4.81 120.64 110.59 2cmc n GLU 207 Ca 0.08 0.26 -0.24 0.00 -0.02 0.00 0.00 57.16 57.23 2cmc n GLU 207 Cb 0.10 -1.77 -0.10 0.00 -0.02 0.00 0.00 31.44 29.65 2cmc n GLU 207 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2cmc s HIS 208 N -3.15 2.24 1.17 -0.32 3.76 -1.01 -5.11 115.29 112.86 2cmc s HIS 208 Ca 0.09 -0.56 -0.16 0.00 -0.15 0.00 0.00 55.06 54.28 2cmc s HIS 208 Cb 0.12 -1.26 0.27 0.00 1.11 0.00 0.00 32.58 32.82 2cmc s HIS 208 CO 0.50 0.49 1.05 0.20 -0.85 0.00 0.00 174.74 176.13 2cmc s GLY 209 N -3.54 1.53 0.47 -2.22 0.00 0.12 -4.90 107.32 98.78 2cmc s GLY 209 Ca 0.31 -0.50 -0.24 0.00 0.00 0.00 0.00 44.72 44.30 2cmc s GLY 209 CO 0.15 0.28 1.35 -4.14 0.00 0.00 0.00 173.10 170.73 2cmc s PRO 210 N -4.90 3.58 0.43 2.90 0.02 -1.26 -4.40 135.00 131.37 2cmc s PRO 210 Ca 0.68 2.23 -0.25 0.00 0.02 0.00 0.00 61.00 63.68 2cmc s PRO 210 Cb -0.18 -2.52 -0.08 0.00 0.02 0.00 0.00 34.50 31.74 2cmc s PRO 210 CO 0.60 -0.84 1.33 0.54 -0.33 0.00 0.00 177.00 178.30 2cmc s VAL 211 N -1.29 2.47 -0.34 3.83 0.11 -1.26 -4.50 120.40 119.44 2cmc s VAL 211 Ca 0.64 0.41 -0.12 0.00 -2.93 0.00 0.00 61.98 59.98 2cmc s VAL 211 Cb -0.40 -3.24 -0.02 0.00 -1.53 0.00 0.00 36.38 31.20 2cmc s VAL 211 CO 0.49 0.05 0.23 -0.69 -3.33 0.00 0.00 175.10 171.86 2cmc s VAL 212 N -1.27 5.20 -0.10 2.04 1.01 -0.66 -1.07 120.40 125.54 2cmc s VAL 212 Ca 0.59 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.33 2cmc s VAL 212 Cb -0.39 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 2cmc s VAL 212 CO 0.50 -0.00 -0.11 -0.69 0.00 0.00 0.00 175.10 174.80 2cmc s VAL 213 N 1.71 3.33 0.11 2.92 1.01 0.47 -0.64 120.40 129.30 2cmc s VAL 213 Ca 0.06 -0.59 -0.14 0.00 0.00 0.00 0.00 61.98 61.32 2cmc s VAL 213 Cb -0.17 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 33.85 2cmc s VAL 213 CO 0.10 0.55 0.33 -1.38 0.00 0.00 0.00 175.10 174.70 2cmc s HIS 214 N -0.11 -0.09 0.00 5.22 -3.43 -0.56 -0.99 115.29 115.33 2cmc s HIS 214 Ca -0.00 -0.27 0.00 0.00 -0.80 0.00 0.00 55.06 53.99 2cmc s HIS 214 Cb -0.13 0.15 0.00 0.00 -1.43 0.00 0.00 32.58 31.17 2cmc s HIS 214 CO 0.03 -0.65 0.00 0.00 -2.00 0.00 0.00 174.74 172.13 2cmc h SER 216 N 0.00 0.00 0.17 0.00 0.87 -1.90 -2.53 113.55 110.16 2cmc h SER 216 Ca 0.00 -0.74 0.00 0.00 -1.23 0.00 0.00 61.79 59.82 2cmc h SER 216 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2cmc h SER 216 CO 0.00 0.99 -1.66 0.00 -0.53 0.00 0.00 176.83 175.63 2cmc n ALA 217 N -2.79 3.06 -1.75 6.23 0.00 -1.26 -1.66 120.51 122.34 2cmc n ALA 217 Ca -0.12 -0.48 -0.01 0.00 0.00 0.00 0.00 53.44 52.83 2cmc n ALA 217 Cb 0.43 -0.82 -0.00 0.00 0.00 0.00 0.00 19.45 19.06 2cmc n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cmc n GLY 218 N 1.29 0.36 0.36 0.00 0.00 -1.25 -4.23 105.19 101.72 2cmc n GLY 218 Ca -0.02 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.11 2cmc