#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pbf s LYS 2 N 0.00 1.59 0.30 3.17 2.20 -1.26 -0.96 119.74 124.78 1pbf s LYS 2 Ca 0.00 -1.67 -0.19 0.00 -0.36 0.00 0.00 55.97 53.76 1pbf s LYS 2 Cb 0.00 -1.73 0.06 0.00 -1.51 0.00 0.00 37.83 34.65 1pbf s LYS 2 CO 0.00 0.34 0.87 -0.08 -0.36 0.00 0.00 175.35 176.12 1pbf s THR 3 N -2.25 0.00 -0.22 3.43 -1.32 0.32 -4.90 115.64 110.69 1pbf s THR 3 Ca 0.26 -0.85 -0.18 0.00 -1.21 0.00 0.00 61.69 59.71 1pbf s THR 3 Cb -0.06 -2.76 -0.15 0.00 -1.51 0.00 0.00 72.50 68.02 1pbf s THR 3 CO 0.12 0.00 -0.02 0.00 -2.21 0.00 0.00 174.62 172.51 1pbf n GLN 4 N -0.57 0.56 -3.96 7.08 6.02 -1.14 -3.86 117.38 121.51 1pbf n GLN 4 Ca -0.06 0.46 -0.30 0.00 -0.01 0.00 0.00 57.00 57.09 1pbf n GLN 4 Cb 0.60 -1.65 -0.16 0.00 1.02 0.00 0.00 30.24 30.05 1pbf n GLN 4 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1pbf s VAL 5 N -2.42 1.49 -0.09 5.09 1.01 -1.04 -0.57 120.40 123.87 1pbf s VAL 5 Ca -0.31 -0.97 -0.22 0.00 0.00 0.00 0.00 61.98 60.48 1pbf s VAL 5 Cb 0.08 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1pbf s VAL 5 CO 0.52 0.10 0.67 0.00 0.00 0.00 0.00 175.10 176.39 1pbf s ALA 6 N 1.45 3.38 -0.22 5.51 0.00 -0.27 -1.96 121.76 129.65 1pbf s ALA 6 Ca -0.02 0.06 -0.03 0.00 0.00 0.00 0.00 51.96 51.96 1pbf s ALA 6 Cb -0.17 -2.92 -0.00 0.00 0.00 0.00 0.00 23.12 20.03 1pbf s ALA 6 CO -0.08 -0.13 -0.05 0.42 0.00 0.00 0.00 175.76 175.92 1pbf s ILE 7 N 0.89 3.27 -0.26 0.00 1.01 0.11 -0.59 121.20 125.62 1pbf s ILE 7 Ca 0.35 -0.57 -0.16 0.00 0.00 0.00 0.00 60.65 60.27 1pbf s ILE 7 Cb -0.17 -2.51 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 1pbf s ILE 7 CO 0.16 0.40 0.42 -0.63 0.00 0.00 0.00 174.94 175.29 1pbf s ILE 8 N 1.46 5.14 0.00 2.92 -1.09 -0.68 -0.30 121.20 128.66 1pbf s ILE 8 Ca 0.05 0.68 0.00 0.00 -2.23 0.00 0.00 60.65 59.15 1pbf s ILE 8 Cb -0.14 -3.74 0.00 0.00 -1.58 0.00 0.00 42.46 36.99 1pbf s ILE 8 CO -0.04 0.14 0.00 0.61 -1.23 0.00 0.00 174.94 174.42 1pbf n GLY 9 N 4.57 2.13 1.17 6.18 0.00 0.13 -1.39 105.19 117.97 1pbf n GLY 9 Ca -0.07 -1.49 -0.05 0.00 0.00 0.00 0.00 46.02 44.41 1pbf n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pbf n ALA 10 N 2.17 4.35 -1.40 4.61 0.00 -1.26 -4.28 120.51 124.70 1pbf n ALA 10 Ca 0.00 -3.17 -0.14 0.00 0.00 0.00 0.00 53.44 50.13 1pbf n ALA 10 Cb 0.00 -0.73 0.15 0.00 0.00 0.00 0.00 19.45 18.87 1pbf n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pbf n GLY 11 N -1.13 -1.84 0.35 0.00 0.00 -1.26 -4.58 105.19 96.72 1pbf n GLY 11 Ca 0.33 -1.62 0.17 0.00 0.00 0.00 0.00 46.02 44.90 1pbf n GLY 11 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pbf h PRO 12 N 0.00 0.00 0.88 1.61 0.13 -1.94 -1.87 132.00 130.81 1pbf h PRO 12 Ca -0.28 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.81 1pbf h PRO 12 Cb 0.80 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.94 1pbf h PRO 12 CO 0.19 0.00 -0.42 0.77 -0.23 0.00 0.00 178.00 178.31 1pbf h SER 13 N 0.00 -1.00 -0.35 1.44 0.02 -1.90 -1.19 113.55 110.56 1pbf h SER 13 Ca 0.16 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.18 1pbf h SER 13 Cb 0.68 0.26 -0.04 0.00 0.14 0.00 0.00 62.40 63.45 1pbf h SER 13 CO -0.00 -0.67 0.14 1.23 -1.14 0.00 0.00 176.83 176.38 1pbf h GLY 14 N -1.27 0.45 1.00 -3.77 0.00 -1.62 -0.76 103.07 97.10 1pbf h GLY 14 Ca -0.12 -0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 1pbf h GLY 14 CO 0.20 0.05 0.34 1.41 0.00 0.00 0.00 176.54 178.54 1pbf h LEU 15 N 0.30 0.85 -0.32 3.11 3.38 -1.42 0.24 115.31 121.44 1pbf h LEU 15 Ca 0.15 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1pbf h LEU 15 Cb 0.11 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1pbf h LEU 15 CO -0.14 0.72 0.01 0.25 0.09 0.00 0.00 178.44 179.37 1pbf h LEU 16 N 0.91 0.55 -0.22 1.67 5.85 -0.77 0.36 115.31 123.67 1pbf h LEU 16 Ca 0.23 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 1pbf h LEU 16 Cb 0.08 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1pbf h LEU 16 CO -0.03 0.72 0.06 0.25 -0.34 0.00 0.00 178.44 179.09 1pbf h LEU 17 N 0.37 0.33 -1.36 2.25 5.85 -0.96 -0.91 115.31 120.87 1pbf h LEU 17 Ca 0.09 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1pbf h LEU 17 Cb 0.43 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1pbf h LEU 17 CO 0.01 0.47 0.36 1.23 -0.34 0.00 0.00 178.44 180.17 1pbf h GLY 18 N 0.18 0.84 0.87 3.75 0.00 -0.45 -1.18 103.07 107.09 1pbf h GLY 18 Ca 0.07 -0.34 -0.13 0.00 0.00 0.00 0.00 47.33 46.93 1pbf h GLY 18 CO -0.00 0.33 -0.43 -1.61 0.00 0.00 0.00 176.54 174.83 1pbf h GLN 19 N 0.81 0.53 -0.41 4.80 5.75 -0.56 -1.80 115.11 124.22 1pbf h GLN 19 Ca 0.21 -0.39 -0.03 0.00 -0.15 0.00 0.00 58.65 58.29 1pbf h GLN 19 Cb -0.04 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 1pbf h GLN 19 CO -0.04 1.01 0.13 -0.07 -2.65 0.00 0.00 178.83 177.21 1pbf h LEU 20 N 0.15 0.60 -0.36 -2.39 3.38 -0.96 -2.49 115.31 113.24 1pbf h LEU 20 Ca -0.02 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1pbf h LEU 20 Cb 1.06 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1pbf h LEU 20 CO 0.09 0.64 0.07 -0.07 0.09 0.00 0.00 178.44 179.26 1pbf h LEU 21 N 0.52 0.56 -0.43 1.67 3.38 -1.27 -2.79 115.31 116.95 1pbf h LEU 21 Ca 0.13 -0.25 0.06 0.00 0.09 0.00 0.00 57.88 57.91 1pbf h LEU 21 Cb 0.26 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1pbf h LEU 21 CO -0.00 0.66 0.12 -0.74 0.09 0.00 0.00 178.44 178.57 1pbf h HIS 22 N 0.42 0.21 0.00 1.13 2.76 -1.28 -0.18 115.15 118.21 1pbf h HIS 22 Ca 0.11 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.30 1pbf h HIS 22 Cb 0.34 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.27 1pbf h HIS 22 CO 0.02 0.06 0.00 0.87 -1.30 0.00 0.00 177.93 177.58 1pbf h LYS 23 N 0.27 0.00 -0.08 5.26 1.57 -1.31 -1.35 116.57 120.93 1pbf h LYS 23 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1pbf h LYS 23 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1pbf h LYS 23 CO -0.24 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.64 1pbf n ALA 24 N -2.08 2.49 0.00 3.86 0.00 -0.17 -4.94 120.51 119.68 1pbf n ALA 24 Ca -0.02 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.78 1pbf n ALA 24 Cb 0.11 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1pbf n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pbf n GLY 25 N 1.30 2.93 3.64 0.00 0.00 -0.51 -5.03 105.19 107.51 1pbf n GLY 25 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1pbf n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pbf s ILE 26 N -2.60 4.05 0.15 -0.61 1.09 -0.66 -4.95 121.20 117.67 1pbf s ILE 26 Ca 0.00 1.20 -0.30 0.00 -1.10 0.00 0.00 60.65 60.45 1pbf s ILE 26 Cb 0.00 -4.01 -0.07 0.00 -1.06 0.00 0.00 42.46 37.32 1pbf s ILE 26 CO 0.00 -0.36 1.01 -1.81 -0.10 0.00 0.00 174.94 173.68 1pbf s ASP 27 N 2.99 7.43 0.09 3.58 1.01 -1.26 -3.19 116.67 127.32 1pbf s ASP 27 Ca 0.60 1.92 0.03 0.00 0.71 0.00 0.00 52.55 55.81 1pbf s ASP 27 Cb -0.20 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.10 1pbf s ASP 27 CO 0.23 -0.10 -0.09 0.54 0.21 0.00 0.00 175.17 175.97 1pbf s ASN 28 N -0.18 1.25 -0.05 0.27 2.20 -1.26 -2.50 114.94 114.67 1pbf s ASN 28 Ca 0.47 -0.83 0.03 0.00 -0.94 0.00 0.00 52.86 51.60 1pbf s ASN 28 Cb -0.26 0.04 0.00 0.00 -2.00 0.00 0.00 41.25 39.03 1pbf s ASN 28 CO 0.32 -0.32 -0.14 -0.69 -2.94 0.00 0.00 177.10 173.33 1pbf s VAL 29 N -2.63 1.21 -0.12 3.54 1.01 -0.83 -4.38 120.40 118.21 1pbf s VAL 29 Ca 0.05 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 1pbf s VAL 29 Cb -0.02 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 1pbf s VAL 29 CO -0.01 0.36 0.00 -0.63 0.00 0.00 0.00 175.10 174.82 1pbf s ILE 30 N 0.26 4.29 -0.23 2.22 1.01 -1.06 0.07 121.20 127.77 1pbf s ILE 30 Ca -0.07 -0.24 -0.00 0.00 0.00 0.00 0.00 60.65 60.34 1pbf s ILE 30 Cb -0.12 -2.84 0.03 0.00 0.01 0.00 0.00 42.46 39.53 1pbf s ILE 30 CO 0.02 0.56 -0.11 -0.76 0.00 0.00 0.00 174.94 174.65 1pbf s LEU 31 N -0.40 2.87 -0.10 2.97 1.02 0.59 -0.69 118.68 124.94 1pbf s LEU 31 Ca 0.07 -0.83 0.04 0.00 0.02 0.00 0.00 54.13 53.43 1pbf s LEU 31 Cb -0.12 -1.60 0.00 0.00 0.02 0.00 0.00 46.19 44.49 1pbf s LEU 31 CO 0.02 -0.09 -0.22 -0.70 0.02 0.00 0.00 176.35 175.39 1pbf s GLU 32 N 1.30 2.82 0.22 1.70 2.56 -0.78 0.21 118.70 126.72 1pbf s GLU 32 Ca 0.01 -0.80 -0.05 0.00 0.00 0.00 0.00 54.97 54.13 1pbf s GLU 32 Cb -0.16 -2.16 0.19 0.00 2.00 0.00 0.00 34.13 34.00 1pbf s GLU 32 CO -0.07 0.14 1.65 -0.09 -0.56 0.00 0.00 175.26 176.32 1pbf h ARG 33 N 6.80 0.82 0.00 4.30 2.43 -1.85 0.14 114.38 127.01 1pbf h ARG 33 Ca -0.22 -0.31 -0.08 0.00 -0.81 0.00 0.00 59.98 58.57 1pbf h ARG 33 Cb 1.23 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 30.74 1pbf h ARG 33 CO 0.48 0.93 0.02 1.04 -1.51 0.00 0.00 179.97 180.92 1pbf n GLN 34 N -4.13 0.51 -4.03 0.20 1.13 -1.26 -3.71 117.38 106.09 1pbf n GLN 34 Ca 0.01 -0.46 -0.25 0.00 -1.94 0.00 0.00 57.00 54.35 1pbf n GLN 34 Cb 0.41 -0.11 -0.04 0.00 0.11 0.00 0.00 30.24 30.60 1pbf n GLN 34 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1pbf s THR 35 N -0.30 4.86 0.43 5.09 -4.23 -1.26 -1.82 115.64 118.40 1pbf s THR 35 Ca 0.11 -0.96 0.19 0.00 -1.18 0.00 0.00 61.69 59.86 1pbf s THR 35 Cb -0.01 -3.51 0.39 0.00 1.34 0.00 0.00 72.50 70.71 1pbf s THR 35 CO 0.07 -0.14 1.86 -0.65 -0.54 0.00 0.00 174.62 175.22 1pbf h PRO 36 N 2.12 0.35 -0.23 3.99 0.11 -1.99 -0.79 132.00 135.56 1pbf h PRO 36 Ca -0.48 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 1pbf h PRO 36 Cb 1.20 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1pbf h PRO 36 CO 0.65 0.23 -0.07 -0.44 -0.21 0.00 0.00 178.00 178.16 1pbf h ASP 37 N 0.36 0.45 -0.58 -2.05 3.32 -1.96 -1.17 116.42 114.79 1pbf h ASP 37 Ca 0.47 -0.38 0.02 0.00 0.02 0.00 0.00 57.03 57.16 1pbf h ASP 37 Cb 1.24 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 40.63 1pbf h ASP 37 CO -0.16 0.73 0.36 0.22 -1.72 0.00 0.00 179.24 178.66 1pbf h TYR 38 N 0.18 0.67 -0.69 4.55 5.03 -1.57 0.91 116.97 126.05 1pbf h TYR 38 Ca 0.06 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.35 1pbf h TYR 38 Cb 0.54 -0.22 -0.03 0.00 1.55 0.00 0.00 36.73 38.57 1pbf h TYR 38 CO 0.05 0.39 0.30 0.28 -1.32 0.00 0.00 178.16 177.87 1pbf h VAL 39 N 0.71 1.24 0.00 1.81 2.07 -1.27 -1.76 116.25 119.05 1pbf h VAL 39 Ca 0.23 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 67.04 1pbf h VAL 39 Cb -0.00 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1pbf h VAL 39 CO -0.09 0.29 0.00 0.18 0.02 0.00 0.00 177.57 177.97 1pbf n LEU 40 N -4.41 0.00 0.05 2.57 4.32 -0.45 -2.55 117.00 116.52 1pbf n LEU 40 Ca 0.05 0.28 0.13 0.00 -0.02 0.00 0.00 56.01 56.46 1pbf n LEU 40 Cb 0.15 -0.28 0.49 0.00 -1.62 0.00 0.00 43.42 42.15 1pbf n LEU 40 CO 0.39 -0.05 0.88 0.61 -1.22 0.00 0.00 177.39 178.00 1pbf n GLY 41 N 0.79 -1.58 3.66 -0.72 0.00 0.25 -4.81 105.19 102.77 1pbf n GLY 41 Ca 0.12 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1pbf n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pbf s ARG 42 N -3.05 4.24 -0.13 1.61 0.52 -1.06 -4.96 118.95 116.12 1pbf s ARG 42 Ca 0.12 1.09 -0.22 0.00 -0.52 0.00 0.00 55.73 56.20 1pbf s ARG 42 Cb 0.16 -3.62 -0.20 0.00 0.52 0.00 0.00 34.95 31.81 1pbf s ARG 42 CO 0.58 -0.49 0.60 0.82 0.02 0.00 0.00 175.30 176.83 1pbf h ILE 43 N 5.36 1.36 0.00 1.52 1.08 -1.90 -3.38 117.51 121.55 1pbf h ILE 43 Ca -0.24 -2.00 0.00 0.00 -0.39 0.00 0.00 64.86 62.23 1pbf h ILE 43 Cb 1.10 2.56 0.00 0.00 -3.07 0.00 0.00 36.82 37.41 1pbf h ILE 43 CO 0.89 0.46 0.00 0.54 -0.69 0.00 0.00 178.15 179.35 1pbf n ARG 44 N -4.66 0.00 -0.52 2.37 5.12 -1.26 -4.21 116.66 113.50 1pbf n ARG 44 Ca -0.08 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.55 1pbf n ARG 44 Cb 0.36 0.00 0.24 0.00 -1.16 0.00 0.00 32.46 31.90 1pbf n ARG 44 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1pbf n ALA 45 N 5.61 -2.40 -0.36 7.54 0.00 -1.26 -4.84 120.51 124.79 1pbf n ALA 45 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.41 1pbf n ALA 45 Cb 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.40 1pbf n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pbf n GLY 46 N 0.83 0.58 3.61 0.00 0.00 -1.26 -1.10 105.19 107.85 1pbf n GLY 46 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1pbf n GLY 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pbf s VAL 47 N 0.00 4.60 -0.07 1.61 1.01 -1.26 -0.64 120.40 125.65 1pbf s VAL 47 Ca 0.00 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 61.92 1pbf s VAL 47 Cb 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.32 1pbf s VAL 47 CO 0.00 0.48 -0.20 -0.76 0.00 0.00 0.00 175.10 174.62 1pbf s LEU 48 N 0.28 1.94 0.74 3.92 1.43 0.39 -4.80 118.68 122.58 1pbf s LEU 48 Ca 0.02 -0.44 -0.11 0.00 -1.03 0.00 0.00 54.13 52.57 1pbf s LEU 48 Cb -0.13 -1.16 0.03 0.00 0.03 0.00 0.00 46.19 44.97 1pbf s LEU 48 CO 0.01 0.15 1.08 -1.61 0.23 0.00 0.00 176.35 176.20 1pbf s GLU 49 N 0.25 2.56 0.45 1.70 2.02 -1.26 -1.58 118.70 122.83 1pbf s GLU 49 Ca -0.11 1.08 0.12 0.00 0.02 0.00 0.00 54.97 56.08 1pbf s GLU 49 Cb -0.15 -1.94 1.05 0.00 0.10 0.00 0.00 34.13 33.19 1pbf s GLU 49 CO 0.05 -1.41 2.06 0.37 0.02 0.00 0.00 175.26 176.35 1pbf h GLN 50 N -0.94 0.32 -0.70 1.61 -0.00 -1.73 -1.04 115.11 112.64 1pbf h GLN 50 Ca -0.44 -0.02 -0.03 0.00 -0.00 0.00 0.00 58.65 58.17 1pbf h GLN 50 Cb 1.22 -0.07 -0.03 0.00 0.00 0.00 0.00 27.48 28.60 1pbf h GLN 50 CO 0.54 0.21 0.33 0.78 0.00 0.00 0.00 178.83 180.69 1pbf h GLY 51 N 0.33 1.07 1.64 2.39 0.00 -1.91 -1.55 103.07 105.04 1pbf