#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xgi n PRO 5 N 0.00 1.26 0.12 0.00 -0.02 -1.26 -4.72 135.00 130.38 1xgi n PRO 5 Ca 0.00 0.46 0.03 0.00 -2.02 0.00 0.00 63.50 61.97 1xgi n PRO 5 Cb 0.00 -2.04 0.42 0.00 -0.02 0.00 0.00 33.50 31.86 1xgi n PRO 5 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1xgi h GLN 6 N 1.36 0.25 -0.41 -0.52 4.15 -2.05 -0.93 115.11 116.96 1xgi h GLN 6 Ca -0.45 -0.05 0.03 0.00 0.77 0.00 0.00 58.65 58.96 1xgi h GLN 6 Cb 1.34 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 28.96 1xgi h GLN 6 CO 0.56 0.33 0.20 0.37 -1.93 0.00 0.00 178.83 178.36 1xgi h GLN 7 N 0.24 0.40 -0.01 1.69 4.15 -1.99 0.33 115.11 119.91 1xgi h GLN 7 Ca 0.05 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 1xgi h GLN 7 Cb 0.28 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.88 1xgi h GLN 7 CO 0.01 0.27 -0.01 0.82 -1.93 0.00 0.00 178.83 177.99 1xgi h ILE 8 N 0.41 1.37 -0.53 2.39 2.04 -1.81 -1.93 117.51 119.45 1xgi h ILE 8 Ca 0.18 -1.09 0.10 0.00 1.00 0.00 0.00 64.86 65.04 1xgi h ILE 8 Cb 0.09 2.08 -0.08 0.00 -0.74 0.00 0.00 36.82 38.17 1xgi h ILE 8 CO -0.13 0.29 0.06 -1.13 0.00 0.00 0.00 178.15 177.24 1xgi h ASN 9 N -0.42 -0.10 0.51 1.72 -0.73 -0.89 -1.79 115.58 113.89 1xgi h ASN 9 Ca 0.00 0.11 -0.03 0.00 1.87 0.00 0.00 56.30 58.26 1xgi h ASN 9 Cb 0.47 0.17 0.01 0.00 0.27 0.00 0.00 38.32 39.24 1xgi h ASN 9 CO 0.00 -0.02 -0.25 0.44 -0.37 0.00 0.00 177.43 177.23 1xgi h ASP 10 N 0.19 -0.58 -0.92 1.15 3.45 -0.31 -2.24 116.42 117.15 1xgi h ASP 10 Ca 0.27 -0.05 0.05 0.00 0.43 0.00 0.00 57.03 57.73 1xgi h ASP 10 Cb 0.40 0.15 -0.06 0.00 -0.56 0.00 0.00 39.33 39.26 1xgi h ASP 10 CO -0.39 -0.30 0.59 -0.29 -1.57 0.00 0.00 179.24 177.28 1xgi h ILE 11 N -0.86 1.11 0.36 0.35 6.09 -1.25 -0.24 117.51 123.06 1xgi h ILE 11 Ca -0.07 -0.38 -0.02 0.00 -1.37 0.00 0.00 64.86 63.02 1xgi h ILE 11 Cb 0.59 -0.10 0.00 0.00 0.47 0.00 0.00 36.82 37.79 1xgi h ILE 11 CO 0.12 0.20 -0.17 0.58 -3.07 0.00 0.00 178.15 175.81 1xgi h VAL 12 N 1.11 0.65 -0.79 2.19 2.07 -1.33 -2.10 116.25 118.06 1xgi h VAL 12 Ca 0.38 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 1xgi h VAL 12 Cb 0.09 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 1xgi h VAL 12 CO -0.15 0.07 0.36 0.45 0.02 0.00 0.00 177.57 178.32 1xgi h HIS 13 N -0.68 1.15 0.00 1.57 3.86 -1.25 0.17 115.15 119.97 1xgi h HIS 13 Ca -0.05 -0.07 -0.04 0.00 -1.16 0.00 0.00 60.37 59.06 1xgi h HIS 13 Cb 0.48 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 1xgi h HIS 13 CO -0.00 0.85 -0.18 0.00 0.86 0.00 0.00 177.93 179.46 1xgi h ARG 14 N 1.12 0.00 0.04 2.45 3.08 -1.05 -2.22 114.38 117.79 1xgi h ARG 14 Ca 0.27 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 60.01 1xgi h ARG 14 Cb 0.15 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 1xgi h ARG 14 CO -0.03 0.18 -1.69 2.41 -1.07 0.00 0.00 179.97 179.76 1xgi n THR 15 N -3.71 1.62 0.06 2.04 -1.04 -0.79 -4.45 114.28 108.00 1xgi n THR 15 Ca -0.02 -0.30 -0.17 0.00 -2.04 0.00 0.00 64.05 61.53 1xgi n THR 15 Cb 0.29 -1.90 -0.08 0.00 -1.82 0.00 0.00 70.33 66.83 1xgi n THR 15 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1xgi h ILE 16 N -0.60 1.34 -0.48 12.58 1.08 -0.73 -3.16 117.51 127.55 1xgi h ILE 16 Ca -0.42 -2.37 0.05 0.00 -0.39 0.00 0.00 64.86 61.73 1xgi h ILE 16 Cb 1.61 2.42 -0.05 0.00 -3.07 0.00 0.00 36.82 37.73 1xgi h ILE 16 CO -0.13 0.72 0.22 0.74 -0.69 0.00 0.00 178.15 179.01 1xgi h THR 17 N 0.30 0.91 -0.55 -0.27 2.02 -1.60 0.95 112.91 114.68 1xgi h THR 17 Ca -0.11 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 1xgi h THR 17 Cb 1.65 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.49 1xgi h THR 17 CO 0.19 0.08 0.22 -0.65 0.37 0.00 0.00 175.52 175.72 1xgi h PRO 18 N 0.43 0.82 -0.05 6.66 0.11 -1.78 -2.15 132.00 136.05 1xgi h PRO 18 Ca 0.22 -0.15 0.03 0.00 0.11 0.00 0.00 66.00 66.20 1xgi h PRO 18 Cb 0.17 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.11 1xgi h PRO 18 CO -0.18 0.72 -0.12 1.25 -0.21 0.00 0.00 178.00 179.46 1xgi h LEU 19 N 0.75 -0.35 -1.31 2.35 5.85 -1.38 0.17 115.31 121.39 1xgi h LEU 19 Ca 0.18 0.06 0.04 0.00 0.84 0.00 0.00 57.88 59.01 1xgi h LEU 19 Cb 0.21 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 1xgi h LEU 19 CO -0.01 -0.16 0.50 0.40 -0.34 0.00 0.00 178.44 178.82 1xgi h ILE 20 N -0.17 1.08 0.32 4.05 2.04 -0.69 -1.10 117.51 123.04 1xgi h ILE 20 Ca 0.06 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 1xgi h ILE 20 Cb 0.26 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1xgi h ILE 20 CO -0.15 0.16 -0.15 -0.33 0.00 0.00 0.00 178.15 177.67 1xgi h GLU 21 N 0.88 -0.41 -0.71 2.37 5.08 -0.65 -1.20 114.58 119.94 1xgi h GLU 21 Ca 0.31 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.67 1xgi h GLU 21 Cb 0.12 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1xgi h GLU 21 CO -0.10 -0.09 0.34 -0.56 -1.00 0.00 0.00 179.01 177.61 1xgi h GLN 22 N -0.78 1.01 -0.01 2.33 -0.00 -0.48 -2.87 115.11 114.30 1xgi h GLN 22 Ca -0.04 -0.14 0.00 0.00 -0.00 0.00 0.00 58.65 58.47 1xgi h GLN 22 Cb 0.51 -0.19 0.00 0.00 -0.00 0.00 0.00 27.48 27.80 1xgi h GLN 22 CO 0.07 0.78 -0.21 1.04 -0.00 0.00 0.00 178.83 180.51 1xgi n GLN 23 N -4.33 1.12 -3.71 0.06 1.13 -0.44 -4.96 117.38 106.25 1xgi n GLN 23 Ca 0.07 -0.70 -0.22 0.00 -1.94 0.00 0.00 57.00 54.21 1xgi n GLN 23 Cb 0.13 -1.49 0.04 0.00 0.11 0.00 0.00 30.24 29.03 1xgi n GLN 23 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1xgi n LYS 24 N -0.33 -5.12 -2.84 -1.09 2.85 -0.50 -4.93 118.16 106.19 1xgi n LYS 24 Ca 0.14 0.63 -0.42 0.00 -1.05 0.00 0.00 58.31 57.61 1xgi n LYS 24 Cb 0.37 -5.26 -0.04 0.00 -0.65 0.00 0.00 35.03 29.45 1xgi n LYS 24 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1xgi s ILE 25 N -3.61 4.85 0.17 0.58 1.01 -0.89 -4.97 121.20 118.35 1xgi s ILE 25 Ca 0.08 1.72 -0.11 0.00 0.00 0.00 0.00 60.65 62.34 1xgi s ILE 25 Cb -0.04 -4.18 0.08 0.00 0.01 0.00 0.00 42.46 38.33 1xgi s ILE 25 CO 0.81 0.02 1.71 -0.65 0.00 0.00 0.00 174.94 176.83 1xgi h PRO 26 N 7.28 0.93 -2.98 2.79 0.11 -1.88 -3.46 132.00 134.80 1xgi h PRO 26 Ca -0.29 -0.19 -0.12 0.00 0.11 0.00 0.00 66.00 65.51 1xgi h PRO 26 Cb 1.13 -0.14 -0.20 0.00 0.11 0.00 0.00 31.00 31.90 1xgi h PRO 26 CO 0.85 0.82 -0.25 0.20 -0.21 0.00 0.00 178.00 179.40 1xgi s GLY 27 N -3.22 -0.18 -0.02 -0.55 0.00 -1.18 -0.61 107.32 101.56 1xgi s GLY 27 Ca -0.13 0.40 -0.20 0.00 0.00 0.00 0.00 44.72 44.80 1xgi s GLY 27 CO 0.81 0.19 0.43 -0.29 0.00 0.00 0.00 173.10 174.23 1xgi s MET 28 N -1.26 0.81 -0.01 2.90 1.75 -0.42 -2.36 119.30 120.71 1xgi s MET 28 Ca -0.13 -0.09 0.02 0.00 -1.25 0.00 0.00 55.69 54.25 1xgi s MET 28 Cb -0.05 0.37 -0.00 0.00 2.84 0.00 0.00 34.83 37.98 1xgi s MET 28 CO 0.04 -0.24 -0.07 0.00 -0.65 0.00 0.00 175.02 174.10 1xgi s ALA 29 N -1.42 0.64 0.01 4.11 0.00 0.10 -0.73 121.76 124.46 1xgi s ALA 29 Ca -0.12 -0.31 0.01 0.00 0.00 0.00 0.00 51.96 51.54 1xgi s ALA 29 Cb -0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 1xgi s ALA 29 CO 0.05 0.15 -0.05 0.08 0.00 0.00 0.00 175.76 175.99 1xgi s VAL 30 N -0.11 0.37 -0.03 0.00 1.01 0.08 -0.72 120.40 120.98 1xgi s VAL 30 Ca 0.02 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.48 1xgi s VAL 30 Cb -0.04 -0.38 0.01 0.00 0.00 0.00 0.00 36.38 35.98 1xgi s VAL 30 CO -0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 175.10 174.92 1xgi s ALA 31 N -0.65 0.66 -0.11 5.51 0.00 -0.51 -0.84 121.76 125.83 1xgi s ALA 31 Ca -0.04 -0.12 0.02 0.00 0.00 0.00 0.00 51.96 51.83 1xgi s ALA 31 Cb -0.05 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 1xgi s ALA 31 CO -0.00 0.04 -0.19 0.08 0.00 0.00 0.00 175.76 175.69 1xgi s VAL 32 N 0.62 2.53 -0.34 0.00 1.01 -0.41 -1.20 120.40 122.60 1xgi s VAL 32 Ca -0.08 -0.86 -0.10 0.00 0.00 0.00 0.00 61.98 60.94 1xgi s VAL 32 Cb -0.12 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.26 1xgi s VAL 32 CO 0.00 0.55 0.18 -0.63 0.00 0.00 0.00 175.10 175.20 1xgi s ILE 33 N 0.24 4.58 -0.22 2.22 1.09 0.57 -0.88 121.20 128.81 1xgi s ILE 33 Ca -0.13 -0.64 0.00 0.00 -1.10 0.00 0.00 60.65 58.79 1xgi s ILE 33 Cb -0.16 -3.45 0.03 0.00 -1.06 0.00 0.00 42.46 37.82 1xgi s ILE 33 CO 0.07 -0.08 -0.13 -0.47 -0.10 0.00 0.00 174.94 174.22 1xgi s TYR 34 N 1.58 2.97 -1.44 3.97 6.14 0.10 -1.46 117.35 129.21 1xgi s TYR 34 Ca 0.03 -1.73 -0.10 0.00 0.64 0.00 0.00 57.07 55.92 1xgi s TYR 34 Cb -0.18 -1.97 0.05 0.00 0.42 0.00 0.00 41.96 40.28 1xgi s TYR 34 CO 0.06 -0.79 0.97 1.04 0.64 0.00 0.00 175.55 177.47 1xgi n GLN 35 N 4.60 -5.90 -1.00 4.97 6.02 -0.85 -2.03 117.38 123.19 1xgi n GLN 35 Ca -0.18 0.65 0.00 0.00 -0.01 0.00 0.00 57.00 57.46 1xgi n GLN 35 Cb 0.48 -5.51 0.00 0.00 1.02 0.00 0.00 30.24 26.22 1xgi n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xgi n GLY 36 N -1.71 0.99 3.45 1.08 0.00 -1.15 -5.03 105.19 102.82 1xgi n GLY 36 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 1xgi n GLY 36 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xgi s LYS 37 N -0.00 2.49 0.09 1.61 -2.85 -0.86 -5.06 119.74 115.16 1xgi s LYS 37 Ca 0.00 -0.73 -0.09 0.00 -1.00 0.00 0.00 55.97 54.15 1xgi s LYS 37 Cb 0.00 -2.34 -0.06 0.00 -2.06 0.00 0.00 37.83 33.37 1xgi s LYS 37 CO 0.00 0.59 0.39 -1.25 0.10 0.00 0.00 175.35 175.19 1xgi s PRO 38 N -0.65 3.73 -0.07 1.78 0.04 -1.26 -0.72 135.00 137.85 1xgi s PRO 38 Ca 0.10 0.13 0.02 0.00 0.04 0.00 0.00 61.00 61.28 1xgi s PRO 38 Cb -0.11 -2.97 0.02 0.00 0.04 0.00 0.00 34.50 31.48 1xgi s PRO 38 CO 0.01 0.54 -0.10 0.71 0.04 0.00 0.00 177.00 178.19 1xgi s TYR 39 N -1.45 1.38 0.12 0.56 2.02 -0.06 -4.96 117.35 114.96 1xgi s TYR 39 Ca 0.34 -0.54 0.04 0.00 -0.37 0.00 0.00 57.07 56.55 1xgi s TYR 39 Cb -0.14 -1.05 -0.04 0.00 -0.40 0.00 0.00 41.96 40.33 1xgi s TYR 39 CO 0.19 -0.31 0.08 0.71 -1.57 0.00 0.00 175.55 174.65 1xgi s TYR 40 N 0.90 3.11 -0.10 2.71 1.51 -1.26 -1.29 117.35 122.93 1xgi s TYR 40 Ca -0.10 0.00 -0.09 0.00 -1.01 0.00 0.00 57.07 55.88 1xgi s TYR 40 Cb -0.15 -1.54 0.03 0.00 -0.11 0.00 0.00 41.96 40.19 1xgi s TYR 40 CO 0.01 0.51 0.26 -0.06 -1.11 0.00 0.00 175.55 175.16 1xgi s PHE 41 N -1.55 -0.30 0.02 2.71 0.08 -0.02 -5.00 117.98 113.92 1xgi s PHE 41 Ca 0.29 0.72 0.01 0.00 0.12 0.00 0.00 56.93 58.06 1xgi s PHE 41 Cb -0.11 0.09 -0.02 0.00 -0.57 0.00 0.00 43.02 42.41 1xgi s PHE 41 CO 0.22 -0.15 -0.04 0.95 -0.10 0.00 0.00 175.22 176.09 1xgi s THR 42 N 0.29 0.21 0.02 0.64 -4.23 -1.26 -0.74 115.64 110.56 1xgi s THR 42 Ca -0.01 -0.92 -0.01 0.00 -1.18 0.00 0.00 61.69 59.57 1xgi s THR 42 Cb -0.03 -0.33 -0.02 0.00 1.34 0.00 0.00 72.50 73.46 1xgi s THR 42 CO -0.01 -0.46 -0.00 0.26 -0.54 0.00 0.00 174.62 173.87 1xgi s TRP 43 N -1.39 0.23 0.00 3.99 0.51 0.09 -5.00 118.94 117.36 1xgi s TRP 43 Ca -0.14 -0.47 0.00 0.00 -2.12 0.00 0.00 56.10 53.37 1xgi s TRP 43 Cb -0.10 -0.17 0.00 0.00 -0.81 0.00 0.00 33.47 32.39 1xgi s TRP 43 CO -0.01 -0.21 0.00 0.41 -0.51 0.00 0.00 176.95 176.63 1xgi n GLY 44 N 1.55 0.62 3.47 0.98 0.00 -1.26 -1.31 105.19 109.24 1xgi n GLY 44 Ca -0.24 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.70 1xgi n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xgi s TYR 45 N 0.00 2.70 -0.05 1.61 2.02 0.22 -1.46 117.35 122.39 1xgi s TYR 45 Ca 0.00 -0.19 0.13 0.00 -0.37 0.00 0.00 57.07 56.64 1xgi s TYR 45 Cb 0.00 -1.64 -0.22 0.00 -0.40 0.00 0.00 41.96 39.70 1xgi s TYR 45 CO 0.00 0.16 0.67 0.00 -1.57 0.00 0.00 175.55 174.81 1xgi n ALA 46 N 2.38 1.53 -3.49 3.71 0.00 0.56 -3.12 120.51 122.07 1xgi n ALA 46 Ca -0.17 -0.76 -0.22 0.00 0.00 0.00 0.00 53.44 52.29 1xgi n ALA 46 Cb 0.52 -0.85 -0.13 0.00 0.00 0.00 0.00 19.45 18.99 1xgi n ALA 46 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xgi s ASP 47 N -6.06 2.27 0.09 0.00 -1.08 -1.04 -0.64 116.67 110.21 1xgi s ASP 47 Ca -0.05 -0.77 -0.25 0.00 -0.52 0.00 0.00 52.55 50.96 1xgi s ASP 47 Cb 0.08 0.11 -0.13 0.00 -1.46 0.00 0.00 42.92 41.52 