#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dgf s ASP 6 N 0.00 6.15 0.21 0.55 -4.77 -1.26 -4.90 116.67 112.66 1dgf s ASP 6 Ca 0.00 1.41 -0.09 0.00 -3.30 0.00 0.00 52.55 50.57 1dgf s ASP 6 Cb 0.00 -2.44 0.31 0.00 -1.09 0.00 0.00 42.92 39.71 1dgf s ASP 6 CO 0.00 -0.92 1.71 -0.65 0.70 0.00 0.00 175.17 176.01 1dgf h PRO 7 N -0.35 0.29 -0.29 2.11 0.11 -1.96 -2.09 132.00 129.82 1dgf h PRO 7 Ca -0.44 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.69 1dgf h PRO 7 Cb 1.19 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 1dgf h PRO 7 CO 0.62 0.19 0.08 0.00 -0.21 0.00 0.00 178.00 178.68 1dgf h ALA 8 N 1.48 0.32 -0.19 -0.75 0.00 -1.93 -2.07 119.26 116.12 1dgf h ALA 8 Ca 0.33 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.26 1dgf h ALA 8 Cb 0.48 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1dgf h ALA 8 CO -0.39 -0.33 0.00 0.77 0.00 0.00 0.00 179.25 179.30 1dgf h SER 9 N 0.20 0.25 -0.36 0.00 0.02 -1.82 -2.62 113.55 109.22 1dgf h SER 9 Ca 0.13 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1dgf h SER 9 Cb 0.12 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.60 1dgf h SER 9 CO -0.16 0.30 0.00 0.47 -1.14 0.00 0.00 176.83 176.30 1dgf n ASP 10 N -4.38 3.63 -0.01 3.07 8.00 -0.80 -4.58 116.55 121.48 1dgf n ASP 10 Ca -0.00 -2.48 -0.09 0.00 0.71 0.00 0.00 54.79 52.93 1dgf n ASP 10 Cb 0.18 -0.57 -0.03 0.00 -0.02 0.00 0.00 41.12 40.68 1dgf n ASP 10 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 1dgf h GLN 11 N 2.42 -0.28 -0.31 -1.24 -0.00 -1.16 -0.32 115.11 114.23 1dgf h GLN 11 Ca 0.00 0.02 -0.05 0.00 -0.00 0.00 0.00 58.65 58.61 1dgf h GLN 11 Cb 1.28 0.06 -0.01 0.00 0.00 0.00 0.00 27.48 28.81 1dgf h GLN 11 CO 0.25 -0.18 -0.02 0.52 0.00 0.00 0.00 178.83 179.40 1dgf h MET 12 N -0.29 0.56 -0.66 1.69 2.86 -1.86 -1.87 114.93 115.36 1dgf h MET 12 Ca 0.11 -0.19 0.09 0.00 -2.06 0.00 0.00 59.70 57.65 1dgf h MET 12 Cb 0.45 -0.05 -0.07 0.00 0.06 0.00 0.00 31.60 31.99 1dgf h MET 12 CO -0.31 0.71 0.30 0.37 1.06 0.00 0.00 176.91 179.04 1dgf h GLN 13 N 0.35 0.51 -0.40 1.72 5.75 -1.82 0.05 115.11 121.27 1dgf h GLN 13 Ca 0.09 -0.03 -0.10 0.00 -0.15 0.00 0.00 58.65 58.46 1dgf h GLN 13 Cb 0.47 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.89 1dgf h GLN 13 CO 0.02 0.34 -0.15 0.45 -2.65 0.00 0.00 178.83 176.84 1dgf h HIS 14 N 0.53 0.82 -0.61 3.99 3.86 -0.96 -1.10 115.15 121.67 1dgf h HIS 14 Ca 0.33 -0.16 -0.06 0.00 -1.16 0.00 0.00 60.37 59.32 1dgf h HIS 14 Cb 0.36 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.59 1dgf h HIS 14 CO -0.13 0.84 0.17 2.35 0.86 0.00 0.00 177.93 182.02 1dgf h TRP 15 N 0.67 1.01 -0.10 2.45 7.01 -0.44 -1.80 115.95 124.75 1dgf h TRP 15 Ca 0.11 -0.11 -0.00 0.00 2.11 0.00 0.00 58.89 60.99 1dgf h TRP 15 Cb 0.62 -0.29 -0.00 0.00 -2.10 0.00 0.00 29.16 27.39 1dgf h TRP 15 CO 0.03 0.85 0.05 -0.22 -2.79 0.00 0.00 178.44 176.35 1dgf h LYS 16 N 0.89 0.15 -0.51 2.65 3.64 -0.75 -2.90 116.57 119.74 1dgf h LYS 16 Ca 0.19 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1dgf h LYS 16 Cb 0.33 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 1dgf h LYS 16 CO -0.00 0.22 0.31 0.93 -2.27 0.00 0.00 179.45 178.65 1dgf h GLU 17 N 0.04 0.67 -0.64 1.90 5.08 -1.06 -1.97 114.58 118.60 1dgf h GLU 17 Ca 0.04 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1dgf h GLU 17 Cb 0.13 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1dgf h GLU 17 CO -0.00 0.47 0.13 0.37 -1.00 0.00 0.00 179.01 178.97 1dgf h GLN 18 N 0.69 1.01 -0.02 2.33 -0.00 -1.17 -1.88 115.11 116.08 1dgf h GLN 18 Ca 0.18 -0.24 -0.03 0.00 -0.00 0.00 0.00 58.65 58.57 1dgf h GLN 18 Cb -0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 27.48 27.30 1dgf h GLN 18 CO -0.04 0.91 -0.11 0.00 0.00 0.00 0.00 178.83 179.59 1dgf h ARG 19 N 0.96 0.02 0.00 1.69 2.47 -1.17 -3.47 114.38 114.89 1dgf h ARG 19 Ca 0.20 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.92 1dgf h ARG 19 Cb 0.37 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.69 1dgf h ARG 19 CO 0.00 0.14 0.00 0.00 0.56 0.00 0.00 179.97 180.68 1dgf n ALA 20 N -2.51 0.00 1.28 0.04 0.00 -0.71 -1.80 120.51 116.80 1dgf n ALA 20 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.54 1dgf n ALA 20 Cb 0.19 0.00 0.41 0.00 0.00 0.00 0.00 19.45 20.06 1dgf n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dgf n ALA 21 N 12.30 2.53 -1.77 0.00 0.00 -1.26 -4.96 120.51 127.35 1dgf n ALA 21 Ca 0.00 -0.53 -0.41 0.00 0.00 0.00 0.00 53.44 52.50 1dgf n ALA 21 Cb 0.00 -1.09 -0.01 0.00 0.00 0.00 0.00 19.45 18.35 1dgf n ALA 21 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1dgf s GLN 22 N -1.90 4.13 0.43 0.00 -0.21 -0.75 -4.98 119.66 116.38 1dgf s GLN 22 Ca 0.35 2.56 -0.24 0.00 0.02 0.00 0.00 55.36 58.05 1dgf s GLN 22 Cb 0.20 -3.01 -0.08 0.00 1.00 0.00 0.00 33.01 31.12 1dgf s GLN 22 CO 0.31 -0.58 1.13 0.21 -2.12 0.00 0.00 175.29 174.23 1dgf s LYS 23 N -1.13 3.96 0.49 2.91 2.20 -1.26 -4.98 119.74 121.93 1dgf s LYS 23 Ca 0.59 1.70 -0.23 0.00 -0.36 0.00 0.00 55.97 57.66 1dgf s LYS 23 Cb -0.47 -2.51 -0.07 0.00 -1.51 0.00 0.00 37.83 33.27 1dgf s LYS 23 CO 0.54 -0.36 1.32 0.00 -0.36 0.00 0.00 175.35 176.49 1dgf s ALA 24 N -1.56 2.99 0.78 3.13 0.00 -1.26 -4.98 121.76 120.86 1dgf s ALA 24 Ca 0.60 1.26 -0.12 0.00 0.00 0.00 0.00 51.96 53.69 1dgf s ALA 24 Cb -0.27 -3.52 0.06 0.00 0.00 0.00 0.00 23.12 19.40 1dgf s ALA 24 CO 0.33 -1.11 1.14 -0.51 0.00 0.00 0.00 175.76 175.61 1dgf s ASP 25 N -0.93 4.12 0.04 0.00 -0.00 -1.26 -4.96 116.67 113.68 1dgf s ASP 25 Ca 0.66 2.10 -0.30 0.00 -0.00 0.00 0.00 52.55 55.00 1dgf s ASP 25 Cb -0.38 -2.56 -0.05 0.00 -0.00 0.00 0.00 42.92 39.93 1dgf s ASP 25 CO 0.47 -2.30 1.13 -0.69 -0.00 0.00 0.00 175.17 173.78 1dgf s VAL 26 N -2.48 4.29 0.02 -1.27 1.01 -1.26 -4.99 120.40 115.72 1dgf s VAL 26 Ca 0.67 1.64 -0.30 0.00 0.00 0.00 0.00 61.98 63.99 1dgf s VAL 26 Cb -0.22 -4.05 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 1dgf s VAL 26 CO 0.51 0.13 1.26 -0.22 0.00 0.00 0.00 175.10 176.77 1dgf s LEU 27 N 1.06 4.33 0.31 3.92 0.20 -1.26 -4.97 118.68 122.27 1dgf s LEU 27 Ca 0.57 2.01 0.04 0.00 0.69 0.00 0.00 54.13 57.44 1dgf s LEU 27 Cb -0.27 -3.57 -0.06 0.00 -0.43 0.00 0.00 46.19 41.86 1dgf s LEU 27 CO 0.29 -0.57 0.04 0.42 -0.29 0.00 0.00 176.35 176.23 1dgf s THR 28 N 1.66 1.22 0.98 3.68 -4.23 -1.26 -0.71 115.64 116.98 1dgf s THR 28 Ca 0.60 -2.02 -0.17 0.00 -1.18 0.00 0.00 61.69 58.92 1dgf s THR 28 Cb -0.29 -2.70 0.21 0.00 1.34 0.00 0.00 72.50 71.06 1dgf s THR 28 CO 0.27 -0.07 1.34 0.42 -0.54 0.00 0.00 174.62 176.03 1dgf s THR 29 N -3.28 1.99 0.46 3.99 -4.23 -0.11 -4.88 115.64 109.58 1dgf s THR 29 Ca 0.35 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 61.00 1dgf s THR 29 Cb 0.08 -2.99 0.20 0.00 1.34 0.00 0.00 72.50 71.13 1dgf s THR 29 CO 0.14 0.00 2.02 1.23 -0.54 0.00 0.00 174.62 177.48 1dgf h GLY 30 N -1.72 0.06 -0.68 3.99 0.00 -1.92 -1.26 103.07 101.54 1dgf h GLY 30 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1dgf h GLY 30 CO 0.35 0.03 0.00 0.00 0.00 0.00 0.00 176.54 176.91 1dgf n ALA 31 N -2.51 2.49 -1.00 3.60 0.00 -1.26 -4.90 120.51 116.93 1dgf n ALA 31 Ca -0.02 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1dgf n ALA 31 Cb 0.20 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1dgf n ALA 31 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dgf n GLY 32 N 0.74 0.50 3.70 0.00 0.00 -0.48 -5.02 105.19 104.64 1dgf n GLY 32 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1dgf n GLY 32 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dgf s ASN 33 N -2.07 7.25 0.39 1.61 0.02 -1.26 -4.72 114.94 116.16 1dgf s ASN 33 Ca 0.00 1.67 -0.27 0.00 -1.02 0.00 0.00 52.86 53.24 1dgf s ASN 33 Cb 0.00 -2.56 -0.11 0.00 0.02 0.00 0.00 41.25 38.60 1dgf s ASN 33 CO 0.00 -0.40 1.36 -2.65 0.02 0.00 0.00 177.10 175.44 1dgf n PRO 34 N 4.50 2.25 -3.83 -0.60 -0.02 -1.26 -0.94 135.00 135.10 1dgf n PRO 34 Ca 0.08 0.79 -0.36 0.00 -2.02 0.00 0.00 63.50 61.99 1dgf n PRO 34 Cb 0.49 -2.49 -0.11 0.00 -0.02 0.00 0.00 33.50 31.37 1dgf n PRO 34 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1dgf s VAL 35 N -1.15 4.69 0.07 -1.45 1.01 0.11 -4.84 120.40 118.84 1dgf s VAL 35 Ca 0.57 -0.05 -0.15 0.00 0.00 0.00 0.00 61.98 62.35 1dgf s VAL 35 Cb -0.51 -3.17 -0.21 0.00 0.00 0.00 0.00 36.38 32.49 1dgf s VAL 35 CO 0.61 0.37 1.21 1.23 0.00 0.00 0.00 175.10 178.52 1dgf h GLY 36 N 7.62 0.76 -6.35 4.51 0.00 -1.94 -3.45 103.07 104.23 1dgf h GLY 36 Ca -0.37 -1.25 -0.14 0.00 0.00 0.00 0.00 47.33 45.57 1dgf h GLY 36 CO 0.62 1.11 -0.46 -0.35 0.00 0.00 0.00 176.54 177.47 1dgf s ASP 37 N -7.15 0.12 -0.26 0.19 2.15 -1.26 -5.02 116.67 105.43 1dgf s ASP 37 Ca -0.10 0.40 0.12 0.00 0.43 0.00 0.00 52.55 53.39 1dgf s ASP 37 Cb 0.07 1.17 0.57 0.00 -0.30 0.00 0.00 42.92 44.42 1dgf s ASP 37 CO 0.90 -0.28 1.54 1.17 -0.17 0.00 0.00 175.17 178.33 1dgf n LYS 38 N 5.37 2.62 -0.00 4.34 4.81 -1.26 -4.42 118.16 129.61 1dgf n LYS 38 Ca -0.05 -3.02 0.02 0.00 -0.87 0.00 0.00 58.31 54.39 1dgf n LYS 38 Cb 0.50 -1.92 -0.03 0.00 0.02 0.00 0.00 35.03 33.60 1dgf n LYS 38 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1dgf n LEU 39 N -0.72 0.21 -3.83 3.14 4.77 -1.26 -5.01 117.00 114.29 1dgf n LEU 39 Ca 0.32 -0.48 -0.13 0.00 -0.03 0.00 0.00 56.01 55.69 1dgf n LEU 39 Cb 1.09 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 42.04 1dgf n LEU 39 CO 0.25 0.05 -0.27 0.20 -1.33 0.00 0.00 177.39 176.29 1dgf s ASN 40 N -1.47 -0.08 0.65 -1.43 0.01 -1.26 -5.17 114.94 106.19 1dgf s ASN 40 Ca 0.02 0.18 -0.08 0.00 -0.71 0.00 0.00 52.86 52.27 1dgf s ASN 40 Cb 0.03 0.16 0.02 0.00 0.41 0.00 0.00 41.25 41.88 1dgf s ASN 40 CO 0.19 -0.05 0.98 0.68 -1.51 0.00 0.00 177.10 177.39 1dgf s VAL 41 N 0.25 3.26 -0.16 1.60 -7.23 -1.26 -4.97 120.40 111.88 1dgf s VAL 41 Ca -0.02 0.05 -0.24 0.00 -1.81 0.00 0.00 61.98 59.96 1dgf s VAL 41 Cb -0.03 -3.35 -0.02 0.00 0.56 0.00 0.00 36.38 33.55 1dgf s VAL 41 CO -0.01 -0.39 0.78 -0.63 -0.31 0.00 0.00 175.10 174.55 1dgf s ILE 42 N -3.15 4.92 0.17 -0.62 1.01 -1.26 -5.05 121.20 117.22 1dgf s ILE 42 Ca 0.56 1.54 0.04 0.00 0.00 0.00 0.00 60.65 62.80 1dgf s ILE 42 Cb -0.11 -4.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.22 1dgf s ILE 42 CO 0.47 0.06 -0.07 0.42 0.00 0.00 0.00 174.94 175.82 1dgf s THR 43 N 1.97 1.13 -0.95 2.92 -4.23 -1.26 -1.99 115.64 113.23 1dgf s THR 43 Ca 0.37 -2.05 -0.21 0.00 -1.18 0.00 0.00 61.69 58.61 1dgf s THR 43 Cb -0.17 -2.01 0.09 0.00 1.34 0.00 0.00 72.50 71.75 1dgf s THR 43 CO 0.13 -0.60 1.25 -0.69 -0.54 0.00 0.00 174.62 174.16 1dgf s VAL 44 N -3.36 4.37 0.00 2.29 1.01 -0.82 -4.83 120.40 119.06 1dgf s VAL 44 Ca 0.21 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 61.04 1dgf s VAL 44 Cb 0.04 -4.89 0.00 0.00 0.00 0.00 0.00 36.38 31.53 1dgf s VAL 44 CO 0.03 -1.68 0.00 0.61 0.00 0.00 0.00 175.10 174.06 1dgf n GLY 45 N 6.04 -1.52 0.31 4.51 0.00 -1.26 -2.87 105.19 110.39 1dgf n GLY 45 Ca 0.26 -1.56 0.12 0.00 0.00 0.00 0.00 46.02 44.83 1dgf n GLY 45 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dgf h PRO 46 N 0.00 0.08 -0.26 1.61 0.13 -2.01 -2.80 132.00 128.75 1dgf h PRO 46 Ca 0.00 -0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.92 1dgf h PRO 46 Cb 0.00 -0.02 -0.19 0.00 0.13 0.00 0.00 31.00 30.92 1dgf h PRO 46 CO 0.00 0.05 -0.68 0.54 -0.23 0.00 0.00 178.00 177.68 1dgf n ARG 47 N -4.48 2.09 -3.31 0.86 1.74 -1.26 -5.06 116.66 107.25 1dgf n ARG 47 Ca 0.03 -3.47 -0.20 0.00 -0.77 0.00 0.00 57.85 53.44 1dgf n ARG 47 Cb 0.28 -1.68 -0.00 0.00 -1.02 0.00 0.00 32.46 30.04 1dgf n ARG 47 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1dgf s GLY 48 N -3.27 2.03 0.84 -0.13 0.00 -1.06 -5.03 107.32 100.71 1dgf s GLY 48 Ca 0.41 -1.79 -0.11 0.00 0.00 0.00 0.00 44.72 43.23 1dgf s GLY 48 CO -0.04 -1.64 1.09 2.56 0.00 0.00 0.00 173.10 175.07 1dgf s PRO 49 N -4.30 1.69 0.23 2.90 0.04 -1.26 -4.25 135.00 130.04 1dgf s PRO 49 Ca 0.52 1.06 -0.30 0.00 0.04 0.00 0.00 61.00 62.32 1dgf s PRO 49 Cb -0.06 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 32.55 1dgf s PRO 49 CO 0.31 -2.01 1.06 -1.17 0.04 0.00 0.00 177.00 175.23 1dgf s LEU 50 N -6.13 4.55 0.02 -3.56 2.96 -1.26 -1.95 118.68 113.31 1dgf s LEU 50 Ca 0.63 2.11 -0.11 0.00 -0.22 0.00 0.00 54.13 56.54 1dgf s LEU 50 Cb -0.18 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 42.84 1dgf s LEU 50 CO 0.57 -0.10 0.36 -0.76 -1.32 0.00 0.00 176.35 175.10 1dgf s LEU 51 N -0.94 4.41 0.45 -0.68 2.01 -0.84 -4.99 118.68 118.10 1dgf s LEU 51 Ca 0.45 0.81 0.17 0.00 0.01 0.00 0.00 54.13 55.57 1dgf s LEU 51 Cb -0.29 -2.68 1.03 0.00 0.01 0.00 0.00 46.19 44.26 1dgf s LEU 51 CO 0.36 0.27 1.97 0.58 1.01 0.00 0.00 176.35 180.55 1dgf h VAL 52 N 3.37 1.05 0.00 -1.59 2.07 -1.97 -2.22 116.25 116.97 1dgf h VAL 52 Ca -0.51 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.26 1dgf h VAL 52 Cb 1.21 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.39 1dgf h VAL 52 CO 0.63 0.21 0.00 0.00 0.02 0.00 0.00 177.57 178.43 1dgf n GLN 53 N -4.14 0.44 -2.72 1.57 10.64 -1.26 -4.06 117.38 117.85 1dgf n GLN 53 Ca -0.02 0.03 -0.43 0.00 -1.83 0.00 0.00 57.00 54.75 1dgf n GLN 53 Cb 0.28 -1.50 -0.01 0.00 -0.86 0.00 0.00 30.24 28.15 1dgf n GLN 53 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1dgf s ASP 54 N -2.12 6.82 0.33 2.61 3.68 -0.84 -4.72 116.67 122.44 1dgf s ASP 54 Ca 0.22 -2.38 0.18 0.00 2.13 0.00 0.00 52.55 52.69 1dgf s ASP 54 Cb 0.11 -2.51 0.33 0.00 -1.45 0.00 0.00 42.92 39.40 1dgf s ASP 54 CO 0.19 -1.10 1.57 0.58 0.13 0.00 0.00 175.17 176.54 1dgf h VAL 55 N 5.56 0.77 -0.40 1.11 2.07 -1.88 -2.99 116.25 120.49 1dgf h VAL 55 Ca 0.34 -1.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.00 1dgf h VAL 55 Cb 0.91 2.