h GLY 51 Ca 0.15 -0.51 -0.23 0.00 0.00 0.00 0.00 47.33 46.73 1pbf h GLY 51 CO -0.03 0.49 -1.02 1.98 0.00 0.00 0.00 176.54 177.95 1pbf h MET 52 N 0.99 0.30 -0.42 4.80 1.85 -1.58 -2.17 114.93 118.71 1pbf h MET 52 Ca 0.24 -0.38 0.02 0.00 -0.61 0.00 0.00 59.70 58.97 1pbf h MET 52 Cb 0.11 0.12 -0.02 0.00 0.43 0.00 0.00 31.60 32.24 1pbf h MET 52 CO -0.03 1.10 0.28 0.28 -0.40 0.00 0.00 176.91 178.14 1pbf h VAL 53 N 0.14 1.07 0.12 -5.77 2.07 -1.00 -1.07 116.25 111.82 1pbf h VAL 53 Ca -0.09 -0.18 -0.27 0.00 0.82 0.00 0.00 66.70 66.98 1pbf h VAL 53 Cb 1.69 0.51 0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1pbf h VAL 53 CO 0.17 0.09 -1.21 0.44 0.02 0.00 0.00 177.57 177.08 1pbf h ASP 54 N 0.52 0.48 -0.31 0.57 3.32 -1.17 -3.06 116.42 116.76 1pbf h ASP 54 Ca 0.16 -0.49 -0.04 0.00 0.02 0.00 0.00 57.03 56.69 1pbf h ASP 54 Cb 0.03 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1pbf h ASP 54 CO -0.04 1.36 0.09 0.25 -1.72 0.00 0.00 179.24 179.18 1pbf h LEU 55 N 0.11 0.53 -0.36 1.55 5.85 -0.65 0.10 115.31 122.44 1pbf h LEU 55 Ca -0.14 -0.08 -0.14 0.00 0.84 0.00 0.00 57.88 58.37 1pbf h LEU 55 Cb 1.92 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.81 1pbf h LEU 55 CO 0.20 0.54 -0.32 -0.07 -0.34 0.00 0.00 178.44 178.46 1pbf h LEU 56 N 0.57 0.91 -1.36 2.25 3.38 -1.29 0.16 115.31 119.93 1pbf h LEU 56 Ca 0.13 -0.46 -0.07 0.00 0.09 0.00 0.00 57.88 57.58 1pbf h LEU 56 Cb 0.23 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1pbf h LEU 56 CO -0.00 1.18 -0.32 -0.09 0.09 0.00 0.00 178.44 179.30 1pbf h ARG 57 N 0.66 0.00 -0.01 1.13 2.43 -1.31 -0.96 114.38 116.32 1pbf h ARG 57 Ca 0.06 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 59.00 1pbf h ARG 57 Cb 0.90 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.46 1pbf h ARG 57 CO 0.08 0.32 -0.96 1.49 -1.51 0.00 0.00 179.97 179.40 1pbf h GLU 58 N 0.00 0.51 0.00 0.20 4.81 -0.61 -2.72 114.58 116.78 1pbf h GLU 58 Ca -0.00 -0.54 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1pbf h GLU 58 Cb 0.57 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1pbf h GLU 58 CO 0.04 1.17 0.00 0.00 -0.73 0.00 0.00 179.01 179.49 1pbf n ALA 59 N -2.57 2.39 -0.95 2.92 0.00 0.53 -4.85 120.51 117.98 1pbf n ALA 59 Ca -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1pbf n ALA 59 Cb 0.84 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.93 1pbf n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pbf n GLY 60 N 0.49 0.37 2.70 0.00 0.00 -0.79 -4.83 105.19 103.12 1pbf n GLY 60 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1pbf n GLY 60 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1pbf n VAL 61 N -2.45 3.72 -0.37 1.61 3.14 -0.43 -4.72 118.33 118.82 1pbf n VAL 61 Ca 0.00 -5.55 0.00 0.00 -2.96 0.00 0.00 64.34 55.83 1pbf n VAL 61 Cb 0.16 -2.09 0.00 0.00 -1.06 0.00 0.00 33.84 30.84 1pbf n VAL 61 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 1pbf n ASP 62 N 1.09 0.18 -0.07 6.55 5.75 -1.26 -4.69 116.55 124.11 1pbf n ASP 62 Ca 0.28 -0.63 -0.07 0.00 -0.01 0.00 0.00 54.79 54.36 1pbf n ASP 62 Cb 0.37 0.15 -0.05 0.00 -1.03 0.00 0.00 41.12 40.56 1pbf n ASP 62 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 1pbf h ARG 63 N 0.00 -0.21 -0.57 0.11 2.43 -1.95 0.12 114.38 114.32 1pbf h ARG 63 Ca 0.00 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.26 1pbf h ARG 63 Cb 0.18 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.72 1pbf h ARG 63 CO 0.00 -0.14 0.22 0.00 -1.51 0.00 0.00 179.97 178.55 1pbf h ARG 64 N -0.21 0.41 -0.37 0.20 3.08 -1.99 -2.45 114.38 113.05 1pbf h ARG 64 Ca 0.04 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.10 1pbf h ARG 64 Cb 0.31 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 1pbf h ARG 64 CO -0.30 0.27 0.15 1.98 -1.07 0.00 0.00 179.97 181.00 1pbf h MET 65 N 0.42 0.31 -0.49 0.04 4.05 -1.68 0.21 114.93 117.80 1pbf h MET 65 Ca 0.28 -0.02 0.10 0.00 -0.28 0.00 0.00 59.70 59.78 1pbf h MET 65 Cb 0.30 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.00 1pbf h MET 65 CO -0.26 0.20 0.33 0.00 0.23 0.00 0.00 176.91 177.42 1pbf h ALA 66 N 1.22 2.18 0.00 0.39 0.00 -0.32 -0.28 119.26 122.44 1pbf h ALA 66 Ca 0.16 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1pbf h ALA 66 Cb 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1pbf h ALA 66 CO -0.15 -0.30 -0.35 -0.09 0.00 0.00 0.00 179.25 178.36 1pbf h ARG 67 N 0.21 0.00 0.00 0.00 2.43 -0.81 -3.42 114.38 112.79 1pbf h ARG 67 Ca 0.23 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.26 1pbf h ARG 67 Cb 0.62 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 1pbf h ARG 67 CO -0.04 0.98 -1.90 -0.25 -1.51 0.00 0.00 179.97 177.25 1pbf n ASP 68 N -4.56 0.25 -4.77 -3.80 8.00 0.60 -4.95 116.55 107.32 1pbf n ASP 68 Ca -0.16 0.11 -0.37 0.00 0.71 0.00 0.00 54.79 55.07 1pbf n ASP 68 Cb 0.53 1.21 0.00 0.00 -0.02 0.00 0.00 41.12 42.84 1pbf n ASP 68 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1pbf s GLY 69 N -4.83 2.80 -0.19 0.44 0.00 -0.13 -4.94 107.32 100.48 1pbf s GLY 69 Ca -0.07 1.02 -0.06 0.00 0.00 0.00 0.00 44.72 45.61 1pbf s GLY 69 CO 0.86 1.48 0.02 1.08 0.00 0.00 0.00 173.10 176.54 1pbf s LEU 70 N -3.18 3.48 -0.10 0.66 1.43 0.59 -4.89 118.68 116.67 1pbf s LEU 70 Ca 0.66 -0.09 -0.24 0.00 -1.03 0.00 0.00 54.13 53.43 1pbf s LEU 70 Cb -0.31 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 1pbf s LEU 70 CO 0.37 0.11 0.75 -0.69 0.23 0.00 0.00 176.35 177.13 1pbf s VAL 71 N 0.71 4.98 0.01 -1.59 1.01 -1.26 -0.01 120.40 124.25 1pbf s VAL 71 Ca 0.01 1.52 0.06 0.00 0.00 0.00 0.00 61.98 63.58 1pbf s VAL 71 Cb -0.14 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 1pbf s VAL 71 CO 0.02 0.17 -0.17 -1.00 0.00 0.00 0.00 175.10 174.11 1pbf s HIS 72 N 1.31 2.59 -0.17 5.22 3.76 -0.04 -4.99 115.29 122.97 1pbf s HIS 72 Ca 0.38 -0.24 0.04 0.00 -0.15 0.00 0.00 55.06 55.09 1pbf s HIS 72 Cb -0.17 -1.52 0.10 0.00 1.11 0.00 0.00 32.58 32.09 1pbf s HIS 72 CO 0.17 0.21 1.07 0.39 -0.85 0.00 0.00 174.74 175.72 1pbf n GLU 73 N 1.86 2.79 -3.54 1.40 1.02 -1.26 -2.66 120.64 120.24 1pbf n GLU 73 Ca -0.16 -1.75 -0.08 0.00 -0.02 0.00 0.00 57.16 55.15 1pbf n GLU 73 Cb 0.52 -1.12 -0.03 0.00 -0.02 0.00 0.00 31.44 30.79 1pbf n GLU 73 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1pbf s GLY 74 N -1.23 -0.39 0.34 0.62 0.00 -1.26 -0.63 107.32 104.77 1pbf s GLY 74 Ca 0.08 1.33 0.04 0.00 0.00 0.00 0.00 44.72 46.17 1pbf s GLY 74 CO 0.03 0.50 0.07 0.14 0.00 0.00 0.00 173.10 173.84 1pbf s VAL 75 N -2.61 1.09 -0.05 1.40 1.01 -0.78 -4.42 120.40 116.04 1pbf s VAL 75 Ca 0.05 -2.00 0.02 0.00 0.00 0.00 0.00 61.98 60.05 1pbf s VAL 75 Cb -0.01 -2.72 0.02 0.00 0.00 0.00 0.00 36.38 33.67 1pbf s VAL 75 CO -0.06 0.00 -0.09 -1.61 0.00 0.00 0.00 175.10 173.34 1pbf s GLU 76 N -3.87 1.26 -0.16 2.72 2.02 -0.61 -0.14 118.70 119.92 1pbf s GLU 76 Ca 0.34 -0.28 -0.03 0.00 0.02 0.00 0.00 54.97 55.03 1pbf s GLU 76 Cb 0.08 -1.11 -0.02 0.00 0.10 0.00 0.00 34.13 33.17 1pbf s GLU 76 CO 0.15 -0.00 -0.06 0.42 0.02 0.00 0.00 175.26 175.79 1pbf s ILE 77 N 0.70 3.61 -0.18 -1.63 -1.09 0.86 -0.62 121.20 122.84 1pbf s ILE 77 Ca -0.12 -0.45 -0.00 0.00 -2.23 0.00 0.00 60.65 57.84 1pbf s ILE 77 Cb -0.14 -2.58 0.01 0.00 -1.58 0.00 0.00 42.46 38.16 1pbf s ILE 77 CO 0.02 0.49 -0.15 0.00 -1.23 0.00 0.00 174.94 174.07 1pbf s ALA 78 N 0.52 2.49 -0.01 9.38 0.00 -0.03 0.03 121.76 134.14 1pbf s ALA 78 Ca -0.05 -1.14 -0.10 0.00 0.00 0.00 0.00 51.96 50.67 1pbf s ALA 78 Cb -0.15 -1.30 0.01 0.00 0.00 0.00 0.00 23.12 21.68 1pbf s ALA 78 CO 0.03 -0.23 0.21 -0.59 0.00 0.00 0.00 175.76 175.17 1pbf s PHE 79 N 1.13 -0.05 -1.05 0.00 -0.71 0.08 -0.59 117.98 116.79 1pbf s PHE 79 Ca 0.01 0.05 -0.23 0.00 -1.04 0.00 0.00 56.93 55.72 1pbf s PHE 79 Cb -0.14 0.01 0.03 0.00 -1.21 0.00 0.00 43.02 41.71 1pbf s PHE 79 CO -0.06 -0.32 0.43 0.00 -1.34 0.00 0.00 175.22 173.94 1pbf n ALA 80 N 1.47 -2.21 0.00 1.99 0.00 -1.26 -0.85 120.51 119.64 1pbf n ALA 80 Ca -0.22 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1pbf n ALA 80 Cb 0.56 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1pbf n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pbf n GLY 81 N -1.98 2.12 3.83 0.00 0.00 -1.26 -5.00 105.19 102.90 1pbf n GLY 81 Ca -0.13 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.25 1pbf n GLY 81 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pbf s GLN 82 N 0.00 3.16 -0.17 1.61 -2.07 -0.03 -4.96 119.66 117.20 1pbf s GLN 82 Ca 0.00 0.97 -0.01 0.00 -1.82 0.00 0.00 55.36 54.50 1pbf s GLN 82 Cb 0.00 -2.02 0.05 0.00 -1.09 0.00 0.00 33.01 29.95 1pbf s GLN 82 CO 0.00 -0.92 -0.02 1.03 -1.32 0.00 0.00 175.29 174.06 1pbf s ARG 83 N -4.84 1.18 -0.15 9.60 0.52 -1.26 -0.74 118.95 123.25 1pbf s ARG 83 Ca 0.59 -0.50 -0.02 0.00 -0.52 0.00 0.00 55.73 55.27 1pbf s ARG 83 Cb -0.14 -2.03 -0.02 0.00 0.52 0.00 0.00 34.95 33.29 1pbf s ARG 83 CO 0.50 -0.50 -0.09 0.50 0.02 0.00 0.00 175.30 175.74 1pbf s ARG 84 N 1.69 3.47 -0.00 3.54 6.06 0.10 -4.95 118.95 128.87 1pbf s ARG 84 Ca -0.00 -0.62 -0.12 0.00 -2.50 0.00 0.00 55.73 52.48 1pbf s ARG 84 Cb -0.16 -2.79 -0.05 0.00 0.06 0.00 0.00 34.95 32.01 1pbf s ARG 84 CO -0.07 0.15 0.36 0.50 -2.50 0.00 0.00 175.30 173.74 1pbf s ARG 85 N 0.56 3.81 -0.29 5.12 3.52 -1.26 -0.10 118.95 130.30 1pbf s ARG 85 Ca -0.06 0.28 -0.05 0.00 -0.13 0.00 0.00 55.73 55.77 1pbf s ARG 85 Cb -0.15 -3.17 0.03 0.00 -1.56 0.00 0.00 34.95 30.10 1pbf s ARG 85 CO 0.03 0.68 0.04 0.42 -0.81 0.00 0.00 175.30 175.66 1pbf s ILE 86 N -1.14 3.48 -0.85 4.11 1.01 0.80 -4.96 121.20 123.65 1pbf s ILE 86 Ca 0.24 -1.00 -0.25 0.00 0.00 0.00 0.00 60.65 59.64 1pbf s ILE 86 Cb -0.15 -2.86 0.04 0.00 0.01 0.00 0.00 42.46 39.49 1pbf s ILE 86 CO 0.13 0.02 1.37 -0.62 0.00 0.00 0.00 174.94 175.84 1pbf s ASP 87 N 1.39 6.26 0.10 3.58 -1.08 -1.26 -1.86 116.67 123.79 1pbf s ASP 87 Ca -0.00 -0.83 -0.19 0.00 -0.52 0.00 0.00 52.55 51.00 1pbf s ASP 87 Cb -0.18 -2.56 -0.07 0.00 -1.46 0.00 0.00 42.92 38.65 1pbf s ASP 87 CO 0.00 -1.74 1.63 -0.07 0.52 0.00 0.00 175.17 175.51 1pbf h LEU 88 N 13.10 0.36 -1.37 -1.34 3.38 -1.19 -2.46 115.31 125.80 1pbf h LEU 88 Ca -0.08 -0.18 0.14 0.00 0.09 0.00 0.00 57.88 57.84 1pbf h LEU 88 Cb 1.04 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.63 1pbf h LEU 88 CO 1.34 0.45 0.55 0.50 0.09 0.00 0.00 178.44 181.36 1pbf h LYS 89 N 0.25 0.61 0.00 1.13 3.64 -1.41 -0.41 116.57 120.38 1pbf h LYS 89 Ca 0.08 -0.04 -0.33 0.00 -1.27 0.00 0.00 60.65 59.10 1pbf h LYS 89 Cb 0.21 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 31.83 1pbf h LYS 89 CO -0.00 0.40 -2.04 2.89 -2.27 0.00 0.00 179.45 178.43 1pbf n ARG 90 N -4.53 0.66 0.16 1.90 1.85 -1.22 0.14 116.66 115.62 1pbf n ARG 90 Ca 0.16 0.15 0.13 0.00 -1.00 0.00 0.00 57.85 57.29 1pbf n ARG 90 Cb 0.46 -1.66 0.39 0.00 -1.05 0.00 0.00 32.46 30.61 1pbf n ARG 90 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 1pbf h LEU 91 N 0.00 0.00 -0.75 2.89 3.38 -1.16 -3.16 115.31 116.51 1pbf h LEU 91 Ca -0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1pbf h LEU 91 Cb 2.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.88 1pbf h LEU 91 CO 0.06 0.00 -0.51 -1.54 0.09 0.00 0.00 178.44 176.54 1pbf n SER 92 N -2.59 1.64 -0.76 -0.43 3.41 -0.19 -4.63 113.62 110.08 1pbf n SER 92 Ca 0.04 -1.32 0.00 0.00 -0.26 0.00 0.00 58.87 57.33 1pbf n SER 92 Cb 0.40 0.59 0.00 0.00 -0.26 0.00 0.00 64.21 64.94 1pbf n SER 92 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pbf n GLY 93 N 1.33 0.55 2.19 5.00 0.00 -1.19 -4.47 105.19 108.60 1pbf n GLY 93 Ca 0.07 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1pbf n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pbf n GLY 94 N -0.76 0.62 3.91 -0.02 0.00 0.38 -5.02 105.19 104.30 1pbf n GLY 94 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1pbf n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pbf s LYS 95 N -0.02 3.61 0.28 1.61 1.02 -1.24 -4.91 119.74 120.10 1pbf s LYS 95 Ca 0.00 0.01 0.03 0.00 0.02 0.00 0.00 55.97 56.03 1pbf s LYS 95 Cb 0.00 -2.61 -0.03 0.00 -0.52 0.00 0.00 37.83 34.67 1pbf s LYS 95 CO 0.00 0.15 0.24 0.95 -0.92 0.00 0.00 175.35 175.77 1pbf s THR 96 N -2.19 0.00 0.17 2.17 -4.23 -1.26 -2.77 115.64 107.52 1pbf s THR 96 Ca 0.44 -1.96 0.08 0.00 -1.18 0.00 0.00 61.69 59.08 1pbf s THR 96 Cb -0.10 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.19 1pbf s THR 96 CO 0.32 0.00 -0.18 0.68 -0.54 0.00 0.00 174.62 174.90 1pbf s VAL 97 N -3.71 1.79 -0.11 2.29 -7.23 -1.09 -4.18 120.40 108.17 1pbf s VAL 97 Ca 0.39 -1.94 -0.01 0.00 -1.81 0.00 0.00 61.98 58.62 1pbf s VAL 97 Cb 0.04 -1.85 -0.03 0.00 0.56 0.00 0.00 36.38 35.10 1pbf s VAL 97 CO 0.21 -0.35 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.69 1pbf s THR 98 N -2.14 3.58 -0.25 5.32 2.01 -0.61 -0.86 115.64 122.69 1pbf s THR 98 Ca 0.16 -0.49 -0.12 0.00 0.31 0.00 0.00 61.69 61.55 1pbf s THR 98 Cb -0.05 -2.51 -0.05 0.00 0.01 0.00 0.00 72.50 69.90 1pbf s THR 98 CO 0.07 0.55 0.23 -0.69 -0.69 0.00 0.00 174.62 174.08 1pbf s VAL 99 N -0.14 5.30 -0.30 3.82 1.01 0.98 -0.46 120.40 130.61 1pbf s VAL 99 Ca 0.01 0.29 -0.11 0.00 0.00 0.00 0.00 61.98 62.17 1pbf s VAL 99 Cb -0.13 -3.56 0.14 0.00 0.00 0.00 0.00 36.38 32.83 1pbf s VAL 99 CO 0.03 0.28 0.76 -0.47 0.00 0.00 0.00 175.10 175.71 1pbf s TYR 100 N 1.42 -1.13 0.45 5.22 5.04 0.19 -0.30 117.35 128.25 1pbf s TYR 100 Ca 0.10 1.92 -0.22 0.00 -2.44 0.00 0.00 57.07 56.42 1pbf s TYR 100 Cb -0.15 0.66 -0.11 0.00 0.35 0.00 