1xgi s ASP 47 CO 0.82 -0.38 1.70 0.40 0.52 0.00 0.00 175.17 178.23 1xgi h ILE 48 N 6.34 0.75 -0.78 4.11 2.04 -1.84 -0.08 117.51 128.05 1xgi h ILE 48 Ca -0.17 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 1xgi h ILE 48 Cb 1.08 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 37.87 1xgi h ILE 48 CO 0.35 0.00 0.47 0.00 0.00 0.00 0.00 178.15 178.97 1xgi h ALA 49 N 0.60 1.37 -0.53 1.87 0.00 -1.98 -2.32 119.26 118.27 1xgi h ALA 49 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xgi h ALA 49 Cb 0.24 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1xgi h ALA 49 CO -0.02 0.55 0.00 1.63 0.00 0.00 0.00 179.25 181.41 1xgi n LYS 50 N -4.38 2.42 -3.62 0.00 5.02 -1.18 -4.95 118.16 111.46 1xgi n LYS 50 Ca 0.08 -2.19 -0.27 0.00 -2.02 0.00 0.00 58.31 53.92 1xgi n LYS 50 Cb 0.06 -1.49 -0.00 0.00 -0.02 0.00 0.00 35.03 33.58 1xgi n LYS 50 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1xgi n LYS 51 N 1.31 -3.81 -2.96 1.97 5.02 -0.16 -4.93 118.16 114.59 1xgi n LYS 51 Ca 0.20 0.49 -0.41 0.00 -2.02 0.00 0.00 58.31 56.58 1xgi n LYS 51 Cb 0.54 -5.25 -0.04 0.00 -0.02 0.00 0.00 35.03 30.25 1xgi n LYS 51 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1xgi s GLN 52 N -6.29 4.34 0.70 1.97 -1.52 -0.49 -4.98 119.66 113.40 1xgi s GLN 52 Ca 0.52 0.94 -0.11 0.00 -1.95 0.00 0.00 55.36 54.75 1xgi s GLN 52 Cb -0.27 -3.53 0.01 0.00 -0.22 0.00 0.00 33.01 29.00 1xgi s GLN 52 CO 0.63 -0.18 1.07 -1.25 -0.25 0.00 0.00 175.29 175.31 1xgi s PRO 53 N 1.63 2.88 0.12 2.91 0.04 -1.26 -0.32 135.00 141.00 1xgi s PRO 53 Ca 0.37 0.77 -0.29 0.00 0.04 0.00 0.00 61.00 61.89 1xgi s PRO 53 Cb -0.17 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.31 1xgi s PRO 53 CO 0.15 -1.09 0.94 0.08 0.04 0.00 0.00 177.00 177.11 1xgi s VAL 54 N -3.14 4.48 0.40 -0.36 1.01 -0.54 -4.23 120.40 118.02 1xgi s VAL 54 Ca 0.58 2.02 0.05 0.00 0.00 0.00 0.00 61.98 64.64 1xgi s VAL 54 Cb -0.13 -4.30 -0.02 0.00 0.00 0.00 0.00 36.38 31.93 1xgi s VAL 54 CO 0.54 0.34 0.20 0.42 0.00 0.00 0.00 175.10 176.60 1xgi s THR 55 N -0.15 0.32 -1.21 3.92 -4.23 -1.26 -4.69 115.64 108.34 1xgi s THR 55 Ca 0.45 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 59.15 1xgi s THR 55 Cb -0.23 -2.35 0.24 0.00 1.34 0.00 0.00 72.50 71.50 1xgi s THR 55 CO 0.29 0.00 1.59 0.00 -0.54 0.00 0.00 174.62 175.96 1xgi n GLN 56 N -0.85 0.13 0.00 3.99 6.02 -1.26 -2.36 117.38 123.06 1xgi n GLN 56 Ca -0.01 0.15 0.09 0.00 -0.01 0.00 0.00 57.00 57.21 1xgi n GLN 56 Cb 0.64 -1.50 0.03 0.00 1.02 0.00 0.00 30.24 30.43 1xgi n GLN 56 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1xgi n GLN 57 N -1.39 1.57 -2.23 -1.09 3.00 -1.26 -3.84 117.38 112.14 1xgi n GLN 57 Ca 0.07 -1.17 -0.41 0.00 -0.01 0.00 0.00 57.00 55.48 1xgi n GLN 57 Cb 0.18 -1.33 -0.03 0.00 0.00 0.00 0.00 30.24 29.07 1xgi n GLN 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1xgi s THR 58 N -1.79 3.08 -0.17 5.09 2.01 -0.99 -4.84 115.64 118.03 1xgi s THR 58 Ca 0.17 0.99 -0.16 0.00 0.31 0.00 0.00 61.69 63.00 1xgi s THR 58 Cb 0.14 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.98 1xgi s THR 58 CO 0.34 0.19 0.38 -0.76 -0.69 0.00 0.00 174.62 174.09 1xgi s LEU 59 N -0.91 4.21 0.07 4.42 1.43 0.20 -4.14 118.68 123.97 1xgi s LEU 59 Ca 0.52 0.58 0.08 0.00 -1.03 0.00 0.00 54.13 54.28 1xgi s LEU 59 Cb -0.37 -2.51 -0.03 0.00 0.03 0.00 0.00 46.19 43.30 1xgi s LEU 59 CO 0.44 -0.01 -0.20 -0.36 0.23 0.00 0.00 176.35 176.46 1xgi s PHE 60 N 0.89 2.51 -0.03 0.29 0.40 -0.16 -1.48 117.98 120.40 1xgi s PHE 60 Ca 0.20 -0.28 -0.30 0.00 -0.60 0.00 0.00 56.93 55.94 1xgi s PHE 60 Cb -0.14 -1.40 -0.04 0.00 0.51 0.00 0.00 43.02 41.95 1xgi s PHE 60 CO 0.07 0.29 1.20 -1.21 0.70 0.00 0.00 175.22 176.27 1xgi s GLU 61 N -1.69 4.38 0.07 0.44 2.02 -1.26 -1.83 118.70 120.82 1xgi s GLU 61 Ca 0.15 1.69 0.26 0.00 0.02 0.00 0.00 54.97 57.09 1xgi s GLU 61 Cb -0.10 -3.51 0.75 0.00 0.10 0.00 0.00 34.13 31.37 1xgi s GLU 61 CO 0.07 -0.39 1.62 1.28 0.02 0.00 0.00 175.26 177.86 1xgi n LEU 62 N 4.89 0.46 0.00 1.80 4.77 -0.48 -4.67 117.00 123.76 1xgi n LEU 62 Ca 0.10 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.41 1xgi n LEU 62 Cb 0.46 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1xgi n LEU 62 CO 0.55 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1xgi n GLY 63 N 1.42 2.99 0.21 -0.72 0.00 -1.26 -2.13 105.19 105.70 1xgi n GLY 63 Ca 0.05 -0.26 0.15 0.00 0.00 0.00 0.00 46.02 45.96 1xgi n GLY 63 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xgi h SER 64 N 5.65 0.00 0.12 1.61 0.02 -1.74 -0.48 113.55 118.74 1xgi h SER 64 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1xgi h SER 64 Cb 0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1xgi h SER 64 CO 0.00 0.00 -0.00 0.58 -1.14 0.00 0.00 176.83 176.27 1xgi h VAL 65 N 0.00 0.06 -0.16 2.27 2.07 -1.55 0.53 116.25 119.48 1xgi h VAL 65 Ca 0.00 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.49 1xgi h VAL 65 Cb 0.07 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1xgi h VAL 65 CO 0.00 0.00 0.14 0.28 0.02 0.00 0.00 177.57 178.02 1xgi h SER 66 N 0.00 0.00 0.26 0.57 0.02 -1.25 -1.46 113.55 111.70 1xgi h SER 66 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1xgi h SER 66 Cb 0.07 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 1xgi h SER 66 CO 0.00 0.00 -0.06 0.11 -1.14 0.00 0.00 176.83 175.74 1xgi h LYS 67 N 0.00 0.00 -0.03 3.45 1.57 -1.01 -1.82 116.57 118.72 1xgi h LYS 67 Ca 0.07 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.74 1xgi h LYS 67 Cb 0.36 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1xgi h LYS 67 CO -0.00 0.06 -0.52 1.79 -0.57 0.00 0.00 179.45 180.21 1xgi h THR 68 N 0.00 1.37 -0.08 -0.16 1.35 -1.44 -0.01 112.91 113.94 1xgi h THR 68 Ca -0.00 -1.78 -0.04 0.00 -0.55 0.00 0.00 66.41 64.04 1xgi h THR 68 Cb 0.20 1.92 -0.00 0.00 -1.73 0.00 0.00 68.15 68.54 1xgi h THR 68 CO 0.01 0.52 -0.10 -0.26 -0.25 0.00 0.00 175.52 175.43 1xgi h PHE 69 N 0.07 0.25 -0.54 4.73 -1.00 -1.48 -1.86 116.94 117.11 1xgi h PHE 69 Ca -0.00 -0.08 0.05 0.00 2.81 0.00 0.00 57.97 60.74 1xgi h PHE 69 Cb 0.94 -0.05 -0.05 0.00 3.61 0.00 0.00 35.95 40.40 1xgi h PHE 69 CO 0.01 0.68 0.27 1.15 -1.61 0.00 0.00 178.31 178.81 1xgi h THR 70 N -0.24 0.95 -0.98 -1.55 2.02 -1.38 0.32 112.91 112.05 1xgi h THR 70 Ca 0.01 -0.18 0.01 0.00 0.77 0.00 0.00 66.41 67.01 1xgi h THR 70 Cb 0.65 0.38 -0.05 0.00 -1.74 0.00 0.00 68.15 67.39 1xgi h THR 70 CO 0.02 0.10 0.63 1.23 0.37 0.00 0.00 175.52 177.88 1xgi h GLY 71 N 0.53 1.38 1.44 2.16 0.00 -0.95 -0.22 103.07 107.42 1xgi h GLY 71 Ca 0.24 -0.53 -0.20 0.00 0.00 0.00 0.00 47.33 46.84 1xgi h GLY 71 CO -0.17 0.52 -0.78 -2.08 0.00 0.00 0.00 176.54 174.04 1xgi h VAL 72 N 1.33 1.35 -0.43 4.60 2.07 -0.64 -1.23 116.25 123.29 1xgi h VAL 72 Ca 0.36 -2.12 -0.06 0.00 0.82 0.00 0.00 66.70 65.69 1xgi h VAL 72 Cb -0.13 2.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1xgi h VAL 72 CO -0.07 0.65 0.01 0.25 0.02 0.00 0.00 177.57 178.42 1xgi h LEU 73 N 0.36 0.67 -0.44 2.57 5.85 -0.67 0.91 115.31 124.56 1xgi h LEU 73 Ca -0.05 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.44 1xgi h LEU 73 Cb 1.38 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 1xgi h LEU 73 CO 0.14 0.73 -0.07 1.23 -0.34 0.00 0.00 178.44 180.14 1xgi h GLY 74 N 0.94 0.89 1.61 3.75 0.00 -0.90 -1.66 103.07 107.71 1xgi h GLY 74 Ca 0.13 -0.71 -0.06 0.00 0.00 0.00 0.00 47.33 46.69 1xgi h GLY 74 CO 0.01 0.65 -0.10 -1.33 0.00 0.00 0.00 176.54 175.78 1xgi h GLY 75 N 0.66 0.51 1.01 4.60 0.00 -0.56 -1.95 103.07 107.34 1xgi h GLY 75 Ca 0.12 -0.34 -0.09 0.00 0.00 0.00 0.00 47.33 47.02 1xgi h GLY 75 CO 0.04 0.31 -0.09 -1.80 0.00 0.00 0.00 176.54 175.00 1xgi h ASP 76 N 0.44 0.85 0.25 0.19 3.58 -0.61 -0.97 116.42 120.15 1xgi h ASP 76 Ca 0.09 -0.35 -0.04 0.00 0.42 0.00 0.00 57.03 57.14 1xgi h ASP 76 Cb 0.44 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.25 1xgi h ASP 76 CO 0.02 1.01 -0.21 0.00 -2.88 0.00 0.00 179.24 177.18 1xgi h ALA 77 N 0.87 1.56 -0.14 -0.78 0.00 -0.83 0.07 119.26 120.02 1xgi h ALA 77 Ca 0.11 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 1xgi h ALA 77 Cb 0.63 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.39 1xgi h ALA 77 CO 0.04 0.27 -0.57 0.82 0.00 0.00 0.00 179.25 179.81 1xgi h ILE 78 N 0.00 1.33 0.00 0.00 2.04 -1.04 -0.40 117.51 119.44 1xgi h ILE 78 Ca -0.00 -1.83 -0.05 0.00 1.00 0.00 0.00 64.86 63.97 1xgi h ILE 78 Cb 0.40 2.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 1xgi h ILE 78 CO 0.03 0.57 -0.24 0.00 0.00 0.00 0.00 178.15 178.51 1xgi h ALA 79 N 0.52 1.55 -0.00 1.87 0.00 -0.32 -0.89 119.26 122.00 1xgi h ALA 79 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1xgi h ALA 79 Cb 1.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1xgi h ALA 79 CO 0.12 0.30 -0.00 0.54 0.00 0.00 0.00 179.25 180.20 1xgi n ARG 80 N -4.18 0.31 -1.15 0.00 1.74 -0.07 -4.90 116.66 108.41 1xgi n ARG 80 Ca -0.02 -0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.00 1xgi n ARG 80 Cb 0.30 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.21 1xgi n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xgi n GLY 81 N 1.35 0.79 0.14 -0.13 0.00 -0.34 -4.92 105.19 102.07 1xgi n GLY 81 Ca 0.12 -0.72 0.03 0.00 0.00 0.00 0.00 46.02 45.46 1xgi n GLY 81 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1xgi h GLU 82 N 0.07 0.00 -3.91 1.61 5.08 -1.29 -3.48 114.58 112.67 1xgi h GLU 82 Ca -0.11 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.14 1xgi h GLU 82 Cb 0.37 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.51 1xgi h GLU 82 CO 0.16 0.38 -0.26 0.96 -1.00 0.00 0.00 179.01 179.25 1xgi s ILE 83 N -3.00 0.00 0.00 3.13 -4.36 -1.19 -4.84 121.20 110.93 1xgi s ILE 83 Ca 0.03 -1.57 0.02 0.00 -0.26 0.00 0.00 60.65 58.86 1xgi s ILE 83 Cb 0.08 -2.28 -0.01 0.00 1.25 0.00 0.00 42.46 41.50 1xgi s ILE 83 CO 0.75 -0.00 -0.05 -0.54 0.24 0.00 0.00 174.94 175.34 1xgi s LYS 84 N -4.06 0.43 0.55 0.37 1.02 -1.26 -4.42 119.74 112.37 1xgi s LYS 84 Ca 0.27 -0.27 0.33 0.00 0.02 0.00 0.00 55.97 56.32 1xgi s LYS 84 Cb 0.01 -0.38 1.43 0.00 -0.52 0.00 0.00 37.83 38.38 1xgi s LYS 84 CO 0.10 0.10 2.01 -0.07 -0.92 0.00 0.00 175.35 176.57 1xgi h LEU 85 N 5.78 0.00 -0.16 3.17 3.38 -1.99 -1.99 115.31 123.51 1xgi h LEU 85 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1xgi h LEU 85 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1xgi h LEU 85 CO 0.49 0.03 -0.03 -1.54 0.09 0.00 0.00 178.44 177.47 1xgi n SER 86 N -3.15 0.28 -4.75 -0.43 3.41 -1.26 -1.50 113.62 106.22 1xgi n SER 86 Ca 0.00 -0.68 -0.41 0.00 -0.26 0.00 0.00 58.87 57.52 1xgi n SER 86 Cb 0.29 -0.10 -0.04 0.00 -0.26 0.00 0.00 64.21 64.10 1xgi n SER 86 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1xgi s ASP 87 N -2.30 7.18 0.52 4.04 -0.00 -0.75 -4.84 116.67 120.52 1xgi s ASP 87 Ca 0.36 2.29 -0.21 0.00 -0.00 0.00 0.00 52.55 54.99 1xgi s ASP 87 Cb 0.21 -2.62 -0.06 0.00 -0.00 0.00 0.00 42.92 40.45 1xgi s ASP 87 CO 0.42 -0.23 1.19 -2.16 -0.00 0.00 0.00 175.17 174.39 1xgi s PRO 88 N -1.14 3.41 0.44 8.23 0.04 -1.26 -1.72 135.00 143.00 1xgi s PRO 88 Ca 0.47 1.80 0.13 0.00 0.04 0.00 0.00 61.00 63.44 1xgi s PRO 88 Cb -0.33 -2.18 1.03 0.00 0.04 0.00 0.00 34.50 33.06 1xgi s PRO 88 CO 0.41 -0.85 2.01 1.15 0.04 0.00 0.00 177.00 179.76 1xgi h THR 89 N 1.43 0.94 0.00 1.26 2.02 -1.52 -2.04 112.91 115.01 1xgi h THR 89 Ca -0.50 -0.13 -0.03 0.00 0.77 0.00 0.00 66.41 66.52 1xgi h THR 89 Cb 1.27 0.52 -0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1xgi h THR 89 CO 0.58 0.07 -0.14 0.71 0.37 0.00 0.00 175.52 177.11 1xgi h THR 90 N 0.39 0.47 -0.05 3.16 1.35 -1.83 -2.58 112.91 113.81 1xgi h THR 90 Ca 0.22 -0.70 0.01 0.00 -0.55 0.00 0.00 66.41 65.40 1xgi h THR 90 Cb 0.38 1.48 -0.00 0.00 -1.73 0.00 0.00 68.15 68.28 1xgi h THR 90 CO -0.06 0.13 0.05 0.50 -0.25 0.00 0.00 175.52 