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.87 1dgf h VAL 55 CO 1.36 0.40 0.22 0.58 0.02 0.00 0.00 177.57 180.14 1dgf h VAL 56 N 0.00 1.15 0.38 2.57 2.07 -1.95 0.65 116.25 121.13 1dgf h VAL 56 Ca -0.00 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1dgf h VAL 56 Cb 1.17 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1dgf h VAL 56 CO 0.05 0.16 -0.18 0.15 0.02 0.00 0.00 177.57 177.77 1dgf h PHE 57 N 0.52 -0.48 -0.58 1.57 3.57 -1.95 -2.62 116.94 116.97 1dgf h PHE 57 Ca 0.14 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.65 1dgf h PHE 57 Cb 0.06 0.16 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 1dgf h PHE 57 CO -0.02 -0.24 0.36 1.15 -2.23 0.00 0.00 178.31 177.33 1dgf h THR 58 N -0.62 1.08 -0.56 4.41 2.02 -1.42 0.95 112.91 118.77 1dgf h THR 58 Ca -0.05 -0.25 0.04 0.00 0.77 0.00 0.00 66.41 66.93 1dgf h THR 58 Cb 0.46 0.31 -0.05 0.00 -1.74 0.00 0.00 68.15 67.13 1dgf h THR 58 CO 0.09 0.13 0.30 -0.78 0.37 0.00 0.00 175.52 175.63 1dgf h ASP 59 N 0.71 0.45 -0.09 4.18 1.82 -0.87 0.16 116.42 122.79 1dgf h ASP 59 Ca 0.23 0.02 -0.08 0.00 -0.39 0.00 0.00 57.03 56.81 1dgf h ASP 59 Cb -0.00 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 39.95 1dgf h ASP 59 CO -0.09 0.31 -0.26 -0.08 -1.61 0.00 0.00 179.24 177.51 1dgf h GLU 60 N 0.58 0.33 -0.63 0.28 4.81 -1.14 -3.09 114.58 115.72 1dgf h GLU 60 Ca 0.24 -0.24 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 1dgf h GLU 60 Cb 0.13 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 1dgf h GLU 60 CO -0.15 0.86 0.18 1.98 -0.73 0.00 0.00 179.01 181.15 1dgf h MET 61 N -0.14 0.99 -0.87 1.92 4.05 -0.64 -1.76 114.93 118.49 1dgf h MET 61 Ca -0.01 -0.22 0.00 0.00 -0.28 0.00 0.00 59.70 59.19 1dgf h MET 61 Cb 0.88 -0.14 -0.04 0.00 -0.80 0.00 0.00 31.60 31.50 1dgf h MET 61 CO 0.06 0.88 0.54 0.00 0.23 0.00 0.00 176.91 178.62 1dgf h ALA 62 N 1.06 1.33 -0.26 0.39 0.00 -0.77 0.67 119.26 121.69 1dgf h ALA 62 Ca 0.20 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 1dgf h ALA 62 Cb 0.31 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1dgf h ALA 62 CO -0.00 0.60 -0.56 1.25 0.00 0.00 0.00 179.25 180.53 1dgf h HIS 63 N 1.18 1.01 -0.79 0.00 6.17 -1.41 -2.95 115.15 118.37 1dgf h HIS 63 Ca 0.31 -0.36 0.02 0.00 0.71 0.00 0.00 60.37 61.04 1dgf h HIS 63 Cb -0.09 -0.19 -0.04 0.00 2.52 0.00 0.00 27.41 29.61 1dgf h HIS 63 CO 0.00 1.18 0.52 0.35 0.71 0.00 0.00 177.93 180.68 1dgf h PHE 64 N 0.61 0.97 0.00 5.26 3.57 -0.79 -1.05 116.94 125.52 1dgf h PHE 64 Ca 0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1dgf h PHE 64 Cb 1.16 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.57 1dgf h PHE 64 CO 0.07 0.60 0.00 -0.25 -2.23 0.00 0.00 178.31 176.49 1dgf n ASP 65 N -4.56 0.47 -0.11 0.41 10.43 0.18 -2.46 116.55 120.91 1dgf n ASP 65 Ca 0.08 0.68 0.06 0.00 2.57 0.00 0.00 54.79 58.18 1dgf n ASP 65 Cb 0.04 -0.75 0.09 0.00 1.84 0.00 0.00 41.12 42.34 1dgf n ASP 65 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1dgf n ARG 66 N -2.08 2.11 -0.15 -1.24 1.74 -0.43 -4.80 116.66 111.82 1dgf n ARG 66 Ca 0.00 -2.15 0.00 0.00 -0.77 0.00 0.00 57.85 54.93 1dgf n ARG 66 Cb 0.10 -1.32 0.27 0.00 -1.02 0.00 0.00 32.46 30.49 1dgf n ARG 66 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1dgf h GLU 67 N 0.19 0.85 -6.60 5.56 5.08 -1.13 -3.44 114.58 115.08 1dgf h GLU 67 Ca 0.00 -0.08 -0.51 0.00 -1.00 0.00 0.00 59.36 57.77 1dgf h GLU 67 Cb 0.82 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 1dgf h GLU 67 CO 0.01 0.61 0.19 1.03 -1.00 0.00 0.00 179.01 179.85 1dgf s ARG 68 N -5.61 4.48 0.25 2.33 1.81 -1.26 -5.09 118.95 115.86 1dgf s ARG 68 Ca -0.10 1.11 0.09 0.00 -1.72 0.00 0.00 55.73 55.10 1dgf s ARG 68 Cb 0.17 -3.08 -0.05 0.00 -0.45 0.00 0.00 34.95 31.55 1dgf s ARG 68 CO 0.77 0.47 -0.14 0.96 -0.68 0.00 0.00 175.30 176.69 1dgf s ILE 69 N -1.34 1.94 0.36 1.52 -4.36 -1.26 -5.11 121.20 112.96 1dgf s ILE 69 Ca 0.40 -2.25 -0.28 0.00 -0.26 0.00 0.00 60.65 58.26 1dgf s ILE 69 Cb -0.21 -2.22 -0.11 0.00 1.25 0.00 0.00 42.46 41.18 1dgf s ILE 69 CO 0.24 -0.47 1.51 -2.65 0.24 0.00 0.00 174.94 173.81 1dgf n PRO 70 N -0.50 2.69 -1.65 0.37 -0.02 -1.26 -4.98 135.00 129.64 1dgf n PRO 70 Ca -0.07 0.94 -0.30 0.00 -2.02 0.00 0.00 63.50 62.06 1dgf n PRO 70 Cb 0.61 -2.69 0.08 0.00 -0.02 0.00 0.00 33.50 31.48 1dgf n PRO 70 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1dgf s GLU 71 N -1.85 2.35 0.36 -0.52 -1.05 -1.26 -4.95 118.70 111.78 1dgf s GLU 71 Ca 0.55 0.60 -0.28 0.00 -0.15 0.00 0.00 54.97 55.68 1dgf s GLU 71 Cb -0.48 -1.95 -0.11 0.00 -0.44 0.00 0.00 34.13 31.15 1dgf s GLU 71 CO 0.61 -1.42 1.52 0.54 0.95 0.00 0.00 175.26 177.46 1dgf n ARG 72 N -3.29 2.70 0.08 -4.83 1.74 -1.26 -4.88 116.66 106.92 1dgf n ARG 72 Ca 0.07 0.95 0.14 0.00 -0.77 0.00 0.00 57.85 58.23 1dgf n ARG 72 Cb 0.56 -2.69 0.63 0.00 -1.02 0.00 0.00 32.46 29.94 1dgf n ARG 72 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 1dgf h VAL 73 N 3.03 0.88 -4.07 1.55 3.04 -1.98 -3.37 116.25 115.33 1dgf h VAL 73 Ca -0.50 -0.03 -0.13 0.00 -1.01 0.00 0.00 66.70 65.03 1dgf h VAL 73 Cb 1.24 0.77 -0.17 0.00 -2.01 0.00 0.00 31.29 31.12 1dgf h VAL 73 CO 0.67 0.02 -0.63 0.68 -1.01 0.00 0.00 177.57 177.30 1dgf s VAL 74 N -5.12 0.17 -1.35 1.51 -7.23 -1.26 -4.87 120.40 102.25 1dgf s VAL 74 Ca -0.06 -1.44 -0.03 0.00 -1.81 0.00 0.00 61.98 58.64 1dgf s VAL 74 Cb 0.19 -1.13 0.00 0.00 0.56 0.00 0.00 36.38 36.00 1dgf s VAL 74 CO 0.71 -0.79 0.40 1.41 -0.31 0.00 0.00 175.10 176.51 1dgf n HIS 75 N 0.53 -1.46 -0.09 2.82 -0.00 -0.14 -4.92 115.22 111.97 1dgf n HIS 75 Ca -0.17 0.34 -0.02 0.00 -0.00 0.00 0.00 57.72 57.87 1dgf n HIS 75 Cb 0.59 -3.83 0.23 0.00 -0.00 0.00 0.00 29.99 26.98 1dgf n HIS 75 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1dgf h ALA 76 N 0.84 1.28 -2.41 -1.41 0.00 -1.72 -3.42 119.26 112.42 1dgf h ALA 76 Ca -0.44 -0.20 -0.63 0.00 0.00 0.00 0.00 54.91 53.64 1dgf h ALA 76 Cb 1.31 -0.20 -0.14 0.00 0.00 0.00 0.00 17.79 18.76 1dgf h ALA 76 CO 0.48 0.50 0.05 0.21 0.00 0.00 0.00 179.25 180.49 1dgf s LYS 77 N -5.14 3.72 0.22 0.00 2.47 -1.25 -4.57 119.74 115.18 1dgf s LYS 77 Ca -0.09 0.02 -0.07 0.00 -1.56 0.00 0.00 55.97 54.27 1dgf s LYS 77 Cb 0.16 -3.78 0.03 0.00 -1.46 0.00 0.00 37.83 32.77 1dgf s LYS 77 CO 0.79 -0.64 0.42 0.41 0.16 0.00 0.00 175.35 176.49 1dgf n GLY 78 N 4.66 1.58 3.03 5.54 0.00 -1.26 -1.96 105.19 116.78 1dgf n GLY 78 Ca -0.03 -1.20 -0.09 0.00 0.00 0.00 0.00 46.02 44.70 1dgf n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgf s ALA 79 N -1.68 0.36 0.12 4.61 0.00 -0.26 -4.91 121.76 119.99 1dgf s ALA 79 Ca 0.10 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.27 1dgf s ALA 79 Cb -0.02 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 1dgf s ALA 79 CO 0.07 -0.19 -0.08 0.20 0.00 0.00 0.00 175.76 175.76 1dgf s GLY 80 N -1.93 0.90 0.21 0.00 0.00 -1.26 -0.38 107.32 104.86 1dgf s GLY 80 Ca -0.08 -1.41 -0.22 0.00 0.00 0.00 0.00 44.72 43.01 1dgf s GLY 80 CO -0.03 -1.51 0.70 0.00 0.00 0.00 0.00 173.10 172.25 1dgf s ALA 81 N -3.48 -1.43 0.21 3.20 0.00 -0.70 -4.43 121.76 115.13 1dgf s ALA 81 Ca 0.14 0.10 0.05 0.00 0.00 0.00 0.00 51.96 52.24 1dgf s ALA 81 Cb 0.04 0.83 -0.05 0.00 0.00 0.00 0.00 23.12 23.94 1dgf s ALA 81 CO -0.02 -0.92 -0.06 -0.06 0.00 0.00 0.00 175.76 174.70 1dgf s PHE 82 N -3.77 1.56 0.00 0.00 0.40 0.47 -0.72 117.98 115.92 1dgf s PHE 82 Ca 0.07 -0.79 0.00 0.00 -0.60 0.00 0.00 56.93 55.61 1dgf s PHE 82 Cb -0.03 -0.85 0.00 0.00 0.51 0.00 0.00 43.02 42.64 1dgf s PHE 82 CO -0.02 0.10 0.00 0.41 0.70 0.00 0.00 175.22 176.41 1dgf n GLY 83 N -0.38 -0.71 3.40 4.36 0.00 -0.69 -0.81 105.19 110.36 1dgf n GLY 83 Ca -0.07 0.16 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 1dgf n GLY 83 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1dgf s TYR 84 N -1.44 0.05 -0.11 1.61 -0.85 -0.22 -1.16 117.35 115.23 1dgf s TYR 84 Ca 0.00 -0.40 0.01 0.00 -0.52 0.00 0.00 57.07 56.16 1dgf s TYR 84 Cb 0.00 0.19 -0.01 0.00 0.38 0.00 0.00 41.96 42.51 1dgf s TYR 84 CO 0.00 -0.78 -0.15 0.12 -1.52 0.00 0.00 175.55 173.22 1dgf s PHE 85 N -3.89 2.75 -0.10 -3.49 5.36 0.70 -0.97 117.98 118.34 1dgf s PHE 85 Ca 0.10 -0.62 0.03 0.00 -0.96 0.00 0.00 56.93 55.48 1dgf s PHE 85 Cb 0.01 -1.78 0.01 0.00 -0.34 0.00 0.00 43.02 40.92 1dgf s PHE 85 CO -0.04 -0.17 -0.18 -2.00 -1.46 0.00 0.00 175.22 171.36 1dgf s GLU 86 N 0.16 2.46 0.01 10.12 2.12 0.23 -0.87 118.70 132.93 1dgf s GLU 86 Ca -0.08 -0.67 -0.30 0.00 0.36 0.00 0.00 54.97 54.28 1dgf s GLU 86 Cb -0.15 -1.97 -0.04 0.00 0.26 0.00 0.00 34.13 32.23 1dgf s GLU 86 CO 0.05 0.05 1.11 0.08 -0.54 0.00 0.00 175.26 176.02 1dgf s VAL 87 N 0.66 4.40 -0.01 3.70 1.01 -0.63 -0.44 120.40 129.09 1dgf s VAL 87 Ca -0.13 1.72 0.07 0.00 0.00 0.00 0.00 61.98 63.64 1dgf s VAL 87 Cb -0.16 -4.10 -0.11 0.00 0.00 0.00 0.00 36.38 32.01 1dgf s VAL 87 CO 0.03 0.10 0.14 0.35 0.00 0.00 0.00 175.10 175.72 1dgf n THR 88 N 4.10 0.04 -4.19 3.92 -2.24 0.29 -0.31 114.28 115.89 1dgf n THR 88 Ca 0.08 -0.17 -0.13 0.00 -2.27 0.00 0.00 64.05 61.56 1dgf n THR 88 Cb 0.48 0.22 -0.10 0.00 -2.10 0.00 0.00 70.33 68.83 1dgf n THR 88 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1dgf s HIS 89 N -2.45 1.06 -0.40 4.78 3.76 -0.62 -4.88 115.29 116.53 1dgf s HIS 89 Ca -0.03 -0.75 -0.21 0.00 -0.15 0.00 0.00 55.06 53.92 1dgf s HIS 89 Cb 0.04 -0.57 0.01 0.00 1.11 0.00 0.00 32.58 33.17 1dgf s HIS 89 CO 0.29 -0.02 0.67 0.34 -0.85 0.00 0.00 174.74 175.16 1dgf s ASP 90 N -2.78 6.39 -0.14 1.40 -1.08 -1.26 -4.77 116.67 114.43 1dgf s ASP 90 Ca 0.10 -0.07 0.16 0.00 -0.52 0.00 0.00 52.55 52.22 1dgf s ASP 90 Cb 0.01 -2.33 0.31 0.00 -1.46 0.00 0.00 42.92 39.44 1dgf s ASP 90 CO -0.01 -0.72 1.16 2.30 0.52 0.00 0.00 175.17 178.42 1dgf n ILE 91 N 5.78 1.78 0.28 4.11 -5.35 -1.26 -4.76 119.36 119.93 1dgf n ILE 91 Ca -0.01 -2.32 0.17 0.00 -0.27 0.00 0.00 62.75 60.33 1dgf n ILE 91 Cb 0.48 -0.15 0.87 0.00 -1.74 0.00 0.00 39.64 39.11 1dgf n ILE 91 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1dgf h THR 92 N 1.00 0.00 0.00 7.28 1.35 -1.85 -0.27 112.91 120.42 1dgf h THR 92 Ca -0.01 -0.10 -0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1dgf h THR 92 Cb 1.06 0.91 -0.00 0.00 -1.73 0.00 0.00 68.15 68.39 1dgf h THR 92 CO 0.00 0.00 -0.01 0.07 -0.25 0.00 0.00 175.52 175.33 1dgf h LYS 93 N 0.00 0.00 0.00 4.72 2.10 -2.00 -3.28 116.57 118.11 1dgf h LYS 93 Ca 0.00 0.00 -0.35 0.00 -2.00 0.00 0.00 60.65 58.30 1dgf h LYS 93 Cb 0.12 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.39 1dgf h LYS 93 CO 0.00 0.01 -2.28 0.66 -2.00 0.00 0.00 179.45 175.84 1dgf n TYR 94 N -3.11 0.00 -4.33 0.07 0.53 -0.19 -4.73 117.16 105.40 1dgf n TYR 94 Ca 0.00 0.00 -0.20 0.00 -1.02 0.00 0.00 57.90 56.69 1dgf n TYR 94 Cb 0.30 -0.86 -0.15 0.00 -1.03 0.00 0.00 39.34 37.60 1dgf n TYR 94 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 1dgf s SER 95 N -6.40 1.08 0.00 7.72 0.15 -0.74 -2.80 113.70 112.71 1dgf s SER 95 Ca -0.31 -0.16 0.24 0.00 0.70 0.00 0.00 55.95 56.41 1dgf s SER 95 Cb 0.09 -0.29 0.75 0.00 -1.71 0.00 0.00 66.02 64.86 1dgf s SER 95 CO 0.49 0.05 1.56 2.29 1.20 0.00 0.00 173.24 178.84 1dgf n LYS 96 N 3.32 1.86 -1.65 5.44 2.85 -0.28 -4.16 118.16 125.54 1dgf n LYS 96 Ca -0.18 -1.28 -0.47 0.00 -1.05 0.00 0.00 58.31 55.33 1dgf n LYS 96 Cb 0.54 -1.44 -0.04 0.00 -0.65 0.00 0.00 35.03 33.44 1dgf n LYS 96 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1dgf n ALA 97 N 0.52 0.77 0.10 0.58 0.00 -1.22 -4.85 120.51 116.40 1dgf n ALA 97 Ca 0.17 0.45 0.16 0.00 0.00 0.00 0.00 53.44 54.22 1dgf n ALA 97 Cb 0.40 -2.26 0.69 0.00 0.00 0.00 0.00 19.45 18.27 1dgf n ALA 97 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1dgf h LYS 98 N 5.05 0.00 0.00 0.00 1.57 -1.93 -0.77 116.57 120.48 1dgf h LYS 98 Ca -0.45 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1dgf h LYS 98 Cb 1.28 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.59 1dgf h LYS 98 CO 0.82 0.00 -0.02 -0.24 -0.57 0.00 0.00 179.45 179.44 1dgf h VAL 99 N 0.00 0.19 -0.05 0.50 3.04 -1.95 -2.41 116.25 115.58 1dgf h VAL 99 Ca 0.16 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1dgf h VAL 99 Cb 0.66 1.13 0.00 0.00 -2.01 0.00 0.00 31.29 31.07 1dgf h VAL 99 CO -0.00 0.02 0.00 0.49 -1.01 0.00 0.00 177.57 177.07 1dgf n PHE 100 N -3.32 0.05 -0.35 3.17 3.72 -0.31 -4.81 117.46 115.61 1dgf n PHE 100 Ca -0.02 -0.05 0.33 0.00 -0.05 0.00 0.00 57.45 57.65 1dgf n PHE 100 Cb 0.13 -0.00 0.68 0.00 -0.94 0.00 0.00 39.48 39.35 1dgf n PHE 100 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 176.76 177.76 1dgf h GLU 101 N 2.13 0.11 -2.46 -1.08 4.11 -1.25 -3.44 114.58 112.71 1dgf h GLU 101 Ca 0.00 -0.01 -0.08 0.00 0.07 0.00 0.00 59.36 59.34 1dgf h GLU 101 Cb 0.48 -0.02 -0.19 0.00 0.50 0.00 0.00 28.75 29.51 1dgf h GLU 101 CO 0.00 0.07 -0.01 -3.38 0.07 0.00 0.00 179.01 175.76 1dgf s HIS 102 N -5.12 -0.45 0.22 2.06 -3.43 -1.26 -4.99 115.29 102.32 1dgf s HIS 102 Ca -0.06 0.75 -0.31 0.00 -0.80 0.00 0.00 55.06 54.63 1dgf s HIS 102 Cb 0.24 0.28 -0.11 0.00 -1.43 0.00 0.00 32.58 31.56 1dgf s HIS 102 CO 0.81 -0.52 1.57 0.42 -2.00 0.00 0.00 174.74 175.02 1dgf s ILE 103 N -1.28 2.41 0.00 -5.38 1.01 -1.26 -2.05 121.20 114.65 1dgf s ILE 103 Ca -0.12 0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.85 1dgf s ILE 103 Cb -0.02 -3.20 0.00 0.00 0.01 0.00 0.00 42.46 39.24 1dgf s ILE 103 CO 0.07 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.66 1dgf n GLY 104 N 3.14 1.75 3.70 6.18 0.00 0.58 -5.00 105.19 115.53 1dgf n GLY 104 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1dgf n GLY 104 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dgf s LYS 105 N -0.98 4.21 -0.12 1.61 2.20 -0.87 -4.70 119.74 121.09 1dgf s LYS 105 Ca 0.00 2.31 -0.02 0.00 -0.36 0.00 0.00 55.97 57.90 1dgf s LYS 105 Cb 0.00 -3.48 -0.03 0.00 -1.51 0.00 0.00 37.83 32.81 1dgf s LYS 105 CO 0.00 -0.68 -0.04 0.15 -0.36 0.00 0.00 175.35 174.42 1dgf s LYS 106 N 2.22 3.32 -0.07 4.03 1.02 -1.26 -1.60 119.74 127.40 1dgf s LYS 106 Ca 0.72 -0.51 0.03 0.00 0.02 0.00 0.00 55.97 56.23 1dgf s LYS 106 Cb -0.40 -2.81 0.01 0.00 -0.52 0.00 0.00 37.83 34.11 1dgf s LYS 106 CO 0.32 0.43 -0.16 0.99 -0.92 0.00 0.00 175.35 176.00 1dgf s THR 107 N -0.15 1.44 0.41 2.17 2.01 -0.05 -4.94 115.64 116.52 1dgf s THR 107 Ca 0.03 -0.66 -0.26 0.00 0.31 0.00 0.00 61.69 61.10 1dgf s THR 107 Cb -0.13 -1.28 -0.09 0.00 0.01 0.00 0.00 72.50 71.01 1dgf s THR 107 CO 0.02 0.42 1.38 -2.84 -0.69 0.00 0.00 174.62 172.91 1dgf s PRO 108 N 0.53 3.95 0.13 4.92 0.02 -1.26 -0.22 135.00 143.07 1dgf s PRO 108 Ca -0.15 2.32 0.04 0.00 0.02 0.00 0.00 61.00 63.23 1dgf s PRO 108 Cb -0.16 -2.80 -0.04 0.00 0.02 0.00 0.00 34.50 31.52 1dgf s PRO 108 CO 0.05 -0.57 -0.10 0.96 -0.33 0.00 0.00 177.00 177.01 1dgf s ILE 109 N -1.20 1.09 -0.02 2.83 -4.36 -0.31 -1.79 121.20 117.44 1dgf s ILE 109 Ca 0.57 -1.95 0.03 0.00 -0.26 0.00 0.00 60.65 59.04 1dgf s ILE 109 Cb -0.42 -1.72 -0.00 0.00 1.25 0.00 0.00 42.46 41.57 1dgf s ILE 109 CO 0.54 -0.71 -0.12 0.00 0.24 0.00 0.00 174.94 174.90 1dgf s ALA 110 N -3.12 1.01 0.02 2.27 0.00 -0.62 -1.71 121.76 119.61 1dgf s ALA 110 Ca 0.14 -0.48 0.03 0.00 0.00 0.00 0.00 51.96 51.65 1dgf s ALA 110 Cb 0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 1dgf s ALA 110 CO 0.00 0.22 -0.09 0.08 0.00 0.00 0.00 175.76 175.97 1dgf s VAL 111 N -0.11 0.65 -0.05 0.00 1.01 0.10 -0.54 120.40 121.45 1dgf s VAL 111 Ca 0.02 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.29 1dgf s VAL 111 Cb -0.06 -0.62 0.02 0.00 0.00 0.00 0.00 36.38 35.72 1dgf s VAL 111 CO 0.00 -0.07 -0.04 -0.60 0.00 0.00 0.00 175.10 174.39 1dgf s ARG 112 N -0.86 0.89 0.16 2.72 3.52 -0.91 -1.72 118.95 122.73 1dgf s ARG 112 Ca -0.02 -0.10 0.04 0.00 -0.13 0.00 0.00 55.73 55.53 1dgf s ARG 112 Cb -0.06 -0.94 -0.04 0.00 -1.56 0.00 0.00 34.95 32.35 1dgf s ARG 112 CO 0.00 -0.12 0.17 -0.06 -0.81 0.00 0.00 175.30 174.48 1dgf s PHE 113 N 1.12 3.23 0.05 5.12 0.40 0.49 -1.81 117.98 126.58 1dgf s PHE 113 Ca -0.08 0.02 -0.28 0.00 -0.60 0.00 0.00 56.93 55.99 1dgf s PHE 113 Cb -0.14 -1.55 0.09 0.00 0.51 0.00 0.00 43.02 41.93 1dgf s PHE 113 CO -0.01 0.52 1.06 -1.54 0.70 0.00 0.00 175.22 175.95 1dgf s SER 114 N -3.09 -0.17 0.08 1.36 1.04 -0.85 -1.11 113.70 110.95 1dgf s SER 114 Ca 0.32 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.52 1dgf s SER 114 Cb -0.10 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.37 1dgf s SER 114 CO 0.24 -0.63 0.00 0.35 0.98 0.00 0.00 173.24 174.18 1dgf n THR 115 N -0.40 0.00 0.06 2.02 -2.24 -0.83 -0.05 114.28 112.84 1dgf n THR 115 Ca -0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1dgf n THR 115 Cb 0.61 -1.31 0.00 0.00 -2.10 0.00 0.00 70.33 67.53 1dgf n THR 115 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1dgf