0.00 41.96 42.72 1pbf s TYR 100 CO 0.07 -0.56 0.76 0.41 -1.34 0.00 0.00 175.55 174.89 1pbf n GLY 101 N 5.29 -0.90 0.30 8.97 0.00 -1.26 -4.45 105.19 113.14 1pbf n GLY 101 Ca -0.11 0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 1pbf n GLY 101 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1pbf h GLN 102 N 0.98 1.04 -0.42 1.61 4.15 -1.28 -2.18 115.11 119.01 1pbf h GLN 102 Ca -0.43 -0.31 0.06 0.00 0.77 0.00 0.00 58.65 58.75 1pbf h GLN 102 Cb 1.37 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.93 1pbf h GLN 102 CO 0.53 1.00 0.29 1.15 -1.93 0.00 0.00 178.83 179.86 1pbf h THR 103 N 0.95 0.95 0.02 2.39 2.02 -1.74 -0.14 112.91 117.36 1pbf h THR 103 Ca 0.18 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.25 1pbf h THR 103 Cb 0.49 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1pbf h THR 103 CO 0.02 0.06 -0.01 -0.33 0.37 0.00 0.00 175.52 175.63 1pbf h GLU 104 N 0.31 -0.03 -0.36 6.66 3.07 -1.76 -1.27 114.58 121.19 1pbf h GLU 104 Ca 0.19 0.00 0.07 0.00 -0.50 0.00 0.00 59.36 59.12 1pbf h GLU 104 Cb 0.34 0.01 -0.06 0.00 -0.84 0.00 0.00 28.75 28.19 1pbf h GLU 104 CO -0.04 0.50 -0.05 0.28 -1.40 0.00 0.00 179.01 178.30 1pbf h VAL 105 N -0.58 0.68 0.30 3.13 2.07 -0.89 0.24 116.25 121.20 1pbf h VAL 105 Ca -0.00 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 1pbf h VAL 105 Cb 0.54 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1pbf h VAL 105 CO 0.01 0.01 -0.25 0.74 0.02 0.00 0.00 177.57 178.09 1pbf h THR 106 N 0.04 0.46 -0.66 2.57 2.02 -1.07 -1.08 112.91 115.20 1pbf h THR 106 Ca 0.18 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.49 1pbf h THR 106 Cb 0.26 0.46 -0.10 0.00 -1.74 0.00 0.00 68.15 67.03 1pbf h THR 106 CO -0.34 0.00 0.09 -0.09 0.37 0.00 0.00 175.52 175.55 1pbf h ARG 107 N -0.57 0.19 0.84 6.66 2.43 -0.46 0.20 114.38 123.68 1pbf h ARG 107 Ca -0.02 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 1pbf h ARG 107 Cb 0.51 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 30.02 1pbf h ARG 107 CO -0.03 0.13 -0.40 -0.44 -1.51 0.00 0.00 179.97 177.71 1pbf h ASP 108 N 0.20 -0.96 -0.90 -3.80 3.32 -0.22 -1.83 116.42 112.23 1pbf h ASP 108 Ca 0.35 0.03 0.19 0.00 0.02 0.00 0.00 57.03 57.63 1pbf h ASP 108 Cb 0.58 0.25 -0.11 0.00 0.22 0.00 0.00 39.33 40.26 1pbf h ASP 108 CO -0.50 -0.66 0.44 -0.07 -1.72 0.00 0.00 179.24 176.73 1pbf h LEU 109 N -1.19 0.46 -1.27 1.55 3.38 -0.85 0.15 115.31 117.55 1pbf h LEU 109 Ca -0.12 0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1pbf h LEU 109 Cb 0.87 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 1pbf h LEU 109 CO 0.19 0.10 0.06 0.24 0.09 0.00 0.00 178.44 179.12 1pbf h MET 110 N 0.52 0.55 -0.04 1.13 2.86 -0.53 -0.23 114.93 119.19 1pbf h MET 110 Ca 0.53 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 58.03 1pbf h MET 110 Cb 0.92 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.50 1pbf h MET 110 CO -0.46 0.53 -0.13 0.93 1.06 0.00 0.00 176.91 178.85 1pbf h GLU 111 N 0.53 0.15 -0.56 1.72 5.08 0.10 -2.90 114.58 118.71 1pbf h GLU 111 Ca 0.12 -0.11 0.10 0.00 -1.00 0.00 0.00 59.36 58.47 1pbf h GLU 111 Cb 0.26 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.45 1pbf h GLU 111 CO 0.00 0.74 0.12 0.00 -1.00 0.00 0.00 179.01 178.87 1pbf h ALA 112 N 0.42 0.64 0.11 3.43 0.00 -0.75 -2.23 119.26 120.88 1pbf h ALA 112 Ca -0.00 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1pbf h ALA 112 Cb 0.75 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1pbf h ALA 112 CO 0.03 -0.30 -0.05 -0.09 0.00 0.00 0.00 179.25 178.83 1pbf h ARG 113 N 0.25 -0.14 -0.91 0.00 2.43 -1.08 -1.91 114.38 113.02 1pbf h ARG 113 Ca 0.29 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.57 1pbf h ARG 113 Cb 0.40 0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 29.91 1pbf h ARG 113 CO -0.37 0.04 0.55 1.49 -1.51 0.00 0.00 179.97 180.17 1pbf h GLU 114 N -0.28 0.87 -0.19 0.20 4.22 -1.30 -0.30 114.58 117.80 1pbf h GLU 114 Ca -0.01 -0.05 -0.13 0.00 0.08 0.00 0.00 59.36 59.24 1pbf h GLU 114 Cb 0.23 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1pbf h GLU 114 CO 0.02 0.58 -0.44 0.00 -2.18 0.00 0.00 179.01 176.99 1pbf h ALA 115 N 1.49 0.88 0.00 2.92 0.00 -1.24 -2.91 119.26 120.40 1pbf h ALA 115 Ca 0.44 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pbf h ALA 115 Cb 0.41 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1pbf h ALA 115 CO -0.25 0.65 -0.01 0.66 0.00 0.00 0.00 179.25 180.29 1pbf h SER 116 N 0.38 0.00 0.00 0.00 4.64 -0.24 -3.46 113.55 114.87 1pbf h SER 116 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1pbf h SER 116 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 1pbf h SER 116 CO 0.08 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 1pbf n GLY 117 N -0.61 0.87 3.76 -0.77 0.00 -0.94 -5.00 105.19 102.51 1pbf n GLY 117 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1pbf n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pbf s ALA 118 N -3.48 2.85 0.21 4.61 0.00 -1.24 -4.94 121.76 119.77 1pbf s ALA 118 Ca 0.00 1.05 -0.31 0.00 0.00 0.00 0.00 51.96 52.71 1pbf s ALA 118 Cb 0.00 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.58 1pbf s ALA 118 CO 0.00 -0.94 1.49 0.99 0.00 0.00 0.00 175.76 177.29 1pbf s THR 119 N -1.50 2.67 -0.11 0.00 2.01 -1.26 -4.80 115.64 112.65 1pbf s THR 119 Ca 0.68 0.53 -0.04 0.00 0.31 0.00 0.00 61.69 63.17 1pbf s THR 119 Cb -0.32 -3.34 0.06 0.00 0.01 0.00 0.00 72.50 68.91 1pbf s THR 119 CO 0.38 0.07 0.19 -0.89 -0.69 0.00 0.00 174.62 173.68 1pbf s THR 120 N 0.49 -0.31 -0.65 -0.82 2.01 -1.26 -2.55 115.64 112.56 1pbf s THR 120 Ca 0.64 0.27 -0.08 0.00 0.31 0.00 0.00 61.69 62.82 1pbf s THR 120 Cb -0.42 -0.39 0.17 0.00 0.01 0.00 0.00 72.50 71.87 1pbf s THR 120 CO 0.38 0.09 0.53 -0.69 -0.69 0.00 0.00 174.62 174.24 1pbf s VAL 121 N 2.33 4.51 0.78 3.82 1.01 0.13 -4.98 120.40 128.00 1pbf s VAL 121 Ca 0.03 -2.47 -0.11 0.00 0.00 0.00 0.00 61.98 59.43 1pbf s VAL 121 Cb -0.13 -3.88 0.06 0.00 0.00 0.00 0.00 36.38 32.43 1pbf s VAL 121 CO -0.07 -0.90 1.10 -0.31 0.00 0.00 0.00 175.10 174.91 1pbf s TYR 122 N 0.41 2.93 -1.44 5.22 2.02 -1.26 -1.87 117.35 123.36 1pbf s TYR 122 Ca 0.14 1.13 -0.10 0.00 -0.37 0.00 0.00 57.07 57.87 1pbf s TYR 122 Cb -0.19 -3.11 0.04 0.00 -0.40 0.00 0.00 41.96 38.30 1pbf s TYR 122 CO -0.04 -1.65 1.03 1.04 -1.57 0.00 0.00 175.55 174.36 1pbf n GLN 123 N -3.35 -6.69 -3.02 -0.62 6.02 -0.03 -4.85 117.38 104.85 1pbf n GLN 123 Ca 0.07 0.75 -0.43 0.00 -0.01 0.00 0.00 57.00 57.38 1pbf n GLN 123 Cb 0.56 -5.72 -0.05 0.00 1.02 0.00 0.00 30.24 26.05 1pbf n GLN 123 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1pbf s ALA 124 N -3.28 3.29 0.35 -1.58 0.00 0.28 -4.67 121.76 116.15 1pbf s ALA 124 Ca 0.58 -1.51 -0.07 0.00 0.00 0.00 0.00 51.96 50.96 1pbf s ALA 124 Cb -0.27 -3.51 -0.06 0.00 0.00 0.00 0.00 23.12 19.28 1pbf s ALA 124 CO 0.71 -2.16 0.66 0.00 0.00 0.00 0.00 175.76 174.97 1pbf s ALA 125 N 3.19 3.49 -1.37 0.00 0.00 -0.17 -3.90 121.76 123.01 1pbf s ALA 125 Ca 0.22 -0.41 -0.19 0.00 0.00 0.00 0.00 51.96 51.57 1pbf s ALA 125 Cb -0.16 -2.48 0.03 0.00 0.00 0.00 0.00 23.12 20.50 1pbf s ALA 125 CO 0.15 0.10 0.38 0.39 0.00 0.00 0.00 175.76 176.78 1pbf n GLU 126 N -1.16 -0.56 -2.06 0.00 1.02 -1.26 0.11 120.64 116.72 1pbf n GLU 126 Ca 0.00 0.07 -0.41 0.00 -0.02 0.00 0.00 57.16 56.80 1pbf n GLU 126 Cb 0.54 -2.98 -0.02 0.00 -0.02 0.00 0.00 31.44 28.96 1pbf n GLU 126 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1pbf s VAL 127 N -3.92 2.80 -0.01 2.62 1.01 -1.26 -4.39 120.40 117.25 1pbf s VAL 127 Ca 0.27 0.66 0.02 0.00 0.00 0.00 0.00 61.98 62.94 1pbf s VAL 127 Cb -0.15 -3.42 -0.00 0.00 0.00 0.00 0.00 36.38 32.80 1pbf s VAL 127 CO 0.99 0.10 -0.06 -0.13 0.00 0.00 0.00 175.10 176.00 1pbf s ARG 128 N -0.28 0.50 -0.12 2.72 1.81 0.64 -4.97 118.95 119.26 1pbf s ARG 128 Ca 0.59 -0.21 -0.06 0.00 -1.72 0.00 0.00 55.73 54.33 1pbf s ARG 128 Cb -0.40 -0.49 -0.04 0.00 -0.45 0.00 0.00 34.95 33.57 1pbf s ARG 128 CO 0.42 0.12 0.10 -0.51 -0.68 0.00 0.00 175.30 174.74 1pbf s LEU 129 N -0.08 4.12 0.09 2.53 1.43 -1.26 -1.01 118.68 124.49 1pbf s LEU 129 Ca 0.02 0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.48 1pbf s LEU 129 Cb -0.03 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 1pbf s LEU 129 CO -0.00 0.38 -0.07 -1.00 0.23 0.00 0.00 176.35 175.88 1pbf s HIS 130 N -0.84 0.89 -1.51 0.29 3.76 0.60 -4.89 115.29 113.58 1pbf s HIS 130 Ca 0.13 -0.82 -0.09 0.00 -0.15 0.00 0.00 55.06 54.14 1pbf s HIS 130 Cb -0.12 -0.51 0.07 0.00 1.11 0.00 0.00 32.58 33.13 1pbf s HIS 130 CO 0.03 -0.11 0.68 -0.25 -0.85 0.00 0.00 174.74 174.24 1pbf n ASP 131 N 0.23 -2.27 0.24 1.40 9.92 -1.26 -1.52 116.55 123.29 1pbf n ASP 131 Ca -0.14 -0.94 0.15 0.00 -0.53 0.00 0.00 54.79 53.34 1pbf n ASP 131 Cb 0.60 -3.26 0.84 0.00 -0.64 0.00 0.00 41.12 38.66 1pbf n ASP 131 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 1pbf h LEU 132 N -1.80 0.00 -1.37 0.64 3.38 -1.91 -2.09 115.31 112.17 1pbf h LEU 132 Ca -0.61 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.36 1pbf h LEU 132 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1pbf h LEU 132 CO 0.68 0.00 -0.22 0.00 0.09 0.00 0.00 178.44 178.98 1pbf n GLN 133 N -3.92 1.66 -0.10 1.13 6.02 -1.26 0.08 117.38 120.99 1pbf n GLN 133 Ca -0.01 -1.32 0.00 0.00 -0.01 0.00 0.00 57.00 55.66 1pbf n GLN 133 Cb 0.21 -1.40 0.00 0.00 1.02 0.00 0.00 30.24 30.07 1pbf n GLN 133 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1pbf n GLY 134 N 1.26 -0.71 0.08 1.08 0.00 -0.78 -4.93 105.19 101.19 1pbf n GLY 134 Ca 0.10 -1.72 0.06 0.00 0.00 0.00 0.00 46.02 44.46 1pbf n GLY 134 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pbf n GLU 135 N -0.82 0.63 -3.78 1.61 4.71 -1.26 -4.61 120.64 117.12 1pbf n GLU 135 Ca 0.00 0.07 -0.29 0.00 -0.01 0.00 0.00 57.16 56.93 1pbf n GLU 135 Cb 0.00 -1.72 -0.12 0.00 -1.01 0.00 0.00 31.44 28.58 1pbf n GLU 135 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 1pbf s ARG 136 N -3.18 1.79 0.69 3.49 3.00 -1.26 -4.82 118.95 118.66 1pbf s ARG 136 Ca -0.04 -2.62 -0.11 0.00 0.00 0.00 0.00 55.73 52.96 1pbf s ARG 136 Cb 0.10 -2.79 0.01 0.00 0.00 0.00 0.00 34.95 32.27 1pbf s ARG 136 CO 0.83 -1.23 1.07 -1.25 0.00 0.00 0.00 175.30 174.72 1pbf s PRO 137 N -0.46 2.89 0.14 3.54 0.04 -1.24 -4.85 135.00 135.06 1pbf s PRO 137 Ca 0.22 0.41 -0.10 0.00 0.04 0.00 0.00 61.00 61.57 1pbf s PRO 137 Cb -0.14 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.35 1pbf s PRO 137 CO -0.09 -0.98 0.28 1.52 0.04 0.00 0.00 177.00 177.78 1pbf s TYR 138 N -3.31 0.22 -0.07 0.56 1.13 -0.57 -3.15 117.35 112.16 1pbf s TYR 138 Ca 0.58 -0.60 0.05 0.00 -1.41 0.00 0.00 57.07 55.68 1pbf s TYR 138 Cb -0.11 0.01 -0.00 0.00 -1.10 0.00 0.00 41.96 40.75 1pbf s TYR 138 CO 0.51 -0.68 -0.21 0.08 -2.51 0.00 0.00 175.55 172.74 1pbf s VAL 139 N -3.91 1.79 0.04 -3.49 1.01 0.29 -0.29 120.40 115.83 1pbf s VAL 139 Ca 0.11 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.26 1pbf s VAL 139 Cb 0.03 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 1pbf s VAL 139 CO -0.05 0.50 -0.16 0.42 0.00 0.00 0.00 175.10 175.81 1pbf s THR 140 N 0.11 2.94 0.26 3.92 -4.23 -0.18 -0.33 115.64 118.12 1pbf s THR 140 Ca -0.09 -1.13 -0.15 0.00 -1.18 0.00 0.00 61.69 59.14 1pbf s THR 140 Cb -0.14 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.45 1pbf s THR 140 CO 0.05 0.33 0.55 0.72 -0.54 0.00 0.00 174.62 175.73 1pbf s PHE 141 N -0.95 0.19 -0.10 3.99 -0.71 -1.06 -0.26 117.98 119.08 1pbf s PHE 141 Ca 0.15 -0.58 0.04 0.00 -1.04 0.00 0.00 56.93 55.50 1pbf s PHE 141 Cb -0.11 0.35 -0.00 0.00 -1.21 0.00 0.00 43.02 42.05 1pbf s PHE 141 CO 0.06 -1.07 -0.23 -1.21 -1.34 0.00 0.00 175.22 171.43 1pbf s GLU 142 N -3.99 3.08 -0.32 1.99 2.02 0.12 -0.33 118.70 121.27 1pbf s GLU 142 Ca 0.19 -0.86 0.04 0.00 0.02 0.00 0.00 54.97 54.35 1pbf s GLU 142 Cb -0.02 -2.33 0.09 0.00 0.10 0.00 0.00 34.13 31.96 1pbf s GLU 142 CO 0.08 0.18 0.00 0.50 0.02 0.00 0.00 175.26 176.05 1pbf s ARG 143 N 0.34 1.70 2.27 1.61 3.52 -0.67 -1.00 118.95 126.72 1pbf s ARG 143 Ca -0.18 -1.71 0.00 0.00 -0.13 0.00 0.00 55.73 53.71 1pbf s ARG 143 Cb -0.18 -3.10 0.00 0.00 -1.56 0.00 0.00 34.95 30.11 1pbf s ARG 143 CO 0.09 -0.83 0.00 -3.47 -0.81 0.00 0.00 175.30 170.28 1pbf n ASP 144 N 4.31 0.00 0.00 -2.12 2.03 -1.26 -2.94 116.55 116.57 1pbf n ASP 144 Ca -0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 1pbf n ASP 144 Cb 0.42 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.82 1pbf n ASP 144 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pbf n GLY 145 N 0.00 -0.54 3.67 0.27 0.00 -1.26 -5.05 105.19 102.27 1pbf n GLY 145 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1pbf n GLY 145 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1pbf s GLU 146 N -0.03 4.08 -0.29 1.61 -1.05 -1.15 -5.05 118.70 116.82 1pbf s GLU 146 Ca 0.00 -0.27 -0.25 0.00 -0.15 0.00 0.00 54.97 54.30 1pbf s GLU 146 Cb 0.00 -3.52 0.00 0.00 -0.44 0.00 0.00 34.13 30.18 1pbf s GLU 146 CO 0.00 0.09 0.87 0.50 0.95 0.00 0.00 175.26 177.68 1pbf s ARG 147 N 0.96 4.05 0.34 -4.83 6.06 -1.26 -1.66 118.95 122.61 1pbf s ARG 147 Ca 0.07 0.81 0.07 0.00 -2.50 0.00 0.00 55.73 54.19 1pbf s ARG 147 Cb -0.13 -3.71 -0.02 0.00 0.06 0.00 0.00 34.95 31.16 1pbf s ARG 147 CO 0.04 -0.69 0.41 -0.51 -2.50 0.00 0.00 175.30 172.05 1pbf s LEU 148 N 3.09 3.78 -0.03 -0.88 1.43 0.55 -4.95 118.68 121.67 1pbf s LEU 148 Ca 0.36 -0.35 0.04 0.00 -1.03 0.00 0.00 54.13 