175.90 1xgi h LYS 91 N 0.00 0.00 -0.01 4.72 3.64 -1.73 -1.91 116.57 121.28 1xgi h LYS 91 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xgi h LYS 91 Cb 0.47 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1xgi h LYS 91 CO 0.02 0.00 -0.26 0.66 -2.27 0.00 0.00 179.45 177.60 1xgi n TYR 92 N -3.87 0.00 -3.05 1.91 4.01 -1.00 -4.72 117.16 110.43 1xgi n TYR 92 Ca -0.02 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.55 1xgi n TYR 92 Cb 0.15 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.14 1xgi n TYR 92 CO 0.00 0.00 0.00 1.87 -0.46 0.00 0.00 176.86 178.27 1xgi n TRP 93 N -0.35 -1.98 -0.26 -0.72 -0.00 -0.80 -5.00 117.44 108.33 1xgi n TRP 93 Ca 0.04 -2.59 0.29 0.00 -0.00 0.00 0.00 57.50 55.24 1xgi n TRP 93 Cb 0.23 0.66 0.67 0.00 -0.00 0.00 0.00 31.31 32.87 1xgi n TRP 93 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1xgi h PRO 94 N 4.68 0.12 0.00 5.87 0.11 -1.66 -0.35 132.00 140.77 1xgi h PRO 94 Ca 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1xgi h PRO 94 Cb 0.97 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1xgi h PRO 94 CO 0.31 0.08 0.00 0.39 -0.21 0.00 0.00 178.00 178.56 1xgi n GLU 95 N -4.34 0.10 -2.67 1.05 4.71 -1.26 -4.12 120.64 114.11 1xgi n GLU 95 Ca 0.22 0.45 -0.43 0.00 -0.01 0.00 0.00 57.16 57.39 1xgi n GLU 95 Cb 1.01 -1.73 -0.01 0.00 -1.01 0.00 0.00 31.44 29.69 1xgi n GLU 95 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1xgi s LEU 96 N -3.85 4.05 0.03 -4.62 1.43 -0.14 -4.69 118.68 110.90 1xgi s LEU 96 Ca 0.03 -2.22 0.22 0.00 -1.03 0.00 0.00 54.13 51.13 1xgi s LEU 96 Cb 0.07 -2.53 -0.17 0.00 0.03 0.00 0.00 46.19 43.59 1xgi s LEU 96 CO 0.24 -1.19 0.77 0.35 0.23 0.00 0.00 176.35 176.76 1xgi n THR 97 N 6.17 0.14 -1.61 5.49 -2.24 -1.26 -4.82 114.28 116.15 1xgi n THR 97 Ca 0.40 -0.37 -0.46 0.00 -2.27 0.00 0.00 64.05 61.35 1xgi n THR 97 Cb 0.47 0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.80 1xgi n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xgi n ALA 98 N -2.03 -0.07 0.18 6.98 0.00 -1.26 -4.85 120.51 119.46 1xgi n ALA 98 Ca -0.01 0.43 0.15 0.00 0.00 0.00 0.00 53.44 54.01 1xgi n ALA 98 Cb 0.50 -2.10 0.75 0.00 0.00 0.00 0.00 19.45 18.61 1xgi n ALA 98 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1xgi h LYS 99 N 3.16 0.00 0.00 0.00 6.56 -1.94 -2.38 116.57 121.98 1xgi h LYS 99 Ca -0.43 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.16 1xgi h LYS 99 Cb 1.32 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.98 1xgi h LYS 99 CO 0.69 0.00 0.00 -0.56 -2.06 0.00 0.00 179.45 177.52 1xgi h GLN 100 N 0.00 0.00 0.00 3.15 -0.00 -1.93 -2.51 115.11 113.81 1xgi h GLN 100 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.74 1xgi h GLN 100 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.91 1xgi h GLN 100 CO -0.00 0.00 -0.02 0.91 -0.00 0.00 0.00 178.83 179.72 1xgi n TRP 101 N -2.87 0.13 -2.07 0.06 7.02 -0.89 -4.70 117.44 114.12 1xgi n TRP 101 Ca -0.01 0.04 -0.42 0.00 -1.02 0.00 0.00 57.50 56.08 1xgi n TRP 101 Cb 0.16 -0.55 -0.03 0.00 -2.42 0.00 0.00 31.31 28.47 1xgi n TRP 101 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1xgi s ASN 102 N -3.21 6.72 0.00 -0.99 0.01 -0.95 -1.90 114.94 114.61 1xgi s ASN 102 Ca 0.13 2.24 0.00 0.00 -0.71 0.00 0.00 52.86 54.52 1xgi s ASN 102 Cb 0.18 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 39.29 1xgi s ASN 102 CO 0.55 -0.85 0.00 0.61 -1.51 0.00 0.00 177.10 175.89 1xgi n GLY 103 N 3.94 0.69 3.52 0.66 0.00 -1.26 -5.03 105.19 107.70 1xgi n GLY 103 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1xgi n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xgi s ILE 104 N -2.37 5.09 0.52 -0.61 1.01 -0.80 -4.88 121.20 119.16 1xgi s ILE 104 Ca 0.00 -0.07 0.07 0.00 0.00 0.00 0.00 60.65 60.65 1xgi s ILE 104 Cb 0.00 -3.96 0.05 0.00 0.01 0.00 0.00 42.46 38.56 1xgi s ILE 104 CO 0.00 -0.29 0.72 0.42 0.00 0.00 0.00 174.94 175.79 1xgi s THR 105 N 2.18 2.58 0.37 2.92 -4.23 -1.26 -1.42 115.64 116.78 1xgi s THR 105 Ca 0.14 -0.91 0.07 0.00 -1.18 0.00 0.00 61.69 59.81 1xgi s THR 105 Cb -0.16 -2.67 0.18 0.00 1.34 0.00 0.00 72.50 71.19 1xgi s THR 105 CO 0.13 0.00 1.94 -0.07 -0.54 0.00 0.00 174.62 176.08 1xgi h LEU 106 N 0.28 0.39 -0.64 4.79 3.38 -1.29 -2.18 115.31 120.04 1xgi h LEU 106 Ca -0.37 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 57.57 1xgi h LEU 106 Cb 1.28 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.89 1xgi h LEU 106 CO 0.44 0.44 0.41 0.25 0.09 0.00 0.00 178.44 180.07 1xgi h LEU 107 N 0.42 0.67 -0.69 1.67 5.85 -1.56 -1.05 115.31 120.63 1xgi h LEU 107 Ca 0.10 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1xgi h LEU 107 Cb 0.25 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1xgi h LEU 107 CO 0.00 0.47 0.44 0.45 -0.34 0.00 0.00 178.44 179.47 1xgi h HIS 108 N 0.80 0.89 -0.33 1.25 3.86 -1.69 -1.21 115.15 118.72 1xgi h HIS 108 Ca 0.25 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.43 1xgi h HIS 108 Cb -0.01 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.15 1xgi h HIS 108 CO -0.04 0.58 0.05 -0.07 0.86 0.00 0.00 177.93 179.31 1xgi h LEU 109 N 0.94 0.53 -1.59 2.43 3.38 -1.17 -1.20 115.31 118.63 1xgi h LEU 109 Ca 0.25 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1xgi h LEU 109 Cb -0.07 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1xgi h LEU 109 CO -0.05 0.66 -0.22 0.00 0.09 0.00 0.00 178.44 178.92 1xgi h ALA 110 N 0.89 1.50 -0.28 1.53 0.00 -0.90 -2.82 119.26 119.18 1xgi h ALA 110 Ca 0.10 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xgi h ALA 110 Cb 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1xgi h ALA 110 CO 0.01 0.28 0.00 0.25 0.00 0.00 0.00 179.25 179.78 1xgi n THR 111 N -4.07 1.68 -1.91 0.00 -2.24 -0.48 -4.45 114.28 102.80 1xgi n THR 111 Ca -0.02 -1.48 -0.17 0.00 -2.27 0.00 0.00 64.05 60.11 1xgi n THR 111 Cb 0.29 0.10 -0.04 0.00 -2.10 0.00 0.00 70.33 68.58 1xgi n THR 111 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1xgi n TYR 112 N -0.09 -0.41 -1.36 4.78 4.02 -0.90 -4.86 117.16 118.35 1xgi n TYR 112 Ca 0.16 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 58.06 1xgi n TYR 112 Cb 0.67 -3.18 0.21 0.00 -0.02 0.00 0.00 39.34 37.01 1xgi n TYR 112 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1xgi n THR 113 N -3.27 2.40 0.36 -0.72 -2.24 -0.51 -1.57 114.28 108.75 1xgi n THR 113 Ca -0.19 -2.61 0.14 0.00 -2.27 0.00 0.00 64.05 59.12 1xgi n THR 113 Cb 0.61 -0.29 0.48 0.00 -2.10 0.00 0.00 70.33 69.02 1xgi n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xgi h ALA 114 N 1.06 1.00 0.00 6.98 0.00 -1.79 0.36 119.26 126.86 1xgi h ALA 114 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1xgi h ALA 114 Cb 1.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1xgi h ALA 114 CO 0.28 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.94 1xgi n GLY 115 N 0.47 1.52 0.20 0.00 0.00 -1.26 -4.09 105.19 102.04 1xgi n GLY 115 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1xgi n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xgi n GLY 116 N 0.00 0.97 3.76 -0.02 0.00 -1.26 -1.67 105.19 106.97 1xgi n GLY 116 Ca 0.00 -0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1xgi n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xgi s LEU 117 N -0.14 3.87 0.58 0.99 1.43 -1.26 -4.79 118.68 119.35 1xgi s LEU 117 Ca 0.00 2.47 -0.18 0.00 -1.03 0.00 0.00 54.13 55.39 1xgi s LEU 117 Cb 0.00 -4.35 -0.04 0.00 0.03 0.00 0.00 46.19 41.83 1xgi s LEU 117 CO 0.00 -1.31 1.14 -2.16 0.23 0.00 0.00 176.35 174.26 1xgi s PRO 118 N -2.94 3.15 0.22 1.29 0.04 -1.26 -4.76 135.00 130.75 1xgi s PRO 118 Ca 0.70 1.62 -0.07 0.00 0.04 0.00 0.00 61.00 63.28 1xgi s PRO 118 Cb -0.33 -1.98 0.31 0.00 0.04 0.00 0.00 34.50 32.54 1xgi s PRO 118 CO 0.38 -1.01 1.79 1.25 0.04 0.00 0.00 177.00 179.45 1xgi h LEU 119 N 0.90 0.51 -8.85 -3.56 5.85 -1.92 -3.22 115.31 105.02 1xgi h LEU 119 Ca -0.49 0.05 -0.67 0.00 0.84 0.00 0.00 57.88 57.60 1xgi h LEU 119 Cb 1.27 -0.04 -0.23 0.00 0.37 0.00 0.00 40.66 42.03 1xgi h LEU 119 CO 0.56 0.31 -0.87 -1.10 -0.34 0.00 0.00 178.44 177.00 1xgi s GLN 120 N -6.07 1.41 0.01 1.25 1.11 -1.26 -0.16 119.66 115.95 1xgi s GLN 120 Ca -0.13 -1.29 -0.26 0.00 0.01 0.00 0.00 55.36 53.69 1xgi s GLN 120 Cb 0.17 -1.84 -0.04 0.00 -1.01 0.00 0.00 33.01 30.29 1xgi s GLN 120 CO 0.76 0.44 0.83 0.08 0.01 0.00 0.00 175.29 177.41 1xgi s VAL 121 N -1.04 4.83 0.52 1.09 1.01 -1.26 -4.82 120.40 120.73 1xgi s VAL 121 Ca 0.13 1.75 -0.21 0.00 0.00 0.00 0.00 61.98 63.64 1xgi s VAL 121 Cb -0.10 -4.17 -0.08 0.00 0.00 0.00 0.00 36.38 32.03 1xgi s VAL 121 CO 0.05 0.27 0.99 -2.65 0.00 0.00 0.00 175.10 173.76 1xgi n PRO 122 N 3.37 1.14 0.28 2.72 -0.02 -1.26 -4.85 135.00 136.38 1xgi n PRO 122 Ca 0.01 0.42 0.15 0.00 -2.02 0.00 0.00 63.50 62.06 1xgi n PRO 122 Cb 0.51 -2.12 0.84 0.00 -0.02 0.00 0.00 33.50 32.70 1xgi n PRO 122 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1xgi h ASP 123 N 1.01 0.00 0.92 2.55 3.32 -2.01 -1.95 116.42 120.25 1xgi h ASP 123 Ca -0.47 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.57 1xgi h ASP 123 Cb 1.35 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.90 1xgi h ASP 123 CO 0.54 0.06 -0.06 -0.33 -1.72 0.00 0.00 179.24 177.74 1xgi h GLU 124 N 0.00 0.00 -6.67 3.56 4.39 -2.03 -3.42 114.58 110.40 1xgi h GLU 124 Ca -0.00 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.14 1xgi h GLU 124 Cb 0.20 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.78 1xgi h GLU 124 CO 0.01 0.06 0.91 0.08 -1.16 0.00 0.00 179.01 178.90 1xgi s VAL 125 N -3.72 4.23 0.02 3.13 1.01 -0.74 -4.86 120.40 119.47 1xgi s VAL 125 Ca 0.01 1.21 -0.01 0.00 0.00 0.00 0.00 61.98 63.19 1xgi s VAL 125 Cb 0.10 -4.59 -0.00 0.00 0.00 0.00 0.00 36.38 31.88 1xgi s VAL 125 CO 0.56 -0.99 -0.01 0.29 0.00 0.00 0.00 175.10 174.95 1xgi n LYS 126 N 7.78 0.02 -1.04 2.72 4.76 -1.26 -4.30 118.16 126.84 1xgi n LYS 126 Ca 0.12 0.01 -0.29 0.00 -2.87 0.00 0.00 58.31 55.27 1xgi n LYS 126 Cb 0.49 -0.21 0.22 0.00 -1.84 0.00 0.00 35.03 33.69 1xgi n LYS 126 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1xgi s SER 127 N -5.18 1.36 0.19 4.39 1.04 -1.26 -4.85 113.70 109.38 1xgi s SER 127 Ca -0.01 0.88 -0.09 0.00 0.48 0.00 0.00 55.95 57.21 1xgi s SER 127 Cb 0.00 -1.31 0.09 0.00 0.10 0.00 0.00 66.02 64.90 1xgi s SER 127 CO 0.01 -3.88 1.67 0.28 0.98 0.00 0.00 173.24 172.30 1xgi h SER 128 N -2.41 1.06 0.05 7.02 0.02 -1.99 -2.33 113.55 114.96 1xgi h SER 128 Ca -0.49 -0.28 -0.14 0.00 -0.84 0.00 0.00 61.79 60.03 1xgi h SER 128 Cb 1.31 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.56 1xgi h SER 128 CO 0.43 1.08 -0.47 0.77 -1.14 0.00 0.00 176.83 177.51 1xgi h SER 129 N 1.01 0.53 -0.86 3.07 4.64 -1.99 -1.59 113.55 118.35 1xgi h SER 129 Ca 0.19 -0.25 -0.03 0.00 -0.47 0.00 0.00 61.79 61.23 1xgi h SER 129 Cb 0.51 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 62.41 1xgi h SER 129 CO 0.02 0.92 0.44 0.44 -0.87 0.00 0.00 176.83 177.78 1xgi h ASP 130 N 0.40 1.11 -0.27 4.97 3.45 -1.87 -0.89 116.42 123.31 1xgi h ASP 130 Ca 0.02 -0.12 -0.13 0.00 0.43 0.00 0.00 57.03 57.23 1xgi h ASP 130 Cb 0.97 -0.29 -0.00 0.00 -0.56 0.00 0.00 39.33 39.45 1xgi h ASP 130 CO 0.09 0.92 -0.33 0.25 -1.57 0.00 0.00 179.24 178.60 1xgi h LEU 131 N 1.22 0.76 -0.82 1.55 5.85 -1.21 -1.47 115.31 121.19 1xgi h LEU 131 Ca 0.30 -0.49 0.03 0.00 0.84 0.00 0.00 57.88 58.56 1xgi h LEU 131 Cb 0.09 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.86 1xgi h LEU 131 CO -0.04 1.10 0.53 0.25 -0.34 0.00 0.00 178.44 179.94 1xgi h LEU 132 N 0.44 0.88 -0.41 2.25 5.85 -0.97 -1.97 115.31 121.38 1xgi h LEU 132 Ca 0.04 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1xgi h LEU 132 Cb 0.90 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 1xgi h LEU 132 CO 0.08 0.61 0.21 -0.09 -0.34 0.00 0.00 178.44 178.91 1xgi h ARG 133 N 1.04 0.59 -0.16 1.25 