n VAL 116 N -0.33 0.98 0.09 2.28 0.31 -1.26 -3.89 118.33 116.51 1dgf n VAL 116 Ca 0.00 0.33 -0.22 0.00 -0.01 0.00 0.00 64.34 64.44 1dgf n VAL 116 Cb 0.00 -1.44 -0.13 0.00 -0.91 0.00 0.00 33.84 31.37 1dgf n VAL 116 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1dgf h ALA 117 N 0.00 0.02 -2.93 3.52 0.00 -1.93 -0.35 119.26 117.58 1dgf h ALA 117 Ca 0.00 -0.78 -0.54 0.00 0.00 0.00 0.00 54.91 53.59 1dgf h ALA 117 Cb 0.07 0.10 0.12 0.00 0.00 0.00 0.00 17.79 18.08 1dgf h ALA 117 CO 0.00 0.71 0.57 0.20 0.00 0.00 0.00 179.25 180.74 1dgf s GLY 118 N -4.45 2.86 0.98 0.00 0.00 -1.26 -4.91 107.32 100.53 1dgf s GLY 118 Ca -0.09 1.22 -0.16 0.00 0.00 0.00 0.00 44.72 45.69 1dgf s GLY 118 CO 0.93 1.72 1.34 -0.54 0.00 0.00 0.00 173.10 176.55 1dgf s GLU 119 N -2.86 0.49 0.55 2.90 8.01 -1.26 -3.92 118.70 122.60 1dgf s GLU 119 Ca 0.70 -0.48 0.35 0.00 0.01 0.00 0.00 54.97 55.54 1dgf s GLU 119 Cb -0.37 -1.84 1.52 0.00 -4.31 0.00 0.00 34.13 29.13 1dgf s GLU 119 CO 0.44 -2.51 1.82 0.77 0.01 0.00 0.00 175.26 175.79 1dgf h SER 120 N -1.71 0.00 -0.87 -0.19 0.02 -1.96 -2.02 113.55 106.82 1dgf h SER 120 Ca -0.44 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 59.97 1dgf h SER 120 Cb 1.22 0.00 -0.29 0.00 0.14 0.00 0.00 62.40 63.48 1dgf h SER 120 CO 0.35 0.00 0.44 0.61 -1.14 0.00 0.00 176.83 177.08 1dgf n GLY 121 N -1.74 5.44 3.90 -3.77 0.00 -1.26 -4.84 105.19 102.91 1dgf n GLY 121 Ca 0.23 -1.87 -0.21 0.00 0.00 0.00 0.00 46.02 44.17 1dgf n GLY 121 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dgf s SER 122 N -2.04 5.11 0.33 1.61 1.04 -0.76 -5.10 113.70 113.88 1dgf s SER 122 Ca 0.58 -0.73 -0.20 0.00 0.48 0.00 0.00 55.95 56.08 1dgf s SER 122 Cb 0.47 -0.52 -0.10 0.00 0.10 0.00 0.00 66.02 65.97 1dgf s SER 122 CO 0.03 -0.70 0.84 0.00 0.98 0.00 0.00 173.24 174.39 1dgf s ALA 123 N -2.48 3.23 0.05 5.32 0.00 -1.26 -4.81 121.76 121.82 1dgf s ALA 123 Ca 0.49 0.27 -0.16 0.00 0.00 0.00 0.00 51.96 52.56 1dgf s ALA 123 Cb -0.04 -2.97 -0.23 0.00 0.00 0.00 0.00 23.12 19.88 1dgf s ALA 123 CO 0.28 0.24 1.17 -0.44 0.00 0.00 0.00 175.76 177.01 1dgf h ASP 124 N 2.56 0.79 -0.84 0.00 3.32 -1.02 -3.38 116.42 117.85 1dgf h ASP 124 Ca -0.48 -0.74 -0.73 0.00 0.02 0.00 0.00 57.03 55.11 1dgf h ASP 124 Cb 1.18 -0.24 -0.09 0.00 0.22 0.00 0.00 39.33 40.40 1dgf h ASP 124 CO 0.64 1.42 2.69 0.35 -1.72 0.00 0.00 179.24 182.62 1dgf n THR 125 N -3.99 4.57 -4.31 0.35 -2.24 -1.26 -4.92 114.28 102.48 1dgf n THR 125 Ca -0.11 -3.83 -0.19 0.00 -2.27 0.00 0.00 64.05 57.66 1dgf n THR 125 Cb 0.80 -2.33 -0.11 0.00 -2.10 0.00 0.00 70.33 66.59 1dgf n THR 125 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1dgf s VAL 126 N 0.51 1.60 0.01 2.28 -7.23 -1.26 -4.47 120.40 111.84 1dgf s VAL 126 Ca 0.52 -2.01 -0.30 0.00 -1.81 0.00 0.00 61.98 58.38 1dgf s VAL 126 Cb 0.15 -1.85 -0.06 0.00 0.56 0.00 0.00 36.38 35.18 1dgf s VAL 126 CO -0.06 -0.50 1.41 -0.60 -0.31 0.00 0.00 175.10 175.04 1dgf s ARG 127 N -3.22 4.28 0.00 4.82 3.52 -1.26 -4.71 118.95 122.37 1dgf s ARG 127 Ca 0.17 1.99 0.00 0.00 -0.13 0.00 0.00 55.73 57.76 1dgf s ARG 127 Cb -0.03 -3.56 0.00 0.00 -1.56 0.00 0.00 34.95 29.81 1dgf s ARG 127 CO 0.05 -0.58 0.00 -3.47 -0.81 0.00 0.00 175.30 170.49 1dgf n ASP 128 N 5.31 0.00 -4.37 -2.12 4.64 -1.13 -5.04 116.55 113.84 1dgf n ASP 128 Ca 0.13 0.00 -0.29 0.00 -1.38 0.00 0.00 54.79 53.25 1dgf n ASP 128 Cb 0.43 0.00 0.20 0.00 -1.04 0.00 0.00 41.12 40.71 1dgf n ASP 128 CO 0.00 0.00 0.00 -2.84 -0.82 0.00 0.00 177.20 173.54 1dgf s PRO 129 N -2.00 -0.10 -0.07 -0.67 0.02 -1.26 -4.74 135.00 126.17 1dgf s PRO 129 Ca 0.00 0.23 0.03 0.00 0.02 0.00 0.00 61.00 61.28 1dgf s PRO 129 Cb 0.00 -1.70 0.01 0.00 0.02 0.00 0.00 34.50 32.83 1dgf s PRO 129 CO 0.00 -3.03 -0.16 1.03 -0.33 0.00 0.00 177.00 174.52 1dgf s ARG 130 N -5.20 1.97 0.34 5.54 1.81 -1.26 -4.02 118.95 118.14 1dgf s ARG 130 Ca 0.68 -0.55 -0.25 0.00 -1.72 0.00 0.00 55.73 53.88 1dgf s ARG 130 Cb -0.14 -1.61 -0.10 0.00 -0.45 0.00 0.00 34.95 32.65 1dgf s ARG 130 CO 0.56 0.11 0.95 0.20 -0.68 0.00 0.00 175.30 176.45 1dgf s GLY 131 N 0.44 2.75 -0.45 -3.53 0.00 0.92 -0.37 107.32 107.09 1dgf s GLY 131 Ca -0.13 0.53 0.05 0.00 0.00 0.00 0.00 44.72 45.17 1dgf s GLY 131 CO 0.04 0.95 0.51 0.33 0.00 0.00 0.00 173.10 174.94 1dgf n PHE 132 N 0.39 -2.01 -3.44 1.90 -0.00 0.07 -2.01 117.46 112.36 1dgf n PHE 132 Ca 0.03 -2.59 -0.38 0.00 -0.00 0.00 0.00 57.45 54.51 1dgf n PHE 132 Cb 0.50 0.70 -0.06 0.00 -0.00 0.00 0.00 39.48 40.62 1dgf n PHE 132 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1dgf s ALA 133 N 0.27 3.63 -0.10 3.13 0.00 -0.75 -2.45 121.76 125.49 1dgf s ALA 133 Ca 0.32 -0.21 0.02 0.00 0.00 0.00 0.00 51.96 52.09 1dgf s ALA 133 Cb 0.05 -2.47 0.01 0.00 0.00 0.00 0.00 23.12 20.71 1dgf s ALA 133 CO -0.14 0.33 -0.15 0.08 0.00 0.00 0.00 175.76 175.87 1dgf s VAL 134 N -0.54 1.47 -0.28 0.00 1.01 -0.19 -2.15 120.40 119.71 1dgf s VAL 134 Ca 0.24 -0.64 -0.07 0.00 0.00 0.00 0.00 61.98 61.52 1dgf s VAL 134 Cb -0.16 -1.33 0.00 0.00 0.00 0.00 0.00 36.38 34.89 1dgf s VAL 134 CO 0.12 0.43 0.07 -0.75 0.00 0.00 0.00 175.10 174.97 1dgf s LYS 135 N 0.86 3.23 -0.29 2.72 2.20 0.30 -0.74 119.74 128.01 1dgf s LYS 135 Ca -0.09 -0.76 -0.12 0.00 -0.36 0.00 0.00 55.97 54.64 1dgf s LYS 135 Cb -0.15 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 32.80 1dgf s LYS 135 CO 0.01 -0.37 0.21 -0.06 -0.36 0.00 0.00 175.35 174.77 1dgf s PHE 136 N 1.52 3.22 -1.08 4.03 0.40 0.57 -1.59 117.98 125.05 1dgf s PHE 136 Ca 0.04 0.04 -0.17 0.00 -0.60 0.00 0.00 56.93 56.24 1dgf s PHE 136 Cb -0.16 -2.41 0.14 0.00 0.51 0.00 0.00 43.02 41.10 1dgf s PHE 136 CO 0.02 -0.21 1.33 0.71 0.70 0.00 0.00 175.22 177.77 1dgf s TYR 137 N 1.76 3.21 0.50 0.36 2.02 -0.74 -1.12 117.35 123.33 1dgf s TYR 137 Ca 0.07 -1.68 0.01 0.00 -0.37 0.00 0.00 57.07 55.10 1dgf s TYR 137 Cb -0.16 -4.36 0.02 0.00 -0.40 0.00 0.00 41.96 37.05 1dgf s TYR 137 CO 0.11 -1.51 0.73 0.95 -1.57 0.00 0.00 175.55 174.26 1dgf s THR 138 N 2.52 3.32 0.26 -0.71 -4.23 -0.90 -4.45 115.64 111.45 1dgf s THR 138 Ca 0.39 -0.58 0.34 0.00 -1.18 0.00 0.00 61.69 60.67 1dgf s THR 138 Cb -0.03 -3.24 0.37 0.00 1.34 0.00 0.00 72.50 70.94 1dgf s THR 138 CO -0.04 -0.17 2.05 -0.33 -0.54 0.00 0.00 174.62 175.59 1dgf h GLU 139 N 0.23 0.00 -0.99 3.99 3.07 -1.95 -1.61 114.58 117.32 1dgf h GLU 139 Ca -0.44 0.00 -0.47 0.00 -0.50 0.00 0.00 59.36 57.95 1dgf h GLU 139 Cb 1.27 0.00 -0.28 0.00 -0.84 0.00 0.00 28.75 28.90 1dgf h GLU 139 CO 0.55 0.04 0.60 -0.25 -1.40 0.00 0.00 179.01 178.55 1dgf n ASP 140 N -3.20 3.76 0.00 1.42 10.43 -1.26 -4.56 116.55 123.13 1dgf n ASP 140 Ca -0.00 -3.49 0.00 0.00 2.57 0.00 0.00 54.79 53.87 1dgf n ASP 140 Cb 0.27 -0.81 0.00 0.00 1.84 0.00 0.00 41.12 42.41 1dgf n ASP 140 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1dgf n GLY 141 N -0.99 -2.84 3.76 0.44 0.00 -0.60 -4.64 105.19 100.31 1dgf n GLY 141 Ca 0.55 -1.77 -0.39 0.00 0.00 0.00 0.00 46.02 44.41 1dgf n GLY 141 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dgf s ASN 142 N -1.96 7.56 -0.23 1.61 0.01 -1.26 -2.11 114.94 118.56 1dgf s ASN 142 Ca 0.00 1.92 0.01 0.00 -0.71 0.00 0.00 52.86 54.09 1dgf s ASN 142 Cb 0.00 -2.60 0.04 0.00 0.41 0.00 0.00 41.25 39.10 1dgf s ASN 142 CO 0.00 0.09 -0.14 0.86 -1.51 0.00 0.00 177.10 176.41 1dgf s TRP 143 N -1.30 3.04 -0.35 2.20 -0.00 -0.28 -4.15 118.94 118.10 1dgf s TRP 143 Ca 0.44 -1.91 -0.10 0.00 -0.00 0.00 0.00 56.10 54.52 1dgf s TRP 143 Cb -0.24 -1.95 0.02 0.00 -0.00 0.00 0.00 33.47 31.29 1dgf s TRP 143 CO 0.30 -0.82 0.17 -0.51 -0.00 0.00 0.00 176.95 176.09 1dgf s ASP 144 N 1.22 5.59 -0.70 5.86 -0.00 -0.50 -0.32 116.67 127.82 1dgf s ASP 144 Ca -0.02 -0.84 -0.12 0.00 -0.00 0.00 0.00 52.55 51.57 1dgf s ASP 144 Cb -0.17 -1.99 0.18 0.00 -0.00 0.00 0.00 42.92 40.95 1dgf s ASP 144 CO -0.08 -0.31 0.61 -0.22 -0.00 0.00 0.00 175.17 175.17 1dgf s LEU 145 N 1.55 6.27 -1.21 1.23 2.96 0.08 -4.43 118.68 125.13 1dgf s LEU 145 Ca 0.02 -2.47 -0.16 0.00 -0.22 0.00 0.00 54.13 51.31 1dgf s LEU 145 Cb -0.18 -2.12 0.14 0.00 0.50 0.00 0.00 46.19 44.52 1dgf s LEU 145 CO 0.06 -0.60 1.50 -0.69 -1.32 0.00 0.00 176.35 175.29 1dgf s VAL 146 N 0.52 4.73 0.67 1.68 1.01 -1.26 -1.03 120.40 126.72 1dgf s VAL 146 Ca 0.14 -2.30 0.03 0.00 0.00 0.00 0.00 61.98 59.85 1dgf s VAL 146 Cb -0.17 -4.99 0.12 0.00 0.00 0.00 0.00 36.38 31.34 1dgf s VAL 146 CO -0.05 -1.73 0.92 -0.83 0.00 0.00 0.00 175.10 173.41 1dgf s GLY 147 N 3.34 1.75 0.33 4.51 0.00 -1.03 -4.91 107.32 111.31 1dgf s GLY 147 Ca 0.45 -1.92 0.03 0.00 0.00 0.00 0.00 44.72 43.28 1dgf s GLY 147 CO 0.01 -1.38 0.09 -1.31 0.00 0.00 0.00 173.10 170.51 1dgf s ASN 148 N -4.72 2.21 -0.08 1.64 0.01 -0.83 -0.75 114.94 112.42 1dgf s ASN 148 Ca 0.65 -1.46 0.05 0.00 -0.71 0.00 0.00 52.86 51.39 1dgf s ASN 148 Cb -0.05 0.13 0.27 0.00 0.41 0.00 0.00 41.25 42.01 1dgf s ASN 148 CO 0.42 -0.72 0.92 -0.46 -1.51 0.00 0.00 177.10 175.76 1dgf n ASN 149 N -0.80 2.59 -3.92 -1.22 6.94 0.50 -0.57 115.26 118.77 1dgf n ASN 149 Ca -0.03 -2.31 -0.11 0.00 -0.02 0.00 0.00 54.58 52.11 1dgf n ASN 149 Cb 0.66 -0.56 -0.13 0.00 -2.36 0.00 0.00 39.78 37.39 1dgf n ASN 149 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1dgf s THR 150 N -1.57 0.07 -0.98 5.53 -1.32 -1.26 -4.70 115.64 111.41 1dgf s THR 150 Ca 0.18 -0.41 0.26 0.00 -1.21 0.00 0.00 61.69 60.51 1dgf s THR 150 Cb 0.14 -0.13 0.22 0.00 -1.51 0.00 0.00 72.50 71.21 1dgf s THR 150 CO 0.05 -0.21 1.82 -0.81 -2.21 0.00 0.00 174.62 173.26 1dgf n PRO 151 N 2.43 0.02 -3.90 7.08 -0.04 -1.26 -4.54 135.00 134.78 1dgf n PRO 151 Ca -0.17 0.07 -0.20 0.00 -0.04 0.00 0.00 63.50 63.15 1dgf n PRO 151 Cb 0.58 -1.52 -0.06 0.00 -0.04 0.00 0.00 33.50 32.46 1dgf n PRO 151 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1dgf n ILE 152 N -1.55 0.00 -4.14 0.52 -5.35 -1.26 -4.37 119.36 103.21 1dgf n ILE 152 Ca 0.06 -1.86 -0.11 0.00 -0.27 0.00 0.00 62.75 60.57 1dgf n ILE 152 Cb 0.31 0.63 -0.09 0.00 -1.74 0.00 0.00 39.64 38.75 1dgf n ILE 152 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 1dgf s PHE 153 N -2.70 0.93 0.32 4.28 2.19 -0.78 -4.99 117.98 117.23 1dgf s PHE 153 Ca 0.14 -1.20 0.14 0.00 0.33 0.00 0.00 56.93 56.34 1dgf s PHE 153 Cb 0.01 -0.37 0.67 0.00 -1.31 0.00 0.00 43.02 42.02 1dgf s PHE 153 CO 0.10 -0.71 1.78 0.74 1.83 0.00 0.00 175.22 178.95 1dgf h PHE 154 N 2.55 0.00 -3.37 10.12 -1.00 -1.89 -3.40 116.94 119.95 1dgf h PHE 154 Ca -0.34 0.00 -0.35 0.00 2.81 0.00 0.00 57.97 60.10 1dgf h PHE 154 Cb 1.25 0.00 -0.14 0.00 3.61 0.00 0.00 35.95 40.66 1dgf h PHE 154 CO 0.37 0.42 -0.69 0.96 -1.61 0.00 0.00 178.31 177.76 1dgf s ILE 155 N -3.97 1.09 -0.46 -0.55 -4.36 -1.26 -2.58 121.20 109.10 1dgf s ILE 155 Ca -0.02 -2.05 0.04 0.00 -0.26 0.00 0.00 60.65 58.36 1dgf s ILE 155 Cb 0.13 -2.09 0.06 0.00 1.25 0.00 0.00 42.46 41.82 1dgf s ILE 155 CO 0.72 -0.54 0.80 -2.11 0.24 0.00 0.00 174.94 174.05 1dgf n ARG 156 N -0.30 0.83 -4.00 0.37 1.85 -1.26 -4.62 116.66 109.53 1dgf n ARG 156 Ca -0.08 -1.10 -0.20 0.00 -1.00 0.00 0.00 57.85 55.47 1dgf n ARG 156 Cb 0.62 -1.09 -0.17 0.00 -1.05 0.00 0.00 32.46 30.78 1dgf n ARG 156 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1dgf s ASP 157 N -0.59 0.98 0.60 2.89 2.15 -1.26 -4.20 116.67 117.24 1dgf s ASP 157 Ca 0.06 -0.09 0.34 0.00 0.43 0.00 0.00 52.55 53.30 1dgf s ASP 157 Cb 0.04 -0.38 1.92 0.00 -0.30 0.00 0.00 42.92 44.20 1dgf s ASP 157 CO 0.05 -0.10 2.25 1.55 -0.17 0.00 0.00 175.17 178.75 1dgf h PRO 158 N 7.51 0.00 0.00 4.34 0.13 -1.88 -2.79 132.00 139.31 1dgf h PRO 158 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1dgf h PRO 158 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1dgf h PRO 158 CO 0.41 0.02 0.00 0.97 -0.23 0.00 0.00 178.00 179.18 1dgf h ILE 159 N 0.00 0.00 -0.01 -3.56 2.10 -1.97 -1.21 117.51 112.86 1dgf h ILE 159 Ca -0.00 -0.21 0.00 0.00 1.08 0.00 0.00 64.86 65.72 1dgf h ILE 159 Cb 0.09 0.96 0.00 0.00 -1.09 0.00 0.00 36.82 36.78 1dgf h ILE 159 CO 0.00 0.00 -0.41 0.18 -1.08 0.00 0.00 178.15 176.85 1dgf n LEU 160 N -2.45 1.37 0.05 2.19 4.32 -1.05 -4.50 117.00 116.94 1dgf n LEU 160 Ca 0.01 -0.45 -0.12 0.00 -0.02 0.00 0.00 56.01 55.43 1dgf n LEU 160 Cb 0.19 -0.08 -0.07 0.00 -1.62 0.00 0.00 43.42 41.85 1dgf n LEU 160 CO 0.19 0.26 0.85 0.15 -1.22 0.00 0.00 177.39 177.62 1dgf h PHE 161 N 1.51 -0.08 -0.90 -1.77 3.04 -1.37 -0.13 116.94 117.24 1dgf h PHE 161 Ca 0.00 0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.00 1dgf h PHE 161 Cb 0.60 0.03 -0.06 0.00 2.56 0.00 0.00 35.95 39.09 1dgf h PHE 161 CO 0.00 -0.05 0.57 -1.35 -2.02 0.00 0.00 178.31 175.46 1dgf h PRO 162 N -0.07 1.04 -0.26 6.41 0.11 -1.79 -0.87 132.00 136.57 1dgf h PRO 162 Ca 0.01 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 1dgf h PRO 162 Cb 0.08 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.94 1dgf h PRO 162 CO -0.02 0.69 0.12 0.77 -0.21 0.00 0.00 178.00 179.35 1dgf h SER 163 N 1.07 0.35 -0.05 -2.05 0.02 -1.77 -0.02 113.55 111.10 1dgf h SER 163 Ca 0.38 -0.14 0.02 0.00 -0.84 0.00 0.00 61.79 61.20 1dgf h SER 163 Cb 0.10 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 1dgf h SER 163 CO -0.15 0.39 -0.05 0.15 -1.14 0.00 0.00 176.83 176.04 1dgf h PHE 164 N 0.29 -0.11 -0.84 3.45 -0.00 -0.58 -0.58 116.94 118.56 1dgf h PHE 164 Ca 0.09 0.01 0.02 0.00 -0.00 0.00 0.00 57.97 58.08 1dgf h PHE 164 Cb 0.14 0.06 -0.04 0.00 -0.00 0.00 0.00 35.95 36.10 1dgf h PHE 164 CO -0.02 -0.08 0.55 0.82 -0.00 0.00 0.00 178.31 179.59 1dgf h ILE 165 N -0.06 1.19 -0.48 1.41 1.08 -1.03 -2.01 117.51 117.61 1dgf h ILE 165 Ca 0.04 -0.38 0.02 0.00 -0.39 0.00 0.00 64.86 64.15 1dgf h ILE 165 Cb 0.11 -0.01 -0.03 0.00 -3.07 0.00 0.00 36.82 33.82 1dgf h ILE 165 CO -0.09 0.20 0.28 0.45 -0.69 0.00 0.00 178.15 178.31 1dgf h HIS 166 N 1.11 0.53 0.00 1.37 3.86 -0.60 -1.71 115.15 119.70 1dgf h HIS 166 Ca 0.32 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.53 1dgf h HIS 166 Cb -0.08 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 28.22 1dgf h HIS 166 CO -0.02 0.30 -0.08 0.66 0.86 0.00 0.00 177.93 179.66 1dgf h SER 167 N 0.56 0.00 0.94 2.45 4.64 -0.46 -2.01 113.55 119.68 1dgf h SER 167 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1dgf h SER 167 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1dgf h SER 167 CO -0.09 0.08 -0.61 1.56 -0.87 0.00 0.00 176.83 176.89 1dgf h GLN 168 N 0.00 0.00 0.00 4.77 1.08 -0.65 -3.04 115.11 117.26 1dgf h GLN 168 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1dgf h GLN 168 Cb 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 1dgf h GLN 168 CO 0.01 0.00 0.00 1.63 -0.95 0.00 0.00 178.83 179.52 1dgf n LYS 169 N -2.21 3.98 -3.02 1.46 5.02 -0.75 -4.91 118.16 117.74 1dgf n LYS 169 Ca 0.03 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.97 1dgf n LYS 169 Cb 0.45 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.40 1dgf n LYS 169 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1dgf s ARG 170 N 3.94 4.26 0.28 1.97 0.52 -1.26 -4.24 118.95 124.43 1dgf s ARG 170 Ca 0.00 0.94 -0.30 0.00 -0.52 0.00 0.00 55.73 55.85 1dgf s ARG 170 Cb 0.00 -2.70 -0.11 0.00 0.52 0.00 0.00 34.95 32.66 1dgf s ARG 170 CO 0.00 0.28 1.61 1.21 0.02 0.00 0.00 175.30 178.42 1dgf s ASN 171 N -1.83 6.37 