53.15 1pbf s LEU 148 Cb -0.14 -2.51 -0.00 0.00 0.03 0.00 0.00 46.19 43.57 1pbf s LEU 148 CO 0.11 -0.44 -0.14 -0.60 0.23 0.00 0.00 176.35 175.52 1pbf s ARG 149 N -4.12 1.39 -0.13 1.70 3.52 -1.26 -2.57 118.95 117.48 1pbf s ARG 149 Ca 0.44 -0.49 0.02 0.00 -0.13 0.00 0.00 55.73 55.57 1pbf s ARG 149 Cb -0.08 -1.26 0.01 0.00 -1.56 0.00 0.00 34.95 32.07 1pbf s ARG 149 CO 0.29 0.22 -0.18 -1.17 -0.81 0.00 0.00 175.30 173.66 1pbf s LEU 150 N -0.00 1.88 -0.11 -0.88 2.96 0.55 -2.25 118.68 120.83 1pbf s LEU 150 Ca -0.01 -0.52 -0.06 0.00 -0.22 0.00 0.00 54.13 53.32 1pbf s LEU 150 Cb -0.09 -1.26 -0.04 0.00 0.50 0.00 0.00 46.19 45.30 1pbf s LEU 150 CO 0.01 0.02 0.11 -1.81 -1.32 0.00 0.00 176.35 173.37 1pbf s ASP 151 N 1.03 6.14 0.30 3.68 1.01 -0.13 -0.55 116.67 128.15 1pbf s ASP 151 Ca -0.04 0.39 -0.15 0.00 0.71 0.00 0.00 52.55 53.46 1pbf s ASP 151 Cb -0.15 -1.94 0.02 0.00 1.01 0.00 0.00 42.92 41.87 1pbf s ASP 151 CO -0.04 0.40 0.63 0.00 0.21 0.00 0.00 175.17 176.37 1pbf n ASP 153 N -0.76 2.00 -4.15 0.00 8.00 0.27 -3.61 116.55 118.29 1pbf n ASP 153 Ca -0.04 0.32 -0.16 0.00 0.71 0.00 0.00 54.79 55.63 1pbf n ASP 153 Cb 0.60 -0.92 -0.11 0.00 -0.02 0.00 0.00 41.12 40.67 1pbf n ASP 153 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1pbf s TYR 154 N -2.46 1.04 -0.07 1.24 2.02 -0.93 -4.60 117.35 113.59 1pbf s TYR 154 Ca -0.26 -0.53 0.05 0.00 -0.37 0.00 0.00 57.07 55.96 1pbf s TYR 154 Cb 0.06 -0.59 -0.00 0.00 -0.40 0.00 0.00 41.96 41.03 1pbf s TYR 154 CO 0.68 0.01 -0.23 0.42 -1.57 0.00 0.00 175.55 174.86 1pbf s ILE 155 N -1.68 1.93 -0.28 2.71 1.01 -0.31 -1.11 121.20 123.46 1pbf s ILE 155 Ca -0.01 -0.97 -0.06 0.00 0.00 0.00 0.00 60.65 59.61 1pbf s ILE 155 Cb -0.08 -1.66 0.01 0.00 0.01 0.00 0.00 42.46 40.75 1pbf s ILE 155 CO 0.01 0.54 0.04 0.00 0.00 0.00 0.00 174.94 175.53 1pbf s ALA 156 N 0.12 2.98 -0.95 9.38 0.00 0.24 -1.66 121.76 131.86 1pbf s ALA 156 Ca -0.11 -1.44 -0.22 0.00 0.00 0.00 0.00 51.96 50.19 1pbf s ALA 156 Cb -0.15 -2.03 0.07 0.00 0.00 0.00 0.00 23.12 21.01 1pbf s ALA 156 CO 0.06 -0.87 1.34 0.20 0.00 0.00 0.00 175.76 176.48 1pbf s GLY 157 N 1.46 1.38 -0.28 0.00 0.00 0.13 -1.68 107.32 108.33 1pbf s GLY 157 Ca 0.02 -2.27 0.09 0.00 0.00 0.00 0.00 44.72 42.56 1pbf s GLY 157 CO 0.01 2.50 1.42 0.00 0.00 0.00 0.00 173.10 177.03 1pbf n ASP 159 N -1.12 2.58 -0.66 0.00 5.75 -0.57 -4.41 116.55 118.12 1pbf n ASP 159 Ca 0.31 -2.25 0.09 0.00 -0.01 0.00 0.00 54.79 52.93 1pbf n ASP 159 Cb 0.98 -0.44 -0.02 0.00 -1.03 0.00 0.00 41.12 40.60 1pbf n ASP 159 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1pbf n GLY 160 N 0.58 -1.61 0.27 6.12 0.00 -1.26 -3.22 105.19 106.08 1pbf n GLY 160 Ca 0.12 -1.36 0.01 0.00 0.00 0.00 0.00 46.02 44.79 1pbf n GLY 160 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1pbf h PHE 161 N -0.61 -0.36 -0.61 1.61 3.57 -1.72 -0.69 116.94 118.12 1pbf h PHE 161 Ca 0.01 0.06 -0.15 0.00 3.53 0.00 0.00 57.97 61.42 1pbf h PHE 161 Cb 0.60 0.27 -0.09 0.00 2.79 0.00 0.00 35.95 39.52 1pbf h PHE 161 CO -1.46 -0.31 0.19 0.72 -2.23 0.00 0.00 178.31 175.23 1pbf n HIS 162 N -5.47 2.06 -1.23 0.41 8.25 -1.26 -4.91 115.22 113.06 1pbf n HIS 162 Ca 0.10 -0.97 -0.29 0.00 -0.26 0.00 0.00 57.72 56.30 1pbf n HIS 162 Cb 0.38 -0.59 0.19 0.00 1.12 0.00 0.00 29.99 31.09 1pbf n HIS 162 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1pbf s GLY 163 N -0.75 1.58 0.28 -1.41 0.00 -0.27 -4.99 107.32 101.77 1pbf s GLY 163 Ca 0.47 -0.59 0.20 0.00 0.00 0.00 0.00 44.72 44.80 1pbf s GLY 163 CO 0.12 0.10 1.31 1.19 0.00 0.00 0.00 173.10 175.82 1pbf h ILE 164 N -2.02 0.30 0.41 0.90 6.09 -1.88 -3.39 117.51 117.92 1pbf h ILE 164 Ca -0.51 -1.46 -0.01 0.00 -1.37 0.00 0.00 64.86 61.51 1pbf h ILE 164 Cb 1.32 1.99 -0.02 0.00 0.47 0.00 0.00 36.82 40.58 1pbf h ILE 164 CO 0.52 0.17 -0.41 0.28 -3.07 0.00 0.00 178.15 175.64 1pbf h SER 165 N 0.00 -1.11 -0.21 2.19 0.02 -1.93 -2.35 113.55 110.15 1pbf h SER 165 Ca -0.03 0.09 0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1pbf h SER 165 Cb 1.19 0.37 -0.01 0.00 0.14 0.00 0.00 62.40 64.09 1pbf h SER 165 CO 0.02 -0.56 0.14 -0.09 -1.14 0.00 0.00 176.83 175.21 1pbf h ARG 166 N -0.83 0.22 0.00 3.45 2.43 -1.84 -0.19 114.38 117.62 1pbf h ARG 166 Ca -0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1pbf h ARG 166 Cb 0.74 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 1pbf h ARG 166 CO -0.06 0.15 0.00 1.04 -1.51 0.00 0.00 179.97 179.58 1pbf n GLN 167 N -4.50 0.01 0.13 0.20 6.02 -1.05 -3.14 117.38 115.05 1pbf n GLN 167 Ca 0.01 0.04 0.08 0.00 -0.01 0.00 0.00 57.00 57.11 1pbf n GLN 167 Cb 0.12 -1.50 0.03 0.00 1.02 0.00 0.00 30.24 29.92 1pbf n GLN 167 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.06 176.82 1pbf h SER 168 N 0.00 0.00 -3.49 1.08 0.02 -0.50 -3.45 113.55 107.22 1pbf h SER 168 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 1pbf h SER 168 Cb 0.46 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 1pbf h SER 168 CO 0.00 0.19 0.37 -0.63 -1.14 0.00 0.00 176.83 175.62 1pbf s ILE 169 N -3.18 4.68 -0.00 3.27 1.01 -1.19 -4.96 121.20 120.83 1pbf s ILE 169 Ca 0.02 2.06 -0.32 0.00 0.00 0.00 0.00 60.65 62.40 1pbf s ILE 169 Cb 0.08 -4.32 -0.11 0.00 0.01 0.00 0.00 42.46 38.12 1pbf s ILE 169 CO 0.75 0.24 1.90 -0.81 0.00 0.00 0.00 174.94 177.02 1pbf n PRO 170 N 3.35 2.51 -0.32 2.79 -0.04 -1.26 -4.85 135.00 137.17 1pbf n PRO 170 Ca 0.04 0.92 0.17 0.00 -0.04 0.00 0.00 63.50 64.59 1pbf n PRO 170 Cb 0.50 -2.81 0.33 0.00 -0.04 0.00 0.00 33.50 31.48 1pbf n PRO 170 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1pbf n ALA 171 N 6.69 0.57 0.47 0.55 0.00 -1.26 0.21 120.51 127.74 1pbf n ALA 171 Ca 0.21 1.01 0.04 0.00 0.00 0.00 0.00 53.44 54.70 1pbf n ALA 171 Cb 0.35 -0.78 0.23 0.00 0.00 0.00 0.00 19.45 19.24 1pbf n ALA 171 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1pbf n GLU 172 N -5.36 0.22 -0.04 0.00 1.02 -1.26 -1.97 120.64 113.24 1pbf n GLU 172 Ca 0.25 0.04 0.01 0.00 -0.02 0.00 0.00 57.16 57.44 1pbf n GLU 172 Cb 0.82 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.59 1pbf n GLU 172 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1pbf n ARG 173 N -1.05 0.82 -4.00 3.49 0.63 0.13 -4.98 116.66 111.70 1pbf n ARG 173 Ca 0.06 -0.10 -0.36 0.00 -0.92 0.00 0.00 57.85 56.52 1pbf n ARG 173 Cb 0.03 -1.45 -0.07 0.00 0.45 0.00 0.00 32.46 31.42 1pbf n ARG 173 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1pbf s LEU 174 N -4.76 4.17 -0.18 6.15 1.43 -0.83 -4.47 118.68 120.19 1pbf s LEU 174 Ca -0.08 0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 53.37 1pbf s LEU 174 Cb 0.09 -2.01 -0.02 0.00 0.03 0.00 0.00 46.19 44.29 1pbf s LEU 174 CO 0.76 0.39 -0.06 -1.59 0.23 0.00 0.00 176.35 176.08 1pbf s LYS 175 N -0.94 3.47 -0.14 1.70 -2.85 -0.01 -4.94 119.74 116.02 1pbf s LYS 175 Ca 0.14 -0.61 -0.06 0.00 -1.00 0.00 0.00 55.97 54.44 1pbf s LYS 175 Cb -0.12 -2.88 -0.04 0.00 -2.06 0.00 0.00 37.83 32.73 1pbf s LYS 175 CO 0.03 0.05 0.08 0.08 0.10 0.00 0.00 175.35 175.69 1pbf s VAL 176 N 0.83 4.95 -0.13 1.79 1.01 -1.26 -0.97 120.40 126.63 1pbf s VAL 176 Ca -0.02 0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.00 1pbf s VAL 176 Cb -0.15 -3.18 0.01 0.00 0.00 0.00 0.00 36.38 33.06 1pbf s VAL 176 CO 0.01 0.54 -0.21 -0.36 0.00 0.00 0.00 175.10 175.08 1pbf s PHE 177 N -0.32 2.52 -0.10 5.22 0.40 -0.12 -5.01 117.98 120.58 1pbf s PHE 177 Ca 0.09 -1.22 -0.13 0.00 -0.60 0.00 0.00 56.93 55.07 1pbf s PHE 177 Cb -0.12 -1.72 0.03 0.00 0.51 0.00 0.00 43.02 41.72 1pbf s PHE 177 CO 0.01 -0.56 0.34 -2.00 0.70 0.00 0.00 175.22 173.72 1pbf s GLU 178 N 0.77 0.48 -0.04 0.44 2.12 -1.26 -1.00 118.70 120.21 1pbf s GLU 178 Ca -0.09 0.30 -0.00 0.00 0.36 0.00 0.00 54.97 55.54 1pbf s GLU 178 Cb -0.16 0.23 0.03 0.00 0.26 0.00 0.00 34.13 34.49 1pbf s GLU 178 CO -0.00 -0.09 0.01 0.50 -0.54 0.00 0.00 175.26 175.14 1pbf s ARG 179 N -0.23 0.35 -0.17 4.30 3.00 -0.28 -4.99 118.95 120.93 1pbf s ARG 179 Ca -0.04 0.11 -0.03 0.00 -1.00 0.00 0.00 55.73 54.77 1pbf s ARG 179 Cb -0.03 -0.62 -0.02 0.00 0.00 0.00 0.00 34.95 34.28 1pbf s ARG 179 CO 0.02 -0.19 -0.05 0.08 0.00 0.00 0.00 175.30 175.15 1pbf s VAL 180 N 1.38 3.60 0.23 7.11 1.01 -1.26 -0.10 120.40 132.37 1pbf s VAL 180 Ca -0.05 -0.45 -0.20 0.00 0.00 0.00 0.00 61.98 61.28 1pbf s VAL 180 Cb -0.13 -2.59 -0.08 0.00 0.00 0.00 0.00 36.38 33.58 1pbf s VAL 180 CO -0.03 0.47 0.75 -0.31 0.00 0.00 0.00 175.10 175.98 1pbf s TYR 181 N 0.73 3.65 -0.88 5.22 1.51 -0.97 -4.95 117.35 121.67 1pbf s TYR 181 Ca -0.02 1.43 0.00 0.00 -1.01 0.00 0.00 57.07 57.46 1pbf s TYR 181 Cb -0.15 -2.65 0.00 0.00 -0.11 0.00 0.00 41.96 39.06 1pbf s TYR 181 CO 0.02 0.32 0.40 -0.35 -1.11 0.00 0.00 175.55 174.83 1pbf n PRO 182 N 0.71 0.71 -3.96 -1.71 -0.04 -1.26 -4.67 135.00 124.77 1pbf n PRO 182 Ca -0.02 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.35 1pbf n PRO 182 Cb 0.51 -1.33 -0.05 0.00 -0.04 0.00 0.00 33.50 32.59 1pbf n PRO 182 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1pbf s PHE 183 N -0.84 0.26 0.25 0.54 -0.12 -1.26 -3.98 117.98 112.83 1pbf s PHE 183 Ca 0.00 -0.63 0.04 0.00 -0.05 0.00 0.00 56.93 56.29 1pbf s PHE 183 Cb 0.00 0.27 -0.02 0.00 -0.63 0.00 0.00 43.02 42.65 1pbf s PHE 183 CO 0.00 -1.02 0.16 0.41 -0.05 0.00 0.00 175.22 174.72 1pbf n GLY 184 N -0.39 3.35 3.30 1.99 0.00 -0.07 -2.70 105.19 110.68 1pbf n GLY 184 Ca -0.02 -1.92 -0.32 0.00 0.00 0.00 0.00 46.02 43.76 1pbf n GLY 184 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pbf s TRP 185 N -2.81 2.54 -0.50 1.61 0.52 0.92 -1.64 118.94 119.58 1pbf s TRP 185 Ca 0.22 -0.71 -0.16 0.00 0.02 0.00 0.00 56.10 55.48 1pbf s TRP 185 Cb 0.01 -1.65 0.09 0.00 -1.15 0.00 0.00 33.47 30.77 1pbf s TRP 185 CO 0.16 -0.21 0.44 -1.17 0.02 0.00 0.00 176.95 176.19 1pbf s LEU 186 N -0.07 5.78 0.47 2.99 2.96 -0.41 -0.61 118.68 129.80 1pbf s LEU 186 Ca -0.06 -1.46 -0.03 0.00 -0.22 0.00 0.00 54.13 52.36 1pbf s LEU 186 Cb -0.14 -2.20 -0.03 0.00 0.50 0.00 0.00 46.19 44.32 1pbf s LEU 186 CO 0.05 -0.73 0.74 -0.83 -1.32 0.00 0.00 176.35 174.26 1pbf s GLY 187 N 2.93 1.49 -0.18 7.98 0.00 0.23 -2.19 107.32 117.57 1pbf s GLY 187 Ca 0.04 -0.68 -0.14 0.00 0.00 0.00 0.00 44.72 43.94 1pbf s GLY 187 CO 0.06 -0.52 0.47 -2.27 0.00 0.00 0.00 173.10 170.83 1pbf s LEU 188 N -4.67 -0.01 -0.07 0.66 0.20 0.71 -2.30 118.68 113.20 1pbf s LEU 188 Ca 0.47 0.98 0.04 0.00 0.69 0.00 0.00 54.13 56.30 1pbf s LEU 188 Cb -0.10 1.59 -0.02 0.00 -0.43 0.00 0.00 46.19 47.23 1pbf s LEU 188 CO 0.42 -0.18 -0.18 -0.22 -0.29 0.00 0.00 176.35 175.90 1pbf s LEU 189 N 0.79 2.47 -0.08 -0.68 2.96 -0.38 -0.65 118.68 123.11 1pbf s LEU 189 Ca -0.04 -0.35 -0.11 0.00 -0.22 0.00 0.00 54.13 53.40 1pbf s LEU 189 Cb -0.05 -1.49 0.03 0.00 0.50 0.00 0.00 46.19 45.17 1pbf s LEU 189 CO -0.06 0.27 0.29 0.00 -1.32 0.00 0.00 176.35 175.52 1pbf s ALA 190 N -0.26 -0.72 -1.54 5.97 0.00 -0.45 0.06 121.76 124.81 1pbf s ALA 190 Ca 0.01 0.64 -0.12 0.00 0.00 0.00 0.00 51.96 52.49 1pbf s ALA 190 Cb -0.13 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 1pbf s ALA 190 CO 0.03 -0.17 2.62 -3.47 0.00 0.00 0.00 175.76 174.76 1pbf n ASP 191 N 2.41 6.55 -4.19 0.00 -0.08 -1.26 -1.29 116.55 118.68 1pbf n ASP 191 Ca -0.16 -2.71 -0.12 0.00 -1.51 0.00 0.00 54.79 50.29 1pbf n ASP 191 Cb 0.57 -1.60 -0.10 0.00 2.34 0.00 0.00 41.12 42.33 1pbf n ASP 191 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1pbf s THR 192 N 2.54 0.88 0.32 5.18 -4.23 -1.15 -4.86 115.64 114.32 1pbf s THR 192 Ca 0.59 -1.90 -0.28 0.00 -1.18 0.00 0.00 61.69 58.91 1pbf s THR 192 Cb 0.16 -1.65 -0.10 0.00 1.34 0.00 0.00 72.50 72.25 1pbf s THR 192 CO -0.07 -0.77 1.21 -2.84 -0.54 0.00 0.00 174.62 171.61 1pbf s PRO 193 N -3.57 4.42 0.76 3.99 0.02 -1.26 -2.24 135.00 137.11 1pbf s PRO 193 Ca 0.12 2.02 -0.12 0.00 0.02 0.00 0.00 61.00 63.03 1pbf s PRO 193 Cb 0.03 -3.06 0.05 0.00 0.02 0.00 0.00 34.50 31.54 1pbf s PRO 193 CO -0.02 -0.06 1.11 -1.25 -0.33 0.00 0.00 177.00 176.45 1pbf s PRO 194 N -1.74 2.24 0.06 5.54 0.04 -1.26 -4.57 135.00 135.32 1pbf s PRO 194 Ca 0.48 1.31 0.28 0.00 0.04 0.00 0.00 61.00 63.11 1pbf s PRO 194 Cb -0.36 -1.89 1.00 0.00 0.04 0.00 0.00 34.50 33.30 1pbf s PRO 194 CO 0.47 -1.68 1.80 1.55 0.04 0.00 0.00 177.00 179.18 1pbf n VAL 195 N -3.27 0.17 -3.78 -0.36 3.14 -1.26 -4.87 118.33 108.11 1pbf n VAL 195 Ca 0.10 -0.09 -0.12 0.00 -2.96 0.00 0.00 64.34 61.27 1pbf n VAL 195 Cb 0.52 -0.42 -0.08 0.00 -1.06 0.00 0.00 33.84 32.80 1pbf n VAL 195 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1pbf s SER 196 N -3.47 -0.12 0.40 6.55 0.15 -1.26 -4.95 113.70 111.01 1pbf s SER 196 Ca 0.12 -0.09 0.24 0.00 0.70 0.00 0.00 55.95 56.93 1pbf s SER 196 Cb 0.17 0.31 0.52 0.00 -1.71 0.00 0.00 66.02 65.31 1pbf s SER 196 CO 0.58 -0.51 1.67 0.45 1.20 0.00 0.00 173.24 176.63 1pbf h HIS 197 N 3.65 0.00 -2.65 3.44 -0.00 -2.00 -3.45 115.15 114.14 1pbf h HIS 197 Ca -0.31 0.00 -0.50 0.00 -0.00 0.00 0.00 60.37 59.56 1pbf h HIS 197 Cb 1.19 0.00 -0.14 0.00 -0.00 0.00 0.00 27.41 28.45 1pbf h HIS 197 CO 0.51 0.00 -0.74 -1.21 -0.00 0.00 0.00 177.93 176.49 1pbf s GLU 198 N -3.23 1.45 0.68 2.45 2.02 -1.26 -5.03 118.70 115.79 1pbf s GLU 198 Ca 0.07 -1.66 -0.14 0.00 0.02 0.00 0.00 54.97 53.27 1pbf s GLU 198 Cb 0.07 -1.33 0.01 0.00 0.10 0.00 0.00 34.13 32.98 1pbf s GLU 198 CO 0.64 0.22 1.10 -0.51 0.02 0.00 0.00 175.26 176.73 1pbf s LEU 199 N -3.38 3.31 -0.09 1.80 1.02 -1.26 -4.91 118.68 115.16 1pbf s LEU 199 Ca 0.25 1.93 -0.00 