2.43 -1.03 -1.02 114.38 117.47 1xgi h ARG 133 Ca 0.32 -0.08 0.05 0.00 -0.81 0.00 0.00 59.98 59.46 1xgi h ARG 133 Cb -0.01 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.38 1xgi h ARG 133 CO -0.11 0.50 -0.14 0.35 -1.51 0.00 0.00 179.97 179.06 1xgi h PHE 134 N 0.53 -0.34 -0.09 2.20 3.57 -0.63 -0.97 116.94 121.20 1xgi h PHE 134 Ca 0.14 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.55 1xgi h PHE 134 Cb 0.10 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1xgi h PHE 134 CO -0.02 -0.20 -0.47 1.88 -2.23 0.00 0.00 178.31 177.27 1xgi h TYR 135 N -0.15 0.28 -0.42 0.41 0.05 -1.22 -2.42 116.97 113.49 1xgi h TYR 135 Ca 0.10 -0.09 -0.15 0.00 0.05 0.00 0.00 58.73 58.65 1xgi h TYR 135 Cb 0.30 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 1xgi h TYR 135 CO -0.27 0.67 -0.31 1.96 -1.05 0.00 0.00 178.16 179.15 1xgi h GLN 136 N 0.19 0.95 0.00 4.88 1.08 -0.92 -3.18 115.11 118.12 1xgi h GLN 136 Ca 0.01 -0.46 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 1xgi h GLN 136 Cb 0.91 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.33 1xgi h GLN 136 CO 0.07 1.12 -0.13 0.09 -0.95 0.00 0.00 178.83 179.03 1xgi n ASN 137 N -4.08 0.48 -4.72 1.46 5.03 -0.39 -4.84 115.26 108.20 1xgi n ASN 137 Ca -0.01 0.41 -0.42 0.00 0.87 0.00 0.00 54.58 55.43 1xgi n ASN 137 Cb 0.51 -0.46 -0.03 0.00 -1.02 0.00 0.00 39.78 38.77 1xgi n ASN 137 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1xgi s TRP 138 N -3.06 3.10 -0.27 3.10 -0.00 -0.92 -5.00 118.94 115.89 1xgi s TRP 138 Ca 0.11 0.77 -0.05 0.00 -0.00 0.00 0.00 56.10 56.93 1xgi s TRP 138 Cb 0.15 -3.85 0.01 0.00 -0.00 0.00 0.00 33.47 29.78 1xgi s TRP 138 CO 0.60 -3.05 0.03 -0.65 -0.00 0.00 0.00 176.95 173.87 1xgi s GLN 139 N 0.91 3.08 0.49 5.86 -1.52 -1.26 -4.98 119.66 122.24 1xgi s GLN 139 Ca 0.67 -0.85 -0.22 0.00 -1.95 0.00 0.00 55.36 53.02 1xgi s GLN 139 Cb -0.42 -3.22 -0.07 0.00 -0.22 0.00 0.00 33.01 29.08 1xgi s GLN 139 CO 0.33 -0.39 1.15 -1.25 -0.25 0.00 0.00 175.29 174.88 1xgi s PRO 140 N 1.45 3.62 0.13 2.91 0.04 -1.26 -4.93 135.00 136.96 1xgi s PRO 140 Ca 0.02 1.71 0.20 0.00 0.04 0.00 0.00 61.00 62.97 1xgi s PRO 140 Cb -0.17 -2.27 -0.07 0.00 0.04 0.00 0.00 34.50 32.03 1xgi s PRO 140 CO -0.00 -0.65 0.92 0.00 0.04 0.00 0.00 177.00 177.31 1xgi n ALA 141 N -0.77 2.22 -2.26 8.56 0.00 -0.67 -4.95 120.51 122.65 1xgi n ALA 141 Ca 0.09 -0.40 -0.14 0.00 0.00 0.00 0.00 53.44 52.99 1xgi n ALA 141 Cb 0.49 -1.03 -0.10 0.00 0.00 0.00 0.00 19.45 18.81 1xgi n ALA 141 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1xgi s TRP 142 N -3.14 1.27 0.56 0.00 0.51 -1.18 -5.08 118.94 111.88 1xgi s TRP 142 Ca -0.02 -0.96 -0.18 0.00 -2.12 0.00 0.00 56.10 52.82 1xgi s TRP 142 Cb 0.09 -0.72 -0.05 0.00 -0.81 0.00 0.00 33.47 31.98 1xgi s TRP 142 CO 0.80 -0.13 1.08 0.00 -0.51 0.00 0.00 176.95 178.19 1xgi s ALA 143 N -3.56 2.72 0.49 0.98 0.00 -1.26 -4.41 121.76 116.72 1xgi s ALA 143 Ca 0.23 0.62 -0.23 0.00 0.00 0.00 0.00 51.96 52.58 1xgi s ALA 143 Cb 0.05 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.82 1xgi s ALA 143 CO 0.04 -0.74 1.30 -1.25 0.00 0.00 0.00 175.76 175.12 1xgi s PRO 144 N -3.58 3.47 -0.70 0.00 0.04 -1.26 -3.31 135.00 129.65 1xgi s PRO 144 Ca 0.68 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.83 1xgi s PRO 144 Cb -0.19 -2.40 0.00 0.00 0.04 0.00 0.00 34.50 31.95 1xgi s PRO 144 CO 0.30 -0.89 0.00 0.41 0.04 0.00 0.00 177.00 176.86 1xgi n GLY 145 N 0.63 0.76 0.01 0.56 0.00 0.13 -4.92 105.19 102.36 1xgi n GLY 145 Ca 0.08 -0.72 -0.01 0.00 0.00 0.00 0.00 46.02 45.37 1xgi n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xgi n THR 146 N -3.02 0.16 -4.06 2.61 -2.24 -1.21 -4.85 114.28 101.66 1xgi n THR 146 Ca -0.07 -0.08 -0.13 0.00 -2.27 0.00 0.00 64.05 61.49 1xgi n THR 146 Cb 0.29 -0.83 -0.12 0.00 -2.10 0.00 0.00 70.33 67.56 1xgi n THR 146 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1xgi s GLN 147 N -2.05 0.44 -0.21 -0.78 0.74 -1.26 -1.81 119.66 114.72 1xgi s GLN 147 Ca -0.02 -0.55 -0.07 0.00 0.05 0.00 0.00 55.36 54.77 1xgi s GLN 147 Cb 0.01 -0.25 -0.04 0.00 1.10 0.00 0.00 33.01 33.83 1xgi s GLN 147 CO 0.08 0.05 0.07 0.50 -0.55 0.00 0.00 175.29 175.44 1xgi s ARG 148 N -1.10 3.82 -0.28 1.67 3.52 0.10 -4.27 118.95 122.41 1xgi s ARG 148 Ca -0.07 -0.41 -0.02 0.00 -0.13 0.00 0.00 55.73 55.10 1xgi s ARG 148 Cb -0.07 -3.26 0.09 0.00 -1.56 0.00 0.00 34.95 30.14 1xgi s ARG 148 CO 0.00 0.06 0.08 -1.17 -0.81 0.00 0.00 175.30 173.46 1xgi s LEU 149 N 0.95 1.80 -0.18 -0.88 2.96 -0.61 -1.86 118.68 120.86 1xgi s LEU 149 Ca 0.04 -1.41 -0.41 0.00 -0.22 0.00 0.00 54.13 52.13 1xgi s LEU 149 Cb -0.14 -0.75 -0.18 0.00 0.50 0.00 0.00 46.19 45.63 1xgi s LEU 149 CO 0.03 -0.39 1.49 0.00 -1.32 0.00 0.00 176.35 176.15 1xgi n TYR 150 N 4.94 1.59 -3.70 5.38 4.19 -1.26 -4.78 117.16 123.52 1xgi n TYR 150 Ca -0.04 0.79 -0.12 0.00 3.31 0.00 0.00 57.90 61.84 1xgi n TYR 150 Cb 0.43 -2.31 -0.09 0.00 0.49 0.00 0.00 39.34 37.86 1xgi n TYR 150 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1xgi s ALA 151 N 2.00 -1.22 0.27 2.98 0.00 -1.26 -4.41 121.76 120.11 1xgi s ALA 151 Ca 0.95 1.51 0.06 0.00 0.00 0.00 0.00 51.96 54.48 1xgi s ALA 151 Cb -1.17 -0.89 0.36 0.00 0.00 0.00 0.00 23.12 21.41 1xgi s ALA 151 CO 0.63 -0.25 1.63 -0.91 0.00 0.00 0.00 175.76 176.85 1xgi h ASN 152 N 5.97 0.21 1.02 0.00 2.35 -0.69 -2.92 115.58 121.52 1xgi h ASN 152 Ca -0.30 -0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1xgi h ASN 152 Cb 1.18 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.49 1xgi h ASN 152 CO 0.22 0.70 0.00 0.77 -1.65 0.00 0.00 177.43 177.47 1xgi h SER 153 N 0.15 0.00 0.00 5.81 4.64 -1.63 0.22 113.55 122.73 1xgi h SER 153 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xgi h SER 153 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1xgi h SER 153 CO 0.08 0.00 -0.21 -1.28 -0.87 0.00 0.00 176.83 174.55 1xgi h SER 154 N 0.00 0.00 0.54 4.97 0.87 -1.75 -3.20 113.55 114.97 1xgi h SER 154 Ca 0.00 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 1xgi h SER 154 Cb 0.51 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.46 1xgi h SER 154 CO 0.00 0.42 -0.27 -0.29 -0.53 0.00 0.00 176.83 176.16 1xgi h ILE 155 N -0.63 0.86 -0.68 2.23 2.10 -1.35 -2.37 117.51 117.67 1xgi h ILE 155 Ca 0.00 -1.07 -0.01 0.00 1.08 0.00 0.00 64.86 64.86 1xgi h ILE 155 Cb 0.21 1.64 -0.03 0.00 -1.09 0.00 0.00 36.82 37.55 1xgi h ILE 155 CO 0.00 0.27 0.38 1.23 -1.08 0.00 0.00 178.15 178.94 1xgi h GLY 156 N 1.36 1.01 0.97 8.18 0.00 -1.13 -1.26 103.07 112.20 1xgi h GLY 156 Ca -0.00 -0.46 -0.09 0.00 0.00 0.00 0.00 47.33 46.79 1xgi h GLY 156 CO 0.04 0.44 -0.09 -2.00 0.00 0.00 0.00 176.54 174.92 1xgi h LEU 157 N 0.93 0.74 -0.92 3.11 5.85 -1.45 -2.38 115.31 121.19 1xgi h LEU 157 Ca 0.24 -0.36 0.12 0.00 0.84 0.00 0.00 57.88 58.71 1xgi h LEU 157 Cb 0.03 -0.20 -0.08 0.00 0.37 0.00 0.00 40.66 40.78 1xgi h LEU 157 CO -0.04 0.94 0.55 0.15 -0.34 0.00 0.00 178.44 179.70 1xgi h PHE 158 N 0.54 0.99 -0.16 1.25 3.57 -1.07 -0.67 116.94 121.39 1xgi h PHE 158 Ca 0.10 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 1xgi h PHE 158 Cb 0.61 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1xgi h PHE 158 CO 0.05 0.37 0.02 0.78 -2.23 0.00 0.00 178.31 177.30 1xgi h GLY 159 N 0.86 0.29 1.03 2.40 0.00 -1.00 0.01 103.07 106.66 1xgi h GLY 159 Ca 0.46 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.56 1xgi h GLY 159 CO -0.28 0.18 0.38 0.00 0.00 0.00 0.00 176.54 176.82 1xgi h ALA 160 N 0.80 1.04 -0.01 3.60 0.00 -0.88 -3.11 119.26 120.70 1xgi h ALA 160 Ca 0.05 -0.16 -0.25 0.00 0.00 0.00 0.00 54.91 54.54 1xgi h ALA 160 Cb 0.32 -0.32 0.02 0.00 0.00 0.00 0.00 17.79 17.81 1xgi h ALA 160 CO 0.00 0.62 -1.00 -0.07 0.00 0.00 0.00 179.25 178.80 1xgi h LEU 161 N 1.15 0.81 -2.35 0.00 3.38 -1.11 -3.27 115.31 113.91 1xgi h LEU 161 Ca 0.28 -0.64 0.02 0.00 0.09 0.00 0.00 57.88 57.63 1xgi h LEU 161 Cb 0.14 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1xgi h LEU 161 CO -0.03 1.44 0.08 0.00 0.09 0.00 0.00 178.44 180.01 1xgi h ALA 162 N 0.51 1.66 -0.02 1.53 0.00 -0.92 -2.22 119.26 119.80 1xgi h ALA 162 Ca -0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1xgi h ALA 162 Cb 1.64 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1xgi h ALA 162 CO 0.19 -0.11 -0.15 1.33 0.00 0.00 0.00 179.25 180.51 1xgi n VAL 163 N -3.88 0.00 -0.22 0.00 0.24 -1.20 -4.52 118.33 108.75 1xgi n VAL 163 Ca -0.01 -0.38 -0.06 0.00 -2.04 0.00 0.00 64.34 61.85 1xgi n VAL 163 Cb 0.17 1.24 0.04 0.00 -1.47 0.00 0.00 33.84 33.83 1xgi n VAL 163 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1xgi h LYS 164 N 3.59 0.80 -1.00 7.34 1.57 -1.47 -2.64 116.57 124.76 1xgi h LYS 164 Ca 0.00 -0.05 0.07 0.00 -1.87 0.00 0.00 60.65 58.80 1xgi h LYS 164 Cb 0.84 -0.18 -0.07 0.00 0.08 0.00 0.00 32.23 32.90 1xgi h LYS 164 CO 0.00 0.53 0.64 -1.35 -0.57 0.00 0.00 179.45 178.70 1xgi h PRO 165 N 0.82 1.11 0.00 3.15 0.11 -1.79 -0.16 132.00 135.24 1xgi h PRO 165 Ca 0.23 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.26 1xgi h PRO 165 Cb -0.08 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 30.78 1xgi h PRO 165 CO -0.06 0.74 -0.05 0.66 -0.21 0.00 0.00 178.00 179.08 1xgi h SER 166 N 1.15 0.00 0.00 -2.05 4.64 -1.77 -3.45 113.55 112.06 1xgi h SER 166 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1xgi h SER 166 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1xgi h SER 166 CO -0.19 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.44 1xgi n GLY 167 N -0.79 1.52 3.87 -0.77 0.00 -0.07 -5.00 105.19 103.95 1xgi n GLY 167 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1xgi n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xgi s LEU 168 N 0.00 4.00 0.92 0.99 1.43 -1.25 -5.06 118.68 119.71 1xgi s LEU 168 Ca 0.00 1.06 -0.12 0.00 -1.03 0.00 0.00 54.13 54.04 1xgi s LEU 168 Cb 0.00 -3.89 0.14 0.00 0.03 0.00 0.00 46.19 42.48 1xgi s LEU 168 CO 0.00 -0.25 1.09 -0.94 0.23 0.00 0.00 176.35 176.48 1xgi s SER 169 N -2.76 3.22 0.11 2.29 1.04 -1.26 -4.70 113.70 111.63 1xgi s SER 169 Ca 0.50 1.49 -0.21 0.00 0.48 0.00 0.00 55.95 58.20 1xgi s SER 169 Cb -0.11 -2.16 -0.10 0.00 0.10 0.00 0.00 66.02 63.75 1xgi s SER 169 CO 0.25 -2.80 1.75 0.15 0.98 0.00 0.00 173.24 173.58 1xgi h PHE 170 N -1.66 0.15 -0.65 5.02 3.57 -1.94 -1.20 116.94 120.23 1xgi h PHE 170 Ca -0.50 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.02 1xgi h PHE 170 Cb 1.29 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.94 1xgi h PHE 170 CO 0.40 0.10 0.41 1.49 -2.23 0.00 0.00 178.31 178.49 1xgi h GLU 171 N 0.15 0.80 -0.52 1.11 4.81 -1.98 -0.30 114.58 118.66 1xgi h GLU 171 Ca 0.04 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 1xgi h GLU 171 Cb -0.01 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 1xgi h GLU 171 CO -0.01 0.53 0.06 1.96 -0.73 0.00 0.00 179.01 180.83 1xgi h GLN 172 N 0.83 0.83 -0.28 1.92 1.08 -1.88 -0.52 115.11 117.09 1xgi h GLN 172 Ca 0.25 -0.20 -0.18 0.00 -1.45 0.00 0.00 58.65 57.07 1xgi h GLN 172 Cb -0.03 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.28 1xgi h GLN 172 CO -0.08 0.79 -0.53 0.00 -0.95 0.00 0.00 178.83 178.06 1xgi h ALA 173 N 1.28 0.53 0.15 3.87 0.00 -0.80 -1.40 119.26 122.90 1xgi h ALA 173 Ca 0.16 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1xgi h ALA 173 Cb 0.39 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1xgi h ALA 173 CO 0.01 0.68 -0.07 1.98 0.00 0.00 0.00 179.25 181.85 1xgi h MET 174 N 0.63 -0.19 -0.03 0.00 1.85 -0.78 0.50 114.93 116.91 1xgi h MET 174 Ca 0.02 0.01 0.03 0.00 -0.61 0.00 0.00 59.70 59.16 1xgi h MET 174 Cb 1.12 0.04 -0.05 0.00 0.43 0.00 0.00 31.60 33.15 1xgi h MET 174 CO 0.12 0.06 -0.23 1.96 -0.40 0.00 0.00 176.91 178.42 1xgi h GLN 175 N -0.44 -0.33 -0.43 0.39 1.08 -1.12 0.19 115.11 114.46 1xgi h GLN 175 Ca -0.02 0.02 -0.09 0.00 -1.45 0.00 0.00 