0.63 0.23 3.84 0.41 -4.85 114.94 119.74 1dgf s ASN 171 Ca 0.49 2.95 0.38 0.00 0.21 0.00 0.00 52.86 56.88 1dgf s ASN 171 Cb -0.15 -2.63 2.17 0.00 -0.55 0.00 0.00 41.25 40.09 1dgf s ASN 171 CO 0.20 -0.92 2.32 1.55 -2.79 0.00 0.00 177.10 177.46 1dgf h PRO 172 N 5.04 0.00 0.00 0.43 0.13 -1.95 -0.68 132.00 134.97 1dgf h PRO 172 Ca -0.47 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.24 1dgf h PRO 172 Cb 1.22 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.29 1dgf h PRO 172 CO 0.81 0.00 -2.39 0.94 -0.23 0.00 0.00 178.00 177.13 1dgf n GLN 173 N -3.43 0.58 0.14 0.86 7.27 -1.26 -4.67 117.38 116.87 1dgf n GLN 173 Ca -0.03 0.25 0.05 0.00 0.07 0.00 0.00 57.00 57.34 1dgf n GLN 173 Cb 0.08 -1.47 0.04 0.00 2.41 0.00 0.00 30.24 31.30 1dgf n GLN 173 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 1dgf h THR 174 N -0.99 0.59 -0.93 1.69 1.35 -1.97 -3.47 112.91 109.18 1dgf h THR 174 Ca -0.63 -1.86 -0.22 0.00 -0.55 0.00 0.00 66.41 63.14 1dgf h THR 174 Cb 1.55 2.24 -0.06 0.00 -1.73 0.00 0.00 68.15 70.16 1dgf h THR 174 CO -0.38 0.34 -0.23 1.57 -0.25 0.00 0.00 175.52 176.56 1dgf n HIS 175 N -3.13 -0.21 -4.25 4.73 -0.00 -0.26 -4.97 115.22 107.14 1dgf n HIS 175 Ca 0.01 0.00 -0.24 0.00 0.46 0.00 0.00 57.72 57.95 1dgf n HIS 175 Cb 0.69 -2.25 -0.07 0.00 -0.12 0.00 0.00 29.99 28.24 1dgf n HIS 175 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 1dgf s LEU 176 N -2.73 3.27 0.50 0.27 1.43 -1.26 -4.70 118.68 115.46 1dgf s LEU 176 Ca 0.00 -0.52 -0.23 0.00 -1.03 0.00 0.00 54.13 52.35 1dgf s LEU 176 Cb 0.00 -1.85 -0.06 0.00 0.03 0.00 0.00 46.19 44.31 1dgf s LEU 176 CO 0.00 0.03 1.35 -0.54 0.23 0.00 0.00 176.35 177.42 1dgf s LYS 177 N -3.39 3.40 -0.25 1.70 -0.14 -1.26 -0.45 119.74 119.35 1dgf s LYS 177 Ca 0.30 2.22 -0.02 0.00 -1.36 0.00 0.00 55.97 57.11 1dgf s LYS 177 Cb -0.08 -2.41 0.08 0.00 -1.68 0.00 0.00 37.83 33.75 1dgf s LYS 177 CO 0.20 -0.98 0.06 0.34 -0.76 0.00 0.00 175.35 174.21 1dgf s ASP 178 N -0.88 3.50 0.54 2.83 -1.08 -1.26 -4.84 116.67 115.48 1dgf s ASP 178 Ca 0.67 -1.22 0.20 0.00 -0.52 0.00 0.00 52.55 51.68 1dgf s ASP 178 Cb -0.40 -0.74 1.44 0.00 -1.46 0.00 0.00 42.92 41.76 1dgf s ASP 178 CO 0.48 -0.35 2.18 -0.65 0.52 0.00 0.00 175.17 177.35 1dgf h PRO 179 N 8.16 0.00 -0.40 4.34 0.11 -1.93 -1.47 132.00 140.81 1dgf h PRO 179 Ca -0.15 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.87 1dgf h PRO 179 Cb 1.07 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1dgf h PRO 179 CO 0.41 0.00 -0.06 -0.44 -0.21 0.00 0.00 178.00 177.69 1dgf h ASP 180 N 0.00 0.75 -0.00 -2.05 3.45 -1.94 -1.76 116.42 114.86 1dgf h ASP 180 Ca -0.00 -0.35 -0.00 0.00 0.43 0.00 0.00 57.03 57.11 1dgf h ASP 180 Cb 0.01 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 38.57 1dgf h ASP 180 CO 0.00 0.92 0.00 0.24 -1.57 0.00 0.00 179.24 178.83 1dgf h MET 181 N 0.57 0.01 0.19 3.56 2.86 -1.60 0.39 114.93 120.91 1dgf h MET 181 Ca 0.11 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1dgf h MET 181 Cb 0.57 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.20 1dgf h MET 181 CO 0.03 0.19 -0.36 0.28 1.06 0.00 0.00 176.91 178.12 1dgf h VAL 182 N -0.18 0.26 0.00 -2.22 2.07 -1.20 -2.59 116.25 112.38 1dgf h VAL 182 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1dgf h VAL 182 Cb 0.19 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 1dgf h VAL 182 CO -0.00 0.00 -0.30 -0.50 0.02 0.00 0.00 177.57 176.79 1dgf h TRP 183 N -0.63 0.00 -0.25 1.57 4.06 -1.36 -2.51 115.95 116.83 1dgf h TRP 183 Ca 0.01 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.90 1dgf h TRP 183 Cb 0.63 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.79 1dgf h TRP 183 CO -0.29 0.30 -0.07 0.22 -3.56 0.00 0.00 178.44 175.04 1dgf h ASP 184 N 0.00 0.49 0.26 -3.49 3.58 -0.87 0.09 116.42 116.48 1dgf h ASP 184 Ca -0.00 -0.38 -0.01 0.00 0.42 0.00 0.00 57.03 57.06 1dgf h ASP 184 Cb 1.21 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.12 1dgf h ASP 184 CO 0.04 0.76 -0.12 0.15 -2.88 0.00 0.00 179.24 177.18 1dgf h PHE 185 N 0.22 -0.32 -0.76 0.28 3.04 -1.47 -1.44 116.94 116.50 1dgf h PHE 185 Ca 0.06 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.99 1dgf h PHE 185 Cb 0.55 0.11 -0.04 0.00 2.56 0.00 0.00 35.95 39.13 1dgf h PHE 185 CO 0.05 -0.11 0.43 -1.49 -2.02 0.00 0.00 178.31 175.17 1dgf h TRP 186 N -0.47 1.02 -0.03 0.41 6.55 -1.45 -0.55 115.95 121.44 1dgf h TRP 186 Ca -0.04 -0.02 -0.09 0.00 0.95 0.00 0.00 58.89 59.69 1dgf h TRP 186 Cb 0.35 -0.33 -0.01 0.00 -0.86 0.00 0.00 29.16 28.31 1dgf h TRP 186 CO -0.03 0.71 -0.43 0.66 -1.05 0.00 0.00 178.44 178.31 1dgf h SER 187 N 1.04 0.06 1.71 -3.49 4.64 -0.92 -2.71 113.55 113.88 1dgf h SER 187 Ca 0.27 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.51 1dgf h SER 187 Cb 0.01 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1dgf h SER 187 CO -0.05 0.48 -0.29 -0.07 -0.87 0.00 0.00 176.83 176.04 1dgf h LEU 188 N 0.05 0.00 -6.49 5.97 3.38 -0.95 -3.38 115.31 113.90 1dgf h LEU 188 Ca 0.00 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.37 1dgf h LEU 188 Cb 0.78 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 41.11 1dgf h LEU 188 CO 0.06 0.25 -0.63 0.54 0.09 0.00 0.00 178.44 178.74 1dgf n ARG 189 N -3.14 2.09 0.00 1.13 5.12 -0.24 -4.96 116.66 116.66 1dgf n ARG 189 Ca 0.03 -4.46 0.00 0.00 -1.93 0.00 0.00 57.85 51.48 1dgf n ARG 189 Cb 0.63 -2.18 0.00 0.00 -1.16 0.00 0.00 32.46 29.76 1dgf n ARG 189 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1dgf n PRO 190 N 1.33 0.00 0.24 5.56 -0.04 -1.19 -1.76 135.00 139.15 1dgf n PRO 190 Ca 0.26 0.39 0.17 0.00 -0.04 0.00 0.00 63.50 64.28 1dgf n PRO 190 Cb 0.40 -1.53 0.83 0.00 -0.04 0.00 0.00 33.50 33.16 1dgf n PRO 190 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1dgf h GLU 191 N 0.00 0.00 0.00 0.54 9.09 -1.86 -1.34 114.58 121.00 1dgf h GLU 191 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1dgf h GLU 191 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.15 1dgf h GLU 191 CO 0.00 0.00 0.00 -1.13 0.05 0.00 0.00 179.01 177.93 1dgf n SER 192 N -2.71 0.15 -0.28 3.06 3.41 -0.72 -4.07 113.62 112.45 1dgf n SER 192 Ca -0.01 0.53 0.08 0.00 -0.26 0.00 0.00 58.87 59.21 1dgf n SER 192 Cb 0.13 -0.56 0.23 0.00 -0.26 0.00 0.00 64.21 63.75 1dgf n SER 192 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1dgf h LEU 193 N 0.00 0.38 0.40 1.04 3.38 -1.49 -0.01 115.31 119.01 1dgf h LEU 193 Ca 0.00 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1dgf h LEU 193 Cb 0.39 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1dgf h LEU 193 CO 0.00 0.11 -0.19 -0.74 0.09 0.00 0.00 178.44 177.71 1dgf h HIS 194 N 0.49 -0.50 -0.03 1.13 2.76 -1.81 -1.19 115.15 116.00 1dgf h HIS 194 Ca 0.47 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.52 1dgf h HIS 194 Cb 0.76 0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.87 1dgf h HIS 194 CO -0.13 -0.25 -0.51 0.37 -1.30 0.00 0.00 177.93 176.11 1dgf h GLN 195 N -0.64 0.09 -0.54 5.26 5.75 -1.74 -2.41 115.11 120.89 1dgf h GLN 195 Ca -0.05 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.32 1dgf h GLN 195 Cb 0.47 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.00 1dgf h GLN 195 CO 0.09 0.58 0.04 0.28 -2.65 0.00 0.00 178.83 177.17 1dgf h VAL 196 N 0.07 1.25 -0.51 2.39 2.07 -0.93 0.21 116.25 120.80 1dgf h VAL 196 Ca -0.00 -1.01 -0.06 0.00 0.82 0.00 0.00 66.70 66.45 1dgf h VAL 196 Cb 0.93 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1dgf h VAL 196 CO 0.07 0.36 0.08 0.28 0.02 0.00 0.00 177.57 178.38 1dgf h SER 197 N 0.84 0.81 -0.39 0.57 0.02 -0.93 -1.57 113.55 112.90 1dgf h SER 197 Ca 0.16 -0.26 -0.11 0.00 -0.84 0.00 0.00 61.79 60.74 1dgf h SER 197 Cb 0.44 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 1dgf h SER 197 CO 0.02 0.87 -0.19 0.15 -1.14 0.00 0.00 176.83 176.54 1dgf h PHE 198 N 0.73 0.94 -0.76 3.45 3.04 -1.10 -2.94 116.94 120.30 1dgf h PHE 198 Ca 0.15 -0.23 0.02 0.00 3.98 0.00 0.00 57.97 61.89 1dgf h PHE 198 Cb 0.41 -0.22 -0.04 0.00 2.56 0.00 0.00 35.95 38.66 1dgf h PHE 198 CO 0.03 0.99 0.50 1.25 -2.02 0.00 0.00 178.31 179.06 1dgf h LEU 199 N 0.62 0.85 -0.75 0.59 5.85 -0.44 -2.51 115.31 119.52 1dgf h LEU 199 Ca 0.09 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1dgf h LEU 199 Cb 0.74 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.57 1dgf h LEU 199 CO 0.06 0.60 0.00 0.49 -0.34 0.00 0.00 178.44 179.25 1dgf n PHE 200 N -4.58 0.18 -2.46 1.25 3.01 -0.60 -3.79 117.46 110.47 1dgf n PHE 200 Ca 0.08 -0.09 -0.13 0.00 1.01 0.00 0.00 57.45 58.32 1dgf n PHE 200 Cb 0.04 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 39.58 1dgf n PHE 200 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1dgf n SER 201 N -0.00 0.78 -0.23 4.37 3.41 -0.95 -4.30 113.62 116.70 1dgf n SER 201 Ca 0.13 -1.65 0.10 0.00 -0.26 0.00 0.00 58.87 57.20 1dgf n SER 201 Cb 0.22 -0.37 0.38 0.00 -0.26 0.00 0.00 64.21 64.19 1dgf n SER 201 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1dgf h ASP 202 N -0.34 0.63 0.00 4.04 3.32 -1.89 -1.38 116.42 120.80 1dgf h ASP 202 Ca -0.19 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1dgf h ASP 202 Cb 0.70 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1dgf h ASP 202 CO 0.20 0.35 0.00 0.54 -1.72 0.00 0.00 179.24 178.61 1dgf n ARG 203 N -4.52 0.65 0.26 3.56 1.74 -1.26 -3.02 116.66 114.06 1dgf n ARG 203 Ca 0.15 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.37 1dgf n ARG 203 Cb 0.39 -1.34 0.60 0.00 -1.02 0.00 0.00 32.46 31.09 1dgf n ARG 203 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1dgf h GLY 204 N 3.45 0.00 -6.58 -0.13 0.00 -1.34 -3.36 103.07 95.11 1dgf h GLY 204 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 1dgf h GLY 204 CO 0.00 0.00 -0.87 -0.42 0.00 0.00 0.00 176.54 175.25 1dgf s ILE 205 N -3.70 0.74 0.67 2.60 1.01 -1.17 -2.85 121.20 118.51 1dgf s ILE 205 Ca 0.01 -2.63 -0.16 0.00 0.00 0.00 0.00 60.65 57.87 1dgf s ILE 205 Cb 0.10 -1.52 0.01 0.00 0.01 0.00 0.00 42.46 41.06 1dgf s ILE 205 CO 0.58 -1.11 1.15 -2.16 0.00 0.00 0.00 174.94 173.40 1dgf s PRO 206 N 0.14 2.62 -1.21 2.79 0.04 -1.26 -0.78 135.00 137.34 1dgf s PRO 206 Ca 0.27 1.56 -0.17 0.00 0.04 0.00 0.00 61.00 62.70 1dgf s PRO 206 Cb -0.07 -1.91 0.10 0.00 0.04 0.00 0.00 34.50 32.66 1dgf s PRO 206 CO -0.12 -1.42 1.56 0.34 0.04 0.00 0.00 177.00 177.40 1dgf s ASP 207 N -2.27 6.86 0.01 6.66 3.68 0.64 -4.48 116.67 127.76 1dgf s ASP 207 Ca 0.71 -2.47 0.00 0.00 2.13 0.00 0.00 52.55 52.92 1dgf s ASP 207 Cb -0.24 -2.51 0.00 0.00 -1.45 0.00 0.00 42.92 38.72 1dgf s ASP 207 CO 0.41 -1.07 0.00 0.61 0.13 0.00 0.00 175.17 175.25 1dgf n GLY 208 N 5.19 -2.25 0.16 2.66 0.00 -1.26 -4.13 105.19 105.55 1dgf n GLY 208 Ca 0.41 -1.53 0.05 0.00 0.00 0.00 0.00 46.02 44.96 1dgf n GLY 208 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1dgf h HIS 209 N -0.02 0.00 0.00 1.61 3.86 -1.89 -3.31 115.15 115.40 1dgf h HIS 209 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1dgf h HIS 209 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 1dgf h HIS 209 CO 0.00 0.34 0.00 0.54 0.86 0.00 0.00 177.93 179.67 1dgf n ARG 210 N -3.13 0.21 -1.49 2.45 1.74 -1.26 -3.84 116.66 111.34 1dgf n ARG 210 Ca 0.01 0.25 -0.25 0.00 -0.77 0.00 0.00 57.85 57.10 1dgf n ARG 210 Cb 0.68 -1.78 0.08 0.00 -1.02 0.00 0.00 32.46 30.42 1dgf n ARG 210 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1dgf n HIS 211 N -2.16 2.64 -3.99 -1.55 8.25 -1.25 -4.46 115.22 112.70 1dgf n HIS 211 Ca 0.05 -2.40 -0.08 0.00 -0.26 0.00 0.00 57.72 55.03 1dgf n HIS 211 Cb 0.36 -0.82 -0.09 0.00 1.12 0.00 0.00 29.99 30.56 1dgf n HIS 211 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1dgf s MET 212 N -3.61 0.74 0.53 -0.41 0.23 -1.25 -2.38 119.30 113.15 1dgf s MET 212 Ca 0.55 -1.12 -0.00 0.00 -1.03 0.00 0.00 55.69 54.09 1dgf s MET 212 Cb 0.45 0.27 0.02 0.00 -1.53 0.00 0.00 34.83 34.04 1dgf s MET 212 CO 0.02 -0.19 0.76 -0.80 -2.03 0.00 0.00 175.02 172.77 1dgf s ASN 213 N -2.90 5.50 0.08 -1.18 0.01 -1.26 -4.11 114.94 111.06 1dgf s ASN 213 Ca 0.07 0.21 0.07 0.00 -0.71 0.00 0.00 52.86 52.50 1dgf s ASN 213 Cb 0.06 -1.23 -0.03 0.00 0.41 0.00 0.00 41.25 40.46 1dgf s ASN 213 CO -0.09 -0.99 -0.18 -0.83 -1.51 0.00 0.00 177.10 173.49 1dgf s GLY 214 N -4.34 1.06 -0.02 0.66 0.00 0.03 -4.15 107.32 100.57 1dgf s GLY 214 Ca 0.54 -1.09 -0.08 0.00 0.00 0.00 0.00 44.72 44.08 1dgf s GLY 214 CO 0.39 -1.09 0.18 -0.19 0.00 0.00 0.00 173.10 172.40 1dgf s TYR 215 N -1.08 -0.06 -0.15 1.90 2.02 0.26 -1.05 117.35 119.18 1dgf s TYR 215 Ca 0.04 0.11 0.26 0.00 -0.37 0.00 0.00 57.07 57.11 1dgf s TYR 215 Cb -0.09 0.01 0.75 0.00 -0.40 0.00 0.00 41.96 42.23 1dgf s TYR 215 CO 0.03 -0.25 1.76 0.78 -1.57 0.00 0.00 175.55 176.30 1dgf h GLY 216 N 4.67 0.00 0.00 0.71 0.00 -1.62 -2.20 103.07 104.63 1dgf h GLY 216 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1dgf h GLY 216 CO 0.40 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.38 1dgf n SER 217 N -3.14 0.00 -4.75 0.19 7.64 -1.26 -4.80 113.62 107.49 1dgf n SER 217 Ca 0.02 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.59 1dgf n SER 217 Cb 0.46 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.76 1dgf n SER 217 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1dgf s HIS 218 N 0.00 2.39 0.05 1.43 3.76 -1.26 -4.78 115.29 116.88 1dgf s HIS 218 Ca 0.00 1.60 -0.26 0.00 -0.15 0.00 0.00 55.06 56.26 1dgf s HIS 218 Cb 0.00 -3.12 -0.05 0.00 1.11 0.00 0.00 32.58 30.52 1dgf s HIS 218 CO 0.00 -2.00 0.80 0.99 -0.85 0.00 0.00 174.74 173.68 1dgf s THR 219 N -2.80 4.71 0.50 1.30 2.01 -1.26 -4.60 115.64 115.50 1dgf s THR 219 Ca 0.63 1.70 0.00 0.00 0.31 0.00 0.00 61.69 64.33 1dgf s THR 219 Cb -0.19 -4.15 0.00 0.00 0.01 0.00 0.00 72.50 68.18 1dgf s THR 219 CO 0.55 0.35 0.03 0.49 -0.69 0.00 0.00 174.62 175.36 1dgf n PHE 220 N 2.84 1.01 -4.97 4.92 3.72 0.48 -4.03 117.46 121.43 1dgf n PHE 220 Ca -0.02 -2.45 -0.28 0.00 -0.05 0.00 0.00 57.45 54.66 1dgf n PHE 220 Cb 0.50 -0.34 -0.16 0.00 -0.94 0.00 0.00 39.48 38.54 1dgf n PHE 220 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1dgf s LYS 221 N -3.84 1.95 -0.07 -1.08 2.20 0.37 -0.79 119.74 118.49 1dgf s LYS 221 Ca 0.03 -0.70 0.02 0.00 -0.36 0.00 0.00 55.97 54.96 1dgf s LYS 221 Cb -0.00 -1.71 -0.02 0.00 -1.51 0.00 0.00 37.83 34.58 1dgf s LYS 221 CO 0.02 0.31 -0.13 -0.51 -0.36 0.00 0.00 175.35 174.67 1dgf s LEU 222 N -0.09 2.78 -0.08 5.43 1.43 -0.14 -0.02 118.68 127.99 1dgf s LEU 222 Ca -0.02 -0.21 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 1dgf s LEU 222 Cb -0.11 -1.58 0.01 0.00 0.03 0.00 0.00 46.19 44.53 1dgf s LEU 222 CO 0.02 0.30 -0.17 -0.69 0.23 0.00 0.00 176.35 176.04 1dgf s VAL 223 N -0.45 1.54 0.72 -1.59 1.01 -0.78 -1.62 120.40 119.22 1dgf s VAL 223 Ca 0.06 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1dgf s VAL 223 Cb -0.12 -1.36 0.14 0.00 0.00 0.00 0.00 36.38 35.04 1dgf s VAL 223 CO 0.02 0.44 0.98 -0.46 0.00 0.00 0.00 175.10 176.09 1dgf n ASN 224 N 3.69 1.40 0.25 3.32 0.23 -0.32 -1.13 115.26 122.69 1dgf n ASN 224 Ca -0.21 -2.16 0.14 0.00 -0.53 0.00 0.00 54.58 51.82 1dgf n ASN 224 Cb 0.52 -0.63 0.82 0.00 -2.08 0.00 0.00 39.78 38.41 1dgf n ASN 224 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1dgf h ALA 225 N -0.56 1.77 -0.01 -2.53 0.00 -1.89 -1.60 119.26 114.44 1dgf h ALA 225 Ca -0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1dgf h ALA 225 Cb 1.