n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2cmc n ILE 219 N -3.71 0.00 0.00 -0.61 -5.35 -1.26 -4.58 119.36 103.85 2cmc n ILE 219 Ca -0.02 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 2cmc n ILE 219 Cb 0.38 -0.31 0.00 0.00 -1.74 0.00 0.00 39.64 37.97 2cmc n ILE 219 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2cmc n GLY 220 N 2.13 -1.05 0.21 3.28 0.00 -1.26 -0.28 105.19 108.23 2cmc n GLY 220 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2cmc n GLY 220 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2cmc h ARG 221 N 0.00 0.69 -0.97 1.61 3.08 -1.94 -1.26 114.38 115.59 2cmc h ARG 221 Ca 0.00 -0.30 0.00 0.00 0.07 0.00 0.00 59.98 59.76 2cmc h ARG 221 Cb 0.00 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 29.98 2cmc h ARG 221 CO 0.00 0.89 0.61 0.77 -1.07 0.00 0.00 179.97 181.18 2cmc h SER 222 N 0.46 1.13 -0.48 7.04 0.02 -1.86 -0.57 113.55 119.28 2cmc h SER 222 Ca 0.07 -0.05 -0.13 0.00 -0.84 0.00 0.00 61.79 60.84 2cmc h SER 222 Cb 0.68 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 2cmc h SER 222 CO 0.05 0.84 -0.22 1.23 -1.14 0.00 0.00 176.83 177.59 2cmc h GLY 223 N 1.32 1.09 0.91 -3.77 0.00 -1.22 -1.92 103.07 99.48 2cmc h GLY 223 Ca 0.35 -0.97 -0.00 0.00 0.00 0.00 0.00 47.33 46.71 2cmc h GLY 223 CO -0.07 0.88 0.06 -0.84 0.00 0.00 0.00 176.54 176.57 2cmc h THR 224 N 0.86 1.11 -0.16 4.70 2.02 -0.48 -0.32 112.91 120.65 2cmc h THR 224 Ca 0.11 -0.32 0.04 0.00 0.77 0.00 0.00 66.41 67.01 2cmc h THR 224 Cb 0.80 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 68.28 2cmc h THR 224 CO 0.07 0.10 -0.07 0.15 0.37 0.00 0.00 175.52 176.14 2cmc h PHE 225 N 0.08 -0.16 -0.14 3.16 3.57 -1.13 -2.41 116.94 119.90 2cmc h PHE 225 Ca 0.04 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.44 2cmc h PHE 225 Cb 0.11 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 2cmc h PHE 225 CO -0.03 -0.11 -0.44 0.00 -2.23 0.00 0.00 178.31 175.50 2cmc h LEU 227 N 0.28 1.02 -0.36 0.00 5.85 -0.96 -1.99 115.31 119.15 2cmc h LEU 227 Ca 0.02 -0.35 -0.03 0.00 0.84 0.00 0.00 57.88 58.36 2cmc h LEU 227 Cb 0.89 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 2cmc h LEU 227 CO 0.07 1.13 0.11 0.00 -0.34 0.00 0.00 178.44 179.42 2cmc h ALA 228 N 0.92 0.47 0.67 1.25 0.00 -1.30 -0.72 119.26 120.56 2cmc h ALA 228 Ca 0.14 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2cmc h ALA 228 Cb 0.67 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2cmc h ALA 228 CO 0.05 0.11 -0.35 0.22 0.00 0.00 0.00 179.25 179.28 2cmc h ASP 229 N 0.43 -0.84 -0.55 0.00 3.58 -1.40 -1.58 116.42 116.07 2cmc h ASP 229 Ca 0.12 0.04 0.08 0.00 0.42 0.00 0.00 57.03 57.69 2cmc h ASP 229 Cb 0.25 0.23 -0.07 0.00 1.72 0.00 0.00 39.33 41.46 2cmc h ASP 229 CO -0.00 -0.57 0.18 0.74 -2.88 0.00 0.00 179.24 176.70 2cmc h THR 230 N -0.93 0.77 -0.75 2.25 2.02 -1.35 -0.93 