0.00 0.02 0.00 0.00 54.13 56.33 1pbf s LEU 199 Cb -0.02 -4.54 0.02 0.00 0.02 0.00 0.00 46.19 41.68 1pbf s LEU 199 CO 0.10 -1.68 -0.06 -0.63 0.02 0.00 0.00 176.35 174.09 1pbf s ILE 200 N -2.50 0.83 -0.27 -0.59 1.01 -0.93 -1.57 121.20 117.18 1pbf s ILE 200 Ca 0.65 -0.19 -0.09 0.00 0.00 0.00 0.00 60.65 61.02 1pbf s ILE 200 Cb -0.19 -0.87 -0.03 0.00 0.01 0.00 0.00 42.46 41.38 1pbf s ILE 200 CO 0.45 0.33 0.12 -0.31 0.00 0.00 0.00 174.94 175.53 1pbf s TYR 201 N 1.59 3.14 -0.10 3.97 1.51 0.20 -1.04 117.35 126.63 1pbf s TYR 201 Ca 0.01 -0.34 0.04 0.00 -1.01 0.00 0.00 57.07 55.77 1pbf s TYR 201 Cb -0.13 -2.30 -0.00 0.00 -0.11 0.00 0.00 41.96 39.41 1pbf s TYR 201 CO -0.05 -0.34 -0.22 0.00 -1.11 0.00 0.00 175.55 173.82 1pbf s ALA 202 N 1.65 2.24 -0.21 3.71 0.00 0.31 -0.85 121.76 128.61 1pbf s ALA 202 Ca 0.06 -0.97 -0.11 0.00 0.00 0.00 0.00 51.96 50.94 1pbf s ALA 202 Cb -0.16 -0.85 -0.05 0.00 0.00 0.00 0.00 23.12 22.06 1pbf s ALA 202 CO 0.06 0.31 0.17 1.21 0.00 0.00 0.00 175.76 177.51 1pbf s ASN 203 N 0.26 6.21 0.02 0.00 3.84 0.24 -1.81 114.94 123.70 1pbf s ASN 203 Ca -0.15 0.24 -0.04 0.00 0.21 0.00 0.00 52.86 53.11 1pbf s ASN 203 Cb -0.17 -2.11 -0.01 0.00 -0.55 0.00 0.00 41.25 38.41 1pbf s ASN 203 CO 0.08 0.12 0.07 -2.28 -2.79 0.00 0.00 177.10 172.29 1pbf s HIS 204 N 0.68 0.18 0.60 0.43 2.46 -1.16 -4.39 115.29 114.08 1pbf s HIS 204 Ca 0.09 -0.42 0.30 0.00 0.47 0.00 0.00 55.06 55.50 1pbf s HIS 204 Cb -0.12 -0.14 1.77 0.00 -0.13 0.00 0.00 32.58 33.96 1pbf s HIS 204 CO 0.02 -0.30 2.18 -1.35 -2.47 0.00 0.00 174.74 172.82 1pbf h PRO 205 N 4.08 0.00 0.00 2.88 0.11 -1.96 0.15 132.00 137.26 1pbf h PRO 205 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1pbf h PRO 205 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1pbf h PRO 205 CO 0.46 0.00 -0.17 0.54 -0.21 0.00 0.00 178.00 178.62 1pbf n ARG 206 N -3.76 0.09 0.00 1.05 1.74 -1.26 -4.99 116.66 109.53 1pbf n ARG 206 Ca -0.01 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.13 1pbf n ARG 206 Cb 0.21 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 1pbf n ARG 206 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pbf n GLY 207 N 1.44 1.37 3.79 -0.13 0.00 0.51 -4.99 105.19 107.18 1pbf n GLY 207 Ca 0.06 -2.08 -0.35 0.00 0.00 0.00 0.00 46.02 43.65 1pbf n GLY 207 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1pbf s PHE 208 N -1.21 3.01 -0.01 1.61 5.36 -1.26 -2.99 117.98 122.49 1pbf s PHE 208 Ca 0.00 1.59 -0.02 0.00 -0.96 0.00 0.00 56.93 57.54 1pbf s PHE 208 Cb 0.00 -3.13 -0.00 0.00 -0.34 0.00 0.00 43.02 39.55 1pbf s PHE 208 CO 0.00 -0.92 0.04 0.00 -1.46 0.00 0.00 175.22 172.88 1pbf s ALA 209 N -1.84 -0.09 -0.04 11.12 0.00 -0.75 -1.03 121.76 129.13 1pbf s ALA 209 Ca 0.65 -0.03 0.02 0.00 0.00 0.00 0.00 51.96 52.61 1pbf s ALA 209 Cb -0.19 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 22.91 1pbf s ALA 209 CO 0.24 -0.07 -0.10 -1.17 0.00 0.00 0.00 175.76 174.66 1pbf s LEU 210 N -0.40 1.71 -0.32 0.00 2.96 -0.24 -0.53 118.68 121.85 1pbf s LEU 210 Ca -0.05 -0.22 -0.01 0.00 -0.22 0.00 0.00 54.13 53.64 1pbf s LEU 210 Cb -0.03 -0.63 0.07 0.00 0.50 0.00 0.00 46.19 46.10 1pbf s LEU 210 CO -0.00 0.05 0.04 0.00 -1.32 0.00 0.00 176.35 175.12 1pbf s SER 212 N 1.32 3.51 0.05 0.00 0.15 0.15 -2.18 113.70 116.71 1pbf s SER 212 Ca -0.01 -1.63 -0.05 0.00 0.70 0.00 0.00 55.95 54.96 1pbf s SER 212 Cb -0.20 0.43 -0.02 0.00 -1.71 0.00 0.00 66.02 64.52 1pbf s SER 212 CO -0.03 -0.85 0.08 0.00 1.20 0.00 0.00 173.24 173.64 1pbf s GLN 213 N -3.80 0.63 -0.02 5.44 -2.07 -1.26 -0.97 119.66 117.61 1pbf s GLN 213 Ca 0.16 -0.91 0.04 0.00 -1.82 0.00 0.00 55.36 52.83 1pbf s GLN 213 Cb 0.03 0.24 -0.06 0.00 -1.09 0.00 0.00 33.01 32.13 1pbf s GLN 213 CO 0.09 -0.16 0.07 0.54 -1.32 0.00 0.00 175.29 174.51 1pbf n ARG 214 N 0.46 1.14 -2.96 9.60 5.12 0.46 -4.77 116.66 125.71 1pbf n ARG 214 Ca -0.17 -0.03 -0.02 0.00 -1.93 0.00 0.00 57.85 55.70 1pbf n ARG 214 Cb 0.60 -1.10 0.01 0.00 -1.16 0.00 0.00 32.46 30.81 1pbf n ARG 214 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1pbf n SER 215 N -1.80 -1.08 0.11 0.55 3.41 -0.97 -4.75 113.62 109.09 1pbf n SER 215 Ca -0.03 -1.56 0.12 0.00 -0.26 0.00 0.00 58.87 57.15 1pbf n SER 215 Cb 0.27 1.75 0.46 0.00 -0.26 0.00 0.00 64.21 66.43 1pbf n SER 215 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pbf n ALA 216 N -1.61 1.89 -1.44 7.33 0.00 -1.26 -2.61 120.51 122.82 1pbf n ALA 216 Ca -0.09 0.03 0.07 0.00 0.00 0.00 0.00 53.44 53.46 1pbf n ALA 216 Cb 0.36 -1.41 0.13 0.00 0.00 0.00 0.00 19.45 18.53 1pbf n ALA 216 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1pbf n THR 217 N -2.17 1.53 -3.68 0.00 -2.24 -1.26 -4.32 114.28 102.13 1pbf n THR 217 Ca 0.04 -2.04 -0.11 0.00 -2.27 0.00 0.00 64.05 59.67 1pbf n THR 217 Cb 0.30 -0.04 -0.11 0.00 -2.10 0.00 0.00 70.33 68.38 1pbf n THR 217 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1pbf s ARG 218 N -2.30 0.30 0.20 -0.78 3.52 -0.95 -2.95 118.95 115.99 1pbf s ARG 218 Ca 0.28 0.82 0.10 0.00 -0.13 0.00 0.00 55.73 56.81 1pbf s ARG 218 Cb 0.26 0.07 -0.04 0.00 -1.56 0.00 0.00 34.95 33.68 1pbf s ARG 218 CO -0.01 -0.21 -0.16 -1.12 -0.81 0.00 0.00 175.30 172.99 1pbf s SER 219 N 1.94 3.85 -0.07 -2.12 0.01 -0.41 -0.40 113.70 116.50 1pbf s SER 219 Ca -0.05 -0.76 0.01 0.00 1.31 0.00 0.00 55.95 56.46 1pbf s SER 219 Cb -0.10 -0.48 0.02 0.00 0.21 0.00 0.00 66.02 65.66 1pbf s SER 219 CO -0.11 0.10 -0.07 -0.60 0.41 0.00 0.00 173.24 172.96 1pbf s ARG 220 N -2.91 1.25 0.17 12.44 3.00 -0.15 -1.34 118.95 131.41 1pbf s ARG 220 Ca 0.24 -0.21 0.05 0.00 -1.00 0.00 0.00 55.73 54.81 1pbf s ARG 220 Cb -0.08 -1.22 -0.05 0.00 0.00 0.00 0.00 34.95 33.60 1pbf s ARG 220 CO 0.13 -0.12 -0.11 0.71 0.00 0.00 0.00 175.30 175.91 1pbf s TYR 221 N 1.17 1.42 -0.01 5.12 2.02 0.18 0.32 117.35 127.57 1pbf s TYR 221 Ca -0.06 -0.71 -0.24 0.00 -0.37 0.00 0.00 57.07 55.68 1pbf s TYR 221 Cb -0.14 -0.71 0.05 0.00 -0.40 0.00 0.00 41.96 40.76 1pbf s TYR 221 CO -0.02 0.16 0.53 0.00 -1.57 0.00 0.00 175.55 174.66 1pbf s ALA 222 N -3.22 -1.38 0.00 3.71 0.00 -0.97 -0.21 121.76 119.69 1pbf s ALA 222 Ca 0.19 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.00 1pbf s ALA 222 Cb 0.02 0.12 -0.00 0.00 0.00 0.00 0.00 23.12 23.26 1pbf s ALA 222 CO 0.03 -0.38 -0.00 0.14 0.00 0.00 0.00 175.76 175.55 1pbf s VAL 223 N -1.57 0.02 0.24 0.00 -7.23 -0.93 -1.08 120.40 109.85 1pbf s VAL 223 Ca -0.10 -0.10 -0.30 0.00 -1.81 0.00 0.00 61.98 59.67 1pbf s VAL 223 Cb -0.02 -0.04 -0.09 0.00 0.56 0.00 0.00 36.38 36.79 1pbf s VAL 223 CO 0.05 -0.05 1.34 -1.58 -0.31 0.00 0.00 175.10 174.55 1pbf s GLN 224 N -0.15 4.36 0.04 4.82 0.74 -0.19 -1.28 119.66 128.00 1pbf s GLN 224 Ca -0.02 2.14 -0.01 0.00 0.05 0.00 0.00 55.36 57.52 1pbf s GLN 224 Cb -0.01 -3.15 -0.03 0.00 1.10 0.00 0.00 33.01 30.91 1pbf s GLN 224 CO -0.00 -0.27 -0.02 0.14 -0.55 0.00 0.00 175.29 174.59 1pbf s VAL 225 N -0.17 0.19 0.94 1.34 -7.23 -0.65 -4.73 120.40 110.08 1pbf s VAL 225 Ca 0.56 -1.59 -0.11 0.00 -1.81 0.00 0.00 61.98 59.03 1pbf s VAL 225 Cb -0.38 -1.25 0.15 0.00 0.56 0.00 0.00 36.38 35.47 1pbf s VAL 225 CO 0.42 -0.88 1.10 -2.84 -0.31 0.00 0.00 175.10 172.60 1pbf s PRO 226 N -3.39 0.89 0.06 4.82 0.02 -1.26 -0.89 135.00 135.25 1pbf s PRO 226 Ca 0.02 1.23 0.22 0.00 0.02 0.00 0.00 61.00 62.48 1pbf s PRO 226 Cb 0.04 -1.74 0.89 0.00 0.02 0.00 0.00 34.50 33.71 1pbf s PRO 226 CO -0.08 -2.61 1.68 1.28 -0.33 0.00 0.00 177.00 176.94 1pbf n LEU 227 N -4.19 0.18 -0.06 -5.54 4.77 -1.26 -2.80 117.00 108.12 1pbf n LEU 227 Ca 0.09 0.53 0.13 0.00 -0.03 0.00 0.00 56.01 56.73 1pbf n LEU 227 Cb 0.53 -0.49 0.49 0.00 -2.33 0.00 0.00 43.42 41.61 1pbf n LEU 227 CO 0.53 -0.21 0.75 0.35 -1.33 0.00 0.00 177.39 177.48 1pbf n THR 228 N -1.69 0.00 -2.80 -5.08 -2.24 -1.26 -4.89 114.28 96.32 1pbf n THR 228 Ca 0.05 -0.03 -0.41 0.00 -2.27 0.00 0.00 64.05 61.38 1pbf n THR 228 Cb 0.26 -0.07 -0.04 0.00 -2.10 0.00 0.00 70.33 68.39 1pbf n THR 228 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1pbf s GLU 229 N -2.78 4.53 -0.18 -0.78 0.41 -1.12 -5.04 118.70 113.74 1pbf s GLU 229 Ca 0.19 1.28 -0.09 0.00 -0.41 0.00 0.00 54.97 55.94 1pbf s GLU 229 Cb 0.19 -3.45 -0.05 0.00 -1.78 0.00 0.00 34.13 29.04 1pbf s GLU 229 CO 0.56 -0.00 0.13 -1.59 -0.49 0.00 0.00 175.26 173.87 1pbf s LYS 230 N 0.89 3.95 0.45 1.61 -2.85 -1.26 -5.00 119.74 117.54 1pbf s LYS 230 Ca 0.48 -0.20 0.20 0.00 -1.00 0.00 0.00 55.97 55.45 1pbf s LYS 230 Cb -0.20 -3.34 1.18 0.00 -2.06 0.00 0.00 37.83 33.41 1pbf s LYS 230 CO 0.25 0.44 1.89 -0.24 0.10 0.00 0.00 175.35 177.80 1pbf h VAL 231 N 4.48 0.69 0.00 1.79 3.04 -1.96 -0.47 116.25 123.81 1pbf h VAL 231 Ca -0.45 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.14 1pbf h VAL 231 Cb 1.17 0.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.83 1pbf h VAL 231 CO 0.70 0.05 0.00 -1.84 -1.01 0.00 0.00 177.57 175.48 1pbf n GLU 232 N -4.45 0.39 0.02 4.17 0.00 -1.26 -1.65 120.64 117.86 1pbf n GLU 232 Ca 0.17 0.04 0.11 0.00 0.00 0.00 0.00 57.16 57.48 1pbf n GLU 232 Cb 0.69 -1.50 0.05 0.00 0.00 0.00 0.00 31.44 30.68 1pbf n GLU 232 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1pbf n ASP 233 N -1.08 0.64 -4.22 -1.84 9.92 -0.19 -4.74 116.55 115.04 1pbf n ASP 233 Ca 0.10 -0.32 -0.42 0.00 -0.53 0.00 0.00 54.79 53.62 1pbf n ASP 233 Cb 0.07 0.71 -0.07 0.00 -0.64 0.00 0.00 41.12 41.18 1pbf n ASP 233 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 1pbf s TRP 234 N -3.13 3.48 0.85 1.24 0.52 -0.66 -5.04 118.94 116.19 1pbf s TRP 234 Ca 0.06 -2.03 -0.11 0.00 0.02 0.00 0.00 56.10 54.04 1pbf s TRP 234 Cb 0.15 -3.53 0.10 0.00 -1.15 0.00 0.00 33.47 29.04 1pbf s TRP 234 CO 0.79 -0.97 1.09 -1.54 0.02 0.00 0.00 176.95 176.35 1pbf s SER 235 N 2.24 3.97 0.17 2.95 1.04 -1.26 -4.83 113.70 117.99 1pbf s SER 235 Ca 0.10 1.44 -0.14 0.00 0.48 0.00 0.00 55.95 57.83 1pbf s SER 235 Cb -0.22 -2.15 0.10 0.00 0.10 0.00 0.00 66.02 63.85 1pbf s SER 235 CO -0.03 -2.32 1.77 0.44 0.98 0.00 0.00 173.24 174.09 1pbf h ASP 236 N -1.33 0.28 -0.54 7.02 3.32 -1.97 -1.36 116.42 121.85 1pbf h ASP 236 Ca -0.48 0.03 0.11 0.00 0.02 0.00 0.00 57.03 56.71 1pbf h ASP 236 Cb 1.27 -0.02 -0.09 0.00 0.22 0.00 0.00 39.33 40.71 1pbf h ASP 236 CO 0.56 0.20 0.00 -0.33 -1.72 0.00 0.00 179.24 177.96 1pbf h GLU 237 N 0.42 0.12 -0.78 3.56 5.08 -1.95 -0.39 114.58 120.62 1pbf h GLU 237 Ca 0.20 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1pbf h GLU 237 Cb 0.13 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 1pbf h GLU 237 CO -0.15 0.08 0.43 -0.09 -1.00 0.00 0.00 179.01 178.28 1pbf h ARG 238 N 0.12 1.09 0.53 2.33 2.43 -1.74 -2.39 114.38 116.74 1pbf h ARG 238 Ca 0.27 -0.12 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 1pbf h ARG 238 Cb 0.42 -0.22 0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1pbf h ARG 238 CO -0.45 0.79 -0.25 0.35 -1.51 0.00 0.00 179.97 178.90 1pbf h PHE 239 N 1.09 -0.66 -0.82 2.20 3.57 -0.01 -1.92 116.94 120.40 1pbf h PHE 239 Ca 0.28 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.80 1pbf h PHE 239 Cb 0.02 0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.93 1pbf h PHE 239 CO 0.01 -0.35 0.54 -1.49 -2.23 0.00 0.00 178.31 174.79 1pbf h TRP 240 N -0.86 0.97 -0.35 0.41 4.06 -1.34 0.42 115.95 119.26 1pbf h TRP 240 Ca -0.07 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.87 1pbf h TRP 240 Cb 0.60 -0.32 -0.01 0.00 -1.00 0.00 0.00 29.16 28.42 1pbf h TRP 240 CO -0.01 0.56 0.11 1.15 -3.56 0.00 0.00 178.44 176.68 1pbf h THR 241 N 1.00 1.21 -0.58 1.49 2.02 -1.42 0.25 112.91 116.88 1pbf h THR 241 Ca 0.33 -0.69 -0.06 0.00 0.77 0.00 0.00 66.41 66.75 1pbf h THR 241 Cb 0.06 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1pbf h THR 241 CO -0.10 0.24 0.12 -0.08 0.37 0.00 0.00 175.52 176.07 1pbf h GLU 242 N 0.42 0.95 0.04 6.66 4.57 -0.50 -1.39 114.58 125.33 1pbf h GLU 242 Ca 0.11 -0.24 -0.00 0.00 -1.18 0.00 0.00 59.36 58.05 1pbf h GLU 242 Cb 0.26 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1pbf h GLU 242 CO -0.00 0.89 -0.02 1.25 -1.18 0.00 0.00 179.01 179.95 1pbf h LEU 243 N 0.85 -0.05 -1.35 1.64 6.46 -0.00 -2.67 115.31 120.19 1pbf h LEU 243 Ca 0.18 -0.08 0.02 0.00 -0.12 0.00 0.00 57.88 57.88 1pbf h LEU 243 Cb 0.38 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.29 1pbf h LEU 243 CO 0.01 0.05 0.45 0.11 -0.62 0.00 0.00 178.44 178.44 1pbf h LYS 244 N -0.14 0.85 0.00 1.25 1.57 -0.81 -1.72 116.57 117.56 1pbf h LYS 244 Ca -0.01 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 1pbf h LYS 244 Cb 0.12 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 1pbf h LYS 244 CO 0.01 0.56 -0.16 0.00 -0.57 0.00 0.00 179.45 179.29 1pbf h ALA 245 N 1.59 1.33 -0.01 3.86 0.00 -0.93 -3.07 119.26 122.03 1pbf h ALA 245 Ca 0.26 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1pbf h ALA 245 Cb -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1pbf h ALA 245 CO -0.07 0.20 -0.43 0.54 0.00 0.00 0.00 179.25 179.49 1pbf n ARG 246 N -3.75 1.05 -3.64 0.00 1.74 -0.66 -4.99 116.66 106.41 1pbf n ARG 246 Ca -0.02 -0.81 -0.20 0.00 -0.77 0.00 0.00 57.85 56.05 1pbf n ARG 246 Cb 0.27 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.20 1pbf n ARG 246 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1pbf s LEU 247 N -2.51 3.69 0.32 0.55 1.43 -1.13 -4.68 118.68 116.36 1pbf s LEU 247 Ca 0.20 -0.42 -0.29 0.00 -1.03 0.00 0.00 54.13 52.58 1pbf s LEU 247 Cb 0.18 -2.39 -0.11 0.00 0.03 0.00 0.00 46.19 43.91 1pbf s LEU 247 CO 0.57 -0.43 1.42 -2.84 0.23 0.00 0.00 176.35 175.30 1pbf s PRO 248 N -4.08 4.24 0.33 1.29 0.02 -1.26 -4.75 135.00 130.79 1pbf s PRO 248 Ca 0.44 2.37 0.10 0.00 0.02 0.00 0.00 61.00 63.93 1pbf s PRO 248 Cb -0.07 -3.05 0.89 0.00 0.02 0.00 0.00 34.50 32.29 1pbf s PRO 248 CO 0.28 -0.39 1.75 0.00 -0.33 0.00 0.00 177.00 178.31 1pbf h ALA 249 N 3.90 1.85 0.00 -1.55 0.00 -1.94 0.17 119.26 121.69 1pbf h ALA 249 Ca -0.48 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 1pbf h ALA 249 Cb 1.23 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1pbf h ALA 249 CO 0.70 -0.28 -0.20 1.05 0.00 0.00 0.00 179.25 180.52 1pbf h GLU 250 N 0.59 0.00 0.07 0.00 9.09 -1.99 -2.51 114.58 119.83 1pbf h GLU 250 Ca 0.62 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.78 1pbf h GLU 250 Cb 1.19 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.28 1pbf h GLU 250 CO -0.42 0.20 -1.30 0.28 0.05 0.00 0.00 179.01 177.82 1pbf h VAL 251 N 0.00 1.02 -0.36 -1.06 2.07 -1.13 -3.35 116.25 113.45 1pbf h VAL 251 Ca -0.00 -2.32 0.10 0.00 0.82 0.00 0.00 66.70 65.30 1pbf h VAL 251 Cb 0.44 2.