58.65 57.11 1xgi h GLN 175 Cb 0.34 0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.83 1xgi h GLN 175 CO 0.03 -0.22 -0.09 1.15 -0.95 0.00 0.00 178.83 178.76 1xgi h THR 176 N -0.34 1.27 0.00 -0.54 2.02 -1.27 0.70 112.91 114.76 1xgi h THR 176 Ca 0.07 -1.18 0.00 0.00 0.77 0.00 0.00 66.41 66.07 1xgi h THR 176 Cb 0.44 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1xgi h THR 176 CO -0.23 0.40 -1.52 0.54 0.37 0.00 0.00 175.52 175.08 1xgi n ARG 177 N -4.31 0.42 0.07 6.66 1.74 0.16 -4.46 116.66 116.94 1xgi n ARG 177 Ca -0.01 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 1xgi n ARG 177 Cb 0.36 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 1xgi n ARG 177 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1xgi n VAL 178 N -2.03 1.00 0.34 1.55 0.31 0.55 -4.75 118.33 115.30 1xgi n VAL 178 Ca -0.01 0.33 -0.18 0.00 -0.01 0.00 0.00 64.34 64.47 1xgi n VAL 178 Cb 0.48 -1.38 -0.09 0.00 -0.91 0.00 0.00 33.84 31.94 1xgi n VAL 178 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1xgi h PHE 179 N 0.00 -1.28 0.19 3.52 0.04 -1.18 -2.70 116.94 115.53 1xgi h PHE 179 Ca 0.00 -0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.78 1xgi h PHE 179 Cb 0.00 0.48 -0.03 0.00 2.20 0.00 0.00 35.95 38.60 1xgi h PHE 179 CO 0.00 -0.66 -0.30 1.96 -0.60 0.00 0.00 178.31 178.71 1xgi h GLN 180 N -1.04 -0.54 -0.42 1.51 4.20 -1.10 -0.41 115.11 117.31 1xgi h GLN 180 Ca -0.07 0.04 0.11 0.00 0.06 0.00 0.00 58.65 58.79 1xgi h GLN 180 Cb 0.87 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.76 1xgi h GLN 180 CO 0.01 -0.36 0.30 -1.35 -0.67 0.00 0.00 178.83 176.76 1xgi h PRO 181 N -0.56 0.05 -0.02 1.46 0.11 -1.78 -0.11 132.00 131.15 1xgi h PRO 181 Ca 0.01 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1xgi h PRO 181 Cb 0.56 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.66 1xgi h PRO 181 CO -0.13 0.03 -0.07 1.28 -0.21 0.00 0.00 178.00 178.90 1xgi n LEU 182 N -4.43 1.94 -2.57 2.35 4.77 -1.00 -4.95 117.00 113.11 1xgi n LEU 182 Ca 0.07 -0.64 -0.18 0.00 -0.03 0.00 0.00 56.01 55.23 1xgi n LEU 182 Cb 0.47 -0.02 0.04 0.00 -2.33 0.00 0.00 43.42 41.58 1xgi n LEU 182 CO 0.36 0.33 0.09 0.29 -1.33 0.00 0.00 177.39 177.13 1xgi n LYS 183 N 0.42 -4.81 -2.86 3.23 5.02 -0.05 -4.92 118.16 114.18 1xgi n LYS 183 Ca 0.16 0.66 -0.44 0.00 -2.02 0.00 0.00 58.31 56.68 1xgi n LYS 183 Cb 0.44 -5.08 0.00 0.00 -0.02 0.00 0.00 35.03 30.37 1xgi n LYS 183 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1xgi n LEU 184 N -3.49 5.94 0.00 -0.35 4.77 -0.29 -4.77 117.00 118.81 1xgi n LEU 184 Ca -0.04 -4.78 0.15 0.00 -0.03 0.00 0.00 56.01 51.30 1xgi n LEU 184 Cb 0.57 -1.48 0.85 0.00 -2.33 0.00 0.00 43.42 41.02 1xgi n LEU 184 CO 0.42 1.23 1.04 0.59 -1.33 0.00 0.00 177.39 179.34 1xgi n ASN 185 N 3.67 0.00 -1.87 -1.43 3.02 -1.26 -3.42 115.26 113.97 1xgi n ASN 185 Ca 0.33 -0.75 -0.05 0.00 -0.03 0.00 0.00 54.58 54.08 1xgi n ASN 185 Cb 0.38 -0.06 0.07 0.00 -0.61 0.00 0.00 39.78 39.56 1xgi n ASN 185 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1xgi n HIS 186 N -1.06 1.19 -4.79 3.10 8.25 -1.26 -5.01 115.22 115.63 1xgi n HIS 186 Ca 0.20 -1.70 -0.29 0.00 -0.26 0.00 0.00 57.72 55.67 1xgi n HIS 186 Cb 0.13 -0.25 -0.17 0.00 1.12 0.00 0.00 29.99 30.82 1xgi n HIS 186 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1xgi s THR 187 N -3.15 1.66 0.05 1.59 2.01 -1.22 -3.55 115.64 113.04 1xgi s THR 187 Ca 0.38 -0.77 0.01 0.00 0.31 0.00 0.00 61.69 61.62 1xgi s THR 187 Cb 0.37 -1.47 -0.03 0.00 0.01 0.00 0.00 72.50 71.37 1xgi s THR 187 CO -0.05 0.47 -0.06 0.26 -0.69 0.00 0.00 174.62 174.56 1xgi s TRP 188 N 0.64 0.62 -0.16 4.92 0.52 0.05 -4.98 118.94 120.54 1xgi s TRP 188 Ca -0.13 -0.74 -0.06 0.00 0.02 0.00 0.00 56.10 55.19 1xgi s TRP 188 Cb -0.16 -0.39 -0.23 0.00 -1.15 0.00 0.00 33.47 31.54 1xgi s TRP 188 CO 0.04 -0.18 0.20 -0.89 0.02 0.00 0.00 176.95 176.13 1xgi n ILE 189 N 0.80 1.69 -4.07 2.03 2.08 -1.26 -0.32 119.36 120.31 1xgi n ILE 189 Ca -0.18 -0.59 -0.31 0.00 0.56 0.00 0.00 62.75 62.23 1xgi n ILE 189 Cb 0.58 -1.69 -0.16 0.00 -0.75 0.00 0.00 39.64 37.62 1xgi n ILE 189 CO 0.00 0.00 0.00 0.20 0.56 0.00 0.00 176.55 177.31 1xgi s ASN 190 N -6.92 2.80 -0.11 4.38 -0.87 -1.26 -4.73 114.94 108.24 1xgi s ASN 190 Ca -0.26 -0.53 -0.29 0.00 -1.57 0.00 0.00 52.86 50.20 1xgi s ASN 190 Cb 0.07 -1.26 -0.04 0.00 -0.02 0.00 0.00 41.25 40.00 1xgi s ASN 190 CO 0.71 -0.04 1.49 -0.69 -2.57 0.00 0.00 177.10 176.00 1xgi s VAL 191 N 1.41 3.88 0.59 1.60 1.01 -1.26 -4.99 120.40 122.64 1xgi s VAL 191 Ca 0.05 1.06 -0.17 0.00 0.00 0.00 0.00 61.98 62.92 1xgi s VAL 191 Cb -0.13 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 1xgi s VAL 191 CO -0.11 -0.10 1.10 -2.84 0.00 0.00 0.00 175.10 173.15 1xgi s PRO 192 N 3.83 3.17 0.51 2.72 0.02 -1.26 -4.91 135.00 139.08 1xgi s PRO 192 Ca 0.65 1.44 0.24 0.00 0.02 0.00 0.00 61.00 63.36 1xgi s PRO 192 Cb -0.28 -2.00 1.34 0.00 0.02 0.00 0.00 34.50 33.59 1xgi s PRO 192 CO 0.23 -0.96 1.96 -1.35 -0.33 0.00 0.00 177.00 176.55 1xgi h PRO 193 N 0.66 0.08 0.00 5.54 0.11 -2.02 -0.57 132.00 135.80 1xgi h PRO 193 Ca -0.48 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 1xgi h PRO 193 Cb 1.25 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1xgi h PRO 193 CO 0.56 0.06 -0.20 0.00 -0.21 0.00 0.00 178.00 178.21 1xgi h ALA 194 N 1.68 1.36 -0.27 -0.75 0.00 -2.02 -2.93 119.26 116.33 1xgi h ALA 194 Ca 0.31 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1xgi h ALA 194 Cb 1.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1xgi h ALA 194 CO -0.03 0.24 0.00 0.39 0.00 0.00 0.00 179.25 179.85 1xgi n GLU 195 N -3.85 2.44 0.25 0.00 -0.58 -0.23 -4.46 120.64 114.21 1xgi n GLU 195 Ca -0.02 -2.15 0.10 0.00 -0.42 0.00 0.00 57.16 54.67 1xgi n GLU 195 Cb 0.29 -1.50 0.67 0.00 -0.57 0.00 0.00 31.44 30.33 1xgi n GLU 195 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1xgi h GLU 196 N 4.52 0.00 0.00 3.49 5.08 -1.42 -1.45 114.58 124.81 1xgi h GLU 196 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1xgi h GLU 196 Cb 0.98 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.23 1xgi h GLU 196 CO 0.00 0.12 -0.05 1.57 -1.00 0.00 0.00 179.01 179.65 1xgi h LYS 197 N 0.00 0.00 -0.01 2.33 2.10 -1.81 -2.69 116.57 116.48 1xgi h LYS 197 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xgi h LYS 197 Cb 0.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 1xgi h LYS 197 CO 0.02 0.05 -0.48 0.09 -2.00 0.00 0.00 179.45 177.13 1xgi n ASN 198 N -3.24 1.80 -4.58 7.07 5.03 -0.57 -4.91 115.26 115.87 1xgi n ASN 198 Ca -0.01 -1.40 -0.42 0.00 0.87 0.00 0.00 54.58 53.62 1xgi n ASN 198 Cb 0.24 0.53 -0.02 0.00 -1.02 0.00 0.00 39.78 39.51 1xgi n ASN 198 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1xgi s TYR 199 N -2.33 2.51 0.74 3.10 6.04 -1.02 0.61 117.35 127.00 1xgi s TYR 199 Ca 0.16 0.37 -0.15 0.00 0.04 0.00 0.00 57.07 57.49 1xgi s TYR 199 Cb 0.16 -4.51 0.04 0.00 -1.04 0.00 0.00 41.96 36.61 1xgi s TYR 199 CO 0.54 -1.72 1.20 0.00 -1.54 0.00 0.00 175.55 174.04 1xgi s ALA 200 N 5.24 2.09 0.20 3.97 0.00 -0.55 -4.91 121.76 127.80 1xgi s ALA 200 Ca 0.44 0.86 -0.08 0.00 0.00 0.00 0.00 51.96 53.18 1xgi s ALA 200 Cb -0.08 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.51 1xgi s ALA 200 CO 0.24 -1.92 0.48 -1.58 0.00 0.00 0.00 175.76 172.99 1xgi s TRP 201 N -2.03 3.44 0.25 0.00 0.52 0.18 -4.92 118.94 116.39 1xgi s TRP 201 Ca 0.74 0.75 0.01 0.00 0.02 0.00 0.00 56.10 57.62 1xgi s TRP 201 Cb -0.29 -2.16 -0.04 0.00 -1.15 0.00 0.00 33.47 29.83 1xgi s TRP 201 CO 0.46 0.33 0.42 0.20 0.02 0.00 0.00 176.95 178.39 1xgi s GLY 202 N -2.39 1.56 -0.09 0.98 0.00 0.09 -4.81 107.32 102.66 1xgi s GLY 202 Ca 0.45 -0.93 0.01 0.00 0.00 0.00 0.00 44.72 44.25 1xgi s GLY 202 CO 0.22 -0.89 -0.12 -0.19 0.00 0.00 0.00 173.10 172.12 1xgi s TYR 203 N -2.00 1.65 -0.19 1.90 1.51 -0.67 0.12 117.35 119.66 1xgi s TYR 203 Ca 0.38 -0.74 -0.00 0.00 -1.01 0.00 0.00 57.07 55.70 1xgi s TYR 203 Cb -0.10 -1.24 0.05 0.00 -0.11 0.00 0.00 41.96 40.56 1xgi s TYR 203 CO 0.31 -0.42 -0.04 0.50 -1.11 0.00 0.00 175.55 174.79 1xgi s ARG 204 N 1.09 1.38 -1.43 -0.62 3.52 -0.55 -4.41 118.95 117.93 1xgi s ARG 204 Ca -0.06 -0.66 -0.10 0.00 -0.13 0.00 0.00 55.73 54.78 1xgi s ARG 204 Cb -0.14 -2.22 0.03 0.00 -1.56 0.00 0.00 34.95 31.05 1xgi s ARG 204 CO -0.02 -0.52 1.03 0.39 -0.81 0.00 0.00 175.30 175.37 1xgi n GLU 205 N 4.83 -6.79 -0.80 5.12 1.02 -1.26 -1.65 120.64 121.11 1xgi n GLU 205 Ca -0.12 0.77 0.00 0.00 -0.02 0.00 0.00 57.16 57.80 1xgi n GLU 205 Cb 0.46 -5.75 0.00 0.00 -0.02 0.00 0.00 31.44 26.13 1xgi n GLU 205 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xgi n GLY 206 N -1.84 0.99 3.82 0.62 0.00 -1.26 -5.01 105.19 102.51 1xgi n GLY 206 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1xgi n GLY 206 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xgi s LYS 207 N -0.17 3.68 0.09 1.61 -2.85 -0.66 -5.05 119.74 116.39 1xgi s LYS 207 Ca 0.00 -0.17 -0.30 0.00 -1.00 0.00 0.00 55.97 54.50 1xgi s LYS 207 Cb 0.00 -3.25 -0.06 0.00 -2.06 0.00 0.00 37.83 32.46 1xgi s LYS 207 CO 0.00 0.61 1.17 0.00 0.10 0.00 0.00 175.35 177.23 1xgi s ALA 208 N -0.55 3.38 0.00 0.59 0.00 -1.26 -1.48 121.76 122.45 1xgi s ALA 208 Ca 0.12 0.83 -0.11 0.00 0.00 0.00 0.00 51.96 52.81 1xgi s ALA 208 Cb -0.12 -3.42 0.01 0.00 0.00 0.00 0.00 23.12 19.60 1xgi s ALA 208 CO 0.02 -0.38 0.23 0.14 0.00 0.00 0.00 175.76 175.77 1xgi s VAL 209 N 0.71 0.08 0.10 0.00 -7.23 0.12 -4.91 120.40 109.27 1xgi s VAL 209 Ca 0.56 -0.62 0.10 0.00 -1.81 0.00 0.00 61.98 60.20 1xgi s VAL 209 Cb -0.29 -0.61 -0.04 0.00 0.56 0.00 0.00 36.38 36.01 1xgi s VAL 209 CO 0.31 -0.34 -0.25 -1.00 -0.31 0.00 0.00 175.10 173.51 1xgi s HIS 210 N -1.59 2.13 0.30 2.82 3.76 -1.26 -0.73 115.29 120.72 1xgi s HIS 210 Ca -0.12 -0.39 -0.29 0.00 -0.15 0.00 0.00 55.06 54.10 1xgi s HIS 210 Cb -0.05 -1.19 -0.13 0.00 1.11 0.00 0.00 32.58 32.32 1xgi s HIS 210 CO 0.02 0.24 1.25 1.55 -0.85 0.00 0.00 174.74 176.95 1xgi n VAL 211 N 1.21 1.69 -2.86 -0.90 3.14 -1.26 -4.97 118.33 114.38 1xgi n VAL 211 Ca -0.18 -0.42 -0.31 0.00 -2.96 0.00 0.00 64.34 60.46 1xgi n VAL 211 Cb 0.53 -1.39 -0.04 0.00 -1.06 0.00 0.00 33.84 31.88 1xgi n VAL 211 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1xgi s SER 212 N -0.20 6.62 0.36 6.55 0.01 -1.26 -5.05 113.70 120.73 1xgi s SER 212 Ca 0.60 1.26 -0.27 0.00 1.31 0.00 0.00 55.95 58.85 1xgi s SER 212 Cb -0.63 -2.37 -0.09 0.00 0.21 0.00 0.00 66.02 63.14 1xgi s SER 212 CO 0.58 -0.38 1.19 -2.84 0.41 0.00 0.00 173.24 172.20 1xgi s PRO 213 N -3.64 4.23 0.23 12.44 0.02 -1.26 -5.04 135.00 141.99 1xgi s PRO 213 Ca 0.54 1.91 -0.16 0.00 0.02 0.00 0.00 61.00 63.31 1xgi s PRO 213 Cb -0.10 -2.86 0.01 0.00 0.02 0.00 0.00 34.50 31.57 1xgi s PRO 213 CO 0.27 -0.19 0.53 0.20 -0.33 0.00 0.00 177.00 177.48 1xgi s GLY 214 N -0.95 0.18 0.27 0.52 0.00 -1.26 -5.08 107.32 101.00 1xgi s GLY 214 Ca 0.53 -0.53 -0.30 0.00 0.00 0.00 0.00 44.72 44.42 1xgi s GLY 214 CO 0.42 -0.40 1.43 0.00 0.00 0.00 0.00 173.10 174.55 1xgi s ALA 215 N -3.94 3.61 -1.55 3.20 0.00 -1.26 -2.26 121.76 119.55 1xgi s ALA 215 Ca 0.15 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.45 1xgi s ALA 215 Cb -0.02 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1xgi s ALA 215 CO 0.04 -0.75 0.00 1.28 0.00 0.00 0.00 175.76 176.33 1xgi n LEU 216 N 2.01 -1.44 -0.17 0.00 4.77 -1.26 -4.86 117.00 116.04 1xgi n LEU 216 Ca 0.05 0.20 -0.10 0.00 -0.03 0.00 0.00 56.01 56.13 1xgi n LEU 216 Cb 0.40 -2.50 0.00 0.00 -2.33 0.00 0.00 43.42 38.99 1xgi n LEU 216 CO 0.61 -0.41 0.76 -2.24 -1.33 0.00 0.00 177.39 174.78 1xgi h ASP 217 N 0.00 0.92 -1.00 -1.43 3.04 -1.87 -2.67 116.42 113.41 1xgi h ASP 217 Ca -0.38 -0.34 0.08 0.00 -3.24 0.00 0.00 57.03 53.15 1xgi h ASP 217 Cb 1.23 -0.25 -0.07 0.00 -1.04 0.00 0.00 39.33 39.19 1xgi h ASP 217 CO 0.48 1.04 0.64 0.00 -2.04 0.00 0.00 179.24 179.36 1xgi h ALA 218 N 0.91 1.44 0.00 4.15 0.00 -1.89 0.34 119.26 124.21 1xgi h ALA 218 Ca 0.13 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 1xgi h ALA 218 Cb 0.60 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1xgi h ALA 218 CO 0.04 0.38 -0.51 0.93 0.00 0.00 0.00 179.25 180.09 1xgi h GLU 219 N 1.12 0.00 0.00 0.00 3.07 -1.86 -3.34 114.58 113.57 1xgi h GLU 219 Ca 0.45 0.00 -0.20 0.00 -0.50 0.00 0.00 59.36 59.11 1xgi h GLU 219 Cb 0.25 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.12 1xgi h GLU 219 CO -0.19 0.51 -1.76 0.00 -1.40 0.00 0.00 179.01 176.17 1xgi n ALA 220 N -2.23 1.72 -2.32 3.43 0.00 -1.02 -4.57 120.51 115.52 1xgi n ALA 220 Ca 0.02 -0.66 -0.03 0.00 0.00 0.00 0.00 53.44 52.76 1xgi n ALA 220 Cb 0.73 0.09 0.01 0.00 0.00 0.00 0.00 19.45 20.28 1xgi n ALA 220 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1xgi n TYR 221 N -2.61 -0.47 0.02 0.00 0.18 -0.61 -4.00 117.16 109.67 1xgi n TYR 221 Ca -0.20 -0.96 0.06 0.00 1.88 0.00 0.00 57.90 58.67 1xgi n TYR 221 Cb 0.81 0.64 0.13 0.00 -0.38 0.00 0.00 39.34 40.54 1xgi n TYR 221 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1xgi n GLY 222 N -0.40 1.83 3.76 -7.48 0.00 0.01 -4.19 105.19 98.72 1xgi n GLY 222 Ca -0.18 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.07 1xgi n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xgi s VAL 223 N -0.99 4.58 -0.06 1.61 1.01 -1.26 -4.45 120.40 120.84 1xgi s VAL 223 Ca 0.21 1.69 0.04 0.00 0.00 0.00 0.00 61.98 63.92 1xgi s VAL 223 Cb 0.12 -4.14 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 1xgi s VAL 223 CO 0.16 0.42 -0.18 -0.54 0.00 0.00 0.00 175.10 174.96 1xgi s LYS 224 N -0.44 2.56 0.22 2.72 3.01 0.57 -1.38 119.74 126.99 1xgi s LYS 224 Ca 0.38 -0.78 -0.14 0.00 -1.01 0.00 0.00 55.97 54.42 1xgi s LYS 224 Cb -0.22 -2.31 0.01 0.00 -1.01 0.00 0.00 37.83 34.30 1xgi s LYS 224 CO 0.25 0.51 0.48 0.45 0.51 0.00 0.00 175.35 177.55 1xgi s SER 225 N -0.46 -0.13 0.33 2.83 0.15 -0.76 -0.77 113.70 114.88 1xgi s SER 225 Ca 0.05 -0.76 0.06 0.00 0.70 0.00 0.00 55.95 56.01 1xgi s SER 225 Cb -0.12 0.57 -0.01 0.00 -1.71 0.00 0.00 66.02 64.75 1xgi s SER 225 CO 0.02 -1.09 0.46 0.42 1.20 0.00 0.00 173.24 174.24 1xgi s THR 226 N -3.96 4.13 0.41 6.45 -4.23 -1.23 -0.99 115.64 116.23 1xgi s THR 226 Ca 0.17 -1.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.81 1xgi s THR 226 Cb -0.01 -3.43 0.14 0.00 1.34 0.00 0.00 72.50 70.55 1xgi s THR 226 CO 0.04 -0.17 1.92 -0.29 -0.54 0.00 0.00 174.62 175.58 1xgi h ILE 227 N 0.92 1.18 -0.15 2.99 6.09 -1.73 -1.24 117.51 125.56 1xgi h ILE 227 Ca -0.46 -0.91 -0.06 0.00 -1.37 0.00 0.00 64.86 62.06 1xgi h ILE 227 Cb 1.25 1.49 -0.00 0.00 0.47 0.00 0.00 36.82 40.03 1xgi h ILE 227 CO 0.53 0.26 -0.12 -0.33 -3.07 0.00 0.00 178.15 175.42 1xgi h GLU 228 N 0.00 0.35 -0.66 2.19 5.08 -1.94 -1.54 114.58 118.06 1xgi h GLU 228 Ca -0.00 -0.18 -0.07 0.00 -1.00 0.00 0.00 59.36 58.11 1xgi h GLU 228 Cb 0.47 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1xgi h GLU 228 CO 0.03 0.71 0.14 -0.44 -1.00 0.00 0.00 179.01 178.46 1xgi h ASP 229 N -0.01 1.00 -0.21 1.42 3.45 -1.84 -1.95 116.42 118.29 1xgi h ASP 229 Ca 0.03 -0.22 -0.06 0.00 0.43 0.00 0.00 57.03 57.21 1xgi h ASP 229 Cb 0.64 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 39.13 1xgi h ASP 229 CO 0.03 0.98 -0.06 0.24 -1.57 0.00 0.00 179.24 178.86 1xgi h MET 230 N 1.00 0.54 -0.55 3.56 2.86 -1.16 0.25 114.93 121.44 1xgi h MET 230 Ca 0.21 -0.14 -0.06 0.00 -2.06 0.00 0.00 59.70 57.65 1xgi h MET 230 Cb 0.38 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 1xgi h MET 230 CO 0.00 0.61 0.09 0.00 1.06 0.00 0.00 176.91 178.67 1xgi h ALA 231 N 1.44 1.13 -0.46 6.32 0.00 -0.93 0.54 119.26 127.30 1xgi h ALA 231 Ca 0.10 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.65 1xgi h ALA 231 Cb 0.41 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1xgi h ALA 231 CO 0.02 0.57 -0.23 -0.09 0.00 0.00 0.00 179.25 179.53 1xgi h ARG 232 N 0.82 0.94 -0.49 0.00 2.43 -0.46 0.31 114.38 117.92 1xgi h ARG 232 Ca 0.17 -0.40 -0.00 0.00 -0.81 0.00 0.00 59.98 58.94 1xgi h ARG 232 Cb 0.37 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 1xgi h ARG 232 CO 0.01 1.07 0.31 2.35 -1.51 0.00 0.00 179.97 182.19 1xgi h TRP 233 N 0.81 0.64 -0.68 2.20 -0.00 0.01 -0.48 115.95 118.45 1xgi h TRP 233 Ca 0.10 0.00 -0.05 0.00 -0.00 0.00 0.00 58.89 58.95 1xgi h TRP 233 Cb 0.79 -0.21 -0.03 0.00 -0.00 0.00 0.00 29.16 29.71 1xgi h TRP 233 CO 0.05 0.43 0.24 0.28 -0.00 0.00 0.00 178.44 179.44 1xgi h VAL 234 N 0.66 1.25 -0.67 2.65 2.07 -0.49 -1.71 116.25 120.02 1xgi h VAL 234 Ca 0.18 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.83 1xgi h VAL 234 Cb -0.03 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 1xgi h VAL 234 CO -0.04 0.32 0.25 1.56 0.02 0.00 0.00 177.57 179.69 1xgi h GLN 235 N 0.98 0.99 -0.61 1.57 4.20 -0.50 -0.41 115.11 121.33 1xgi h GLN 235 Ca 0.22 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1xgi h GLN 235 Cb 0.26 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 1xgi h GLN 235 CO -0.01 0.82 0.25 0.77 -0.67 0.00 0.00 178.83 179.99 1xgi h SER 236 N 0.97 0.83 1.35 1.46 0.02 -0.69 -2.04 113.55 115.46 1xgi h SER 236 Ca 0.22 -0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1xgi h SER 236 Cb 0.21 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1xgi h SER 236 CO -0.02 0.77 -0.09 0.78 -1.14 0.00 0.00 176.83 177.13 1xgi h ASN 237 N 0.84 0.00 0.20 3.07 2.35 -0.94 -2.49 115.58 118.62 1xgi h ASN 237 Ca 0.20 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.66 1xgi h ASN 237 Cb 0.19 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.58 1xgi h ASN 237 CO -0.02 0.09 -1.22 -0.07 -1.65 0.00 0.00 177.43 174.56 1xgi h LEU 238 N 0.00 0.80 -6.39 1.61 3.38 -0.75 -3.40 115.31 110.56 1xgi h LEU 238 Ca -0.00 -0.74 -0.59 0.00 0.09 0.00 0.00 57.88 56.64 1xgi h LEU 238 Cb 0.79 -0.25 -0.40 0.00 0.09 0.00 0.00 40.66 40.89 1xgi h LEU 238 CO 0.01 1.55 -0.87 0.29 0.09 0.00 0.00 178.44 179.52 1xgi n LYS 239 N -3.76 1.05 0.25 1.13 5.02 -0.80 -4.82 118.16 116.24 1xgi n LYS 239 Ca -0.13 -3.71 0.10 0.00 -2.02 0.00 0.00 58.31 52.55 1xgi n LYS 239 Cb 0.98 -1.77 0.65 0.00 -0.02 0.00 0.00 35.03 34.87 1xgi n LYS 239 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1xgi h PRO 240 N 4.91 0.00 0.00 1.97 0.13 -1.67 -2.38 132.00 134.95 1xgi h PRO 240 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1xgi h PRO 240 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1xgi h PRO 240 CO 0.54 0.13 0.00 -0.07 -0.23 0.00 0.00 178.00 178.37 1xgi h LEU 241 N 0.00 0.00 -1.20 1.56 3.38 -1.90 0.17 115.31 117.32 1xgi h LEU 241 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xgi h LEU 241 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1xgi h LEU 241 CO 0.02 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.02 1xgi n ASP 242 N -2.40 1.81 -4.72 -0.43 10.43 -0.90 -4.86 116.55 115.49 1xgi n ASP 242 Ca -0.01 -1.72 -0.38 0.00 2.57 0.00 0.00 54.79 55.24 1xgi n ASP 242 Cb 0.08 -0.11 -0.06 0.00 1.84 0.00 0.00 41.12 42.88 1xgi n ASP 242 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1xgi s ILE 243 N -1.78 5.15 0.08 0.53 1.01 0.04 -5.00 121.20 121.23 1xgi s ILE 243 Ca 0.33 1.08 -0.17 0.00 0.00 0.00 0.00 60.65 61.89 1xgi s ILE 243 Cb 0.18 -3.87 -0.10 0.00 0.01 0.00 0.00 42.46 38.68 1xgi s ILE 243 CO 0.27 0.30 1.42 0.78 0.00 0.00 0.00 174.94 177.71 1xgi h ASN 244 N 6.76 0.57 -2.49 3.58 2.35 -1.89 -3.43 115.58 121.03 1xgi h ASN 244 Ca -0.41 -0.44 -0.58 0.00 -0.55 0.00 0.00 56.30 54.32 1xgi h ASN 244 Cb 1.18 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 39.37 1xgi h ASN 244 CO 0.76 0.89 1.31 -1.83 -1.65 0.00 0.00 177.43 176.91 1xgi s GLU 245 N -4.47 3.38 0.18 0.81 -1.05 -1.26 -4.90 118.70 111.40 1xgi s GLU 245 Ca -0.13 1.68 -0.13 0.00 -0.15 0.00 0.00 54.97 56.23 1xgi s GLU 245 Cb 0.07 -4.22 0.18 0.00 -0.44 0.00 0.00 34.13 29.73 1xgi s GLU 245 CO 0.79 -1.81 1.71 0.87 0.95 0.00 0.00 175.26 177.78 1xgi h LYS 246 N 13.07 0.21 -0.18 -4.83 6.56 -2.00 -0.97 116.57 128.43 1xgi h LYS 246 Ca -0.36 -0.01 -0.10 0.00 -1.06 0.00 0.00 60.65 59.11 1xgi h LYS 246 Cb 1.19 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 32.79 1xgi h LYS 246 CO 1.00 0.14 -0.32 1.79 -2.06 0.00 0.00 179.45 180.00 1xgi h THR 247 N 0.22 1.28 -0.34 -0.16 1.35 -1.91 -1.87 112.91 111.48 1xgi h THR 247 Ca 0.25 -1.36 -0.14 0.00 -0.55 0.00 0.00 66.41 64.61 1xgi h THR 247 Cb 0.33 1.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.25 1xgi h THR 247 CO -0.33 0.42 -0.32 0.25 -0.25 0.00 0.00 175.52 175.29 1xgi h LEU 248 N 0.31 0.86 -0.41 3.87 5.85 -1.79 0.16 115.31 124.17 1xgi h LEU 248 Ca 0.04 -0.46 0.05 0.00 0.84 0.00 0.00 57.88 58.35 1xgi h LEU 248 Cb 0.73 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 1xgi h LEU 248 CO 0.06 1.15 0.13 -0.61 -0.34 0.00 0.00 178.44 178.82 1xgi h GLN 249 N 0.59 0.27 -0.41 1.25 4.15 -0.89 -0.58 115.11 119.49 1xgi h GLN 249 Ca 0.06 -0.02 -0.11 0.00 0.77 0.00 0.00 58.65 59.34 1xgi h GLN 249 Cb 0.90 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.52 1xgi h GLN 249 CO 0.08 0.18 -0.19 1.96 -1.93 0.00 0.00 178.83 178.93 1xgi h GLN 250 N 0.28 0.85 -0.97 1.69 4.20 -1.21 -2.54 115.11 117.41 1xgi h GLN 250 Ca 0.19 -0.37 0.09 0.00 0.06 0.00 0.00 58.65 58.62 1xgi h GLN 250 Cb 0.19 -0.03 -0.07 0.00 0.30 0.00 0.00 27.48 27.87 1xgi h GLN 250 CO -0.21 1.01 0.62 0.78 -0.67 0.00 0.00 178.83 180.36 1xgi h GLY 251 N 0.67 1.49 1.01 3.46 0.00 -0.09 0.22 103.07 109.83 1xgi h GLY 251 Ca 0.09 -0.42 -0.10 0.00 0.00 0.00 0.00 47.33 46.90 1xgi h GLY 251 CO 0.06 0.24 -0.12 -2.22 0.00 0.00 0.00 176.54 174.50 1xgi h ILE 252 N 1.02 1.27 -0.44 2.60 2.04 -1.02 -1.74 117.51 121.25 1xgi h ILE 252 Ca 0.45 -1.23 -0.08 0.00 1.00 0.00 0.00 64.86 65.00 1xgi h ILE 252 Cb 0.36 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 1xgi h ILE 252 CO -0.21 0.42 -0.07 1.56 0.00 0.00 0.00 178.15 179.85 1xgi h GLN 253 N 0.67 0.76 -0.35 2.37 4.20 -0.82 -2.86 115.11 119.09 1xgi h GLN 253 Ca 0.11 -0.23 -0.12 0.00 0.06 0.00 0.00 58.65 58.47 1xgi h GLN 253 Cb 0.65 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 1xgi h GLN 253 CO 0.04 0.82 -0.26 -0.07 -0.67 0.00 0.00 178.83 178.69 1xgi h LEU 254 N 0.70 0.72 -1.62 1.46 3.38 -0.46 -2.83 115.31 116.66 1xgi h LEU 254 Ca 0.13 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1xgi h LEU 254 Cb 0.54 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1xgi h LEU 254 CO 0.03 0.95 -0.15 0.00 0.09 0.00 0.00 178.44 179.36 1xgi h ALA 255 N 1.10 1.16 -0.17 1.53 0.00 -1.09 -2.61 119.26 119.18 1xgi h ALA 255 Ca 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1xgi h ALA 255 Cb 0.76 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1xgi h ALA 255 CO 0.06 0.19 0.00 1.04 0.00 0.00 0.00 179.25 180.54 1xgi n GLN 256 N -3.50 2.09 -1.83 0.00 6.02 -1.08 -0.68 117.38 118.40 1xgi n GLN 256 Ca -0.01 -1.61 -0.33 0.00 -0.01 0.00 0.00 57.00 55.04 1xgi n GLN 256 Cb 0.31 -1.46 0.03 0.00 1.02 0.00 0.00 30.24 30.14 1xgi n GLN 256 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1xgi s SER 257 N -1.74 5.39 -0.45 1.08 0.01 -0.98 -3.89 113.70 113.11 1xgi s SER 257 Ca 0.34 1.87 -0.17 0.00 1.31 0.00 0.00 55.95 59.30 1xgi s SER 257 Cb 0.20 -2.54 0.04 0.00 0.21 0.00 0.00 66.02 63.94 1xgi s SER 257 CO 0.30 -1.44 0.47 -0.13 0.41 0.00 0.00 173.24 172.85 1xgi s ARG 258 N -4.24 3.07 -0.10 12.44 0.52 0.72 -4.00 118.95 127.35 1xgi s ARG 258 Ca 0.64 -0.94 0.08 0.00 -0.52 0.00 0.00 55.73 54.99 1xgi s ARG 258 Cb -0.18 -4.04 -0.24 0.00 0.52 0.00 0.00 34.95 31.02 1xgi s ARG 258 CO 0.42 -0.98 0.43 0.66 0.02 0.00 0.00 175.30 175.85 1xgi n TYR 259 N 5.62 0.82 -3.88 -0.53 4.01 -0.26 -1.94 117.16 121.01 1xgi n TYR 259 Ca -0.08 0.25 -0.10 0.00 -0.16 0.00 0.00 57.90 57.81 1xgi n TYR 259 Cb 