112.91 113.99 2cmc h THR 230 Ca -0.09 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 2cmc h THR 230 Cb 0.73 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 2cmc h THR 230 CO 0.13 0.06 0.40 0.00 0.37 0.00 0.00 175.52 176.49 2cmc h LEU 232 N 1.05 0.00 -0.01 0.00 3.38 -0.59 0.02 115.31 119.15 2cmc h LEU 232 Ca 0.26 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 2cmc h LEU 232 Cb 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2cmc h LEU 232 CO -0.04 0.18 -0.01 -0.07 0.09 0.00 0.00 178.44 178.60 2cmc h LEU 233 N 0.00 0.03 -1.42 1.67 4.07 -0.12 -2.47 115.31 117.08 2cmc h LEU 233 Ca -0.00 -0.47 -0.03 0.00 0.08 0.00 0.00 57.88 57.46 2cmc h LEU 233 Cb 0.35 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.07 2cmc h LEU 233 CO 0.02 0.49 0.07 -0.07 -1.08 0.00 0.00 178.44 177.87 2cmc h LEU 234 N -0.44 0.41 -1.60 1.67 3.38 -0.47 -1.16 115.31 117.11 2cmc h LEU 234 Ca 0.00 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2cmc h LEU 234 Cb 0.48 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 2cmc h LEU 234 CO 0.00 0.43 -0.11 0.24 0.09 0.00 0.00 178.44 179.09 2cmc h MET 235 N 0.45 0.00 0.00 1.13 2.86 -0.88 -1.77 114.93 116.73 2cmc h MET 235 Ca 0.11 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.54 2cmc h MET 235 Cb 0.19 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.81 2cmc h MET 235 CO -0.00 0.11 -1.65 -3.47 1.06 0.00 0.00 176.91 172.95 2cmc n ASP 236 N -3.34 0.67 0.01 1.22 2.03 -0.58 -4.42 116.55 112.14 2cmc n ASP 236 Ca -0.01 0.30 -0.10 0.00 0.52 0.00 0.00 54.79 55.51 2cmc n ASP 236 Cb 0.31 0.38 -0.14 0.00 -0.72 0.00 0.00 41.12 40.96 2cmc n ASP 236 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 2cmc h LYS 237 N 0.00 0.04 -6.83 -0.67 3.64 -1.02 -3.48 116.57 108.25 2cmc h LYS 237 Ca -0.23 -0.08 -0.48 0.00 -1.27 0.00 0.00 60.65 58.60 2cmc h LYS 237 Cb 1.72 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.54 2cmc h LYS 237 CO 0.05 0.74 0.20 1.03 -2.27 0.00 0.00 179.45 179.19 2cmc s ARG 238 N -2.63 4.15 0.22 1.90 0.52 -0.68 -4.98 118.95 117.45 2cmc s ARG 238 Ca -0.05 0.89 -0.08 0.00 -0.52 0.00 0.00 55.73 55.98 2cmc s ARG 238 Cb 0.08 -2.42 0.30 0.00 0.52 0.00 0.00 34.95 33.43 2cmc s ARG 238 CO 0.82 0.13 1.80 0.87 0.02 0.00 0.00 175.30 178.94 2cmc h LYS 239 N 2.32 0.66 -4.04 3.54 1.79 -1.92 -3.33 116.57 115.60 2cmc h LYS 239 Ca -0.48 -0.04 -0.64 0.00 -2.18 0.00 0.00 60.65 57.31 2cmc h LYS 239 Cb 1.18 -0.15 -0.40 0.00 -1.58 0.00 0.00 32.23 31.28 2cmc h LYS 239 CO 0.64 0.44 -0.70 0.34 -1.08 0.00 0.00 179.45 179.08 2cmc s ASP 240 N -5.57 4.45 0.63 0.86 2.15 -1.26 -4.98 116.67 112.94 2cmc s ASP 240 Ca -0.13 -2.35 0.32 0.00 0.43 0.00 0.00 52.55 50.82 2cmc s ASP 240 Cb 0.17 -1.47 1.74 0.00 -0.30 0.00 0.00 42.92 43.06 2cmc s ASP 240 CO 0.76 -0.34 2.05 1.55 -0.17 0.00 0.00 175.17 179.03 2cmc h PRO 241 N 