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1dgf h ALA 225 CO 0.36 -0.12 -0.05 0.09 0.00 0.00 0.00 179.25 179.53 1dgf n ASN 226 N -4.03 1.05 0.00 0.00 3.02 -1.26 -4.91 115.26 109.13 1dgf n ASN 226 Ca -0.01 -1.22 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 1dgf n ASN 226 Cb 0.18 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1dgf n ASN 226 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dgf n GLY 227 N 1.18 0.64 3.79 7.41 0.00 -0.60 -5.04 105.19 112.57 1dgf n GLY 227 Ca 0.18 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 1dgf n GLY 227 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dgf s GLU 228 N -0.36 4.36 0.13 1.61 2.02 -1.26 -4.84 118.70 120.35 1dgf s GLU 228 Ca 0.00 0.91 0.09 0.00 0.02 0.00 0.00 54.97 55.99 1dgf s GLU 228 Cb 0.00 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 30.93 1dgf s GLU 228 CO 0.00 0.57 -0.22 0.00 0.02 0.00 0.00 175.26 175.64 1dgf s ALA 229 N -0.99 2.01 0.11 5.21 0.00 -1.26 -1.18 121.76 125.66 1dgf s ALA 229 Ca 0.32 -1.37 -0.01 0.00 0.00 0.00 0.00 51.96 50.90 1dgf s ALA 229 Cb -0.21 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 1dgf s ALA 229 CO 0.22 0.37 0.02 0.14 0.00 0.00 0.00 175.76 176.50 1dgf s VAL 230 N -1.39 0.23 0.16 0.00 -7.23 -0.64 -4.63 120.40 106.90 1dgf s VAL 230 Ca 0.11 -1.89 0.00 0.00 -1.81 0.00 0.00 61.98 58.39 1dgf s VAL 230 Cb -0.09 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.93 1dgf s VAL 230 CO 0.06 -0.65 0.33 -0.31 -0.31 0.00 0.00 175.10 174.22 1dgf s TYR 231 N -3.95 3.49 0.21 2.82 2.02 0.16 -0.97 117.35 121.13 1dgf s TYR 231 Ca 0.18 0.26 -0.12 0.00 -0.37 0.00 0.00 57.07 57.02 1dgf s TYR 231 Cb 0.07 -1.78 -0.00 0.00 -0.40 0.00 0.00 41.96 39.85 1dgf s TYR 231 CO -0.02 0.46 0.40 0.00 -1.57 0.00 0.00 175.55 174.82 1dgf s LYS 233 N -3.98 1.18 -0.16 0.00 -0.14 -0.70 -0.39 119.74 115.55 1dgf s LYS 233 Ca 0.19 -0.49 -0.08 0.00 -1.36 0.00 0.00 55.97 54.23 1dgf s LYS 233 Cb 0.01 -1.12 -0.04 0.00 -1.68 0.00 0.00 37.83 34.99 1dgf s LYS 233 CO 0.04 0.28 0.10 -0.06 -0.76 0.00 0.00 175.35 174.95 1dgf s PHE 234 N -0.25 3.40 -0.02 3.18 0.08 -1.26 -1.30 117.98 121.81 1dgf s PHE 234 Ca 0.04 0.30 0.02 0.00 0.12 0.00 0.00 56.93 57.41 1dgf s PHE 234 Cb -0.06 -2.04 0.00 0.00 -0.57 0.00 0.00 43.02 40.35 1dgf s PHE 234 CO -0.00 0.40 -0.07 -1.01 -0.10 0.00 0.00 175.22 174.44 1dgf s HIS 235 N -0.17 0.71 -0.29 0.36 3.76 -0.01 -1.67 115.29 117.98 1dgf s HIS 235 Ca 0.09 -0.15 -0.03 0.00 -0.15 0.00 0.00 55.06 54.82 1dgf s HIS 235 Cb -0.12 -0.51 0.10 0.00 1.11 0.00 0.00 32.58 33.16 1dgf s HIS 235 CO 0.01 -0.06 0.11 1.52 -0.85 0.00 0.00 174.74 175.47 1dgf s TYR 236 N 0.10 0.86 0.10 1.40 -0.85 -0.22 0.39 117.35 119.13 1dgf s TYR 236 Ca -0.01 -1.19 -0.25 0.00 -0.52 0.00 0.00 57.07 55.10 1dgf s TYR 236 Cb -0.06 -1.20 -0.07 0.00 0.38 0.00 0.00 41.96 41.01 1dgf s TYR 236 CO -0.00 -0.83 0.77 0.15 -1.52 0.00 0.00 175.55 174.12 1dgf s LYS 237 N 1.91 4.53 0.18 -3.49 -0.14 -0.41 -0.79 119.74 121.53 1dgf s LYS 237 Ca 0.09 1.11 -0.31 0.00 -1.36 0.00 0.00 55.97 55.50 1dgf s LYS 237 Cb -0.16 -3.32 -0.09 0.00 -1.68 0.00 0.00 37.83 32.58 1dgf s LYS 237 CO -0.31 0.42 1.47 -0.08 -0.76 0.00 0.00 175.35 176.08 1dgf s THR 238 N -0.56 2.86 -1.39 2.17 -1.32 -1.26 -0.57 115.64 115.57 1dgf s THR 238 Ca 0.37 0.65 0.28 0.00 -1.21 0.00 0.00 61.69 61.78 1dgf s THR 238 Cb -0.22 -3.41 0.29 0.00 -1.51 0.00 0.00 72.50 67.65 1dgf s THR 238 CO 0.25 0.07 1.74 0.47 -2.21 0.00 0.00 174.62 174.93 1dgf n ASP 239 N 3.45 0.45 -0.21 8.08 10.43 -0.48 -3.19 116.55 135.09 1dgf n ASP 239 Ca 0.11 -0.34 0.12 0.00 2.57 0.00 0.00 54.79 57.25 1dgf n ASP 239 Cb 0.40 -0.06 0.20 0.00 1.84 0.00 0.00 41.12 43.51 1dgf n ASP 239 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1dgf n GLN 240 N -1.14 0.61 0.00 -1.24 3.00 -1.26 -4.99 117.38 112.35 1dgf n GLN 240 Ca 0.11 -0.42 0.00 0.00 -0.01 0.00 0.00 57.00 56.68 1dgf n GLN 240 Cb 0.31 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.06 1dgf n GLN 240 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1dgf n GLY 241 N 1.42 -1.36 3.72 1.08 0.00 -1.19 -4.92 105.19 103.93 1dgf n GLY 241 Ca 0.09 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 1dgf n GLY 241 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dgf s ILE 242 N -3.08 3.42 -0.15 -0.61 -1.09 -1.26 -4.48 121.20 113.95 1dgf s ILE 242 Ca 0.00 1.06 -0.08 0.00 -2.23 0.00 0.00 60.65 59.40 1dgf s ILE 242 Cb 0.00 -3.68 0.06 0.00 -1.58 0.00 0.00 42.46 37.26 1dgf s ILE 242 CO 0.00 0.10 0.35 -0.75 -1.23 0.00 0.00 174.94 173.42 1dgf s LYS 243 N 0.75 0.32 0.31 2.79 2.20 -1.00 -5.04 119.74 120.07 1dgf s LYS 243 Ca 0.61 0.72 0.11 0.00 -0.36 0.00 0.00 55.97 57.05 1dgf s LYS 243 Cb -0.35 -0.04 -0.06 0.00 -1.51 0.00 0.00 37.83 35.87 1dgf s LYS 243 CO 0.32 -0.17 -0.14 -0.80 -0.36 0.00 0.00 175.35 174.20 1dgf s ASN 244 N 1.47 3.67 -0.11 1.43 0.01 -1.26 -0.26 114.94 119.89 1dgf s ASN 244 Ca -0.09 -1.11 -0.05 0.00 -0.71 0.00 0.00 52.86 50.90 1dgf s ASN 244 Cb -0.09 -0.33 -0.04 0.00 0.41 0.00 0.00 41.25 41.20 1dgf s ASN 244 CO -0.11 -0.09 0.09 -0.76 -1.51 0.00 0.00 177.10 174.72 1dgf s LEU 245 N -3.56 4.09 0.78 0.60 1.43 0.04 -4.63 118.68 117.43 1dgf s LEU 245 Ca 0.31 0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 53.65 1dgf s LEU 245 Cb -0.01 -1.98 0.06 0.00 0.03 0.00 0.00 46.19 44.29 1dgf s LEU 245 CO 0.16 0.38 1.09 -0.94 0.23 0.00 0.00 176.35 177.27 1dgf s SER 246 N -0.87 4.44 0.32 2.29 1.04 -1.26 -4.76 113.70 114.90 1dgf s SER 246 Ca 0.14 1.80 0.03 0.00 0.48 0.00 0.00 55.95 58.40 1dgf s SER 246 Cb -0.12 -2.50 0.61 0.00 0.10 0.00 0.00 66.02 64.12 1dgf s SER 246 CO 0.03 -2.07 1.90 0.58 0.98 0.00 0.00 173.24 174.65 1dgf h VAL 247 N -1.15 0.99 -0.07 5.02 2.07 -1.98 -0.56 116.25 120.56 1dgf h VAL 247 Ca -0.44 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 1dgf h VAL 247 Cb 1.23 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1dgf h VAL 247 CO 0.52 0.17 -0.01 -0.33 0.02 0.00 0.00 177.57 177.94 1dgf h GLU 248 N 0.93 0.13 -0.49 1.57 3.07 -2.00 -1.61 114.58 116.18 1dgf h GLU 248 Ca 0.41 -0.04 -0.08 0.00 -0.50 0.00 0.00 59.36 59.14 1dgf h GLU 248 Cb 0.36 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.24 1dgf h GLU 248 CO -0.17 0.42 -0.03 -0.44 -1.40 0.00 0.00 179.01 177.39 1dgf h ASP 249 N -0.17 0.81 -0.53 1.42 3.45 -1.85 -1.77 116.42 117.78 1dgf h ASP 249 Ca 0.02 -0.22 -0.03 0.00 0.43 0.00 0.00 57.03 57.23 1dgf h ASP 249 Cb 0.37 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.89 1dgf h ASP 249 CO 0.00 0.90 0.21 0.00 -1.57 0.00 0.00 179.24 178.78 1dgf h ALA 250 N 1.19 0.69 -0.24 3.45 0.00 -1.05 -0.14 119.26 123.17 1dgf h ALA 250 Ca 0.14 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1dgf h ALA 250 Cb 0.51 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1dgf h ALA 250 CO 0.03 0.31 0.09 0.00 0.00 0.00 0.00 179.25 179.68 1dgf h ALA 251 N 1.06 0.31 -0.41 0.00 0.00 -1.09 -0.83 119.26 118.29 1dgf h ALA 251 Ca 0.18 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1dgf h ALA 251 Cb 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1dgf h ALA 251 CO -0.01 -0.10 0.26 -0.09 0.00 0.00 0.00 179.25 179.31 1dgf h ARG 252 N 0.23 0.54 0.00 0.00 2.43 -1.15 -2.68 114.38 113.76 1dgf h ARG 252 Ca 0.08 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.15 1dgf h ARG 252 Cb 0.18 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1dgf h ARG 252 CO -0.01 0.38 -0.29 -0.07 -1.51 0.00 0.00 179.97 178.48 1dgf h LEU 253 N 0.54 0.00 -1.74 3.80 3.38 -0.88 0.32 115.31 120.72 1dgf h LEU 253 Ca 0.15 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1dgf h LEU 253 Cb -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1dgf h LEU 253 CO -0.03 0.29 -0.16 0.77 0.09 0.00 0.00 178.44 179.40 1dgf h SER 254 N 0.00 0.00 0.04 -0.43 4.64 -0.79 0.33 113.55 117.33 1dgf h SER 254 Ca -0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 1dgf h SER 254 Cb 0.53 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.58 1dgf h SER 254 CO 0.04 0.16 -1.90 1.67 -0.87 0.00 0.00 176.83 175.93 1dgf n GLN 255 N -3.75 0.64 -0.16 4.77 0.00 -0.93 -3.81 117.38 114.14 1dgf n GLN 255 Ca -0.02 0.36 -0.11 0.00 -0.00 0.00 0.00 57.00 57.24 1dgf n GLN 255 Cb 0.27 -1.66 -0.00 0.00 0.00 0.00 0.00 30.24 28.85 1dgf n GLN 255 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1dgf h GLU 256 N -0.53 0.91 -1.72 3.69 5.08 -0.85 -3.41 114.58 117.74 1dgf h GLU 256 Ca -0.47 -0.34 -0.30 0.00 -1.00 0.00 0.00 59.36 57.24 1dgf h GLU 256 Cb 1.67 -0.05 -0.28 0.00 0.50 0.00 0.00 28.75 30.59 1dgf h GLU 256 CO -0.14 0.99 -0.64 0.34 -1.00 0.00 0.00 179.01 178.56 1dgf s ASP 257 N -6.52 0.50 0.61 1.42 2.15 0.11 -4.99 116.67 109.95 1dgf s ASP 257 Ca -0.12 -1.46 0.41 0.00 0.43 0.00 0.00 52.55 51.80 1dgf s ASP 257 Cb 0.12 0.88 2.21 0.00 -0.30 0.00 0.00 42.92 45.83 1dgf s ASP 257 CO 0.84 -0.23 2.25 -0.65 -0.17 0.00 0.00 175.17 177.21 1dgf h PRO 258 N 6.94 0.00 -0.66 4.34 0.11 -1.66 -2.17 132.00 138.91 1dgf h PRO 258 Ca 0.06 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.81 1dgf h PRO 258 Cb 1.08 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 31.98 1dgf h PRO 258 CO 0.17 0.00 0.22 -0.25 -0.21 0.00 0.00 178.00 177.94 1dgf n ASP 259 N -2.94 3.42 -0.21 -2.05 8.00 -1.26 -0.41 116.55 121.11 1dgf n ASP 259 Ca -0.03 -3.73 0.02 0.00 0.71 0.00 0.00 54.79 51.76 1dgf n ASP 259 Cb 0.07 -0.72 0.12 0.00 -0.02 0.00 0.00 41.12 40.57 1dgf n ASP 259 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1dgf h TYR 260 N 1.13 0.16 -0.56 1.24 5.03 -1.72 -0.98 116.97 121.27 1dgf h TYR 260 Ca 0.41 0.04 -0.09 0.00 2.58 0.00 0.00 58.73 61.67 1dgf h TYR 260 Cb 2.04 0.02 -0.02 0.00 1.55 0.00 0.00 36.73 40.32 1dgf h TYR 260 CO 1.27 -0.07 -0.02 0.78 -1.32 0.00 0.00 178.16 178.80 1dgf h GLY 261 N 0.23 1.05 0.79 1.82 0.00 -1.88 -0.96 103.07 104.12 1dgf h GLY 261 Ca 0.34 -0.76 -0.01 0.00 0.00 0.00 0.00 47.33 46.90 1dgf h GLY 261 CO -0.45 0.70 0.02 -2.22 0.00 0.00 0.00 176.54 174.58 1dgf h ILE 262 N 0.89 1.22 -0.21 2.60 2.04 -1.72 -2.55 117.51 119.78 1dgf h ILE 262 Ca 0.16 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 1dgf h ILE 262 Cb 0.55 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 1dgf h ILE 262 CO 0.03 0.20 0.11 -0.09 0.00 0.00 0.00 178.15 178.40 1dgf h ARG 263 N -0.06 0.30 -0.47 2.37 2.43 -1.15 -1.62 114.38 116.19 1dgf h ARG 263 Ca 0.03 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1dgf h ARG 263 Cb 0.30 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.75 1dgf h ARG 263 CO 0.00 0.29 0.22 0.22 -1.51 0.00 0.00 179.97 179.20 1dgf h ASP 264 N 0.22 0.31 -0.24 -3.80 3.58 -1.20 -0.97 116.42 114.33 1dgf h ASP 264 Ca 0.07 0.03 -0.04 0.00 0.42 0.00 0.00 57.03 57.51 1dgf h ASP 264 Cb 0.09 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.10 1dgf h ASP 264 CO -0.01 0.22 -0.03 0.25 -2.88 0.00 0.00 179.24 176.79 1dgf h LEU 265 N 0.45 0.43 -0.22 2.28 5.85 -1.36 -1.88 115.31 120.85 1dgf h LEU 265 Ca 0.21 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 1dgf h LEU 265 Cb 0.13 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1dgf h LEU 265 CO -0.15 0.67 0.13 0.15 -0.34 0.00 0.00 178.44 178.89 1dgf h PHE 266 N 0.19 0.30 -0.36 1.25 3.04 -1.12 -2.35 116.94 117.89 1dgf h PHE 266 Ca 0.06 -0.00 -0.09 0.00 3.98 0.00 0.00 57.97 61.92 1dgf h PHE 266 Cb 0.46 -0.10 -0.02 0.00 2.56 0.00 0.00 35.95 38.86 1dgf h PHE 266 CO 0.04 0.25 -0.15 -0.91 -2.02 0.00 0.00 178.31 175.53 1dgf h ASN 267 N 0.26 0.64 0.04 0.41 2.35 -1.21 0.01 115.58 118.08 1dgf h ASN 267 Ca 0.08 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 1dgf h ASN 267 Cb 0.05 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.24 1dgf h ASN 267 CO -0.01 0.81 -0.02 0.00 -1.65 0.00 0.00 177.43 176.56 1dgf h ALA 268 N 1.25 -0.05 -0.64 -0.83 0.00 -1.19 -1.38 119.26 116.42 1dgf h ALA 268 Ca 0.10 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1dgf h ALA 268 Cb 0.59 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1dgf h ALA 268 CO 0.04 -0.49 0.05 0.82 0.00 0.00 0.00 179.25 179.67 1dgf h ILE 269 N -0.13 1.27 0.00 0.00 2.04 -1.34 0.16 117.51 119.50 1dgf h ILE 269 Ca -0.00 -1.11 -0.04 0.00 1.00 0.00 0.00 64.86 64.71 1dgf h ILE 269 Cb 0.11 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1dgf h ILE 269 CO 0.01 0.41 -0.20 0.00 0.00 0.00 0.00 178.15 178.37 1dgf h ALA 270 N 1.01 1.45 -0.55 1.87 0.00 -0.81 -2.31 119.26 119.92 1dgf h ALA 270 Ca 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1dgf h ALA 270 Cb 0.51 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1dgf h ALA 270 CO 0.02 0.25 0.00 0.25 0.00 0.00 0.00 179.25 179.77 1dgf n THR 271 N -3.98 0.73 -0.74 0.00 -2.24 -0.54 -4.94 114.28 102.57 1dgf n THR 271 Ca -0.02 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 60.98 1dgf n THR 271 Cb 0.28 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 1dgf n THR 271 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dgf n GLY 272 N 1.47 0.75 2.74 3.38 0.00 -0.87 -4.96 105.19 107.70 1dgf n GLY 272 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1dgf n GLY 272 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dgf n LYS 273 N -2.38 3.99 -1.85 1.61 5.02 0.53 -4.98 118.16 120.10 1dgf n LYS 273 Ca 0.00 -3.56 -0.43 0.00 -2.02 0.00 0.00 58.31 52.31 1dgf n LYS 273 Cb 0.00 -2.81 -0.03 0.00 -0.02 0.00 0.00 35.03 32.18 1dgf n LYS 273 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1dgf s TYR 274 N -0.30 1.61 0.39 2.13 4.12 -1.26 -4.18 117.35 119.86 1dgf s TYR 274 Ca 0.44 0.25 -0.25 0.00 0.02 0.00 0.00 57.07 57.53 1dgf s TYR 274 Cb 0.12 -4.04 -0.09 0.00 -1.52 0.00 0.00 41.96 36.44 1dgf s TYR 274 CO -0.02 -4.03 1.10 -1.25 0.02 0.00 0.00 175.55 171.37 1dgf s PRO 275 N 5.06 4.14 0.09 -1.71 0.04 -1.24 -4.82 135.00 136.57 1dgf s PRO 275 Ca 0.84 1.67 0.01 0.00 0.04 0.00 0.00 61.00 63.56 1dgf s PRO 275 Cb -0.32 -2.64 -0.04 0.00 0.04 0.00 0.00 34.50 31.53 1dgf s PRO 275 CO 0.34 -0.19 -0.06 -1.54 0.04 0.00 0.00 177.00 175.59 1dgf s SER 276 N -1.34 1.03 -0.00 6.66 1.04 -1.26 -1.67 113.70 118.15 1dgf s SER 276 Ca 0.57 -1.01 0.02 0.00 0.48 0.00 0.00 55.95 56.01 1dgf s SER 276 Cb -0.26 0.11 -0.00 0.00 0.10 0.00 0.00 66.02 65.97 1dgf s SER 276 CO 0.33 -0.49 -0.06 0.26 0.98 0.00 0.00 173.24 174.26 1dgf s TRP 277 N -3.68 0.52 -0.22 5.02 0.51 0.03 -1.38 118.94 119.74 1dgf s TRP 277 Ca 0.11 -0.10 -0.21 0.00 -2.12 0.00 0.00 56.10 53.79 1dgf s TRP 277 Cb 0.06 -0.33 -0.02 0.00 -0.81 0.00 0.00 33.47 32.36 1dgf s TRP 277 CO -0.06 -0.01 0.63 0.99 -0.51 0.00 0.00 176.95 178.00 1dgf s THR 278 N -0.14 5.00 -0.12 2.01 2.01 0.27 -0.63 115.64 124.04 1dgf s THR 278 Ca 0.02 1.16 -0.22 0.00 0.31 0.00 0.00 61.69 62.97 1dgf s THR 278 Cb -0.02 -3.94 -0.03 0.00 0.01 0.00 0.00 72.50 68.51 1dgf s THR 278 CO -0.00 0.07 0.65 0.12 -0.69 0.00 0.00 174.62 174.77 1dgf s PHE 279 N 2.19 3.49 0.22 4.92 5.36 0.69 -1.29 117.98 133.57 1dgf s PHE 279 Ca 0.28 1.08 0.02 0.00 -0.96 0.00 0.00 56.93 57.35 1dgf s PHE 279 Cb -0.16 -2.77 -0.05 0.00 -0.34 0.00 0.00 43.02 39.70 1dgf s PHE 279 CO 0.09 -0.00 0.05 0.71 -1.46 0.00 0.00 175.22 174.61 1dgf s TYR 280 N 1.21 1.40 0.03 10.12 2.02 0.16 -0.43 117.35 131.86 1dgf s TYR 280 Ca 0.33 -1.09 0.00 0.00 -0.37 0.00 0.00 57.07 55.94 1dgf s TYR 280 Cb -0.17 -0.81 -0.02 0.00 -0.40 0.00 0.00 41.96 40.56 1dgf s TYR 280 CO 0.14 -0.26 -0.04 0.96 -1.57 0.00 0.00 175.55 174.78 1dgf s ILE 281 N -3.68 0.20 -0.00 2.71 -4.36 -0.30 -0.83 121.20 114.93 1dgf s ILE 281 Ca 0.31 -1.09 0.03 0.00 -0.26 0.00 0.00 60.65 59.64 1dgf s ILE 281 Cb 0.07 -0.53 -0.03 0.00 1.25 0.00 0.00 42.46 43.22 1dgf s ILE 281 CO 0.09 -0.57 -0.08 -1.10 0.24 0.00 0.00 174.94 173.53 1dgf s GLN 282 N -1.90 2.54 -0.04 0.37 -0.21 -0.42 -0.25 119.66 119.76 1dgf s GLN 282 Ca -0.11 -0.72 0.06 0.00 0.02 0.00 0.00 55.36 54.61 1dgf s GLN 282 Cb -0.07 -2.49 -0.01 0.00 1.00 0.00 0.00 33.01 31.44 1dgf s GLN 282 CO -0.02 0.61 -0.21 0.08 -2.12 0.00 0.00 175.29 173.62 1dgf s VAL 283 N -0.97 1.74 -0.10 1.09 1.01 -1.26 -1.72 120.40 120.20 1dgf s VAL 283 Ca 0.16 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.23 1dgf s VAL 283 Cb -0.11 -1.47 0.03 0.00 0.00 0.00 0.00 36.38 34.83 1dgf s VAL 283 CO 0.07 0.49 -0.02 -0.32 0.00 0.00 0.00 175.10 175.32 1dgf s MET 284 N -0.18 0.88 0.87 2.72 0.00 -0.02 -4.93 119.30 118.64 1dgf s MET 284 Ca -0.01 -0.06 -0.11 0.00 0.00 0.00 0.00 55.69 55.50 1dgf s MET 284 Cb -0.12 -1.29 0.11 0.00 0.00 0.00 0.00 34.83 33.54 1dgf s MET 284 CO 0.02 -0.34 1.09 0.95 0.00 0.00 0.00 175.02 176.75 1dgf s THR 285 N 1.88 2.76 0.41 10.11 -4.23 -1.26 -0.66 115.64 124.65 1dgf s THR 285 Ca 0.04 0.25 0.10 0.00 -1.18 0.00 0.00 61.69 60.90 1dgf s THR 285 Cb -0.13 -2.78 0.21 0.00 1.34 0.00 0.00 72.50 71.14 1dgf s THR 285 CO -0.06 -0.32 2.00 -0.26 -0.54 0.00 0.00 174.62 175.43 1dgf h PHE 286 N -1.44 0.30 -0.38 3.99 -1.00 -1.96 -0.86 116.94 115.59 1dgf h PHE 286 Ca -0.49 -0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.21 1dgf h PHE 286 Cb 1.28 -0.09 -0.01 0.00 3.61 0.00 0.00 35.95 40.73 1dgf h PHE 286 CO 0.44 0.30 -0.05 -0.91 -1.61 0.00 0.00 178.31 176.48 1dgf h ASN 287 N 0.30 0.70 -0.06 2.17 2.35 -1.98 -2.77 115.58 116.29 1dgf h ASN 287 Ca 0.07 -0.34 -0.07 0.00 -0.55 0.00 0.00 56.30 55.41 1dgf h ASN 287 Cb 0.18 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1dgf h ASN 287 CO 0.00 0.87 -0.17 1.56 -1.65 0.00 0.00 177.43 178.04 1dgf h GLN 288 N 0.51 0.42 0.00 0.81 4.20 -1.76 -2.20 115.11 117.08 1dgf h GLN 288 Ca 0.10 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1dgf h GLN 288 Cb 0.54 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.28 1dgf h GLN 288 CO 0.03 0.58 -0.11 0.00 -0.67 0.00 0.00 178.83 178.66 1dgf h ALA 289 N 1.44 1.60 0.00 3.87 0.00 -0.92 -0.73 119.26 124.52 1dgf h ALA 289 Ca 0.07 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1dgf h ALA 289 Cb 0.53 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1dgf h ALA 289 CO 0.03 0.14 -0.66 0.93 0.00 0.00 0.00 179.25 179.69 1dgf h GLU 290 N 0.00 0.00 -0.00 0.00 4.39 -1.13 -3.32 114.58 114.51 1dgf h GLU 290 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1dgf h GLU 290 Cb 0.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1dgf h GLU 290 CO 0.01 0.66 -0.94 0.25 -1.16 0.00 0.00 179.01 177.83 1dgf n THR 291 N -3.43 0.00 -1.66 1.13 -2.24 -0.70 -4.98 114.28 102.40 1dgf n THR 291 Ca 0.00 -0.02 -0.46 0.00 -2.27 0.00 0.00 64.05 61.30 1dgf n THR 291 Cb 0.73 1.01 -0.04 0.00 -2.10 0.00 0.00 70.33 69.94 1dgf n THR 291 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1dgf n PHE 292 N -1.37 2.19 0.11 4.78 -0.00 -0.36 -4.84 117.46 117.97 1dgf n PHE 292 Ca 0.05 0.34 0.05 0.00 -0.00 0.00 0.00 57.45 57.89 1dgf n PHE 292 Cb 0.34 -2.50 0.25 0.00 -0.00 0.00 0.00 39.48 37.57 1dgf n PHE 292 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1dgf n PRO 293 N 2.92 0.06 -3.82 -7.13 -0.04 -1.26 -4.69 135.00 121.04 1dgf n PRO 293 Ca 0.15 0.53 -0.19 0.00 -0.04 0.00 0.00 63.50 63.95 1dgf n PRO 293 Cb 0.29 -1.68 -0.05 0.00 -0.04 0.00 0.00 33.50 32.01 1dgf n PRO 293 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1dgf n PHE 294 N -1.80 0.09 -2.59 0.54 3.72 -1.26 -5.09 117.46 111.07 1dgf n PHE 294 Ca -0.00 -1.99 -0.43 0.00 -0.05 0.00 0.00 57.45 54.98 1dgf n PHE 294 Cb 0.03 -0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.55 1dgf n PHE 294 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1dgf s ASN 295 N -2.90 6.93 0.13 4.37 2.47 -1.26 -4.88 114.94 119.80 1dgf s ASN 295 Ca 0.16 1.20 0.14 0.00 0.42 0.00 0.00 52.86 54.78 1dgf s ASN 295 Cb 0.01 -2.54 0.64 0.00 -1.45 0.00 0.00 41.25 37.91 1dgf s ASN 295 CO 0.11 -0.86 1.42 -0.81 -3.72 0.00 0.00 177.10 173.25 1dgf n PRO 296 N 6.80 0.07 -0.36 0.43 -0.04 -1.26 -1.69 135.00 138.96 1dgf n PRO 296 Ca 0.13 0.46 0.09 0.00 -0.04 0.00 0.00 63.50 64.14 1dgf n PRO 296 Cb 0.47 -1.69 0.26 0.00 -0.04 0.00 0.00 33.50 32.50 1dgf n PRO 296 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1dgf n PHE 297 N -1.84 0.90 -2.88 0.54 3.72 -1.26 -4.71 117.46 111.92 1dgf n PHE 297 Ca 0.01 -0.55 -0.42 0.00 -0.05 0.00 0.00 57.45 56.43 1dgf n PHE 297 Cb 0.09 -0.08 -0.04 0.00 -0.94 0.00 0.00 39.48 38.51 1dgf n PHE 297 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1dgf s ASP 298 N -1.05 6.59 0.00 4.37 3.68 -0.68 -4.40 116.67 125.18 1dgf s ASP 298 Ca 0.40 0.40 0.07 0.00 2.13 0.00 0.00 52.55 55.55 1dgf s ASP 298 Cb 0.23 -2.43 0.30 0.00 -1.45 0.00 0.00 42.92 39.57 1dgf s ASP 298 CO 0.23 -0.83 1.22 -0.11 0.13 0.00 0.00 175.17 175.82 1dgf n LEU 299 N 6.66 0.00 -0.80 -1.34 7.94 -1.26 -1.60 117.00 126.60 1dgf n LEU 299 Ca 0.05 0.50 0.09 0.00 -1.11 0.00 0.00 56.01 55.54 1dgf n LEU 299 Cb 0.48 -0.50 0.26 0.00 0.53 0.00 0.00 43.42 44.20 1dgf n LEU 299 CO 0.57 -0.38 0.71 0.35 -1.11 0.00 0.00 177.39 177.53 1dgf n THR 300 N -1.50 0.47 -4.37 1.96 -2.24 -1.26 -1.86 114.28 105.48 1dgf n THR 300 Ca 0.02 -0.55 -0.27 0.00 -2.27 0.00 0.00 64.05 60.98 1dgf n THR 300 Cb 0.08 0.43 -0.13 0.00 -2.10 0.00 0.00 70.33 68.61 1dgf n THR 300 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1dgf s LYS 301 N -1.53 1.35 0.28 -0.78 -0.14 -0.63 -4.88 119.74 113.42 1dgf s LYS 301 Ca 0.32 -1.34 0.10 0.00 -1.36 0.00 0.00 55.97 53.69 1dgf s LYS 301 Cb 0.17 -1.74 -0.04 0.00 -1.68 0.00 0.00 37.83 34.54 1dgf s LYS 301 CO 0.24 0.40 -0.00 0.14 -0.76 0.00 0.00 175.35 175.37 1dgf s VAL 302 N -1.25 3.23 -0.38 3.17 -7.23 -1.26 -4.85 120.40 111.83 1dgf s VAL 302 Ca 0.14 -1.94 -0.15 0.00 -1.81 0.00 0.00 61.98 58.22 1dgf s VAL 302 Cb -0.09 -2.81 0.00 0.00 0.56 0.00 0.00 36.38 34.04 1dgf s VAL 302 CO 0.06 -0.34 0.34 0.26 -0.31 0.00 0.00 175.10 175.12 1dgf s TRP 303 N -2.37 3.21 0.02 2.82 0.51 -1.26 -5.03 118.94 116.83 1dgf s TRP 303 Ca 0.32 -0.28 -0.36 0.00 -2.12 0.00 0.00 56.10 53.66 1dgf s TRP 303 Cb -0.05 -2.67 -0.15 0.00 -0.81 0.00 0.00 33.47 29.79 1dgf s TRP 303 CO 0.20 -0.52 1.53 -2.30 -0.51 0.00 0.00 176.95 175.35 1dgf n PRO 304 N 5.33 1.50 -0.14 4.98 -0.02 -1.26 -4.77 135.00 140.62 1dgf n PRO 304 Ca -0.10 0.55 0.11 0.00 -2.02 0.00 0.00 63.50 62.04 1dgf n PRO 304 Cb 0.48 -2.25 0.45 0.00 -0.02 0.00 0.00 33.50 32.17 1dgf n PRO 304 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1dgf h HIS 305 N 5.90 0.56 0.00 6.00 3.86 -1.97 0.39 115.15 129.90 1dgf h HIS 305 Ca -0.47 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 58.71 1dgf h HIS 305 Cb 1.31 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 29.59 1dgf h HIS 305 CO 0.67 0.26 -0.24 1.57 0.86 0.00 0.00 177.93 181.05 1dgf h LYS 306 N 0.53 0.00 0.00 2.45 2.10 -1.99 -2.23 116.57 117.42 1dgf h LYS 306 Ca 0.32 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.66 1dgf h LYS 306 Cb 0.53 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.81 1dgf h LYS 306 CO -0.10 0.24 -1.96 -0.25 -2.00 0.00 0.00 179.45 175.38 1dgf n ASP 307 N -3.89 0.51 -3.57 7.07 10.43 -0.61 -4.67 116.55 121.83 1dgf n ASP 307 Ca -0.02 0.24 -0.28 0.00 2.57 0.00 0.00 54.79 57.31 1dgf n ASP 307 Cb 0.33 0.42 -0.11 0.00 1.84 0.00 0.00 41.12 43.60 1dgf n ASP 307 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 1dgf s TYR 308 N -2.60 1.86 0.49 1.24 2.02 0.03 -5.05 117.35 115.33 1dgf s TYR 308 Ca -0.07 -2.59 -0.23 0.00 -0.37 0.00 0.00 57.07 53.81 1dgf s TYR 308 Cb 0.07 -1.51 -0.07 0.00 -0.40 0.00 0.00 41.96 40.05 1dgf s TYR 308 CO 0.83 -0.74 1.32 -2.30 -1.57 0.00 0.00 175.55 173.08 1dgf n PRO 309 N 2.72 1.82 -2.27 -1.71 -0.02 -0.85 -4.41 135.00 130.29 1dgf n PRO 309 Ca 0.24 0.66 -0.42 0.00 -2.02 0.00 0.00 63.50 61.96 1dgf n PRO 309 Cb 0.42 -2.50 -0.03 0.00 -0.02 0.00 0.00 33.50 31.37 1dgf n PRO 309 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1dgf s LEU 310 N -2.64 4.40 -0.24 2.45 1.43 -1.26 -4.60 118.68 118.22 1dgf s LEU 310 Ca 0.66 2.27 -0.05 0.00 -1.03 0.00 0.00 54.13 55.99 1dgf s LEU 310 Cb -0.45 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.16 1dgf s LEU 310 CO 0.53 -0.53 -0.00 -0.63 0.23 0.00 0.00 176.35 175.95 1dgf s ILE 311 N 0.60 3.65 0.31 -0.59 1.01 0.66 -4.93 121.20 121.92 1dgf s ILE 311 Ca 0.59 -0.45 -0.29 0.00 0.00 0.00 0.00 60.65 60.50 1dgf s ILE 311 Cb -0.35 -2.71 -0.10 0.00 0.01 0.00 0.00 42.46 39.31 1dgf s ILE 311 CO 0.33 0.36 1.41 -2.16 0.00 0.00 0.00 174.94 174.88 1dgf s PRO 312 N 1.51 4.26 0.00 2.79 0.04 -1.26 -1.15 135.00 141.18 1dgf s PRO 312 Ca 0.05 2.35 0.00 0.00 0.04 0.00 0.00 61.00 63.44 1dgf s PRO 312 Cb -0.15 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.34 1dgf s PRO 312 CO -0.01 -0.37 0.00 0.28 0.04 0.00 0.00 177.00 176.94 1dgf n VAL 313 N 1.27 0.00 -1.86 -0.36 0.31 0.42 -4.59 118.33 113.52 1dgf n VAL 313 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1dgf n VAL 313 Cb 0.40 -1.24 0.00 0.00 -0.91 0.00 0.00 33.84 32.09 1dgf n VAL 313 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1dgf n GLY 314 N 2.70 2.07 2.92 2.92 0.00 -0.94 -0.54 105.19 114.32 1dgf n GLY 314 Ca 0.00 -0.47 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 1dgf n GLY 314 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dgf s LYS 315 N 1.63 0.17 -0.17 1.61 -0.14 0.42 -0.22 119.74 123.05 1dgf s LYS 315 Ca 0.00 -0.17 -0.04 0.00 -1.36 0.00 0.00 55.97 54.40 1dgf s LYS 315 Cb 0.00 -0.10 -0.02 0.00 -1.68 0.00 0.00 37.83 36.03 1dgf s LYS 315 CO 0.00 0.02 -0.04 -0.51 -0.76 0.00 0.00 175.35 174.06 1dgf s LEU 316 N -0.32 3.14 -0.07 3.17 1.43 0.20 -0.60 118.68 125.62 1dgf s LEU 316 Ca -0.02 -0.21 0.02 0.00 -1.03 0.00 0.00 54.13 52.89 1dgf s LEU 316 Cb -0.02 -1.77 0.02 0.00 0.03 0.00 0.00 46.19 44.45 1dgf s LEU 316 CO -0.00 0.12 -0.10 -0.69 0.23 0.00 0.00 176.35 175.90 1dgf s VAL 317 N 0.67 1.01 -0.32 -1.59 1.01 -0.14 -0.79 120.40 120.24 1dgf s VAL 317 Ca -0.02 -0.39 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 1dgf s VAL 317 Cb -0.14 -0.95 0.02 0.00 0.00 0.00 0.00 36.38 35.31 1dgf s VAL 317 CO 0.02 0.33 0.11 -0.76 0.00 0.00 0.00 175.10 174.80 1dgf s LEU 318 N 0.80 4.10 -0.03 3.92 1.43 -0.67 -1.06 118.68 127.17 1dgf s LEU 318 Ca -0.12 -0.84 0.05 0.00 -1.03 0.00 0.00 54.13 52.18 1dgf s LEU 318 Cb -0.15 -1.90 0.07 0.00 0.03 0.00 0.00 46.19 44.24 1dgf s LEU 318 CO 0.02 -0.25 0.91 -0.46 0.23 0.00 0.00 176.35 176.80 1dgf n ASN 319 N 4.88 1.10 -3.73 2.29 0.23 0.01 -3.60 115.26 116.44 1dgf n ASN 319 Ca -0.14 -2.02 -0.14 0.00 -0.53 0.00 0.00 54.58 51.75 1dgf n ASN 319 Cb 0.47 -0.16 -0.15 0.00 -2.08 0.00 0.00 39.78 37.87 1dgf n ASN 319 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1dgf s ARG 320 N -0.98 0.09 0.46 -3.83 3.52 -0.53 -4.99 118.95 112.69 1dgf s ARG 320 Ca 0.08 0.43 -0.10 0.00 -0.13 0.00 0.00 55.73 56.02 1dgf s ARG 320 Cb 0.07 -0.19 -0.06 0.00 -1.56 0.00 0.00 34.95 33.21 1dgf s ARG 320 CO 0.01 -0.20 0.83 -0.80 -0.81 0.00 0.00 175.30 174.33 1dgf s ASN 321 N 1.45 6.43 0.57 -2.12 0.01 -1.26 -0.40 114.94 119.61 1dgf s ASN 321 Ca -0.06 1.16 -0.19 0.00 -0.71 0.00 0.00 52.86 53.06 1dgf s ASN 321 Cb -0.12 -2.34 -0.05 0.00 0.41 0.00 0.00 41.25 39.16 1dgf s ASN 321 CO -0.06 -0.53 1.15 -2.84 -1.51 0.00 0.00 177.10 173.32 1dgf s PRO 322 N -4.28 3.18 -0.17 -0.60 0.02 -1.26 -4.86 135.00 127.02 1dgf s PRO 322 Ca 0.51 1.67 -0.07 0.00 0.02 0.00 0.00 61.00 63.14 1dgf s PRO 322 Cb -0.10 -1.98 -0.22 0.00 0.02 0.00 0.00 34.50 32.22 1dgf s PRO 322 CO 0.38 -1.00 0.16 0.28 -0.33 0.00 0.00 177.00 176.49 1dgf n VAL 323 N -1.48 1.67 -3.87 3.83 0.31 -1.26 -4.80 118.33 112.73 1dgf n VAL 323 Ca 0.12 -0.55 -0.29 0.00 -0.01 0.00 0.00 64.34 63.62 1dgf n VAL 323 Cb 0.51 -1.70 -0.16 0.00 -0.91 0.00 0.00 33.84 31.57 1dgf n VAL 323 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1dgf s ASN 324 N -6.92 3.25 0.13 4.52 3.84 -1.26 -5.04 114.94 113.47 1dgf s ASN 324 Ca -0.27 -0.91 -0.19 0.00 0.21 0.00 0.00 52.86 51.70 1dgf s ASN 324 Cb 0.08 -0.94 -0.01 0.00 -0.55 0.00 0.00 41.25 39.83 1dgf s ASN 324 CO 0.69 -0.24 1.73 0.22 -2.79 0.00 0.00 177.10 176.72 1dgf h TYR 325 N 8.09 0.06 -0.20 0.43 3.20 -1.97 -1.33 116.97 125.24 1dgf h TYR 325 Ca -0.20 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.72 1dgf h TYR 325 Cb 1.10 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.35 1dgf h TYR 325 CO 0.43 0.01 0.02 0.35 -1.64 0.00 0.00 178.16 177.32 1dgf h PHE 326 N 0.12 0.02 -0.45 -3.82 3.04 -1.96 0.50 116.94 114.39 1dgf h PHE 326 Ca 0.11 0.01 -0.11 0.00 3.98 0.00 0.00 57.97 61.96 1dgf h PHE 326 Cb 0.12 0.02 -0.02 0.00 2.56 0.00 0.00 35.95 38.64 1dgf h PHE 326 CO -0.16 -0.01 -0.17 0.00 -2.02 0.00 0.00 178.31 175.95 1dgf h ALA 327 N 1.16 0.85 0.00 2.41 0.00 -1.95 -1.51 119.26 120.23 1dgf h ALA 327 Ca 0.09 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 1dgf h ALA 327 Cb 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1dgf h ALA 327 CO -0.15 0.64 -2.05 0.39 0.00 0.00 0.00 179.25 178.08 1dgf n GLU 328 N -4.13 0.66 -0.00 0.00 1.02 -0.51 -4.41 120.64 113.27 1dgf n GLU 328 Ca 0.01 -0.16 -0.04 0.00 -0.02 0.00 0.00 57.16 56.95 1dgf n GLU 328 Cb 0.41 -1.53 -0.01 0.00 -0.02 0.00 0.00 31.44 30.30 1dgf n GLU 328 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1dgf n VAL 329 N -2.36 0.78 -0.27 2.62 0.31 0.17 -4.34 118.33 115.23 1dgf n VAL 329 Ca -0.09 0.14 -0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1dgf n VAL 329 Cb 0.68 -1.65 0.20 0.00 -0.91 0.00 0.00 33.84 32.16 1dgf n VAL 329 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1dgf h GLU 330 N -0.19 1.10 -0.00 5.55 4.57 -1.17 -2.66 114.58 121.78 1dgf h GLU 330 Ca -0.07 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 1dgf h GLU 330 Cb 0.66 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 1dgf h GLU 330 CO -0.04 0.73 -0.19 1.04 -1.18 0.00 0.00 179.01 179.37 1dgf n GLN 331 N -4.41 0.65 -2.15 1.92 6.02 -0.58 -4.92 117.38 113.91 1dgf n GLN 331 Ca 0.09 -0.29 -0.40 0.00 -0.01 0.00 0.00 57.00 56.39 1dgf n GLN 331 Cb 0.02 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 29.77 1dgf n GLN 331 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 1dgf s ILE 332 N -2.55 2.82 -0.08 5.09 2.07 -1.00 -4.88 121.20 122.67 1dgf s ILE 332 Ca 0.25 0.77 0.00 0.00 -1.41 0.00 0.00 60.65 60.27 1dgf s ILE 332 Cb 0.19 -3.47 0.02 0.00 0.13 0.00 0.00 42.46 39.33 1dgf s ILE 332 CO 0.51 0.15 -0.05 0.00 -1.91 0.00 0.00 174.94 173.64 1dgf s ALA 333 N -1.22 0.97 -0.15 1.50 0.00 -1.26 -5.03 121.76 116.56 1dgf s ALA 333 Ca 0.52 -0.28 -0.03 