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.80 1pbf h VAL 251 CO 0.03 0.60 0.30 0.00 0.02 0.00 0.00 177.57 178.52 1pbf h ALA 252 N -0.16 2.18 -0.02 1.67 0.00 -0.93 -0.01 119.26 121.98 1pbf h ALA 252 Ca -0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1pbf h ALA 252 Cb 1.58 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1pbf h ALA 252 CO -0.03 -0.49 -0.02 -0.85 0.00 0.00 0.00 179.25 177.87 1pbf n GLU 253 N -4.11 1.76 -0.00 0.00 -0.00 -0.95 -3.56 120.64 113.78 1pbf n GLU 253 Ca 0.06 -1.14 0.09 0.00 -0.00 0.00 0.00 57.16 56.16 1pbf n GLU 253 Cb 0.48 -1.48 -0.11 0.00 -0.00 0.00 0.00 31.44 30.33 1pbf n GLU 253 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1pbf n LYS 254 N 0.37 0.98 -1.66 3.44 5.02 -0.06 -4.98 118.16 121.27 1pbf n LYS 254 Ca 0.18 -0.05 -0.42 0.00 -2.02 0.00 0.00 58.31 55.99 1pbf n LYS 254 Cb 0.41 -1.36 -0.03 0.00 -0.02 0.00 0.00 35.03 34.02 1pbf n LYS 254 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1pbf s LEU 255 N -3.28 4.29 -0.41 -0.35 2.96 -0.92 -4.87 118.68 116.10 1pbf s LEU 255 Ca 0.02 2.56 -0.17 0.00 -0.22 0.00 0.00 54.13 56.33 1pbf s LEU 255 Cb 0.13 -3.53 0.02 0.00 0.50 0.00 0.00 46.19 43.31 1pbf s LEU 255 CO 0.73 -1.19 0.42 -0.69 -1.32 0.00 0.00 176.35 174.31 1pbf s VAL 256 N 5.02 5.10 0.67 1.68 1.01 -1.26 -5.06 120.40 127.55 1pbf s VAL 256 Ca 0.90 -0.28 -0.02 0.00 0.00 0.00 0.00 61.98 62.58 1pbf s VAL 256 Cb -0.41 -4.00 0.08 0.00 0.00 0.00 0.00 36.38 32.05 1pbf s VAL 256 CO 0.41 -0.37 0.93 0.42 0.00 0.00 0.00 175.10 176.49 1pbf s THR 257 N 2.11 2.35 0.00 3.92 -4.23 -1.26 -4.68 115.64 113.85 1pbf s THR 257 Ca 0.12 -0.53 0.00 0.00 -1.18 0.00 0.00 61.69 60.10 1pbf s THR 257 Cb -0.17 -2.82 0.00 0.00 1.34 0.00 0.00 72.50 70.85 1pbf s THR 257 CO 0.13 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 1pbf n GLY 258 N -2.72 -0.05 3.77 3.99 0.00 -1.26 -4.97 105.19 103.95 1pbf n GLY 258 Ca 0.11 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.82 1pbf n GLY 258 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1pbf s PRO 259 N -2.00 3.79 0.28 1.61 0.02 -1.26 -4.99 135.00 132.45 1pbf s PRO 259 Ca 0.00 2.28 -0.20 0.00 0.02 0.00 0.00 61.00 63.10 1pbf s PRO 259 Cb 0.00 -2.68 -0.09 0.00 0.02 0.00 0.00 34.50 31.75 1pbf s PRO 259 CO 0.00 -0.69 0.80 -1.54 -0.33 0.00 0.00 177.00 175.24 1pbf s SER 260 N -0.64 7.06 -0.14 2.53 1.04 -1.26 -4.31 113.70 117.98 1pbf s SER 260 Ca 0.60 1.51 0.02 0.00 0.48 0.00 0.00 55.95 58.56 1pbf s SER 260 Cb -0.41 -2.46 -0.23 0.00 0.10 0.00 0.00 66.02 63.02 1pbf s SER 260 CO 0.52 -0.07 0.27 0.18 0.98 0.00 0.00 173.24 175.13 1pbf n LEU 261 N 0.37 2.06 -3.83 2.42 4.77 0.11 -4.98 117.00 117.91 1pbf n LEU 261 Ca 0.01 0.16 -0.12 0.00 -0.03 0.00 0.00 56.01 56.03 1pbf n LEU 261 Cb 0.51 -0.63 -0.09 0.00 -2.33 0.00 0.00 43.42 40.89 1pbf n LEU 261 CO 0.43 0.74 -0.10 -0.70 -1.33 0.00 0.00 177.39 176.42 1pbf s GLU 262 N -2.55 0.60 -0.19 3.23 -6.30 -1.16 -4.99 118.70 107.34 1pbf s GLU 262 Ca -0.20 -0.41 -0.19 0.00 -2.50 0.00 0.00 54.97 51.67 1pbf s GLU 262 Cb 0.07 0.25 0.05 0.00 0.00 0.00 0.00 34.13 34.51 1pbf s GLU 262 CO 0.75 -0.16 0.53 0.21 0.02 0.00 0.00 175.26 176.61 1pbf s LYS 263 N -1.72 0.63 -0.22 4.30 2.20 -1.26 -1.25 119.74 122.42 1pbf s LYS 263 Ca -0.12 0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 55.91 1pbf s LYS 263 Cb -0.05 0.30 0.16 0.00 -1.51 0.00 0.00 37.83 36.73 1pbf s LYS 263 CO 0.01 -0.08 1.17 -1.54 -0.36 0.00 0.00 175.35 174.55 1pbf s SER 264 N 0.22 -0.21 -0.28 1.43 1.04 -0.97 -4.99 113.70 109.94 1pbf s SER 264 Ca -0.00 0.22 -0.08 0.00 0.48 0.00 0.00 55.95 56.57 1pbf s SER 264 Cb -0.04 0.17 -0.01 0.00 0.10 0.00 0.00 66.02 66.25 1pbf s SER 264 CO 0.01 -0.20 0.10 -0.63 0.98 0.00 0.00 173.24 173.50 1pbf s ILE 265 N -1.10 4.30 -0.23 -1.02 1.01 -1.26 -0.60 121.20 122.30 1pbf s ILE 265 Ca 0.03 -0.42 -0.09 0.00 0.00 0.00 0.00 60.65 60.18 1pbf s ILE 265 Cb -0.01 -3.13 -0.04 0.00 0.01 0.00 0.00 42.46 39.29 1pbf s ILE 265 CO -0.03 0.17 0.11 0.00 0.00 0.00 0.00 174.94 175.19 1pbf s ALA 266 N 1.58 3.42 0.46 9.38 0.00 0.22 -4.92 121.76 131.92 1pbf s ALA 266 Ca 0.05 -0.93 -0.21 0.00 0.00 0.00 0.00 51.96 50.87 1pbf s ALA 266 Cb -0.16 -2.15 -0.09 0.00 0.00 0.00 0.00 23.12 20.71 1pbf s ALA 266 CO 0.04 -0.19 1.01 -2.14 0.00 0.00 0.00 175.76 174.48 1pbf s PRO 267 N 1.06 3.95 0.02 0.00 0.02 -1.26 -0.06 135.00 138.73 1pbf s PRO 267 Ca 0.06 1.29 -0.12 0.00 0.02 0.00 0.00 61.00 62.24 1pbf s PRO 267 Cb -0.14 -2.14 -0.06 0.00 0.02 0.00 0.00 34.50 32.19 1pbf s PRO 267 CO 0.04 -0.29 0.38 -0.51 -0.33 0.00 0.00 177.00 176.29 1pbf s LEU 268 N -3.35 4.43 0.04 -5.54 1.02 -1.10 -4.88 118.68 109.29 1pbf s LEU 268 Ca 0.65 0.86 -0.27 0.00 0.02 0.00 0.00 54.13 55.39 1pbf s LEU 268 Cb -0.14 -2.68 0.08 0.00 0.02 0.00 0.00 46.19 43.47 1pbf s LEU 268 CO 0.18 0.28 0.69 -0.60 0.02 0.00 0.00 176.35 176.92 1pbf s ARG 269 N -1.36 1.10 -0.05 1.70 3.52 -1.26 -2.28 118.95 120.31 1pbf s ARG 269 Ca 0.26 -0.15 0.05 0.00 -0.13 0.00 0.00 55.73 55.77 1pbf s ARG 269 Cb -0.15 0.51 -0.01 0.00 -1.56 0.00 0.00 34.95 33.74 1pbf s ARG 269 CO 0.14 -0.43 -0.20 -1.12 -0.81 0.00 0.00 175.30 172.88 1pbf s SER 270 N -2.04 2.52 -0.24 -2.12 0.01 0.86 -1.78 113.70 110.90 1pbf s SER 270 Ca -0.03 -0.42 -0.12 0.00 1.31 0.00 0.00 55.95 56.69 1pbf s SER 270 Cb -0.01 -0.70 0.08 0.00 0.21 0.00 0.00 66.02 65.60 1pbf s SER 270 CO -0.03 0.19 0.58 0.12 0.41 0.00 0.00 173.24 174.50 1pbf s PHE 271 N -0.03 -0.94 -0.01 2.43 2.19 -0.03 -1.12 117.98 120.46 1pbf s PHE 271 Ca -0.04 1.86 0.00 0.00 0.33 0.00 0.00 56.93 59.08 1pbf s PHE 271 Cb -0.12 0.52 0.01 0.00 -1.31 0.00 0.00 43.02 42.12 1pbf s PHE 271 CO 0.03 -0.49 -0.00 0.08 1.83 0.00 0.00 175.22 176.67 1pbf s VAL 272 N 1.81 0.13 -0.08 3.12 1.01 -0.17 -0.62 120.40 125.60 1pbf s VAL 272 Ca -0.09 0.02 0.04 0.00 0.00 0.00 0.00 61.98 61.95 1pbf s VAL 272 Cb -0.07 -0.18 -0.02 0.00 0.00 0.00 0.00 36.38 36.11 1pbf s VAL 272 CO -0.17 0.09 -0.18 0.54 0.00 0.00 0.00 175.10 175.38 1pbf s VAL 273 N 0.52 2.66 -0.08 2.92 0.11 -1.06 -0.94 120.40 124.53 1pbf s VAL 273 Ca -0.05 -0.84 0.01 0.00 -2.93 0.00 0.00 61.98 58.17 1pbf s VAL 273 Cb -0.07 -2.04 0.02 0.00 -1.53 0.00 0.00 36.38 32.76 1pbf s VAL 273 CO -0.01 0.56 -0.08 -1.61 -3.33 0.00 0.00 175.10 170.64 1pbf s GLU 274 N -0.20 1.34 0.58 1.54 2.02 -0.14 -4.34 118.70 119.50 1pbf s GLU 274 Ca -0.01 -0.24 -0.06 0.00 0.02 0.00 0.00 54.97 54.68 1pbf s GLU 274 Cb -0.13 -1.30 0.13 0.00 0.10 0.00 0.00 34.13 32.92 1pbf s GLU 274 CO 0.03 -0.13 0.80 -0.35 0.02 0.00 0.00 175.26 175.63 1pbf n PRO 275 N 4.39 -0.43 -1.14 0.39 -0.04 -1.26 -0.83 135.00 136.08 1pbf n PRO 275 Ca -0.18 -1.59 -0.20 0.00 -0.04 0.00 0.00 63.50 61.49 1pbf n PRO 275 Cb 0.51 -0.71 0.18 0.00 -0.04 0.00 0.00 33.50 33.44 1pbf n PRO 275 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1pbf n MET 276 N -2.61 2.16 -3.44 0.54 2.81 -1.26 -4.92 117.12 110.41 1pbf n MET 276 Ca 0.11 -3.05 -0.12 0.00 -1.81 0.00 0.00 57.70 52.83 1pbf n MET 276 Cb 0.39 -2.10 -0.02 0.00 -0.71 0.00 0.00 33.22 30.78 1pbf n MET 276 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 1pbf s GLN 277 N -3.29 1.21 -0.25 0.03 -2.07 -1.26 -0.75 119.66 113.28 1pbf s GLN 277 Ca 0.54 -0.41 -0.03 0.00 -1.82 0.00 0.00 55.36 53.64 1pbf s GLN 277 Cb 0.46 0.56 0.14 0.00 -1.09 0.00 0.00 33.01 33.08 1pbf s GLN 277 CO 0.08 -0.52 0.42 -1.58 -1.32 0.00 0.00 175.29 172.37 1pbf s HIS 278 N -3.53 -0.96 0.00 9.60 2.46 0.04 -5.01 115.29 117.90 1pbf s HIS 278 Ca 0.01 1.10 0.00 0.00 0.47 0.00 0.00 55.06 56.64 1pbf s HIS 278 Cb -0.01 0.16 0.00 0.00 -0.13 0.00 0.00 32.58 32.60 1pbf s HIS 278 CO -0.11 -0.71 0.00 0.41 -2.47 0.00 0.00 174.74 171.86 1pbf n GLY 279 N 5.38 2.57 1.53 1.59 0.00 -1.26 -1.07 105.19 113.93 1pbf n GLY 279 Ca -0.04 0.32 0.10 0.00 0.00 0.00 0.00 46.02 46.39 1pbf n GLY 279 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pbf n ARG 280 N 5.92 3.62 -4.24 1.61 1.74 0.11 -4.89 116.66 120.53 1pbf n ARG 280 Ca 0.00 -2.85 -0.35 0.00 -0.77 0.00 0.00 57.85 53.88 1pbf n ARG 280 Cb 0.00 -1.85 -0.10 0.00 -1.02 0.00 0.00 32.46 29.49 1pbf n ARG 280 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1pbf s LEU 281 N -1.77 3.61 -0.07 0.55 2.96 -0.23 -1.17 118.68 122.56 1pbf s LEU 281 Ca 0.50 0.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.50 1pbf s LEU 281 Cb 0.32 -1.87 0.01 0.00 0.50 0.00 0.00 46.19 45.15 1pbf s LEU 281 CO 0.25 0.26 -0.12 -0.36 -1.32 0.00 0.00 176.35 175.06 1pbf s PHE 282 N -0.15 1.51 0.10 5.38 0.40 -0.67 -0.78 117.98 123.77 1pbf s PHE 282 Ca 0.05 -0.59 -0.13 0.00 -0.60 0.00 0.00 56.93 55.67 1pbf s PHE 282 Cb -0.12 -1.11 -0.06 0.00 0.51 0.00 0.00 43.02 42.23 1pbf s PHE 282 CO 0.02 -0.31 0.48 -0.51 0.70 0.00 0.00 175.22 175.59 1pbf s LEU 283 N 0.77 4.37 0.01 -0.37 1.43 0.07 0.18 118.68 125.15 1pbf s LEU 283 Ca -0.12 0.97 -0.08 0.00 -1.03 0.00 0.00 54.13 53.86 1pbf s LEU 283 Cb -0.15 -3.04 0.00 0.00 0.03 0.00 0.00 46.19 43.03 1pbf s LEU 283 CO 0.02 0.17 0.16 0.00 0.23 0.00 0.00 176.35 176.94 1pbf s ALA 284 N -1.36 -0.36 0.00 4.21 0.00 -0.27 -4.87 121.76 119.11 1pbf s ALA 284 Ca 0.33 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.16 1pbf s ALA 284 Cb -0.15 0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.11 1pbf s ALA 284 CO 0.18 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.11 1pbf n GLY 285 N 1.29 2.11 0.00 0.00 0.00 -1.26 -2.81 105.19 104.52 1pbf n GLY 285 Ca -0.22 -0.55 0.04 0.00 0.00 0.00 0.00 46.02 45.30 1pbf n GLY 285 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pbf n ASP 286 N 1.58 0.00 0.22 1.61 9.92 -1.26 -2.07 116.55 126.55 1pbf n ASP 286 Ca 0.00 0.42 0.10 0.00 -0.53 0.00 0.00 54.79 54.78 1pbf n ASP 286 Cb 0.00 -0.45 0.47 0.00 -0.64 0.00 0.00 41.12 40.50 1pbf n ASP 286 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1pbf h ALA 287 N 2.34 1.04 0.00 2.24 0.00 -1.64 -2.25 119.26 120.99 1pbf h ALA 287 Ca 0.00 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.51 1pbf h ALA 287 Cb 0.14 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1pbf h ALA 287 CO 0.00 0.29 -1.70 0.00 0.00 0.00 0.00 179.25 177.84 1pbf n ALA 288 N -2.24 1.74 -3.25 0.00 0.00 -0.88 -4.68 120.51 111.20 1pbf n ALA 288 Ca -0.00 -0.63 -0.14 0.00 0.00 0.00 0.00 53.44 52.68 1pbf n ALA 288 Cb 0.42 0.09 -0.08 0.00 0.00 0.00 0.00 19.45 19.88 1pbf n ALA 288 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1pbf s HIS 289 N -2.25 -0.25 -0.03 0.00 0.00 -1.13 -2.56 115.29 109.08 1pbf s HIS 289 Ca -0.09 0.35 0.04 0.00 -3.00 0.00 0.00 55.06 52.36 1pbf s HIS 289 Cb 0.03 0.15 -0.00 0.00 -4.00 0.00 0.00 32.58 28.76 1pbf s HIS 289 CO 0.37 -0.45 -0.14 0.42 -1.00 0.00 0.00 174.74 173.94 1pbf s ILE 290 N -1.56 1.20 0.06 -5.38 -1.09 0.21 -4.11 121.20 110.54 1pbf s ILE 290 Ca -0.11 -0.60 0.07 0.00 -2.23 0.00 0.00 60.65 57.77 1pbf s ILE 290 Cb -0.04 -1.03 -0.03 0.00 -1.58 0.00 0.00 42.46 39.79 1pbf s ILE 290 CO 0.04 0.35 -0.20 0.68 -1.23 0.00 0.00 174.94 174.58 1pbf s VAL 291 N -0.03 1.61 0.51 2.92 -7.23 -1.26 -0.85 120.40 116.09 1pbf s VAL 291 Ca -0.01 -1.29 -0.22 0.00 -1.81 0.00 0.00 61.98 58.65 1pbf s VAL 291 Cb -0.09 -1.43 -0.06 0.00 0.56 0.00 0.00 36.38 35.36 1pbf s VAL 291 CO 0.01 0.09 1.28 -2.16 -0.31 0.00 0.00 175.10 174.01 1pbf s PRO 292 N -1.42 3.38 0.20 4.82 0.04 -0.73 -4.77 135.00 136.51 1pbf s PRO 292 Ca 0.06 2.06 0.15 0.00 0.04 0.00 0.00 61.00 63.31 1pbf s PRO 292 Cb -0.09 -2.31 0.77 0.00 0.04 0.00 0.00 34.50 32.90 1pbf s PRO 292 CO 0.03 -0.94 1.46 -0.35 0.04 0.00 0.00 177.00 177.23 1pbf n PRO 293 N -0.82 0.10 -0.34 0.56 -0.04 -1.26 -3.76 135.00 129.43 1pbf n PRO 293 Ca 0.09 0.55 0.17 0.00 -0.04 0.00 0.00 63.50 64.28 1pbf n PRO 293 Cb 0.46 -1.79 0.39 0.00 -0.04 0.00 0.00 33.50 32.53 1pbf n PRO 293 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1pbf h THR 294 N 0.00 0.58 -0.02 0.52 2.02 -1.90 -0.07 112.91 114.05 1pbf h THR 294 Ca 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1pbf h THR 294 Cb 0.05 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.39 1pbf h THR 294 CO 0.00 0.11 -0.14 0.61 0.37 0.00 0.00 175.52 176.47 1pbf n GLY 295 N -1.34 0.08 2.46 2.16 0.00 -1.25 -4.91 105.19 102.39 1pbf n GLY 295 Ca 0.26 -0.52 -0.18 0.00 0.00 0.00 0.00 46.02 45.58 1pbf n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pbf n ALA 296 N 0.21 -0.35 0.36 4.61 