0.46 -1.14 -0.09 0.00 -0.31 0.00 0.00 39.34 38.27 1xgi n TYR 259 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1xgi s TRP 260 N -2.57 0.11 -0.07 -0.72 0.52 -1.23 -1.99 118.94 112.99 1xgi s TRP 260 Ca -0.12 -0.37 0.03 0.00 0.02 0.00 0.00 56.10 55.66 1xgi s TRP 260 Cb 0.07 -0.07 0.01 0.00 -1.15 0.00 0.00 33.47 32.33 1xgi s TRP 260 CO 0.80 -0.41 -0.16 -1.14 0.02 0.00 0.00 176.95 176.06 1xgi s GLN 261 N -2.65 2.07 -0.28 4.98 0.74 -0.39 -0.94 119.66 123.17 1xgi s GLN 261 Ca -0.04 -0.54 -0.01 0.00 0.05 0.00 0.00 55.36 54.81 1xgi s GLN 261 Cb -0.01 -1.65 0.09 0.00 1.10 0.00 0.00 33.01 32.54 1xgi s GLN 261 CO -0.05 0.07 0.07 -0.08 -0.55 0.00 0.00 175.29 174.76 1xgi s THR 262 N 0.56 0.92 0.00 -0.34 -1.32 -0.13 -1.27 115.64 114.07 1xgi s THR 262 Ca -0.16 -1.26 0.00 0.00 -1.21 0.00 0.00 61.69 59.07 1xgi s THR 262 Cb -0.16 -1.60 0.00 0.00 -1.51 0.00 0.00 72.50 69.23 1xgi s THR 262 CO 0.05 -0.53 0.00 0.61 -2.21 0.00 0.00 174.62 172.54 1xgi n GLY 263 N 4.85 3.22 0.81 6.08 0.00 -1.26 -1.97 105.19 116.91 1xgi n GLY 263 Ca -0.04 -0.18 0.12 0.00 0.00 0.00 0.00 46.02 45.92 1xgi n GLY 263 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xgi n ASP 264 N 8.81 2.68 -4.84 1.61 10.43 -1.26 -4.95 116.55 129.03 1xgi n ASP 264 Ca 0.00 -1.84 -0.35 0.00 2.57 0.00 0.00 54.79 55.18 1xgi n ASP 264 Cb 0.00 0.15 -0.06 0.00 1.84 0.00 0.00 41.12 43.05 1xgi n ASP 264 CO 0.00 0.00 0.00 -0.32 -1.07 0.00 0.00 177.20 175.81 1xgi s MET 265 N -2.12 3.28 -0.05 -1.24 1.75 -0.83 -4.42 119.30 115.66 1xgi s MET 265 Ca 0.25 -0.32 0.05 0.00 -1.25 0.00 0.00 55.69 54.42 1xgi s MET 265 Cb 0.19 -3.02 -0.02 0.00 2.84 0.00 0.00 34.83 34.82 1xgi s MET 265 CO 0.38 0.70 -0.20 0.71 -0.65 0.00 0.00 175.02 175.96 1xgi s TYR 266 N -1.14 2.55 -0.21 4.11 1.51 0.87 -0.95 117.35 124.10 1xgi s TYR 266 Ca 0.20 -0.42 -0.13 0.00 -1.01 0.00 0.00 57.07 55.71 1xgi s TYR 266 Cb -0.12 -1.61 -0.04 0.00 -0.11 0.00 0.00 41.96 40.07 1xgi s TYR 266 CO 0.11 -0.02 0.28 -1.14 -1.11 0.00 0.00 175.55 173.67 1xgi s GLN 267 N -0.44 4.16 0.00 -0.62 2.00 -0.12 -0.70 119.66 123.94 1xgi s GLN 267 Ca 0.05 -0.00 0.00 0.00 -2.00 0.00 0.00 55.36 53.41 1xgi s GLN 267 Cb -0.12 -3.51 0.00 0.00 0.80 0.00 0.00 33.01 30.18 1xgi s GLN 267 CO 0.01 0.07 0.00 0.41 -0.50 0.00 0.00 175.29 175.28 1xgi n GLY 268 N 3.91 3.60 3.29 2.59 0.00 -0.45 -1.10 105.19 117.03 1xgi n GLY 268 Ca -0.12 -1.89 -0.45 0.00 0.00 0.00 0.00 46.02 43.56 1xgi n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xgi s LEU 269 N 0.00 6.11 0.00 0.99 1.43 0.15 -4.60 118.68 122.75 1xgi s LEU 269 Ca 0.00 -1.89 0.00 0.00 -1.03 0.00 0.00 54.13 51.21 1xgi s LEU 269 Cb 0.00 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 44.06 1xgi s LEU 269 CO 0.00 -0.80 0.00 0.61 0.23 0.00 0.00 176.35 176.39 1xgi n GLY 270 N 5.08 2.03 3.77 -3.19 0.00 -1.26 -4.36 105.19 107.25 1xgi n GLY 270 Ca -0.11 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.30 1xgi n GLY 270 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xgi s TRP 271 N 0.00 2.57 0.07 1.61 0.52 -1.26 -4.67 118.94 117.78 1xgi s TRP 271 Ca 0.00 1.56 0.07 0.00 0.02 0.00 0.00 56.10 57.75 1xgi s TRP 271 Cb 0.00 -3.18 -0.03 0.00 -1.15 0.00 0.00 33.47 29.11 1xgi s TRP 271 CO 0.00 -1.77 -0.19 -1.21 0.02 0.00 0.00 176.95 173.80 1xgi s GLU 272 N -4.13 1.16 0.09 4.98 2.02 -0.98 -1.34 118.70 120.50 1xgi s GLU 272 Ca 0.67 -1.00 0.02 0.00 0.02 0.00 0.00 54.97 54.68 1xgi s GLU 272 Cb -0.21 -1.31 -0.04 0.00 0.10 0.00 0.00 34.13 32.67 1xgi s GLU 272 CO 0.43 0.32 -0.06 -1.64 0.02 0.00 0.00 175.26 174.32 1xgi s MET 273 N -1.50 0.80 0.02 1.61 -1.94 0.13 -1.38 119.30 117.04 1xgi s MET 273 Ca 0.05 -1.29 -0.06 0.00 -1.71 0.00 0.00 55.69 52.68 1xgi s MET 273 Cb -0.09 -0.19 -0.00 0.00 2.01 0.00 0.00 34.83 36.56 1xgi s MET 273 CO 0.03 -0.02 0.11 -0.51 -0.01 0.00 0.00 175.02 174.62 1xgi s LEU 274 N -2.94 1.67 0.40 -0.03 1.02 -0.85 -0.09 118.68 117.87 1xgi s LEU 274 Ca 0.10 -0.33 -0.26 0.00 0.02 0.00 0.00 54.13 53.66 1xgi s LEU 274 Cb 0.04 0.62 -0.09 0.00 0.02 0.00 0.00 46.19 46.78 1xgi s LEU 274 CO -0.05 -0.41 1.27 -1.81 0.02 0.00 0.00 176.35 175.38 1xgi s ASP 275 N -1.62 6.36 -0.11 2.29 -0.00 -1.26 -0.74 116.67 121.59 1xgi s ASP 275 Ca -0.12 2.59 -0.04 0.00 -0.00 0.00 0.00 52.55 54.99 1xgi s ASP 275 Cb -0.06 -2.63 -0.04 0.00 -0.00 0.00 0.00 42.92 40.19 1xgi s ASP 275 CO -0.00 -0.81 0.04 0.86 -0.00 0.00 0.00 175.17 175.25 1xgi s TRP 276 N -1.29 3.26 -0.89 4.23 -0.11 0.23 -4.62 118.94 119.75 1xgi s TRP 276 Ca 0.57 0.23 -0.24 0.00 1.22 0.00 0.00 56.10 57.87 1xgi s TRP 276 Cb -0.37 -1.86 -0.01 0.00 -1.50 0.00 0.00 33.47 29.74 1xgi s TRP 276 CO 0.47 0.47 1.75 -1.25 -4.62 0.00 0.00 176.95 173.77 1xgi s PRO 277 N -0.73 2.91 0.00 5.86 0.04 -1.26 -4.77 135.00 137.05 1xgi s PRO 277 Ca 0.12 -0.42 0.00 0.00 0.04 0.00 0.00 61.00 60.74 1xgi s PRO 277 Cb -0.12 -5.01 0.00 0.00 0.04 0.00 0.00 34.50 29.42 1xgi s PRO 277 CO 0.02 -2.88 0.00 0.00 0.04 0.00 0.00 177.00 174.19 1xgi n ALA 294 N 12.05 -0.17 -2.66 8.56 0.00 -1.26 -5.09 120.51 131.93 1xgi n ALA 294 Ca 0.33 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.36 1xgi n ALA 294 Cb 0.49 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.90 1xgi n ALA 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xgi s ALA 295 N 0.00 3.57 -0.08 0.00 0.00 -1.26 -4.62 121.76 119.37 1xgi s ALA 295 Ca 0.00 0.01 0.03 0.00 0.00 0.00 0.00 51.96 52.00 1xgi s ALA 295 Cb 0.00 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.85 1xgi s ALA 295 CO 0.00 -0.76 -0.17 1.03 0.00 0.00 0.00 175.76 175.86 1xgi s ARG 296 N 2.44 2.21 0.32 0.00 1.81 -0.78 -4.96 118.95 119.98 1xgi s ARG 296 Ca 0.38 -0.59 -0.29 0.00 -1.72 0.00 0.00 55.73 53.51 1xgi s ARG 296 Cb -0.16 -1.74 -0.10 0.00 -0.45 0.00 0.00 34.95 32.50 1xgi s ARG 296 CO 0.10 0.08 1.33 -2.14 -0.68 0.00 0.00 175.30 174.00 1xgi s PRO 297 N 0.54 4.33 0.13 3.54 0.02 -1.26 0.01 135.00 142.31 1xgi s PRO 297 Ca -0.16 2.25 0.10 0.00 0.02 0.00 0.00 61.00 63.21 1xgi s PRO 297 Cb -0.17 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.25 1xgi s PRO 297 CO 0.06 -0.24 -0.24 0.14 -0.33 0.00 0.00 177.00 176.39 1xgi s VAL 298 N -1.00 2.04 -0.17 3.83 -7.23 -0.75 -4.71 120.40 112.41 1xgi s VAL 298 Ca 0.50 -1.71 -0.08 0.00 -1.81 0.00 0.00 61.98 58.88 1xgi s VAL 298 Cb -0.40 -1.84 -0.04 0.00 0.56 0.00 0.00 36.38 34.65 1xgi s VAL 298 CO 0.53 -0.01 0.09 -0.75 -0.31 0.00 0.00 175.10 174.65 1xgi s LYS 299 N -2.10 3.88 0.22 4.82 2.20 -0.39 -4.80 119.74 123.56 1xgi s LYS 299 Ca 0.12 -0.27 -0.30 0.00 -0.36 0.00 0.00 55.97 55.16 1xgi s LYS 299 Cb -0.10 -3.24 -0.09 0.00 -1.51 0.00 0.00 37.83 32.90 1xgi s LYS 299 CO 0.06 0.41 0.99 0.00 -0.36 0.00 0.00 175.35 176.44 1xgi s ALA 300 N 0.02 3.34 -0.45 3.13 0.00 -1.26 -1.27 121.76 125.27 1xgi s ALA 300 Ca 0.08 0.68 -0.16 0.00 0.00 0.00 0.00 51.96 52.56 1xgi s ALA 300 Cb -0.12 -3.26 0.05 0.00 0.00 0.00 0.00 23.12 19.79 1xgi s ALA 300 CO 0.00 0.07 0.40 0.42 0.00 0.00 0.00 175.76 176.65 1xgi s ILE 301 N -0.91 5.18 -0.29 0.00 1.01 -0.84 -4.91 121.20 120.44 1xgi s ILE 301 Ca 0.43 -0.77 0.00 0.00 0.00 0.00 0.00 60.65 60.32 1xgi s ILE 301 Cb -0.27 -4.07 0.06 0.00 0.01 0.00 0.00 42.46 38.18 1xgi s ILE 301 CO 0.34 -0.50 -0.04 -0.89 0.00 0.00 0.00 174.94 173.84 1xgi s THR 302 N 1.84 2.65 0.70 2.92 2.01 -1.26 -2.03 115.64 122.47 1xgi s THR 302 Ca 0.07 -1.52 -0.07 0.00 0.31 0.00 0.00 61.69 60.48 1xgi s THR 302 Cb -0.21 -2.55 0.06 0.00 0.01 0.00 0.00 72.50 69.81 1xgi s THR 302 CO 0.09 -0.10 1.02 -2.16 -0.69 0.00 0.00 174.62 172.78 1xgi s PRO 303 N 1.18 2.27 0.46 4.92 0.04 -1.26 -5.09 135.00 137.52 1xgi s PRO 303 Ca -0.06 -0.19 -0.23 0.00 0.04 0.00 0.00 61.00 60.56 1xgi s PRO 303 Cb -0.20 -2.16 -0.09 0.00 0.04 0.00 0.00 34.50 32.09 1xgi s PRO 303 CO -0.03 -1.20 1.09 -2.30 0.04 0.00 0.00 177.00 174.60 1xgi n PRO 304 N -2.92 1.45 -2.94 0.56 -0.02 -0.86 -4.94 135.00 125.34 1xgi n PRO 304 Ca 0.08 0.52 -0.41 0.00 -2.02 0.00 0.00 63.50 61.67 1xgi n PRO 304 Cb 0.60 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.85 1xgi n PRO 304 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1xgi s THR 305 N -1.30 4.93 0.58 3.45 2.01 -0.82 -4.84 115.64 119.65 1xgi s THR 305 Ca 0.65 1.57 -0.20 0.00 0.31 0.00 0.00 61.69 64.02 1xgi s THR 305 Cb -0.51 -4.11 -0.04 0.00 0.01 0.00 0.00 72.50 67.86 1xgi s THR 305 CO 0.55 0.09 1.34 -2.65 -0.69 0.00 0.00 174.62 173.25 1xgi n PRO 306 N 4.84 1.49 -0.94 4.92 -0.02 -1.26 -0.20 135.00 143.82 1xgi n PRO 306 Ca 0.03 0.56 -0.37 0.00 -2.02 0.00 0.00 63.50 61.70 1xgi n PRO 306 Cb 0.49 -2.56 -0.05 0.00 -0.02 0.00 0.00 33.50 31.36 1xgi n PRO 306 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xgi n ALA 307 N -1.35 -1.44 -2.61 3.55 0.00 -1.25 -4.75 120.51 112.66 1xgi n ALA 307 Ca 0.12 0.31 -0.38 0.00 0.00 0.00 0.00 53.44 53.50 1xgi n ALA 307 Cb 0.46 -1.06 -0.10 0.00 0.00 0.00 0.00 19.45 18.74 1xgi n ALA 307 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xgi s VAL 308 N 0.99 5.28 0.31 0.00 1.01 -1.26 -4.99 120.40 121.74 1xgi s VAL 308 Ca 0.57 0.30 -0.00 0.00 0.00 0.00 0.00 61.98 62.85 1xgi s VAL 308 Cb -0.81 -3.58 0.27 0.00 0.00 0.00 0.00 36.38 32.27 1xgi s VAL 308 CO 0.41 0.25 1.94 0.03 0.00 0.00 0.00 175.10 177.73 1xgi h ARG 309 N 8.09 1.01 -2.96 2.72 3.08 -1.97 -3.14 114.38 121.21 1xgi h ARG 309 Ca -0.35 -0.06 -0.66 0.00 0.07 0.00 0.00 59.98 58.98 1xgi h ARG 309 Cb 1.18 -0.23 0.02 0.00 0.08 0.00 0.00 29.97 31.02 1xgi h ARG 309 CO 0.60 0.67 3.72 0.00 -1.07 0.00 0.00 179.97 183.89 1xgi n ALA 310 N -2.41 7.54 -2.31 0.04 0.00 -1.26 -1.15 120.51 120.96 1xgi n ALA 310 Ca 0.11 -3.50 -0.14 0.00 0.00 0.00 0.00 53.44 49.92 1xgi n ALA 310 Cb 0.12 -3.34 -0.10 0.00 0.00 0.00 0.00 19.45 16.14 1xgi n ALA 310 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1xgi s SER 311 N 2.12 1.59 -0.43 0.00 0.01 -1.19 -0.60 113.70 115.20 1xgi s SER 311 Ca 0.70 -0.95 -0.09 0.00 1.31 0.00 0.00 55.95 56.92 1xgi s SER 311 Cb 0.18 0.01 0.08 0.00 0.21 0.00 0.00 66.02 66.51 1xgi s SER 311 CO -0.06 -0.33 0.28 0.86 0.41 0.00 0.00 173.24 174.40 1xgi s TRP 312 N -3.08 3.35 -0.20 2.43 -0.11 0.09 -4.07 118.94 117.34 1xgi s TRP 312 Ca 0.12 -1.56 -0.10 0.00 1.22 0.00 0.00 56.10 55.78 1xgi s TRP 312 Cb 0.01 -3.06 -0.05 0.00 -1.50 0.00 0.00 33.47 28.88 1xgi s TRP 312 CO -0.00 -0.87 0.14 0.08 -4.62 0.00 0.00 176.95 171.67 1xgi s VAL 313 N 1.42 5.40 0.30 5.86 1.01 -0.28 -2.01 120.40 132.11 1xgi s VAL 313 Ca 0.04 0.20 -0.15 0.00 0.00 0.00 0.00 61.98 62.07 1xgi s VAL 313 Cb -0.24 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.68 1xgi s VAL 313 CO 0.02 0.43 0.62 -1.38 0.00 0.00 0.00 175.10 174.79 1xgi s HIS 314 N 0.40 0.23 -0.28 5.22 -3.43 -0.48 -0.30 115.29 116.66 1xgi s HIS 314 Ca 0.08 -0.67 -0.17 0.00 -0.80 0.00 0.00 55.06 53.50 1xgi s HIS 314 Cb -0.11 0.45 0.10 0.00 -1.43 0.00 0.00 32.58 31.58 1xgi s HIS 314 CO -0.01 -1.21 0.79 0.21 -2.00 0.00 0.00 174.74 172.52 1xgi s LYS 315 N -3.52 0.62 0.12 -0.38 2.47 -0.40 -2.31 119.74 116.35 1xgi s LYS 315 Ca 0.19 1.01 0.03 0.00 -1.56 0.00 0.00 55.97 55.63 1xgi s LYS 315 Cb -0.03 0.15 -0.04 0.00 -1.46 0.00 0.00 37.83 36.45 1xgi s LYS 315 CO 0.10 -0.12 0.20 0.95 0.16 0.00 0.00 175.35 176.64 1xgi s THR 316 N 1.36 5.00 0.06 3.43 -4.23 -1.26 -1.69 115.64 118.31 1xgi s THR 316 Ca -0.08 -0.74 -0.15 0.00 -1.18 0.00 0.00 61.69 59.54 1xgi s THR 316 Cb -0.05 -3.52 0.03 0.00 1.34 0.00 0.00 72.50 70.30 1xgi s THR 316 CO -0.16 -0.01 0.34 -0.83 -0.54 0.00 0.00 174.62 173.42 1xgi s GLY 317 N -2.92 -0.17 0.17 3.99 0.00 -0.22 -3.93 107.32 104.24 1xgi s GLY 317 Ca 0.33 0.04 -0.23 0.00 0.00 0.00 0.00 44.72 44.86 1xgi s GLY 317 CO 0.26 -0.19 0.65 0.00 0.00 0.00 0.00 173.10 173.82 1xgi s ALA 318 N -2.79 -1.54 0.32 3.20 0.00 -1.26 -0.31 121.76 119.38 1xgi s ALA 318 Ca -0.03 0.35 0.03 0.00 0.00 0.00 0.00 51.96 52.31 1xgi s ALA 318 Cb -0.00 0.84 -0.02 