7.31 0.00 0.00 4.34 0.13 -1.78 -1.64 132.00 140.36 2cmc h PRO 241 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2cmc h PRO 241 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2cmc h PRO 241 CO 0.55 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.19 2cmc n SER 242 N -3.37 0.00 -0.51 1.44 3.41 -1.26 -2.67 113.62 110.66 2cmc n SER 242 Ca 0.01 -0.26 0.12 0.00 -0.26 0.00 0.00 58.87 58.48 2cmc n SER 242 Cb 0.36 -0.18 0.46 0.00 -0.26 0.00 0.00 64.21 64.59 2cmc n SER 242 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2cmc n SER 243 N -1.18 1.57 -4.68 4.04 3.41 -0.62 -4.90 113.62 111.27 2cmc n SER 243 Ca 0.12 -1.59 -0.42 0.00 -0.26 0.00 0.00 58.87 56.72 2cmc n SER 243 Cb 0.13 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.01 2cmc n SER 243 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2cmc s VAL 244 N -1.90 3.55 -0.80 -3.33 1.01 -1.09 -4.96 120.40 112.87 2cmc s VAL 244 Ca 0.35 0.85 -0.15 0.00 0.00 0.00 0.00 61.98 63.04 2cmc s VAL 244 Cb 0.19 -3.55 0.19 0.00 0.00 0.00 0.00 36.38 33.22 2cmc s VAL 244 CO 0.30 -0.03 0.79 -0.62 0.00 0.00 0.00 175.10 175.54 2cmc s ASP 245 N 2.49 6.66 0.25 3.32 -1.08 -1.26 -4.96 116.67 122.10 2cmc s ASP 245 Ca 0.69 -2.46 -0.03 0.00 -0.52 0.00 0.00 52.55 50.23 2cmc s ASP 245 Cb -0.33 -2.24 0.50 0.00 -1.46 0.00 0.00 42.92 39.38 2cmc s ASP 245 CO 0.28 -0.70 1.70 -0.29 0.52 0.00 0.00 175.17 176.68 2cmc h ILE 246 N 5.09 0.54 -0.58 4.11 2.10 -1.99 0.13 117.51 126.91 2cmc h ILE 246 Ca 0.06 -0.11 -0.10 0.00 1.08 0.00 0.00 64.86 65.78 2cmc h ILE 246 Cb 1.05 0.18 -0.02 0.00 -1.09 0.00 0.00 36.82 36.94 2cmc h ILE 246 CO 0.85 0.06 -0.02 0.50 -1.08 0.00 0.00 178.15 178.46 2cmc h LYS 247 N 0.33 1.03 -0.37 2.19 3.64 -1.99 -1.14 116.57 120.26 2cmc h LYS 247 Ca 0.44 -0.33 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 2cmc h LYS 247 Cb 0.74 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2cmc h LYS 247 CO -0.49 1.02 -0.07 -0.22 -2.27 0.00 0.00 179.45 177.42 2cmc h LYS 248 N 0.94 0.70 -0.79 1.90 3.64 -1.66 -0.73 116.57 120.57 2cmc h LYS 248 Ca 0.16 -0.26 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 2cmc h LYS 248 Cb 0.57 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.31 2cmc h LYS 248 CO 0.03 0.85 0.36 0.28 -2.27 0.00 0.00 179.45 178.70 2cmc h VAL 249 N 0.50 1.25 -0.24 2.00 2.07 -0.63 -0.97 116.25 120.23 2cmc h VAL 249 Ca 0.10 -0.72 -0.20 0.00 0.82 0.00 0.00 66.70 66.70 2cmc h VAL 249 Cb 0.58 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2cmc h VAL 249 CO 0.03 0.31 -0.62 0.25 0.02 0.00 0.00 177.57 177.56 2cmc h LEU 250 N 1.13 0.93 -0.98 2.57 5.85 -1.04 -1.85 115.31 121.92 2cmc h LEU 250 Ca 0.27 -0.54 0.01 0.00 0.84 0.00 0.00 57.88 58.46 2cmc h LEU 250 Cb 0.14 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 2cmc h LEU 250 CO -0.03 1.33 0.63 -0.07 -0.34 0.00 0.00 178.44 