0.00 -0.04 -4.92 120.51 120.37 1pbf n ALA 296 Ca 0.15 0.24 0.12 0.00 0.00 0.00 0.00 53.44 53.95 1pbf n ALA 296 Cb 0.43 -1.86 0.20 0.00 0.00 0.00 0.00 19.45 18.22 1pbf n ALA 296 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1pbf h LYS 297 N 0.00 0.00 -0.02 0.00 1.79 -1.83 -3.40 116.57 113.11 1pbf h LYS 297 Ca -0.38 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.09 1pbf h LYS 297 Cb 1.20 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.85 1pbf h LYS 297 CO 0.52 0.00 -0.06 0.78 -1.08 0.00 0.00 179.45 179.61 1pbf h GLY 298 N 4.21 -1.60 0.96 3.86 0.00 -1.88 0.18 103.07 108.80 1pbf h GLY 298 Ca 0.00 0.71 0.05 0.00 0.00 0.00 0.00 47.33 48.09 1pbf h GLY 298 CO 0.00 -0.58 0.57 -2.00 0.00 0.00 0.00 176.54 174.53 1pbf h LEU 299 N -0.06 0.91 -1.11 3.11 5.85 -1.93 -2.34 115.31 119.75 1pbf h LEU 299 Ca 0.00 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 1pbf h LEU 299 Cb 0.07 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 1pbf h LEU 299 CO -0.05 0.61 -0.06 0.78 -0.34 0.00 0.00 178.44 179.38 1pbf h ASN 300 N 1.04 0.53 0.47 1.25 2.35 -1.67 -1.73 115.58 117.82 1pbf h ASN 300 Ca 0.36 -0.12 -0.17 0.00 -0.55 0.00 0.00 56.30 55.82 1pbf h ASN 300 Cb 0.11 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 1pbf h ASN 300 CO -0.12 0.65 -0.74 -0.07 -1.65 0.00 0.00 177.43 175.50 1pbf h LEU 301 N 0.53 0.27 -0.38 1.61 3.38 -0.16 -2.29 115.31 118.26 1pbf h LEU 301 Ca 0.10 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1pbf h LEU 301 Cb 0.43 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1pbf h LEU 301 CO 0.02 0.91 0.19 0.00 0.09 0.00 0.00 178.44 179.65 1pbf h ALA 302 N 1.08 0.49 -0.26 1.53 0.00 -1.08 -0.39 119.26 120.63 1pbf h ALA 302 Ca -0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1pbf h ALA 302 Cb 1.31 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1pbf h ALA 302 CO 0.11 0.05 0.15 0.00 0.00 0.00 0.00 179.25 179.57 1pbf h ALA 303 N 1.04 0.33 -0.59 0.00 0.00 -1.23 -0.87 119.26 117.93 1pbf h ALA 303 Ca 0.13 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1pbf h ALA 303 Cb 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1pbf h ALA 303 CO -0.02 -0.17 0.08 0.66 0.00 0.00 0.00 179.25 179.81 1pbf h SER 304 N 0.32 0.92 0.20 0.00 4.64 -1.22 0.13 113.55 118.55 1pbf h SER 304 Ca 0.09 -0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1pbf h SER 304 Cb 0.02 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 61.85 1pbf h SER 304 CO -0.02 0.93 -0.17 0.44 -0.87 0.00 0.00 176.83 177.15 1pbf h ASP 305 N 0.91 -0.44 -0.80 4.97 5.19 -0.85 -1.66 116.42 123.74 1pbf h ASP 305 Ca 0.18 0.04 0.05 0.00 -0.62 0.00 0.00 57.03 56.68 1pbf h ASP 305 Cb 0.42 0.14 -0.05 0.00 0.18 0.00 0.00 39.33 40.02 1pbf h ASP 305 CO 0.01 -0.26 0.53 0.58 -3.12 0.00 0.00 179.24 176.98 1pbf h VAL 306 N -0.38 1.08 -0.71 -1.35 2.07 -0.86 0.05 116.25 116.15 1pbf h VAL 306 Ca -0.01 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 1pbf h VAL 306 Cb 0.35 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.16 1pbf h VAL 306 CO -0.02 0.17 0.28 -1.28 0.02 0.00 0.00 177.57 176.74 1pbf h SER 307 N 0.93 0.98 -0.10 0.57 0.87 -0.18 -0.27 113.55 116.35 1pbf h SER 307 Ca 0.33 -0.17 -0.04 0.00 -1.23 0.00 0.00 61.79 60.68 1pbf h SER 307 Cb 0.14 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 61.85 1pbf h SER 307 CO -0.11 0.89 -0.11 0.74 -0.53 0.00 0.00 176.83 177.71 1pbf h THR 308 N 1.01 1.36 -0.49 2.23 2.02 -0.62 -2.09 112.91 116.33 1pbf h THR 308 Ca 0.24 -1.28 0.02 0.00 0.77 0.00 0.00 66.41 66.16 1pbf h THR 308 Cb 0.22 1.98 -0.03 0.00 -1.74 0.00 0.00 68.15 68.58 1pbf h THR 308 CO -0.02 0.36 0.29 0.25 0.37 0.00 0.00 175.52 176.78 1pbf h LEU 309 N -0.16 0.48 -0.03 2.58 5.85 -0.87 -0.36 115.31 122.79 1pbf h LEU 309 Ca 0.02 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.75 1pbf h LEU 309 Cb 0.63 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 1pbf h LEU 309 CO 0.03 0.34 -0.01 0.22 -0.34 0.00 0.00 178.44 178.68 1pbf h TYR 310 N 0.59 -0.01 0.00 1.25 3.20 -1.08 -1.84 116.97 119.08 1pbf h TYR 310 Ca 0.20 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.03 1pbf h TYR 310 Cb 0.02 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1pbf h TYR 310 CO -0.07 -0.01 -0.20 0.00 -1.64 0.00 0.00 178.16 176.24 1pbf h ARG 311 N 0.00 0.00 0.00 1.82 3.08 -1.00 -1.39 114.38 116.90 1pbf h ARG 311 Ca 0.02 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.92 1pbf h ARG 311 Cb 0.02 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 1pbf h ARG 311 CO -0.03 0.20 -0.73 -0.07 -1.07 0.00 0.00 179.97 178.27 1pbf h LEU 312 N 0.00 0.00 0.00 3.04 3.38 -0.83 -3.18 115.31 117.72 1pbf h LEU 312 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1pbf h LEU 312 Cb 0.50 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1pbf h LEU 312 CO 0.03 0.66 -0.97 -0.07 0.09 0.00 0.00 178.44 178.18 1pbf h LEU 313 N 0.00 0.00 -0.08 1.67 3.38 -0.94 -2.78 115.31 116.56 1pbf h LEU 313 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1pbf h LEU 313 Cb 1.52 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.27 1pbf h LEU 313 CO 0.08 0.85 0.03 0.25 0.09 0.00 0.00 178.44 179.74 1pbf h LEU 314 N 0.00 0.12 -1.02 1.67 6.46 -1.32 -1.17 115.31 120.05 1pbf h LEU 314 Ca -0.04 -0.20 0.01 0.00 -0.12 0.00 0.00 57.88 57.53 1pbf h LEU 314 Cb 1.69 -0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 41.54 1pbf h LEU 314 CO 0.10 0.29 0.66 0.11 -0.62 0.00 0.00 178.44 178.99 1pbf h LYS 315 N -0.06 1.30 0.00 1.25 1.57 -1.60 0.78 116.57 119.82 1pbf h LYS 315 Ca 0.03 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1pbf h LYS 315 Cb 0.21 -0.29 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1pbf h LYS 315 CO -0.00 0.86 -0.00 0.00 -0.57 0.00 0.00 179.45 179.74 1pbf h ALA 316 N 1.38 -0.00 0.24 3.86 0.00 -1.40 0.22 119.26 123.56 1pbf h ALA 316 Ca 0.37 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1pbf h ALA 316 Cb -0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1pbf h ALA 316 CO -0.08 -0.32 -0.12 1.88 0.00 0.00 0.00 179.25 180.61 1pbf h TYR 317 N -0.36 -0.30 -0.32 0.00 0.05 -1.07 -1.58 116.97 113.40 1pbf h TYR 317 Ca -0.00 -0.01 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 1pbf h TYR 317 Cb 0.36 0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.19 1pbf h TYR 317 CO 0.05 0.02 -0.08 -0.09 -1.05 0.00 0.00 178.16 177.00 1pbf h ARG 318 N -0.98 0.63 -0.21 4.88 2.43 0.46 -3.29 114.38 118.29 1pbf h ARG 318 Ca -0.03 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1pbf h ARG 318 Cb 0.45 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1pbf h ARG 318 CO 0.05 0.81 0.00 0.39 -1.51 0.00 0.00 179.97 179.71 1pbf n GLU 319 N -4.44 1.81 -1.43 0.20 1.02 0.62 -4.98 120.64 113.45 1pbf n GLU 319 Ca -0.02 -1.73 -0.15 0.00 -0.02 0.00 0.00 57.16 55.24 1pbf n GLU 319 Cb 0.33 -1.30 -0.06 0.00 -0.02 0.00 0.00 31.44 30.38 1pbf n GLU 319 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pbf n GLY 320 N 0.80 1.51 2.75 0.62 0.00 -0.28 -4.90 105.19 105.68 1pbf n GLY 320 Ca 0.11 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1pbf n GLY 320 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pbf n ARG 321 N -2.47 4.93 0.00 1.61 1.74 -0.54 -4.77 116.66 117.17 1pbf n ARG 321 Ca -0.15 -4.41 0.04 0.00 -0.77 0.00 0.00 57.85 52.57 1pbf n ARG 321 Cb 0.50 -2.53 0.21 0.00 -1.02 0.00 0.00 32.46 29.62 1pbf n ARG 321 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pbf n GLY 322 N 0.78 -0.66 0.19 -0.13 0.00 -1.26 -2.09 105.19 102.03 1pbf n GLY 322 Ca 0.42 -0.04 -0.06 0.00 0.00 0.00 0.00 46.02 46.34 1pbf n GLY 322 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1pbf h GLU 323 N 0.00 0.38 -0.17 1.61 3.07 -1.97 -3.07 114.58 114.44 1pbf h GLU 323 Ca 0.00 -0.23 0.03 0.00 -0.50 0.00 0.00 59.36 58.66 1pbf h GLU 323 Cb 0.11 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 1pbf h GLU 323 CO 0.00 0.82 0.12 -0.07 -1.40 0.00 0.00 179.01 178.47 1pbf h LEU 324 N 0.30 0.06 0.00 1.33 3.38 -1.78 -2.12 115.31 116.48 1pbf h LEU 324 Ca 0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1pbf h LEU 324 Cb 1.03 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1pbf h LEU 324 CO 0.09 0.04 0.00 0.18 0.09 0.00 0.00 178.44 178.84 1pbf n LEU 325 N -4.50 0.00 0.09 1.67 4.77 -1.16 -0.92 117.00 116.95 1pbf n LEU 325 Ca 0.01 0.36 -0.01 0.00 -0.03 0.00 0.00 56.01 56.33 1pbf n LEU 325 Cb 0.20 -0.36 -0.04 0.00 -2.33 0.00 0.00 43.42 40.89 1pbf n LEU 325 CO 0.35 -0.32 0.20 -0.08 -1.33 0.00 0.00 177.39 176.21 1pbf h GLU 326 N 0.00 0.00 0.00 3.23 4.22 -1.59 -3.27 114.58 117.17 1pbf h GLU 326 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1pbf h GLU 326 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1pbf h GLU 326 CO 0.00 0.62 0.00 0.54 -2.18 0.00 0.00 179.01 177.99 1pbf n ARG 327 N -3.20 0.12 -0.14 1.92 1.74 -0.09 -4.28 116.66 112.72 1pbf n ARG 327 Ca -0.01 0.28 -0.06 0.00 -0.77 0.00 0.00 57.85 57.29 1pbf n ARG 327 Cb 0.83 -1.69 -0.05 0.00 -1.02 0.00 0.00 32.46 30.53 1pbf n ARG 327 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 1pbf h TYR 328 N 0.00 -0.92 -0.20 -1.55 3.20 -1.67 -2.14 116.97 113.70 1pbf h TYR 328 Ca 0.00 0.05 0.06 0.00 3.14 0.00 0.00 58.73 61.98 1pbf h TYR 328 Cb 0.40 0.45 -0.06 0.00 1.54 0.00 0.00 36.73 39.05 1pbf h TYR 328 CO 0.00 -0.22 -0.22 0.77 -1.64 0.00 0.00 178.16 176.85 1pbf h SER 329 N -0.10 -0.71 -0.72 -2.11 0.02 -1.87 -1.78 113.55 106.28 1pbf h SER 329 Ca 0.06 0.13 0.10 0.00 -0.84 0.00 0.00 61.79 61.23 1pbf h SER 329 Cb 0.26 0.33 -0.07 0.00 0.14 0.00 0.00 62.40 63.05 1pbf h SER 329 CO -0.39 -0.27 0.36 0.00 -1.14 0.00 0.00 176.83 175.39 1pbf h ALA 330 N 0.78 1.01 -0.18 3.77 0.00 -1.79 0.16 119.26 123.02 1pbf h ALA 330 Ca 0.12 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1pbf h ALA 330 Cb 0.43 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1pbf h ALA 330 CO -0.34 -0.05 0.06 0.82 0.00 0.00 0.00 179.25 179.73 1pbf h ILE 331 N 0.60 1.17 -0.53 0.00 2.04 -1.01 -3.20 117.51 116.58 1pbf h ILE 331 Ca 0.36 -0.53 -0.12 0.00 1.00 0.00 0.00 64.86 65.57 1pbf h ILE 331 Cb 0.40 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 1pbf h ILE 331 CO -0.28 0.17 -0.13 0.00 0.00 0.00 0.00 178.15 177.91 1pbf h LEU 333 N 0.90 0.00 -0.19 0.00 3.38 -0.71 -0.98 115.31 117.71 1pbf h LEU 333 Ca 0.14 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1pbf h LEU 333 Cb 0.70 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1pbf h LEU 333 CO 0.05 0.15 -0.01 0.03 0.09 0.00 0.00 178.44 178.75 1pbf h ARG 334 N 0.00 0.34 0.24 1.13 3.08 -1.56 -1.10 114.38 116.50 1pbf h ARG 334 Ca -0.00 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1pbf h ARG 334 Cb 0.39 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.41 1pbf h ARG 334 CO 0.02 0.55 -0.11 -0.09 -1.07 0.00 0.00 179.97 179.26 1pbf h ARG 335 N 0.09 -0.31 -0.75 0.04 2.43 -1.62 -2.85 114.38 111.41 1pbf h ARG 335 Ca 0.05 0.02 0.17 0.00 -0.81 0.00 0.00 59.98 59.42 1pbf h ARG 335 Cb 0.40 0.07 -0.13 0.00 -0.42 0.00 0.00 29.97 29.89 1pbf h ARG 335 CO 0.01 0.02 0.05 0.82 -1.51 0.00 0.00 179.97 179.36 1pbf h ILE 336 N -0.66 0.37 -0.29 1.20 2.04 -1.17 0.47 117.51 119.48 1pbf h ILE 336 Ca -0.03 -0.05 -0.11 0.00 1.00 0.00 0.00 64.86 65.67 1pbf h ILE 336 Cb 0.46 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1pbf h ILE 336 CO 0.05 0.02 -0.30 -0.50 0.00 0.00 0.00 178.15 177.43 1pbf h TRP 337 N 0.13 0.69 -0.46 1.37 4.06 -1.20 -0.36 115.95 120.19 1pbf h TRP 337 Ca 0.42 -0.17 -0.05 0.00 2.06 0.00 0.00 58.89 61.15 1pbf h TRP 337 Cb 0.75 -0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 28.73 1pbf h TRP 337 CO -0.38 0.83 0.09 0.87 -3.56 0.00 0.00 178.44 176.28 1pbf h LYS 338 N 0.51 0.75 -0.17 0.49 6.56 -0.71 -1.29 116.57 122.72 1pbf h LYS 338 Ca 0.06 -0.19 -0.13 0.00 -1.06 0.00 0.00 60.65 59.33 1pbf h LYS 338 Cb 0.77 -0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 32.33 1pbf h LYS 338 CO 0.06 0.76 -0.46 0.00 -2.06 0.00 0.00 179.45 177.75 1pbf h ALA 339 N 0.96 0.90 -0.20 3.86 0.00 -1.08 -1.80 119.26 121.90 1pbf h ALA 339 Ca 0.14 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 1pbf h ALA 339 Cb 0.36 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1pbf h ALA 339 CO 0.01 0.65 -0.35 0.93 0.00 0.00 0.00 179.25 180.48 1pbf h GLU 340 N 0.34 0.42 -0.27 0.00 4.39 -0.86 -0.26 114.58 118.34 1pbf h GLU 340 Ca 0.02 -0.19 -0.15 0.00 0.34 0.00 0.00 59.36 59.39 1pbf h GLU 340 Cb 0.94 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.58 1pbf h GLU 340 CO 0.08 0.72 -0.40 -0.09 -1.16 0.00 0.00 179.01 178.16 1pbf h ARG 341 N 0.36 0.75 -0.34 2.33 2.43 -1.00 -1.42 114.38 117.49 1pbf h ARG 341 Ca 0.04 -0.45 -0.11 0.00 -0.81 0.00 0.00 59.98 58.66 1pbf h ARG 341 Cb 0.79 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 1pbf h ARG 341 CO 0.06 1.07 -0.21 0.35 -1.51 0.00 0.00 179.97 179.73 1pbf h PHE 342 N 0.50 0.86 -0.46 2.20 3.57 -1.21 -1.27 116.94 121.12 1pbf h PHE 342 Ca 0.03 -0.23 -0.05 0.00 3.53 0.00 0.00 57.97 61.24 1pbf h PHE 342 Cb 1.00 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.52 1pbf h PHE 342 CO 0.08 0.97 0.07 0.77 -2.23 0.00 0.00 178.31 177.96 1pbf h SER 343 N 0.51 0.67 -0.15 0.41 0.02 -1.07 -1.26 113.55 112.69 1pbf h SER 343 Ca 0.07 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 60.86 1pbf h SER 343 Cb 0.77 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 1pbf h SER 343 CO 0.06 0.70 -0.02 -0.25 -1.14 