0.00 0.00 0.00 0.00 23.12 23.94 1xgi s ALA 318 CO -0.05 -0.83 0.33 0.95 0.00 0.00 0.00 175.76 176.17 1xgi s THR 319 N -3.73 0.00 0.40 0.00 -4.23 -0.86 -3.78 115.64 103.44 1xgi s THR 319 Ca 0.04 -1.86 0.15 0.00 -1.18 0.00 0.00 61.69 58.84 1xgi s THR 319 Cb -0.02 -2.54 0.36 0.00 1.34 0.00 0.00 72.50 71.64 1xgi s THR 319 CO -0.08 0.00 1.86 1.23 -0.54 0.00 0.00 174.62 177.09 1xgi h GLY 320 N 2.18 0.97 -0.45 3.99 0.00 -1.97 -3.00 103.07 104.79 1xgi h GLY 320 Ca -0.27 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1xgi h GLY 320 CO 0.39 0.02 0.00 0.61 0.00 0.00 0.00 176.54 177.55 1xgi n GLY 321 N -1.49 0.56 3.24 4.60 0.00 -1.26 -4.54 105.19 106.30 1xgi n GLY 321 Ca 0.19 -0.15 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 1xgi n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xgi s PHE 322 N -0.64 1.27 -0.04 1.61 0.40 -1.14 -1.44 117.98 117.99 1xgi s PHE 322 Ca 0.07 -0.70 -0.02 0.00 -0.60 0.00 0.00 56.93 55.68 1xgi s PHE 322 Cb 0.04 -0.65 0.03 0.00 0.51 0.00 0.00 43.02 42.96 1xgi s PHE 322 CO 0.06 0.09 0.09 0.20 0.70 0.00 0.00 175.22 176.36 1xgi s GLY 323 N -2.95 0.06 0.14 4.36 0.00 -0.70 -2.04 107.32 106.19 1xgi s GLY 323 Ca 0.14 0.46 0.01 0.00 0.00 0.00 0.00 44.72 45.33 1xgi s GLY 323 CO 0.01 0.97 -0.01 -1.35 0.00 0.00 0.00 173.10 172.73 1xgi s SER 324 N 1.34 0.98 -0.24 1.64 1.04 0.58 -1.39 113.70 117.65 1xgi s SER 324 Ca -0.06 -1.13 -0.22 0.00 0.48 0.00 0.00 55.95 55.02 1xgi s SER 324 Cb -0.12 0.15 0.06 0.00 0.10 0.00 0.00 66.02 66.21 1xgi s SER 324 CO -0.04 -0.57 0.64 -0.47 0.98 0.00 0.00 173.24 173.77 1xgi s TYR 325 N -3.74 -0.70 -0.01 5.02 5.04 -0.43 -1.06 117.35 121.46 1xgi s TYR 325 Ca 0.20 1.71 0.01 0.00 -2.44 0.00 0.00 57.07 56.54 1xgi s TYR 325 Cb 0.06 0.24 0.01 0.00 0.35 0.00 0.00 41.96 42.62 1xgi s TYR 325 CO 0.00 -0.34 -0.03 0.08 -1.34 0.00 0.00 175.55 173.93 1xgi s VAL 326 N 0.33 0.28 -0.18 3.14 1.01 -0.68 -0.59 120.40 123.71 1xgi s VAL 326 Ca -0.00 -0.08 -0.17 0.00 0.00 0.00 0.00 61.98 61.73 1xgi s VAL 326 Cb -0.04 -0.28 0.05 0.00 0.00 0.00 0.00 36.38 36.10 1xgi s VAL 326 CO 0.01 0.11 0.48 0.00 0.00 0.00 0.00 175.10 175.70 1xgi s ALA 327 N 0.32 -1.19 0.09 5.51 0.00 -0.76 -1.27 121.76 124.46 1xgi s ALA 327 Ca -0.03 1.37 -0.16 0.00 0.00 0.00 0.00 51.96 53.13 1xgi s ALA 327 Cb -0.06 -0.79 0.03 0.00 0.00 0.00 0.00 23.12 22.30 1xgi s ALA 327 CO -0.01 -0.23 0.38 -0.59 0.00 0.00 0.00 175.76 175.32 1xgi s PHE 328 N 0.27 -0.19 -0.32 0.00 -0.12 0.59 -0.29 117.98 117.92 1xgi s PHE 328 Ca -0.00 -0.03 0.01 0.00 -0.05 0.00 0.00 56.93 56.86 1xgi s PHE 328 Cb -0.03 0.21 0.10 0.00 -0.63 0.00 0.00 43.02 42.66 1xgi s PHE 328 CO 0.00 -0.63 0.06 0.42 -0.05 0.00 0.00 175.22 175.02 1xgi s ILE 329 N -3.29 1.54 0.17 -4.49 1.01 0.11 -1.12 121.20 115.13 1xgi s ILE 329 Ca -0.00 -1.79 -0.23 0.00 0.00 0.00 0.00 60.65 58.63 1xgi s ILE 329 Cb 0.01 -2.12 0.07 0.00 0.01 0.00 0.00 42.46 40.43 1xgi s ILE 329 CO -0.08 -0.59 1.59 -0.65 0.00 0.00 0.00 174.94 175.21 1xgi h PRO 330 N 7.87 -0.23 0.00 2.79 0.11 -1.70 -1.54 132.00 139.30 1xgi h PRO 330 Ca -0.10 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1xgi h PRO 330 Cb 1.02 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1xgi h PRO 330 CO 0.49 -0.15 0.00 -0.85 -0.21 0.00 0.00 178.00 177.27 1xgi n GLU 331 N -5.42 0.01 0.00 1.05 0.28 -0.30 -1.51 120.64 114.75 1xgi n GLU 331 Ca 0.02 0.40 0.04 0.00 -0.16 0.00 0.00 57.16 57.45 1xgi n GLU 331 Cb 0.34 -1.50 -0.01 0.00 1.43 0.00 0.00 31.44 31.70 1xgi n GLU 331 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1xgi n LYS 332 N -1.43 2.87 -3.43 3.44 4.76 -0.63 -4.98 118.16 118.76 1xgi n LYS 332 Ca 0.01 -0.39 -0.25 0.00 -2.87 0.00 0.00 58.31 54.81 1xgi n LYS 332 Cb 0.02 -0.96 0.04 0.00 -1.84 0.00 0.00 35.03 32.29 1xgi n LYS 332 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1xgi n GLU 333 N -0.53 -5.58 -5.25 1.97 1.02 -0.57 -4.51 120.64 107.19 1xgi n GLU 333 Ca 0.03 0.75 -0.30 0.00 -0.02 0.00 0.00 57.16 57.61 1xgi n GLU 333 Cb 0.15 -5.64 -0.16 0.00 -0.02 0.00 0.00 31.44 25.76 1xgi n GLU 333 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1xgi s LEU 334 N -6.96 2.05 0.20 -4.62 2.96 -1.15 -2.01 118.68 109.16 1xgi s LEU 334 Ca 0.48 -0.46 -0.23 0.00 -0.22 0.00 0.00 54.13 53.70 1xgi s LEU 334 Cb -0.23 -1.30 0.05 0.00 0.50 0.00 0.00 46.19 45.22 1xgi s LEU 334 CO 0.59 0.29 0.71 -0.83 -1.32 0.00 0.00 176.35 175.79 1xgi s GLY 335 N -0.48 -0.34 -0.01 7.98 0.00 -0.54 0.05 107.32 113.99 1xgi s GLY 335 Ca 0.06 0.14 -0.12 0.00 0.00 0.00 0.00 44.72 44.80 1xgi s GLY 335 CO 0.00 0.05 0.25 -1.50 0.00 0.00 0.00 173.10 171.90 1xgi s ILE 336 N -3.74 0.07 -0.03 0.90 2.07 0.60 -0.31 121.20 120.76 1xgi s ILE 336 Ca 0.07 -0.54 0.01 0.00 -1.41 0.00 0.00 60.65 58.78 1xgi s ILE 336 Cb -0.03 -0.55 0.02 0.00 0.13 0.00 0.00 42.46 42.02 1xgi s ILE 336 CO -0.03 -0.30 -0.04 -0.69 -1.91 0.00 0.00 174.94 171.98 1xgi s VAL 337 N -1.33 0.41 -0.10 4.00 1.01 -0.34 -1.83 120.40 122.22 1xgi s VAL 337 Ca -0.14 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.74 1xgi s VAL 337 Cb -0.06 -0.43 0.02 0.00 0.00 0.00 0.00 36.38 35.92 1xgi s VAL 337 CO 0.03 0.17 -0.09 -0.04 0.00 0.00 0.00 175.10 175.18 1xgi s MET 338 N 0.60 1.55 -0.09 2.72 -1.94 0.24 -1.43 119.30 120.96 1xgi s MET 338 Ca -0.07 -0.29 0.02 0.00 -1.71 0.00 0.00 55.69 53.65 1xgi s MET 338 Cb -0.10 -1.53 0.01 0.00 2.01 0.00 0.00 34.83 35.22 1xgi s MET 338 CO -0.00 -0.20 -0.16 -0.51 -0.01 0.00 0.00 175.02 174.14 1xgi s LEU 339 N 1.45 1.76 0.04 -0.03 1.43 0.10 -1.32 118.68 122.12 1xgi s LEU 339 Ca 0.00 -0.40 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 1xgi s LEU 339 Cb -0.13 -1.05 -0.02 0.00 0.03 0.00 0.00 46.19 45.01 1xgi s LEU 339 CO -0.05 0.05 -0.08 0.00 0.23 0.00 0.00 176.35 176.50 1xgi s ALA 340 N 0.74 0.59 -0.75 4.21 0.00 -0.49 -0.72 121.76 125.34 1xgi s ALA 340 Ca -0.12 -0.76 -0.02 0.00 0.00 0.00 0.00 51.96 51.06 1xgi s ALA 340 Cb -0.16 0.03 0.36 0.00 0.00 0.00 0.00 23.12 23.35 1xgi s ALA 340 CO 0.03 -0.01 2.08 0.27 0.00 0.00 0.00 175.76 178.13 1xgi n ASN 341 N 1.49 7.49 -3.67 0.00 6.94 -0.99 -1.72 115.26 124.80 1xgi n ASN 341 Ca -0.22 -3.76 -0.10 0.00 -0.02 0.00 0.00 54.58 50.48 1xgi n ASN 341 Cb 0.55 -1.05 -0.09 0.00 -2.36 0.00 0.00 39.78 36.83 1xgi n ASN 341 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1xgi s LYS 342 N -3.78 0.61 -0.52 -3.83 2.20 -0.52 -1.66 119.74 112.22 1xgi s LYS 342 Ca 0.56 0.98 -0.26 0.00 -0.36 0.00 0.00 55.97 56.89 1xgi s LYS 342 Cb 0.45 0.14 0.03 0.00 -1.51 0.00 0.00 37.83 36.95 1xgi s LYS 342 CO -0.27 -0.13 1.01 1.21 -0.36 0.00 0.00 175.35 176.81 1xgi s ASN 343 N 1.20 6.44 0.28 1.43 2.47 -1.25 -2.85 114.94 122.66 1xgi s ASN 343 Ca -0.07 -0.02 0.11 0.00 0.42 0.00 0.00 52.86 53.30 1xgi s ASN 343 Cb -0.06 -2.48 -0.05 0.00 -1.45 0.00 0.00 41.25 37.22 1xgi s ASN 343 CO -0.12 -1.23 -0.13 -0.72 -3.72 0.00 0.00 177.10 171.18 1xgi s TYR 344 N 4.16 2.41 -0.14 0.43 1.13 -1.26 -4.96 117.35 119.12 1xgi s TYR 344 Ca 0.37 -0.31 -0.41 0.00 -1.41 0.00 0.00 57.07 55.31 1xgi s TYR 344 Cb -0.10 -1.08 -0.19 0.00 -1.10 0.00 0.00 41.96 39.49 1xgi s TYR 344 CO 0.24 0.68 1.36 -2.30 -2.51 0.00 0.00 175.55 173.01 1xgi n PRO 345 N -0.72 0.43 -0.35 -3.49 -0.02 -1.26 -4.90 135.00 124.70 1xgi n PRO 345 Ca -0.05 0.16 0.08 0.00 -2.02 0.00 0.00 63.50 61.67 1xgi n PRO 345 Cb 0.60 -1.72 0.25 0.00 -0.02 0.00 0.00 33.50 32.61 1xgi n PRO 345 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1xgi h ASN 346 N 4.44 0.83 -0.54 2.55 2.35 -2.00 -1.85 115.58 121.37 1xgi h ASN 346 Ca -0.48 0.07 0.04 0.00 -0.55 0.00 0.00 56.30 55.37 1xgi h ASN 346 Cb 1.38 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 39.63 1xgi h ASN 346 CO 0.80 0.40 0.36 -0.65 -1.65 0.00 0.00 177.43 176.69 1xgi h PRO 347 N 0.88 0.57 -0.35 0.81 0.11 -1.99 -0.85 132.00 131.18 1xgi h PRO 347 Ca 0.51 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.47 1xgi h PRO 347 Cb 0.60 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 1xgi h PRO 347 CO -0.30 0.38 -0.26 0.00 -0.21 0.00 0.00 178.00 177.61 1xgi h ALA 348 N 1.69 0.90 0.49 -0.75 0.00 -1.71 -0.21 119.26 119.67 1xgi h ALA 348 Ca 0.22 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1xgi h ALA 348 Cb 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1xgi h ALA 348 CO -0.06 0.62 -0.23 0.00 0.00 0.00 0.00 179.25 179.58 1xgi h ARG 349 N 0.61 -0.63 -0.68 0.00 3.08 -1.10 -2.45 114.38 113.21 1xgi h ARG 349 Ca 0.08 0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.21 1xgi h ARG 349 Cb 0.75 0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.91 1xgi h ARG 349 CO 0.06 -0.33 0.45 0.28 -1.07 0.00 0.00 179.97 179.36 1xgi h VAL 350 N -0.91 1.09 -0.05 2.04 2.07 -1.22 -0.87 116.25 118.41 1xgi h VAL 350 Ca -0.07 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 1xgi h VAL 350 Cb 0.59 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1xgi h VAL 350 CO 0.11 0.15 0.03 -0.78 0.02 0.00 0.00 177.57 177.09 1xgi h ASP 351 N 0.81 0.06 -0.30 0.57 1.82 -0.97 -0.14 116.42 118.26 1xgi h ASP 351 Ca 0.27 -0.07 -0.02 0.00 -0.39 0.00 0.00 57.03 56.82 1xgi h ASP 351 Cb 0.08 -0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.06 1xgi h ASP 351 CO -0.08 0.12 0.10 0.00 -1.61 0.00 0.00 179.24 177.77 1xgi h ALA 352 N 0.95 0.40 -0.63 -0.78 0.00 -0.94 -1.31 119.26 116.94 1xgi h ALA 352 Ca 0.02 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.82 1xgi h ALA 352 Cb 0.07 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1xgi h ALA 352 CO -0.00 0.03 0.36 0.00 0.00 0.00 0.00 179.25 179.64 1xgi h ALA 353 N 0.93 0.83 -0.68 0.00 0.00 -1.09 -1.16 119.26 118.10 1xgi h ALA 353 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1xgi h ALA 353 Cb 0.24 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1xgi h ALA 353 CO -0.00 0.06 0.13 2.35 0.00 0.00 0.00 179.25 181.79 1xgi h TRP 354 N 0.69 1.18 -0.33 0.00 2.91 -0.73 -0.58 115.95 119.09 1xgi h TRP 354 Ca 0.27 -0.16 -0.00 0.00 1.13 0.00 0.00 58.89 60.13 1xgi h TRP 354 Cb 0.12 -0.33 -0.02 0.00 -0.51 0.00 0.00 29.16 28.42 1xgi h TRP 354 CO -0.07 0.98 0.19 1.96 -1.03 0.00 0.00 178.44 180.47 1xgi h GLN 355 N 1.04 0.45 0.34 2.65 1.08 -0.70 0.98 115.11 120.95 1xgi h GLN 355 Ca 0.21 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.35 1xgi h GLN 355 Cb 0.42 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.76 1xgi h GLN 355 CO 0.01 0.36 -0.16 0.82 -0.95 0.00 0.00 178.83 178.91 1xgi h ILE 356 N 0.42 0.68 -0.41 2.54 2.04 -1.05 -2.60 117.51 119.12 1xgi h ILE 356 Ca 0.12 -0.41 -0.12 0.00 1.00 0.00 0.00 64.86 65.44 1xgi h ILE 356 Cb 0.03 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 1xgi h ILE 356 CO -0.02 0.08 -0.24 -0.07 0.00 0.00 0.00 178.15 177.90 1xgi h LEU 357 N -0.68 0.86 -0.74 1.44 3.38 -1.10 -2.54 115.31 115.91 1xgi h LEU 357 Ca -0.05 -0.33 0.06 0.00 0.09 0.00 0.00 57.88 57.66 1xgi h LEU 357 Cb 0.48 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 1xgi h LEU 357 CO 0.08 1.06 0.44 -1.13 0.09 0.00 0.00 178.44 178.98 1xgi h ASN 358 N 0.72 0.67 -0.58 -0.43 -0.00 -0.84 0.98 115.58 116.09 1xgi h ASN 358 Ca 0.09 0.02 -0.00 0.00 -0.00 0.00 0.00 56.30 56.41 1xgi h ASN 358 Cb 0.78 -0.11 -0.03 0.00 -0.00 0.00 0.00 38.32 38.96 1xgi h ASN 358 CO 0.06 0.43 0.35 0.00 -0.00 0.00 0.00 177.43 178.28 1xgi h ALA 359 N 1.37 0.74 0.00 1.57 0.00 -1.27 -2.55 119.26 119.12 1xgi h ALA 359 Ca 0.33 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1xgi h ALA 359 Cb 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1xgi h ALA 359 CO -0.18 0.22 -0.30 -0.07 0.00 0.00 0.00 179.25 178.93 1xgi h LEU 360 N 0.79 0.00 0.00 0.00 3.38 -0.99 -3.52 115.31 114.96 1xgi h LEU 360 Ca 0.21 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1xgi h LEU 360 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1xgi h LEU 360 CO -0.04 0.04 0.00 1.67 0.09 0.00 0.00 178.44 180.20