179.96 2cmc h LEU 251 N 0.61 1.15 -0.33 2.25 3.38 -0.93 -0.15 115.31 121.29 2cmc h LEU 251 Ca -0.01 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2cmc h LEU 251 Cb 1.23 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 2cmc h LEU 251 CO 0.13 0.85 0.15 -0.08 0.09 0.00 0.00 178.44 179.58 2cmc h GLU 252 N 1.34 0.48 -0.94 1.13 4.57 -1.07 -2.42 114.58 117.67 2cmc h GLU 252 Ca 0.36 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.45 2cmc h GLU 252 Cb -0.13 -0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.34 2cmc h GLU 252 CO -0.07 0.46 0.56 0.52 -1.18 0.00 0.00 179.01 179.30 2cmc h MET 253 N 0.39 1.28 0.00 1.92 2.86 -0.89 -2.25 114.93 118.24 2cmc h MET 253 Ca 0.11 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2cmc h MET 253 Cb 0.15 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 31.54 2cmc h MET 253 CO -0.01 0.90 0.00 0.54 1.06 0.00 0.00 176.91 179.39 2cmc n ARG 254 N -4.35 0.02 0.18 1.72 1.74 -0.11 -1.20 116.66 114.66 2cmc n ARG 254 Ca 0.11 0.45 0.06 0.00 -0.77 0.00 0.00 57.85 57.70 2cmc n ARG 254 Cb 0.06 -1.55 0.29 0.00 -1.02 0.00 0.00 32.46 30.24 2cmc n ARG 254 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2cmc h LYS 255 N 0.00 0.00 0.00 5.56 1.57 -1.26 -3.26 116.57 119.18 2cmc h LYS 255 Ca 0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 2cmc h LYS 255 Cb 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 2cmc h LYS 255 CO 0.00 0.37 -1.50 1.19 -0.57 0.00 0.00 179.45 178.95 2cmc n PHE 256 N -3.43 0.74 -3.63 -1.35 3.72 -0.34 -4.94 117.46 108.23 2cmc n PHE 256 Ca 0.00 0.24 -0.05 0.00 -0.05 0.00 0.00 57.45 57.59 2cmc n PHE 256 Cb 0.54 -0.96 -0.07 0.00 -0.94 0.00 0.00 39.48 38.06 2cmc n PHE 256 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2cmc s ARG 257 N -3.08 0.59 0.56 -1.08 3.52 -1.19 -4.50 118.95 113.77 2cmc s ARG 257 Ca -0.04 1.07 -0.20 0.00 -0.13 0.00 0.00 55.73 56.43 2cmc s ARG 257 Cb 0.09 0.19 -0.04 0.00 -1.56 0.00 0.00 34.95 33.63 2cmc s ARG 257 CO 0.82 -0.13 1.26 0.00 -0.81 0.00 0.00 175.30 176.44 2cmc s MET 258 N 1.68 3.11 0.00 5.12 0.23 -1.26 -3.99 119.30 124.19 2cmc s MET 258 Ca -0.09 1.99 0.00 0.00 -1.03 0.00 0.00 55.69 56.56 2cmc s MET 258 Cb -0.05 -2.11 0.00 0.00 -1.53 0.00 0.00 34.83 31.14 2cmc s MET 258 CO -0.18 -1.14 0.00 0.41 -2.03 0.00 0.00 175.02 172.07 2cmc n GLY 259 N 0.62 0.49 3.68 3.16 0.00 -1.26 -4.82 105.19 107.06 2cmc n GLY 259 Ca 0.12 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.63 2cmc n GLY 259 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cmc n LEU 260 N 0.00 3.16 -1.27 0.99 4.77 -1.25 -3.97 117.00 119.44 2cmc n LEU 260 Ca 0.00 0.97 -0.00 0.00 -0.03 0.00 0.00 56.01 56.95 2cmc n LEU 260 Cb 0.09 -1.32 -0.00 0.00 -2.33 0.00 0.00 43.42 39.86 2cmc n LEU 260 CO 0.00 -0.17 -0.09 -0.38 -1.33 0.00 0.00 177.39 175.43 2cmc n ILE 261 N 5.15 -4.00 0.98 -0.08 5.41 0.62 -4.94 119.36 122.51 2cmc n ILE 261 Ca 0.24 0.53 0.11 0.00 1.00 0.00 0.00 62.75 64.63 2cmc n ILE 261 Cb 0.26 -3.57 0.03 0.00 -0.71 0.00 0.00 39.64 35.65 2cmc n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2cmc n GLN 262 N 0.31 0.01 -3.95 0.38 1.13 -1.25 -4.88 117.38 109.13 2cmc n GLN 262 Ca -0.01 -0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.96 2cmc n GLN 262 Cb 0.01 -1.50 -0.09 0.00 0.11 0.00 0.00 30.24 28.76 2cmc n GLN 262 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2cmc s THR 263 N -3.01 0.14 0.47 5.09 -4.23 -1.26 -5.03 115.64 107.81 2cmc s THR 263 Ca 0.09 -1.18 0.17 0.00 -1.18 0.00 0.00 61.69 59.59 2cmc s THR 263 Cb 0.17 -0.96 0.22 0.00 1.34 0.00 0.00 72.50 73.26 2cmc s THR 263 CO 0.80 -0.65 2.05 0.00 -0.54 0.00 0.00 174.62 176.28 2cmc h ALA 264 N 3.59 1.71 -0.08 3.99 0.00 -1.93 -0.86 119.26 125.68 2cmc h ALA 264 Ca -0.33 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.34 2cmc h ALA 264 Cb 1.18 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2cmc h ALA 264 CO 0.52 0.16 -0.49 0.22 0.00 0.00 0.00 179.25 179.66 2cmc h ASP 265 N 0.00 0.23 0.40 0.00 1.82 -1.96 -0.95 116.42 115.97 2cmc h ASP 265 Ca -0.00 -0.11 -0.13 0.00 -0.39 0.00 0.00 57.03 56.40 2cmc h ASP 265 Cb 0.24 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.17 2cmc h ASP 265 CO 0.02 0.69 -0.54 1.56 -1.61 0.00 0.00 179.24 179.36 2cmc h GLN 266 N 0.17 0.15 -0.17 0.28 4.20 -1.50 0.14 115.11 118.38 2cmc h GLN 266 Ca 0.01 -0.09 -0.07 0.00 0.06 0.00 0.00 58.65 58.55 2cmc h GLN 266 Cb 0.94 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.72 2cmc h GLN 266 CO 0.08 0.65 -0.18 1.25 -0.67 0.00 0.00 178.83 179.96 2cmc h LEU 267 N 0.12 0.45 -0.17 1.46 5.85 -1.07 -1.85 115.31 120.09 2cmc h LEU 267 Ca 0.00 -0.48 -0.00 0.00 0.84 0.00 0.00 57.88 58.23 2cmc h LEU 267 Cb 0.99 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 2cmc h LEU 267 CO 0.08 0.84 0.10 -0.09 -0.34 0.00 0.00 178.44 179.03 2cmc h ARG 268 N 0.06 0.23 -0.43 1.25 2.43 -1.00 -2.23 114.38 114.69 2cmc h ARG 268 Ca 0.03 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 2cmc h ARG 268 Cb 0.72 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.18 2cmc h ARG 268 CO 0.04 0.19 0.17 0.35 -1.51 0.00 0.00 179.97 179.22 2cmc h PHE 269 N 0.20 0.31 -0.80 2.20 3.57 -0.73 -0.67 116.94 121.03 2cmc h PHE 269 Ca 0.06 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.68 2cmc h PHE 269 Cb 0.02 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.61 2cmc h PHE 269 CO -0.05 0.13 0.45 1.03 -2.23 0.00 0.00 178.31 177.64 2cmc h SER 270 N 0.36 0.63 -0.31 0.41 0.87 -1.09 0.29 113.55 114.70 2cmc h SER 270 Ca 0.20 0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.77 2cmc h SER 270 Cb 0.16 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 2cmc h SER 270 CO -0.18 0.36 0.06 0.22 -0.53 