0.00 0.00 0.00 0.00 51.96 52.17 1dgf s ALA 333 Cb -0.37 -0.68 -0.02 0.00 0.00 0.00 0.00 23.12 22.04 1dgf s ALA 333 CO 0.48 -0.24 -0.06 -0.06 0.00 0.00 0.00 175.76 175.89 1dgf s PHE 334 N 1.40 2.98 -0.22 0.00 0.08 -1.26 -4.94 117.98 116.03 1dgf s PHE 334 Ca -0.02 -0.39 0.02 0.00 0.12 0.00 0.00 56.93 56.66 1dgf s PHE 334 Cb -0.13 -1.94 0.04 0.00 -0.57 0.00 0.00 43.02 40.42 1dgf s PHE 334 CO -0.03 -0.09 -0.16 -0.51 -0.10 0.00 0.00 175.22 174.34 1dgf s ASP 335 N 0.39 3.75 0.63 1.36 -0.00 -1.26 -4.87 116.67 116.66 1dgf s ASP 335 Ca -0.05 -0.98 0.32 0.00 -0.00 0.00 0.00 52.55 51.83 1dgf s ASP 335 Cb -0.15 -1.52 1.77 0.00 -0.00 0.00 0.00 42.92 43.02 1dgf s ASP 335 CO 0.03 -0.09 2.07 -0.65 -0.00 0.00 0.00 175.17 176.54 1dgf h PRO 336 N 7.87 0.00 0.00 8.23 0.11 -1.82 0.11 132.00 146.50 1dgf h PRO 336 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1dgf h PRO 336 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1dgf h PRO 336 CO 0.56 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.22 1dgf n SER 337 N -3.39 0.00 -4.53 -2.05 3.41 -1.26 -4.42 113.62 101.37 1dgf n SER 337 Ca 0.00 0.35 -0.42 0.00 -0.26 0.00 0.00 58.87 58.54 1dgf n SER 337 Cb 0.34 -0.44 -0.02 0.00 -0.26 0.00 0.00 64.21 63.83 1dgf n SER 337 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1dgf s ASN 338 N -2.88 6.68 -0.10 4.04 0.01 0.39 -4.93 114.94 118.14 1dgf s ASN 338 Ca 0.13 -2.02 0.01 0.00 -0.71 0.00 0.00 52.86 50.27 1dgf s ASN 338 Cb 0.14 -2.52 0.02 0.00 0.41 0.00 0.00 41.25 39.30 1dgf s ASN 338 CO 0.37 -1.24 -0.10 -0.04 -1.51 0.00 0.00 177.10 174.58 1dgf s MET 339 N 3.91 1.72 0.75 -0.60 -1.94 -1.26 -1.41 119.30 120.47 1dgf s MET 339 Ca 0.45 -0.35 -0.11 0.00 -1.71 0.00 0.00 55.69 53.96 1dgf s MET 339 Cb -0.00 -1.62 0.04 0.00 2.01 0.00 0.00 34.83 35.26 1dgf s MET 339 CO -0.04 -0.17 1.13 -1.25 -0.01 0.00 0.00 175.02 174.68 1dgf s PRO 340 N 1.36 2.45 0.16 2.03 0.04 -1.26 -4.91 135.00 134.87 1dgf s PRO 340 Ca -0.01 0.28 -0.34 0.00 0.04 0.00 0.00 61.00 60.97 1dgf s PRO 340 Cb -0.14 -2.00 -0.15 0.00 0.04 0.00 0.00 34.50 32.26 1dgf s PRO 340 CO -0.05 -1.28 1.47 -2.30 0.04 0.00 0.00 177.00 174.88 1dgf n PRO 341 N -3.14 1.84 0.00 0.56 -0.02 -1.26 -1.82 135.00 131.17 1dgf n PRO 341 Ca 0.07 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1dgf n PRO 341 Cb 0.59 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1dgf n PRO 341 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dgf n GLY 342 N 2.90 1.84 2.89 -1.23 0.00 -1.26 -3.44 105.19 106.89 1dgf n GLY 342 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1dgf n GLY 342 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dgf s ILE 343 N -2.24 0.67 0.21 -0.61 1.01 -0.76 -1.87 121.20 117.61 1dgf s ILE 343 Ca 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 60.65 60.49 1dgf s ILE 343 Cb 0.00 -0.70 -0.04 0.00 0.01 0.00 0.00 42.46 41.73 1dgf s ILE 343 CO 0.00 0.27 0.13 -1.61 0.00 0.00 0.00 174.94 173.73 1dgf s GLU 344 N 1.18 1.24 0.63 2.79 2.02 0.97 -4.40 118.70 123.13 1dgf s GLU 344 Ca -0.07 -1.66 -0.12 0.00 0.02 0.00 0.00 54.97 53.15 1dgf s GLU 344 Cb -0.14 0.20 -0.03 0.00 0.10 0.00 0.00 34.13 34.26 1dgf s GLU 344 CO -0.01 -0.38 1.04 0.00 0.02 0.00 0.00 175.26 175.92 1dgf s ALA 345 N -4.09 2.91 0.46 5.21 0.00 -1.26 -0.48 121.76 124.50 1dgf s ALA 345 Ca 0.39 0.06 0.07 0.00 0.00 0.00 0.00 51.96 52.48 1dgf s ALA 345 Cb 0.07 -3.13 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 1dgf s ALA 345 CO 0.12 -0.83 0.33 -1.54 0.00 0.00 0.00 175.76 173.84 1dgf s SER 346 N -3.75 4.73 0.00 0.00 1.04 -1.26 -4.31 113.70 110.15 1dgf s SER 346 Ca 0.57 -1.01 0.08 0.00 0.48 0.00 0.00 55.95 56.08 1dgf s SER 346 Cb -0.12 -0.23 0.50 0.00 0.10 0.00 0.00 66.02 66.26 1dgf s SER 346 CO 0.50 -0.77 1.05 -2.65 0.98 0.00 0.00 173.24 172.35 1dgf n PRO 347 N -1.52 0.66 -1.61 4.02 -0.02 -1.26 -4.69 135.00 130.58 1dgf n PRO 347 Ca 0.00 0.00 -0.50 0.00 -2.02 0.00 0.00 63.50 60.98 1dgf n PRO 347 Cb 0.63 -1.20 -0.06 0.00 -0.02 0.00 0.00 33.50 32.86 1dgf n PRO 347 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1dgf n ASP 348 N -0.70 2.88 -0.30 2.55 -0.08 -1.26 -4.82 116.55 114.82 1dgf n ASP 348 Ca 0.06 0.76 0.11 0.00 -1.51 0.00 0.00 54.79 54.21 1dgf n ASP 348 Cb 0.03 -1.32 0.34 0.00 2.34 0.00 0.00 41.12 42.51 1dgf n ASP 348 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1dgf h LYS 349 N 10.30 0.75 -0.22 -0.67 1.57 -1.80 -0.16 116.57 126.33 1dgf h LYS 349 Ca -0.41 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.30 1dgf h LYS 349 Cb 1.29 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 1dgf h LYS 349 CO 0.97 0.49 0.04 0.52 -0.57 0.00 0.00 179.45 180.91 1dgf h MET 350 N 0.77 0.36 -0.71 3.15 2.86 -1.88 -1.64 114.93 117.84 1dgf h MET 350 Ca 0.47 -0.09 -0.03 0.00 -2.06 0.00 0.00 59.70 57.99 1dgf h MET 350 Cb 0.69 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 1dgf h MET 350 CO -0.24 0.49 0.32 1.25 1.06 0.00 0.00 176.91 179.80 1dgf h LEU 351 N 0.16 0.95 -0.87 1.22 5.85 -1.70 -2.12 115.31 118.81 1dgf h LEU 351 Ca 0.07 -0.15 0.07 0.00 0.84 0.00 0.00 57.88 58.71 1dgf h LEU 351 Cb 0.31 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.03 1dgf h LEU 351 CO 0.00 0.83 0.54 1.56 -0.34 0.00 0.00 178.44 181.03 1dgf h GLN 352 N 1.00 0.94 -0.51 1.25 1.08 -0.86 -1.44 115.11 116.56 1dgf h GLN 352 Ca 0.24 -0.06 -0.11 0.00 -1.45 0.00 0.00 58.65 57.27 1dgf h GLN 352 Cb 0.15 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 1dgf h GLN 352 CO -0.03 0.62 -0.11 0.78 -0.95 0.00 0.00 178.83 179.14 1dgf h GLY 353 N 0.97 1.04 2.00 3.46 0.00 -0.87 -2.85 103.07 106.82 1dgf h GLY 353 Ca 0.39 -0.83 -0.03 0.00 0.00 0.00 0.00 47.33 46.85 1dgf h GLY 353 CO -0.18 0.76 -0.16 3.21 0.00 0.00 0.00 176.54 180.16 1dgf h ARG 354 N 0.86 0.00 -0.50 4.80 3.08 -0.67 -2.25 114.38 119.69 1dgf h ARG 354 Ca 0.13 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.23 1dgf h ARG 354 Cb 0.66 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.68 1dgf h ARG 354 CO 0.05 0.16 0.33 -0.07 -1.07 0.00 0.00 179.97 179.37 1dgf h LEU 355 N 0.00 0.43 0.00 3.04 3.38 -1.05 -3.14 115.31 117.98 1dgf h LEU 355 Ca -0.00 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1dgf h LEU 355 Cb 0.39 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1dgf h LEU 355 CO 0.02 0.29 -0.92 0.15 0.09 0.00 0.00 178.44 178.08 1dgf h PHE 356 N 0.50 0.00 -0.69 1.13 3.57 -1.54 -3.43 116.94 116.49 1dgf h PHE 356 Ca 0.21 0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.83 1dgf h PHE 356 Cb 0.20 0.00 -0.09 0.00 2.79 0.00 0.00 35.95 38.86 1dgf h PHE 356 CO -0.00 1.31 0.24 0.00 -2.23 0.00 0.00 178.31 177.63 1dgf h ALA 357 N -0.39 0.91 0.18 2.41 0.00 -1.39 -2.96 119.26 118.02 1dgf h ALA 357 Ca -0.25 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1dgf h ALA 357 Cb 1.19 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1dgf h ALA 357 CO -0.15 -0.23 -0.09 1.88 0.00 0.00 0.00 179.25 180.66 1dgf h TYR 358 N 0.38 -0.22 -0.39 0.00 0.05 -1.81 0.28 116.97 115.26 1dgf h TYR 358 Ca 0.37 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 59.12 1dgf h TYR 358 Cb 0.54 0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.33 1dgf h TYR 358 CO -0.19 0.11 0.17 -1.35 -1.05 0.00 0.00 178.16 175.85 1dgf h PRO 359 N -0.58 0.55 0.24 4.88 0.11 -1.83 -0.56 132.00 134.81 1dgf h PRO 359 Ca -0.02 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 1dgf h PRO 359 Cb 0.44 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.44 1dgf h PRO 359 CO 0.04 0.45 -0.12 0.22 -0.21 0.00 0.00 178.00 178.38 1dgf h ASP 360 N 0.55 -0.27 0.16 -2.05 3.58 -1.41 -1.53 116.42 115.45 1dgf h ASP 360 Ca 0.14 -0.05 -0.07 0.00 0.42 0.00 0.00 57.03 57.46 1dgf h ASP 360 Cb 0.09 0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 1dgf h ASP 360 CO -0.02 -0.12 -0.26 0.00 -2.88 0.00 0.00 179.24 175.96 1dgf h THR 361 N -0.41 1.23 -0.23 2.25 1.03 -0.62 -2.78 112.91 113.39 1dgf h THR 361 Ca -0.03 -1.09 -0.11 0.00 -0.01 0.00 0.00 66.41 65.17 1dgf h THR 361 Cb 0.31 1.45 -0.01 0.00 -1.07 0.00 0.00 68.15 68.83 1dgf h THR 361 CO 0.05 0.33 -0.31 0.45 -0.01 0.00 0.00 175.52 176.03 1dgf h HIS 362 N 0.16 0.54 0.00 0.00 3.86 -0.89 0.28 115.15 119.10 1dgf h HIS 362 Ca 0.03 -0.13 -0.05 0.00 -1.16 0.00 0.00 60.37 59.06 1dgf h HIS 362 Cb 0.56 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.89 1dgf h HIS 362 CO 0.01 0.73 -0.22 0.00 0.86 0.00 0.00 177.93 179.30 1dgf h ARG 363 N 0.40 0.00 0.00 2.45 3.08 -1.00 -0.43 114.38 118.88 1dgf h ARG 363 Ca 0.05 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 1dgf h ARG 363 Cb 0.75 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.79 1dgf h ARG 363 CO 0.06 0.22 -0.41 1.25 -1.07 0.00 0.00 179.97 180.02 1dgf h HIS 364 N 0.00 0.00 -0.52 3.04 2.76 -1.33 -2.96 115.15 116.13 1dgf h HIS 364 Ca -0.00 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 1dgf h HIS 364 Cb 0.45 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.39 1dgf h HIS 364 CO 0.00 0.59 0.22 -0.09 -1.30 0.00 0.00 177.93 177.35 1dgf h ARG 365 N -1.00 0.78 0.00 5.26 2.43 -0.47 -3.38 114.38 118.00 1dgf h ARG 365 Ca -0.08 -0.14 -0.22 0.00 -0.81 0.00 0.00 59.98 58.74 1dgf h ARG 365 Cb 0.67 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.06 1dgf h ARG 365 CO -0.05 0.67 -1.65 1.28 -1.51 0.00 0.00 179.97 178.72 1dgf n LEU 366 N -4.54 1.74 0.00 3.80 4.77 -0.25 -4.40 117.00 118.12 1dgf n LEU 366 Ca 0.02 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 1dgf n LEU 366 Cb 0.15 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 1dgf n LEU 366 CO 0.38 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1dgf n GLY 367 N 1.62 3.42 0.34 -0.72 0.00 -0.73 -4.87 105.19 104.25 1dgf n GLY 367 Ca -0.31 -1.37 0.14 0.00 0.00 0.00 0.00 46.02 44.48 1dgf n GLY 367 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1dgf h PRO 368 N 0.00 0.63 -0.96 1.61 0.11 -1.84 -1.98 132.00 129.56 1dgf h PRO 368 Ca 0.00 -0.04 -0.60 0.00 0.11 0.00 0.00 66.00 65.48 1dgf h PRO 368 Cb 0.00 -0.14 -0.30 0.00 0.11 0.00 0.00 31.00 30.67 1dgf h PRO 368 CO 0.00 0.42 0.70 0.09 -0.21 0.00 0.00 178.00 178.99 1dgf n ASN 369 N -4.85 5.91 0.23 -2.05 3.02 -1.26 -4.69 115.26 111.57 1dgf n ASN 369 Ca 0.24 -3.72 0.17 0.00 -0.03 0.00 0.00 54.58 51.24 1dgf n ASN 369 Cb 0.62 -0.89 0.87 0.00 -0.61 0.00 0.00 39.78 39.77 1dgf n ASN 369 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 1dgf h TYR 370 N 1.59 0.00 0.00 3.10 -0.00 -1.68 0.76 116.97 120.75 1dgf h TYR 370 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.33 1dgf h TYR 370 Cb 1.65 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.38 1dgf h TYR 370 CO 1.46 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 180.90 1dgf n LEU 371 N -3.71 0.11 0.16 0.10 4.77 -1.26 -2.31 117.00 114.86 1dgf n LEU 371 Ca 0.00 0.52 0.08 0.00 -0.03 0.00 0.00 56.01 56.59 1dgf n LEU 371 Cb 0.28 -0.50 0.08 0.00 -2.33 0.00 0.00 43.42 40.95 1dgf n LEU 371 CO 0.26 -0.24 0.50 0.45 -1.33 0.00 0.00 177.39 177.04 1dgf h HIS 372 N 0.00 0.00 -2.55 -1.77 3.86 -1.17 -3.20 115.15 110.32 1dgf h HIS 372 Ca 0.00 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.69 1dgf h HIS 372 Cb 0.33 0.00 0.04 0.00 1.06 0.00 0.00 27.41 28.84 1dgf h HIS 372 CO 0.00 0.18 1.10 0.42 0.86 0.00 0.00 177.93 180.49 1dgf s ILE 373 N -3.14 2.42 0.18 2.45 1.01 -0.98 -4.79 121.20 118.35 1dgf s ILE 373 Ca 0.04 0.02 -0.13 0.00 0.00 0.00 0.00 60.65 60.59 1dgf s ILE 373 Cb 0.07 -3.02 0.20 0.00 0.01 0.00 0.00 42.46 39.72 1dgf s ILE 373 CO 0.72 0.00 1.21 -2.65 0.00 0.00 0.00 174.94 174.22 1dgf n PRO 374 N 5.39 -0.17 0.27 2.79 -0.02 -1.26 -0.38 135.00 141.62 1dgf n PRO 374 Ca 0.17 1.20 0.14 0.00 -2.02 0.00 0.00 63.50 62.99 1dgf n PRO 374 Cb 0.38 -1.78 0.79 0.00 -0.02 0.00 0.00 33.50 32.87 1dgf n PRO 374 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1dgf h VAL 375 N 0.00 0.53 -0.00 -1.45 3.04 -1.90 -2.31 116.25 114.15 1dgf h VAL 375 Ca 0.28 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.58 1dgf h VAL 375 Cb 0.47 1.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.01 1dgf h VAL 375 CO -0.77 0.08 -0.61 0.59 -1.01 0.00 0.00 177.57 175.85 1dgf n ASN 376 N -3.66 0.96 -4.73 3.17 3.02 0.49 -4.92 115.26 109.59 1dgf n ASN 376 Ca -0.02 -0.77 -0.42 0.00 -0.03 0.00 0.00 54.58 53.34 1dgf n ASN 376 Cb 0.20 0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 39.83 1dgf n ASN 376 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dgf n PRO 378 N 3.33 3.36 0.07 0.00 -0.04 -1.26 -4.75 135.00 135.71 1dgf n PRO 378 Ca 0.10 -2.81 0.04 0.00 -0.04 0.00 0.00 63.50 60.79 1dgf n PRO 378 Cb 0.41 -3.05 0.22 0.00 -0.04 0.00 0.00 33.50 31.05 1dgf n PRO 378 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1dgf n TYR 379 N 4.67 0.28 -0.58 0.54 4.11 -1.26 -1.53 117.16 123.38 1dgf n TYR 379 Ca 0.56 0.14 0.10 0.00 -0.00 0.00 0.00 57.90 58.70 1dgf n TYR 379 Cb 0.34 -0.69 0.35 0.00 -0.00 0.00 0.00 39.34 39.33 1dgf n TYR 379 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 1dgf n ARG 380 N -1.77 3.55 -3.99 -3.48 1.74 -1.26 -4.92 116.66 106.53 1dgf n ARG 380 Ca -0.01 -2.84 -0.10 0.00 -0.77 0.00 0.00 57.85 54.13 1dgf n ARG 380 Cb 0.06 -1.83 -0.11 0.00 -1.02 0.00 0.00 32.46 29.55 1dgf n ARG 380 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1dgf s ALA 381 N -1.71 0.21 -0.38 7.54 0.00 -0.58 -4.19 121.76 122.65 1dgf s ALA 381 Ca 0.50 -0.60 -0.21 0.00 0.00 0.00 0.00 51.96 51.65 1dgf s ALA 381 Cb 0.31 0.12 0.01 0.00 0.00 0.00 0.00 23.12 23.56 1dgf s ALA 381 CO 0.26 -0.12 0.69 0.50 0.00 0.00 0.00 175.76 177.09 1dgf s ARG 382 N -1.41 3.62 -0.39 0.00 3.52 -1.26 -4.88 118.95 118.16 1dgf s ARG 382 Ca -0.14 0.06 -0.27 0.00 -0.13 0.00 0.00 55.73 55.25 1dgf s ARG 382 Cb -0.09 -3.84 0.02 0.00 -1.56 0.00 0.00 34.95 29.47 1dgf s ARG 382 CO -0.01 -0.84 0.99 0.08 -0.81 0.00 0.00 175.30 174.71 1dgf s VAL 383 N 2.89 4.49 -0.08 7.11 1.01 -1.26 -4.99 120.40 129.57 1dgf s VAL 383 Ca 0.27 1.26 -0.03 0.00 0.00 0.00 0.00 61.98 63.47 1dgf s VAL 383 Cb -0.14 -4.41 0.04 0.00 0.00 0.00 0.00 36.38 31.88 1dgf s VAL 383 CO 0.17 -0.64 0.07 0.00 0.00 0.00 0.00 175.10 174.70 1dgf s ALA 384 N 3.71 0.27 0.00 5.51 0.00 -1.26 -5.06 121.76 124.92 1dgf s ALA 384 Ca 0.41 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1dgf s ALA 384 Cb -0.11 -0.76 0.00 0.00 0.00 0.00 0.00 23.12 22.25 1dgf s ALA 384 CO 0.21 -0.71 0.00 0.27 0.00 0.00 0.00 175.76 175.53 1dgf n ASN 385 N 5.30 0.00 -0.80 0.00 0.23 -1.26 -4.91 115.26 113.81 1dgf n ASN 385 Ca -0.04 -0.10 0.08 0.00 -0.53 0.00 0.00 54.58 53.99 1dgf n ASN 385 Cb 0.50 0.00 0.24 0.00 -2.08 0.00 0.00 39.78 38.44 1dgf n ASN 385 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 1dgf n TYR 386 N 0.00 0.83 -3.28 -2.53 4.02 -1.26 -4.90 117.16 110.04 1dgf n TYR 386 Ca 0.00 -0.94 -0.39 0.00 -0.01 0.00 0.00 57.90 56.56 1dgf n TYR 386 Cb 0.00 -0.31 -0.06 0.00 -0.02 0.00 0.00 39.34 38.95 1dgf n TYR 386 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1dgf s GLN 387 N -2.87 4.20 0.09 -0.72 -0.21 -1.26 -4.87 119.66 114.03 1dgf s GLN 387 Ca 0.41 0.69 -0.07 0.00 0.02 0.00 0.00 55.36 56.41 1dgf s GLN 387 Cb 0.34 -3.27 -0.01 0.00 1.00 0.00 0.00 33.01 31.07 1dgf s GLN 387 CO 0.07 0.56 0.15 1.03 -2.12 0.00 0.00 175.29 