0.00 0.00 176.83 176.17 1pbf h TRP 344 N 0.69 0.31 0.45 3.45 7.01 -1.12 -2.06 115.95 124.68 1pbf h TRP 344 Ca 0.15 -0.06 -0.01 0.00 2.11 0.00 0.00 58.89 61.08 1pbf h TRP 344 Cb 0.32 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.29 1pbf h TRP 344 CO 0.02 0.53 -0.38 2.35 -2.79 0.00 0.00 178.44 178.17 1pbf h TRP 345 N -0.01 -1.03 -0.79 2.65 7.01 -0.91 -0.77 115.95 122.10 1pbf h TRP 345 Ca 0.04 0.00 0.19 0.00 2.11 0.00 0.00 58.89 61.23 1pbf h TRP 345 Cb 0.43 0.39 -0.13 0.00 -2.10 0.00 0.00 29.16 27.75 1pbf h TRP 345 CO 0.04 -0.55 0.15 0.52 -2.79 0.00 0.00 178.44 175.82 1pbf h MET 346 N -0.83 0.20 -0.47 2.65 2.86 -1.27 0.43 114.93 118.50 1pbf h MET 346 Ca -0.04 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1pbf h MET 346 Cb 0.72 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.31 1pbf h MET 346 CO -0.02 0.13 0.27 1.15 1.06 0.00 0.00 176.91 179.50 1pbf h THR 347 N 0.21 1.16 0.00 2.22 2.02 -0.78 -2.71 112.91 115.02 1pbf h THR 347 Ca 0.46 -0.38 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 1pbf h THR 347 Cb 0.84 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1pbf h THR 347 CO -0.60 0.16 -0.16 0.77 0.37 0.00 0.00 175.52 176.06 1pbf h SER 348 N 0.62 0.00 0.28 4.18 4.64 0.53 -2.45 113.55 121.35 1pbf h SER 348 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1pbf h SER 348 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1pbf h SER 348 CO -0.03 0.16 -1.17 1.33 -0.87 0.00 0.00 176.83 176.26 1pbf n VAL 349 N -3.31 0.11 0.07 0.95 0.24 -0.72 -4.46 118.33 111.20 1pbf n VAL 349 Ca 0.00 -0.24 0.08 0.00 -2.04 0.00 0.00 64.34 62.15 1pbf n VAL 349 Cb 0.40 0.32 -0.12 0.00 -1.47 0.00 0.00 33.84 32.98 1pbf n VAL 349 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1pbf n LEU 350 N -1.92 0.07 -4.92 1.34 4.77 -1.03 -4.92 117.00 110.40 1pbf n LEU 350 Ca 0.01 -0.05 -0.30 0.00 -0.03 0.00 0.00 56.01 55.64 1pbf n LEU 350 Cb 0.44 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.49 1pbf n LEU 350 CO 0.42 0.02 -0.09 -1.00 -1.33 0.00 0.00 177.39 175.41 1pbf s HIS 351 N -3.05 3.50 -0.28 -1.77 3.76 -0.93 -4.19 115.29 112.34 1pbf s HIS 351 Ca -0.05 0.32 -0.15 0.00 -0.15 0.00 0.00 55.06 55.03 1pbf s HIS 351 Cb 0.10 -1.82 -0.03 0.00 1.11 0.00 0.00 32.58 31.94 1pbf s HIS 351 CO 0.66 0.53 0.38 0.50 -0.85 0.00 0.00 174.74 175.97 1pbf s ARG 352 N -2.67 3.93 0.01 1.40 6.06 -1.26 -4.91 118.95 121.52 1pbf s ARG 352 Ca 0.37 -0.03 -0.07 0.00 -2.50 0.00 0.00 55.73 53.50 1pbf s ARG 352 Cb -0.12 -3.69 -0.05 0.00 0.06 0.00 0.00 34.95 31.15 1pbf s ARG 352 CO 0.27 -0.34 0.28 -0.06 -2.50 0.00 0.00 175.30 172.96 1pbf s PHE 353 N 2.09 3.58 0.44 5.12 0.40 -1.26 -4.98 117.98 123.37 1pbf s PHE 353 Ca 0.15 0.61 -0.21 0.00 -0.60 0.00 0.00 56.93 56.87 1pbf s PHE 353 Cb -0.16 -2.02 -0.10 0.00 0.51 0.00 0.00 43.02 41.26 1pbf s PHE 353 CO 0.10 0.61 1.00 -1.25 0.70 0.00 0.00 175.22 176.38 1pbf s PRO 354 N -1.73 4.07 -1.12 0.24 0.04 -1.26 -4.01 135.00 131.23 1pbf s PRO 354 Ca 0.28 1.28 -0.06 0.00 0.04 0.00 0.00 61.00 62.54 1pbf s PRO 354 Cb -0.13 -2.24 0.01 0.00 0.04 0.00 0.00 34.50 32.18 1pbf s PRO 354 CO 0.16 -0.18 0.97 -0.25 0.04 0.00 0.00 177.00 177.74 1pbf n ASP 355 N -0.61 -5.06 -4.68 6.66 8.00 -1.26 -5.01 116.55 114.59 1pbf n ASP 355 Ca 0.07 -0.47 -0.35 0.00 0.71 0.00 0.00 54.79 54.76 1pbf n ASP 355 Cb 0.53 -4.33 -0.09 0.00 -0.02 0.00 0.00 41.12 37.21 1pbf n ASP 355 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1pbf s THR 356 N -3.27 5.12 0.92 -3.53 2.01 -1.26 -5.09 115.64 110.53 1pbf s THR 356 Ca 0.41 0.08 -0.14 0.00 0.31 0.00 0.00 61.69 62.35 1pbf s THR 356 Cb -0.18 -3.33 0.15 0.00 0.01 0.00 0.00 72.50 69.16 1pbf s THR 356 CO 0.61 0.44 1.21 1.51 -0.69 0.00 0.00 174.62 177.71 1pbf s ASP 357 N 0.41 3.48 0.23 3.53 1.47 -1.26 -4.89 116.67 119.64 1pbf s ASP 357 Ca 0.06 0.65 -0.07 0.00 1.18 0.00 0.00 52.55 54.37 1pbf s ASP 357 Cb -0.12 -1.00 0.32 0.00 -0.34 0.00 0.00 42.92 41.79 1pbf s ASP 357 CO -0.01 -2.54 1.80 0.00 0.68 0.00 0.00 175.17 175.10 1pbf h ALA 358 N -1.49 1.01 -0.25 2.11 0.00 -2.00 -2.85 119.26 115.78 1pbf h ALA 358 Ca -0.47 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.50 1pbf h ALA 358 Cb 1.30 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1pbf h ALA 358 CO 0.53 0.03 0.12 0.35 0.00 0.00 0.00 179.25 180.28 1pbf h PHE 359 N 0.68 0.22 -0.09 0.00 3.57 -1.99 -1.86 116.94 117.47 1pbf h PHE 359 Ca 0.35 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.81 1pbf h PHE 359 Cb 0.31 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1pbf h PHE 359 CO -0.09 0.12 -0.19 0.66 -2.23 0.00 0.00 178.31 176.59 1pbf h SER 360 N 0.26 0.14 0.20 0.41 4.64 -1.89 -0.81 113.55 116.49 1pbf h SER 360 Ca 0.11 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 1pbf h SER 360 Cb 0.04 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1pbf h SER 360 CO -0.08 0.34 -0.10 1.56 -0.87 0.00 0.00 176.83 177.69 1pbf h GLN 361 N 0.14 -0.26 -0.80 4.77 1.08 -1.24 0.29 115.11 119.09 1pbf h GLN 361 Ca 0.03 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.28 1pbf h GLN 361 Cb 0.42 0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.86 1pbf h GLN 361 CO 0.03 -0.06 0.52 0.00 -0.95 0.00 0.00 178.83 178.37 1pbf h ARG 362 N -0.41 0.96 -0.32 1.46 2.47 -0.97 -0.69 114.38 116.87 1pbf h ARG 362 Ca -0.03 -0.06 -0.17 0.00 -1.26 0.00 0.00 59.98 58.46 1pbf h ARG 362 Cb 0.32 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.42 1pbf h ARG 362 CO 0.04 0.63 -0.48 0.82 0.56 0.00 0.00 179.97 181.55 1pbf h ILE 363 N 0.98 1.27 -0.48 2.04 1.08 -0.92 -0.34 117.51 121.14 1pbf h ILE 363 Ca 0.32 -1.66 -0.01 0.00 -0.39 0.00 0.00 64.86 63.12 1pbf h ILE 363 Cb 0.03 1.53 -0.02 0.00 -3.07 0.00 0.00 36.82 35.29 1pbf h ILE 363 CO -0.09 0.55 0.27 -0.61 -0.69 0.00 0.00 178.15 177.58 1pbf h GLN 364 N 0.70 0.67 -0.42 2.37 4.15 -0.33 0.30 115.11 122.55 1pbf h GLN 364 Ca 0.03 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 1pbf h GLN 364 Cb 1.08 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.62 1pbf h GLN 364 CO 0.11 0.52 0.22 0.37 -1.93 0.00 0.00 178.83 178.12 1pbf h GLN 365 N 0.64 0.59 -0.09 1.69 4.15 -1.08 -2.41 115.11 118.61 1pbf h GLN 365 Ca 0.17 -0.07 -0.11 0.00 0.77 0.00 0.00 58.65 59.40 1pbf h GLN 365 Cb 0.04 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.60 1pbf h GLN 365 CO -0.03 0.48 -0.46 1.15 -1.93 0.00 0.00 178.83 178.05 1pbf h THR 366 N 0.54 1.33 -0.22 2.39 2.02 -0.67 -0.79 112.91 117.51 1pbf h THR 366 Ca 0.15 -1.63 0.02 0.00 0.77 0.00 0.00 66.41 65.72 1pbf h THR 366 Cb 0.07 1.77 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 1pbf h THR 366 CO -0.02 0.48 0.08 -0.33 0.37 0.00 0.00 175.52 176.10 1pbf h GLU 367 N 0.18 0.18 0.22 6.66 4.39 -0.14 0.32 114.58 126.39 1pbf h GLU 367 Ca 0.01 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1pbf h GLU 367 Cb 0.88 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 1pbf h GLU 367 CO 0.07 0.12 -0.11 -0.07 -1.16 0.00 0.00 179.01 177.86 1pbf h LEU 368 N 0.18 -0.26 -0.69 1.33 3.38 -1.10 -0.63 115.31 117.52 1pbf h LEU 368 Ca 0.10 -0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.12 1pbf h LEU 368 Cb 0.06 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 40.81 1pbf h LEU 368 CO -0.10 -0.12 0.32 -0.33 0.09 0.00 0.00 178.44 178.31 1pbf h GLU 369 N -0.38 0.53 0.12 1.13 5.08 -0.74 -0.75 114.58 119.57 1pbf h GLU 369 Ca -0.03 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1pbf h GLU 369 Cb 0.29 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1pbf h GLU 369 CO 0.05 0.35 -0.06 -0.92 -1.00 0.00 0.00 179.01 177.43 1pbf h TYR 370 N 0.54 -0.16 -0.70 4.33 3.20 -0.28 -2.73 116.97 121.17 1pbf h TYR 370 Ca 0.35 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.19 1pbf h TYR 370 Cb 0.40 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.69 1pbf h TYR 370 CO -0.13 0.28 0.35 1.88 -1.64 0.00 0.00 178.16 178.90 1pbf h TYR 371 N -0.66 0.98 -0.00 -3.82 -1.99 -0.89 0.03 116.97 110.61 1pbf h TYR 371 Ca -0.02 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.68 1pbf h TYR 371 Cb 0.50 -0.31 0.00 0.00 2.00 0.00 0.00 36.73 38.92 1pbf h TYR 371 CO 0.07 0.70 -0.12 1.28 -0.00 0.00 0.00 178.16 180.09 1pbf n LEU 372 N -4.34 0.21 -0.08 3.88 4.77 -0.31 -1.95 117.00 119.17 1pbf n LEU 372 Ca 0.07 0.26 -0.09 0.00 -0.03 0.00 0.00 56.01 56.22 1pbf n LEU 372 Cb 0.12 -0.35 -0.13 0.00 -2.33 0.00 0.00 43.42 40.74 1pbf n LEU 372 CO 0.38 0.04 -1.05 0.61 -1.33 0.00 0.00 177.39 176.05 1pbf n GLY 373 N 1.42 -0.80 3.81 -0.72 0.00 -0.91 -4.93 105.19 103.07 1pbf n GLY 373 Ca 0.09 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 1pbf n GLY 373 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pbf s SER 374 N -5.11 7.04 0.18 1.61 0.15 -0.05 -4.97 113.70 112.55 1pbf s SER 374 Ca -0.09 1.57 0.07 0.00 0.70 0.00 0.00 55.95 58.20 1pbf s SER 374 Cb 0.05 -2.48 0.04 0.00 -1.71 0.00 0.00 66.02 61.91 1pbf s SER 374 CO 0.67 -0.16 1.42 -0.33 1.20 0.00 0.00 173.24 176.05 1pbf h GLU 375 N 2.68 0.04 -0.09 5.44 4.39 -1.90 -2.49 114.58 122.65 1pbf h GLU 375 Ca -0.48 -0.05 -0.24 0.00 0.34 0.00 0.00 59.36 58.93 1pbf h GLU 375 Cb 1.18 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.86 1pbf h GLU 375 CO 0.64 0.85 -0.89 0.00 -1.16 0.00 0.00 179.01 178.45 1pbf h ALA 376 N 1.13 0.23 -0.07 3.43 0.00 -1.93 -3.05 119.26 119.01 1pbf h ALA 376 Ca -0.02 -0.64 -0.00 0.00 0.00 0.00 0.00 54.91 54.25 1pbf h ALA 376 Cb 1.47 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 1pbf h ALA 376 CO 0.11 0.68 0.04 0.78 0.00 0.00 0.00 179.25 180.87 1pbf h GLY 377 N 0.49 0.10 1.14 0.00 0.00 -1.77 -2.72 103.07 100.31 1pbf h GLY 377 Ca -0.08 -0.04 0.06 0.00 0.00 0.00 0.00 47.33 47.26 1pbf h GLY 377 CO 0.18 0.04 0.43 1.41 0.00 0.00 0.00 176.54 178.60 1pbf h LEU 378 N 0.06 0.59 -0.83 3.11 3.38 -0.91 -1.72 115.31 118.98 1pbf h LEU 378 Ca 0.02 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1pbf h LEU 378 Cb 0.03 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1pbf h LEU 378 CO -0.00 0.39 -0.00 0.00 0.09 0.00 0.00 178.44 178.91 1pbf h ALA 379 N 1.64 1.03 -0.24 1.53 0.00 -1.38 0.26 119.26 122.10 1pbf h ALA 379 Ca 0.28 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1pbf h ALA 379 Cb 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1pbf h ALA 379 CO -0.09 0.60 -0.21 1.79 0.00 0.00 0.00 179.25 181.35 1pbf h THR 380 N 0.80 1.25 -0.12 0.00 1.35 -1.02 -0.01 112.91 115.16 1pbf h THR 380 Ca 0.15 -1.14 -0.08 0.00 -0.55 0.00 0.00 66.41 64.79 1pbf h THR 380 Cb 0.49 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 1pbf h THR 380 CO 0.02 0.36 -0.24 0.40 -0.25 0.00 0.00 175.52 175.81 1pbf h ILE 381 N 0.39 1.38 0.18 6.82 2.04 -1.23 -3.09 117.51 124.00 1pbf h ILE 381 Ca 0.06 -1.52 -0.01 0.00 1.00 0.00 0.00 64.86 64.39 1pbf h ILE 381 Cb 0.58 2.08 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 1pbf h ILE 381 CO 0.04 0.44 -0.09 0.00 0.00 0.00 0.00 178.15 178.55 1pbf h ALA 382 N 0.52 -0.24 -0.46 1.87 0.00 -0.68 0.14 119.26 120.40 1pbf h ALA 382 Ca 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1pbf h ALA 382 Cb 0.83 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1pbf h ALA 382 CO 0.05 -0.57 0.13 1.05 0.00 0.00 0.00 179.25 179.92 1pbf h GLU 383 N -0.38 0.68 -0.09 0.00 4.11 -1.13 -0.78 114.58 116.99 1pbf h GLU 383 Ca -0.02 -0.12 -0.12 0.00 0.07 0.00 0.00 59.36 59.17 1pbf h GLU 383 Cb 0.29 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.43 1pbf h GLU 383 CO 0.04 0.61 -0.41 -0.91 0.07 0.00 0.00 179.01 178.40 1pbf h ASN 384 N 0.67 0.53 -0.01 3.06 2.35 -1.49 -2.89 115.58 117.79 1pbf h ASN 384 Ca 0.16 -0.64 0.01 0.00 -0.55 0.00 0.00 56.30 55.28 1pbf h ASN 384 Cb 0.22 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1pbf h ASN 384 CO -0.01 1.08 -0.02 0.22 -1.65 0.00 0.00 177.43 177.05 1pbf h TYR 385 N 0.01 -0.05 0.00 1.19 3.20 -0.40 -1.20 116.97 119.72 1pbf h TYR 385 Ca -0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1pbf h TYR 385 Cb 1.06 0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.35 1pbf h TYR 385 CO 0.12 -0.04 0.00 1.33 -1.64 0.00 0.00 178.16 177.93 1pbf n VAL 386 N -5.13 0.88 -0.01 1.81 0.24 -0.33 -4.93 118.33 110.86 1pbf n VAL 386 Ca -0.06 0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.45 1pbf n VAL 386 Cb 0.06 -1.00 0.00 0.00 -1.47 0.00 0.00 33.84 31.43 1pbf n VAL 386 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1pbf n GLY 387 N 0.13 0.57 3.75 7.63 0.00 -0.45 -4.09 105.19 112.73 1pbf n GLY 387 Ca 0.03 -1.28 -0.34 0.00 0.00 0.00 0.00 46.02 44.44 1pbf n GLY 387 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pbf s LEU 388 N -0.20 3.41 0.75 0.99 1.02 -1.20 -4.81 118.68 118.64 1pbf s LEU 388 Ca 0.00 2.17 -0.15 0.00 0.02 0.00 0.00 54.13 56.17 1pbf s LEU 388 Cb 0.00 -4.57 0.05 0.00 0.02 0.00 0.00 46.19 41.69 1pbf s LEU 388 CO 0.00 -1.83 1.21 -0.81 0.02 0.00 0.00 176.35 174.95 1pbf n PRO 389 N -2.38 0.51 -2.79 1.29 -0.04 -1.26 -4.99 135.00 125.34 1pbf n PRO 389 Ca 0.12 0.24 -0.40 0.00 -0.04 0.00 0.00 63.50 63.42 1pbf n PRO 389 Cb 0.51 -2.45 -0.05 0.00 -0.04 0.00 0.00 33.50 31.46 1pbf n PRO 389 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1pbf s TYR 390 N -1.86 3.88 -2.70 0.54 1.51 -1.26 -5.08 117.35 112.38 1pbf s TYR 390 Ca 0.76 1.79 0.26 0.00 -1.01 0.00 0.00 57.07 58.88 1pbf s TYR 390 Cb -0.32 -2.97 0.70 0.00 -0.11 0.00 0.00 41.96 39.26 1pbf s TYR 390 CO 0.47 0.34 1.55 -0.85 -1.11 0.00 0.00 175.55 175.95