0.00 0.00 176.83 176.76 2cmc h TYR 271 N 0.75 0.53 -0.78 2.24 3.20 -0.84 -2.31 116.97 119.76 2cmc h TYR 271 Ca 0.39 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 62.17 2cmc h TYR 271 Cb 0.37 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.45 2cmc h TYR 271 CO -0.07 0.57 0.40 1.25 -1.64 0.00 0.00 178.16 178.67 2cmc h LEU 272 N 0.33 0.99 -1.31 2.82 5.85 -0.26 -2.21 115.31 121.52 2cmc h LEU 272 Ca 0.09 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 2cmc h LEU 272 Cb 0.32 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2cmc h LEU 272 CO 0.00 0.82 -0.34 0.00 -0.34 0.00 0.00 178.44 178.58 2cmc h ALA 273 N 1.34 1.43 -0.02 1.25 0.00 -0.23 -2.39 119.26 120.65 2cmc h ALA 273 Ca 0.27 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2cmc h ALA 273 Cb 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2cmc h ALA 273 CO -0.04 0.43 -0.24 0.28 0.00 0.00 0.00 179.25 179.68 2cmc h VAL 274 N 0.01 1.51 0.00 0.00 2.07 -0.84 0.36 116.25 119.35 2cmc h VAL 274 Ca -0.00 -1.83 0.00 0.00 0.82 0.00 0.00 66.70 65.68 2cmc h VAL 274 Cb 0.61 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 33.00 2cmc h VAL 274 CO 0.04 0.51 0.00 0.16 0.02 0.00 0.00 177.57 178.30 2cmc h ILE 275 N -0.42 0.00 0.10 4.57 3.07 -1.48 0.49 117.51 123.83 2cmc h ILE 275 Ca -0.02 -0.51 -0.13 0.00 1.55 0.00 0.00 64.86 65.74 2cmc h ILE 275 Cb 0.95 1.49 0.01 0.00 -0.27 0.00 0.00 36.82 39.01 2cmc h ILE 275 CO 0.05 0.00 -0.60 -0.08 -1.05 0.00 0.00 178.15 176.47 2cmc h GLU 276 N 0.00 0.21 0.00 0.16 4.57 -1.44 -3.31 114.58 114.77 2cmc h GLU 276 Ca 0.00 -0.36 -0.08 0.00 -1.18 0.00 0.00 59.36 57.75 2cmc h GLU 276 Cb 0.53 0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.24 2cmc h GLU 276 CO 0.00 1.17 -0.36 0.78 -1.18 0.00 0.00 179.01 179.42 2cmc h GLY 277 N -0.55 0.00 1.74 1.92 0.00 -0.46 -2.82 103.07 102.90 2cmc h GLY 277 Ca -0.11 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.26 2cmc h GLY 277 CO 0.10 0.00 0.09 0.00 0.00 0.00 0.00 176.54 176.74 2cmc h ALA 278 N 1.64 2.06 -0.56 3.60 0.00 -0.12 -1.15 119.26 124.73 2cmc h ALA 278 Ca -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2cmc h ALA 278 Cb 0.72 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2cmc h ALA 278 CO 0.05 -0.16 0.34 0.87 0.00 0.00 0.00 179.25 180.35 2cmc h LYS 279 N 0.00 0.75 -4.92 0.00 1.57 -1.60 -3.32 116.57 109.06 2cmc h LYS 279 Ca 0.06 -0.06 -0.71 0.00 -1.87 0.00 0.00 60.65 58.07 2cmc h LYS 279 Cb 0.24 -0.16 -0.17 0.00 0.08 0.00 0.00 32.23 32.22 2cmc h LYS 279 CO -0.00 0.53 1.14 -0.06 -0.57 0.00 0.00 179.45 180.49 2cmc s PHE 280 N -5.59 3.30 0.00 -1.35 0.40 -0.44 -5.17 117.98 109.13 2cmc s PHE 280 Ca -0.09 -1.77 0.00 0.00 -0.60 0.00 0.00 56.93 54.47 2cmc s PHE 280 Cb 0.17 -4.32 0.00 0.00 0.51 0.00 0.00 43.02 39.39 2cmc s PHE 280 CO 0.76 -1.46 0.00 1.51 0.70 0.00 0.00 175.22 176.73