174.98 1dgf s ARG 388 N -0.80 0.82 5.08 2.91 1.81 -1.26 -4.94 118.95 122.58 1dgf s ARG 388 Ca 0.29 -1.04 0.00 0.00 -1.72 0.00 0.00 55.73 53.26 1dgf s ARG 388 Cb -0.19 0.32 0.00 0.00 -0.45 0.00 0.00 34.95 34.63 1dgf s ARG 388 CO 0.17 -0.25 0.00 -0.25 -0.68 0.00 0.00 175.30 174.30 1dgf n ASP 389 N -0.04 0.00 0.00 0.23 8.00 -1.26 -5.07 116.55 118.41 1dgf n ASP 389 Ca -0.14 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.36 1dgf n ASP 389 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.72 1dgf n ASP 389 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dgf n GLY 390 N 0.00 -0.88 3.66 0.44 0.00 -1.26 -4.74 105.19 102.40 1dgf n GLY 390 Ca 0.00 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 1dgf n GLY 390 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1dgf n PRO 391 N -0.53 1.66 -3.84 1.61 -0.02 -1.26 -3.36 135.00 129.26 1dgf n PRO 391 Ca 0.00 0.59 -0.29 0.00 -2.02 0.00 0.00 63.50 61.78 1dgf n PRO 391 Cb 0.00 -2.21 0.01 0.00 -0.02 0.00 0.00 33.50 31.28 1dgf n PRO 391 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1dgf n MET 392 N 0.12 -2.32 -2.39 -0.52 2.81 -1.26 -4.27 117.12 109.29 1dgf n MET 392 Ca 0.08 0.42 -0.38 0.00 -1.81 0.00 0.00 57.70 56.01 1dgf n MET 392 Cb 0.39 -4.27 -0.03 0.00 -0.71 0.00 0.00 33.22 28.60 1dgf n MET 392 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1dgf n MET 394 N 9.07 1.51 -3.49 0.00 2.81 -1.26 -4.90 117.12 120.85 1dgf n MET 394 Ca 0.24 -0.75 -0.20 0.00 -1.81 0.00 0.00 57.70 55.18 1dgf n MET 394 Cb 0.50 -1.43 -0.02 0.00 -0.71 0.00 0.00 33.22 31.55 1dgf n MET 394 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1dgf n GLN 395 N -0.06 1.05 0.00 0.03 6.02 -1.26 -4.99 117.38 118.16 1dgf n GLN 395 Ca 0.18 -2.46 0.05 0.00 -0.01 0.00 0.00 57.00 54.76 1dgf n GLN 395 Cb 0.28 0.48 0.31 0.00 1.02 0.00 0.00 30.24 32.32 1dgf n GLN 395 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1dgf n ASP 396 N -1.54 0.00 -2.48 1.08 3.85 -1.26 -4.82 116.55 111.39 1dgf n ASP 396 Ca -0.08 -0.30 -0.20 0.00 -0.71 0.00 0.00 54.79 53.49 1dgf n ASP 396 Cb 0.44 -0.01 -0.00 0.00 -1.35 0.00 0.00 41.12 40.19 1dgf n ASP 396 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 1dgf n ASN 397 N -1.01 -5.70 -1.60 -1.12 5.15 -1.26 -1.73 115.26 107.98 1dgf n ASN 397 Ca 0.08 -0.02 -0.16 0.00 -0.60 0.00 0.00 54.58 53.87 1dgf n ASN 397 Cb 0.04 -4.74 -0.04 0.00 -0.53 0.00 0.00 39.78 34.51 1dgf n ASN 397 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1dgf n GLN 398 N -3.10 -1.24 0.00 1.20 6.02 -1.26 -4.85 117.38 114.14 1dgf n GLN 398 Ca -0.22 0.93 0.00 0.00 -0.01 0.00 0.00 57.00 57.70 1dgf n GLN 398 Cb 0.67 -5.25 0.00 0.00 1.02 0.00 0.00 30.24 26.68 1dgf n GLN 398 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1dgf n GLY 399 N -0.99 2.98 1.77 1.08 0.00 -0.71 -2.50 105.19 106.82 1dgf n GLY 399 Ca -0.18 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 45.87 1dgf n GLY 399 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dgf n GLY 400 N 0.00 2.86 3.77 -0.02 0.00 -1.26 -5.00 105.19 105.54 1dgf n GLY 400 Ca 0.00 -0.89 -0.41 0.00 0.00 0.00 0.00 46.02 44.72 1dgf n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgf s ALA 401 N -2.34 3.63 0.04 4.61 0.00 -1.04 -4.87 121.76 121.78 1dgf s ALA 401 Ca 0.53 1.56 -0.37 0.00 0.00 0.00 0.00 51.96 53.68 1dgf s ALA 401 Cb 0.38 -3.62 -0.16 0.00 0.00 0.00 0.00 23.12 19.72 1dgf s ALA 401 CO 0.20 -1.01 1.43 -2.30 0.00 0.00 0.00 175.76 174.08 1dgf n PRO 402 N 1.08 1.27 -0.54 0.00 -0.02 -1.26 -4.88 135.00 130.65 1dgf n PRO 402 Ca 0.03 0.46 0.08 0.00 -2.02 0.00 0.00 63.50 62.06 1dgf n PRO 402 Cb 0.39 -2.12 0.31 0.00 -0.02 0.00 0.00 33.50 32.06 1dgf n PRO 402 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1dgf n ASN 403 N 3.09 4.21 -4.15 2.55 0.23 -1.26 -4.89 115.26 115.04 1dgf n ASN 403 Ca 0.19 -2.37 -0.18 0.00 -0.53 0.00 0.00 54.58 51.69 1dgf n ASN 403 Cb 0.19 -0.54 -0.12 0.00 -2.08 0.00 0.00 39.78 37.24 1dgf n ASN 403 CO 0.00 0.00 0.00 -0.72 -0.93 0.00 0.00 177.26 175.61 1dgf s TYR 404 N -1.78 1.13 -0.04 -2.53 -0.85 -1.26 -4.85 117.35 107.16 1dgf s TYR 404 Ca 0.45 -0.44 0.03 0.00 -0.52 0.00 0.00 57.07 56.58 1dgf s TYR 404 Cb 0.29 -0.64 0.01 0.00 0.38 0.00 0.00 41.96 41.99 1dgf s TYR 404 CO 0.22 0.03 -0.11 -0.47 -1.52 0.00 0.00 175.55 173.70 1dgf s TYR 405 N -1.20 1.27 0.70 -3.49 5.04 -1.26 -3.99 117.35 114.42 1dgf s TYR 405 Ca -0.02 -0.39 -0.11 0.00 -2.44 0.00 0.00 57.07 54.11 1dgf s TYR 405 Cb -0.09 -0.91 0.01 0.00 0.35 0.00 0.00 41.96 41.31 1dgf s TYR 405 CO 0.02 -0.18 1.08 -1.25 -1.34 0.00 0.00 175.55 173.87 1dgf s PRO 406 N 0.37 2.91 0.08 4.97 0.04 -1.26 -5.21 135.00 136.90 1dgf s PRO 406 Ca -0.08 0.63 -0.10 0.00 0.04 0.00 0.00 61.00 61.50 1dgf s PRO 406 Cb -0.12 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1dgf s PRO 406 CO 0.02 -1.03 0.22 0.54 0.04 0.00 0.00 177.00 176.78 1dgf s ASN 407 N -4.16 0.05 -0.33 6.66 2.20 -1.26 -5.05 114.94 113.06 1dgf s ASN 407 Ca 0.58 -0.52 0.09 0.00 -0.94 0.00 0.00 52.86 52.07 1dgf s ASN 407 Cb -0.12 0.34 0.68 0.00 -2.00 0.00 0.00 41.25 40.15 1dgf s ASN 407 CO 0.53 -0.69 1.76 -1.20 -2.94 0.00 0.00 177.10 174.56 1dgf n SER 408 N 0.16 4.25 -0.17 3.54 7.64 -1.26 -4.56 113.62 123.22 1dgf n SER 408 Ca -0.16 -3.36 0.09 0.00 1.01 0.00 0.00 58.87 56.46 1dgf n SER 408 Cb 0.61 -0.73 0.15 0.00 -1.01 0.00 0.00 64.21 63.23 1dgf n SER 408 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1dgf n PHE 409 N -0.51 0.06 -1.05 1.43 3.01 -1.26 -5.01 117.46 114.14 1dgf n PHE 409 Ca 0.42 -1.04 -0.02 0.00 1.01 0.00 0.00 57.45 57.82 1dgf n PHE 409 Cb 1.36 -0.17 -0.01 0.00 -0.01 0.00 0.00 39.48 40.65 1dgf n PHE 409 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dgf n GLY 410 N -1.36 0.53 3.80 1.37 0.00 -1.26 -4.90 105.19 103.37 1dgf n GLY 410 Ca 0.17 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1dgf n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgf s ALA 411 N -2.02 1.83 0.21 4.61 0.00 -1.26 -4.95 121.76 120.17 1dgf s ALA 411 Ca 0.00 -0.61 -0.29 0.00 0.00 0.00 0.00 51.96 51.06 1dgf s ALA 411 Cb 0.00 -3.00 -0.16 0.00 0.00 0.00 0.00 23.12 19.96 1dgf s ALA 411 CO 0.00 -2.31 0.80 -2.30 0.00 0.00 0.00 175.76 171.95 1dgf n PRO 412 N -3.78 0.59 -4.84 0.00 -0.02 -1.26 -5.01 135.00 120.69 1dgf n PRO 412 Ca 0.08 0.21 -0.31 0.00 -2.02 0.00 0.00 63.50 61.45 1dgf n PRO 412 Cb 0.59 -1.43 -0.14 0.00 -0.02 0.00 0.00 33.50 32.51 1dgf n PRO 412 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1dgf s GLU 413 N -1.03 2.12 0.65 -0.52 0.41 -1.26 -5.03 118.70 114.04 1dgf s GLU 413 Ca 0.65 -0.94 -0.17 0.00 -0.41 0.00 0.00 54.97 54.10 1dgf s GLU 413 Cb -0.87 -2.17 -0.01 0.00 -1.78 0.00 0.00 34.13 29.30 1dgf s GLU 413 CO 0.57 0.55 1.19 1.14 -0.49 0.00 0.00 175.26 178.23 1dgf s GLN 414 N -1.15 2.67 -0.39 1.61 -2.07 -1.26 -5.00 119.66 114.06 1dgf s GLN 414 Ca 0.13 1.75 -0.01 0.00 -1.82 0.00 0.00 55.36 55.40 1dgf s GLN 414 Cb -0.10 -1.90 0.11 0.00 -1.09 0.00 0.00 33.01 30.02 1dgf s GLN 414 CO 0.03 -1.43 0.16 -1.14 -1.32 0.00 0.00 175.29 171.59 1dgf s GLN 415 N -3.63 1.88 0.48 9.60 0.74 -1.26 -5.00 119.66 122.47 1dgf s GLN 415 Ca 0.75 -1.81 0.33 0.00 0.05 0.00 0.00 55.36 54.67 1dgf s GLN 415 Cb -0.29 -3.47 1.44 0.00 1.10 0.00 0.00 33.01 31.79 1dgf s GLN 415 CO 0.38 -1.02 1.72 -1.35 -0.55 0.00 0.00 175.29 174.47 1dgf h PRO 416 N 7.93 0.12 0.00 1.67 0.11 -2.01 0.96 132.00 140.78 1dgf h PRO 416 Ca -0.11 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1dgf h PRO 416 Cb 1.04 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1dgf h PRO 416 CO 0.65 0.08 0.00 0.66 -0.21 0.00 0.00 178.00 179.17 1dgf h SER 417 N 0.12 0.00 0.01 -2.05 4.64 -2.04 -2.18 113.55 112.05 1dgf h SER 417 Ca 0.69 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.01 1dgf h SER 417 Cb 2.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.47 1dgf h SER 417 CO -0.18 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 175.77 1dgf n ALA 418 N -2.00 2.63 -1.74 5.18 0.00 0.33 -4.94 120.51 119.98 1dgf n ALA 418 Ca -0.00 -0.35 -0.41 0.00 0.00 0.00 0.00 53.44 52.68 1dgf n ALA 418 Cb 0.21 -1.30 0.01 0.00 0.00 0.00 0.00 19.45 18.36 1dgf n ALA 418 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1dgf n LEU 419 N -0.32 4.41 -4.76 0.00 7.94 -0.82 -4.91 117.00 118.55 1dgf n LEU 419 Ca 0.21 1.17 -0.29 0.00 -1.11 0.00 0.00 56.01 55.98 1dgf n LEU 419 Cb 0.26 -1.56 0.13 0.00 0.53 0.00 0.00 43.42 42.78 1dgf n LEU 419 CO 0.18 -0.25 0.69 -1.61 -1.11 0.00 0.00 177.39 175.29 1dgf s GLU 420 N -2.16 1.32 0.02 1.96 8.01 -1.26 -5.01 118.70 121.58 1dgf s GLU 420 Ca 0.57 0.54 -0.30 0.00 0.01 0.00 0.00 54.97 55.79 1dgf s GLU 420 Cb -0.50 -1.84 -0.04 0.00 -4.31 0.00 0.00 34.13 27.44 1dgf s GLU 420 CO 0.61 -2.13 1.08 -1.58 0.01 0.00 0.00 175.26 173.25 1dgf s HIS 421 N -3.12 3.54 -0.09 1.61 5.65 -1.26 -5.04 115.29 116.59 1dgf s HIS 421 Ca 0.63 1.51 -0.17 0.00 0.25 0.00 0.00 55.06 57.28 1dgf s HIS 421 Cb -0.16 -3.26 -0.05 0.00 -1.18 0.00 0.00 32.58 27.93 1dgf s HIS 421 CO 0.55 -0.60 0.43 -1.12 -0.65 0.00 0.00 174.74 173.36 1dgf s SER 422 N 1.06 6.69 0.02 9.88 0.01 -1.26 -5.08 113.70 125.02 1dgf s SER 422 Ca 0.55 0.82 -0.00 0.00 1.31 0.00 0.00 55.95 58.63 1dgf s SER 422 Cb -0.24 -2.26 -0.02 0.00 0.21 0.00 0.00 66.02 63.71 1dgf s SER 422 CO 0.28 0.11 -0.02 -0.63 0.41 0.00 0.00 173.24 173.38 1dgf s ILE 423 N 0.10 0.09 -0.19 1.44 1.01 -1.26 -5.14 121.20 117.24 1dgf s ILE 423 Ca 0.24 -0.72 -0.12 0.00 0.00 0.00 0.00 60.65 60.06 1dgf s ILE 423 Cb -0.15 -0.21 -0.05 0.00 0.01 0.00 0.00 42.46 42.06 1dgf s ILE 423 CO 0.10 -0.39 0.20 -1.10 0.00 0.00 0.00 174.94 173.75 1dgf s GLN 424 N -1.15 4.21 0.04 2.79 -1.52 -1.26 -5.09 119.66 117.68 1dgf s GLN 424 Ca -0.13 -0.09 0.08 0.00 -1.95 0.00 0.00 55.36 53.27 1dgf s GLN 424 Cb -0.08 -3.43 -0.03 0.00 -0.22 0.00 0.00 33.01 29.25 1dgf s GLN 424 CO -0.01 0.26 -0.22 0.71 -0.25 0.00 0.00 175.29 175.78 1dgf s TYR 425 N 0.46 2.44 0.19 0.91 2.02 -1.26 -5.14 117.35 116.97 1dgf s TYR 425 Ca 0.12 -0.33 0.08 0.00 -0.37 0.00 0.00 57.07 56.57 1dgf s TYR 425 Cb -0.12 -1.43 -0.04 0.00 -0.40 0.00 0.00 41.96 39.97 1dgf s TYR 425 CO 0.01 0.19 -0.05 -1.54 -1.57 0.00 0.00 175.55 172.59 1dgf s SER 426 N -1.35 4.47 0.00 2.29 1.04 -1.26 -5.06 113.70 113.83 1dgf s SER 426 Ca 0.13 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 56.04 1dgf s SER 426 Cb -0.10 -0.84 0.00 0.00 0.10 0.00 0.00 66.02 65.18 1dgf s SER 426 CO 0.04 0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.95 1dgf n GLY 427 N -0.12 2.60 3.84 7.32 0.00 -1.26 -5.06 105.19 112.50 1dgf n GLY 427 Ca -0.10 -2.00 -0.31 0.00 0.00 0.00 0.00 46.02 43.61 1dgf n GLY 427 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dgf s GLU 428 N -2.65 3.22 -0.54 1.61 2.02 -1.26 -4.99 118.70 116.11 1dgf s GLU 428 Ca 0.00 0.90 -0.22 0.00 0.02 0.00 0.00 54.97 55.67 1dgf s GLU 428 Cb 0.00 -2.03 0.05 0.00 0.10 0.00 0.00 34.13 32.25 1dgf s GLU 428 CO 0.00 -0.87 0.81 0.08 0.02 0.00 0.00 175.26 175.30 1dgf s VAL 429 N -3.04 4.58 0.16 2.63 1.01 -1.26 -4.95 120.40 119.53 1dgf s VAL 429 Ca 0.57 -0.10 -0.13 0.00 0.00 0.00 0.00 61.98 62.33 1dgf s VAL 429 Cb -0.13 -4.46 0.05 0.00 0.00 0.00 0.00 36.38 31.84 1dgf s VAL 429 CO 0.53 -1.02 0.62 -2.11 0.00 0.00 0.00 175.10 173.11 1dgf n ARG 430 N 6.95 0.52 -3.12 2.72 1.85 -1.26 -5.13 116.66 119.19 1dgf n ARG 430 Ca -0.02 -1.11 -0.41 0.00 -1.00 0.00 0.00 57.85 55.31 1dgf n ARG 430 Cb 0.46 1.45 -0.07 0.00 -1.05 0.00 0.00 32.46 33.26 1dgf n ARG 430 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1dgf s ARG 431 N -2.04 3.83 -0.25 2.89 0.52 -1.26 -5.04 118.95 117.60 1dgf s ARG 431 Ca 0.13 0.21 -0.09 0.00 -0.52 0.00 0.00 55.73 55.47 1dgf s ARG 431 Cb -0.02 -3.75 -0.04 0.00 0.52 0.00 0.00 34.95 31.66 1dgf s ARG 431 CO 0.05 -0.61 0.11 -0.06 0.02 0.00 0.00 175.30 174.81 1dgf s PHE 432 N 2.62 3.17 0.16 -0.53 0.08 -1.26 -5.07 117.98 117.14 1dgf s PHE 432 Ca 0.25 -0.13 -0.31 0.00 0.12 0.00 0.00 56.93 56.85 1dgf s PHE 432 Cb -0.15 -2.26 -0.09 0.00 -0.57 0.00 0.00 43.02 39.95 1dgf s PHE 432 CO 0.13 -0.19 1.43 1.21 -0.10 0.00 0.00 175.22 177.70 1dgf s ASN 433 N 1.43 6.75 0.00 1.36 2.47 -1.26 -4.91 114.94 120.78 1dgf s ASN 433 Ca 0.06 2.46 0.00 0.00 0.42 0.00 0.00 52.86 55.80 1dgf s ASN 433 Cb -0.15 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.05 1dgf s ASN 433 CO 0.06 -0.69 0.83 0.35 -3.72 0.00 0.00 177.10 173.93 1dgf n THR 434 N 3.55 0.69 0.06 -5.21 -2.24 -1.26 -4.74 114.28 105.14 1dgf n THR 434 Ca 0.11 -0.76 0.05 0.00 -2.27 0.00 0.00 64.05 61.17 1dgf n THR 434 Cb 0.41 0.68 0.47 0.00 -2.10 0.00 0.00 70.33 69.79 1dgf n THR 434 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1dgf h ALA 435 N 0.00 1.77 -0.49 6.98 0.00 -2.01 -2.32 119.26 123.19 1dgf h ALA 435 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1dgf h ALA 435 Cb 0.50 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1dgf h ALA 435 CO 0.00 0.21 0.00 0.09 0.00 0.00 0.00 179.25 179.55 1dgf n ASN 436 N -4.49 4.62 -4.72 0.00 5.03 -1.26 -4.79 115.26 109.65 1dgf n ASN 436 Ca 0.02 -2.64 -0.29 0.00 0.87 0.00 0.00 54.58 52.53 1dgf n ASN 436 Cb 0.07 -0.62 0.15 0.00 -1.02 0.00 0.00 39.78 38.36 1dgf n ASN 436 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1dgf s ASP 437 N -0.69 3.20 0.03 6.41 -0.00 -0.87 -4.87 116.67 119.88 1dgf s ASP 437 Ca 0.44 1.26 -0.33 0.00 -0.00 0.00 0.00 52.55 53.91 1dgf s ASP 437 Cb 0.32 -1.92 -0.12 0.00 -0.00 0.00 0.00 42.92 41.20 1dgf s ASP 437 CO 0.15 -2.78 1.77 -0.67 -0.00 0.00 0.00 175.17 173.64 1dgf n ASP 438 N -3.95 3.43 -0.15 0.27 2.03 -1.26 -4.86 116.55 112.06 1dgf n ASP 438 Ca 0.06 1.01 0.03 0.00 0.52 0.00 0.00 54.79 56.41 1dgf n ASP 438 Cb 0.57 -1.42 0.00 0.00 -0.72 0.00 0.00 41.12 39.55 1dgf n ASP 438 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1dgf n ASN 439 N 5.39 1.03 0.00 1.67 3.02 -1.26 -4.85 115.26 120.26 1dgf n ASN 439 Ca 0.20 -1.02 0.00 0.00 -0.03 0.00 0.00 54.58 53.73 1dgf n ASN 439 Cb 0.31 0.38 0.00 0.00 -0.61 0.00 0.00 39.78 39.86 1dgf n ASN 439 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1dgf n VAL 440 N -0.22 0.00 0.04 2.41 0.24 -1.26 -4.59 118.33 114.96 1dgf n VAL 440 Ca 0.03 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.22 1dgf n VAL 440 Cb 0.13 -0.57 -0.04 0.00 -1.47 0.00 0.00 33.84 31.89 1dgf n VAL 440 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1dgf h THR 441 N 0.00 0.42 0.00 3.34 2.02 -1.94 0.93 112.91 117.69 1dgf h THR 441 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1dgf h THR 441 Cb 0.61 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 1dgf h THR 441 CO 0.00 0.00 -0.31 1.56 0.37 0.00 0.00 175.52 177.14 1dgf h GLN 442 N -0.37 0.00 -0.22 6.66 4.20 -1.94 -2.66 115.11 120.79 1dgf h GLN 442 Ca 0.07 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.64 1dgf h GLN 442 Cb 0.47 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1dgf h GLN 442 CO -0.25 0.31 -0.45 0.28 -0.67 0.00 0.00 178.83 178.05 1dgf h VAL 443 N 0.00 1.31 -0.60 -0.54 2.07 -1.69 -1.67 116.25 115.12 1dgf h VAL 443 Ca -0.00 -1.64 -0.04 0.00 0.82 0.00 0.00 66.70 65.83 1dgf h VAL 443 Cb 0.75 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 32.12 1dgf h VAL 443 CO 0.04 0.52 0.20 -0.09 0.02 0.00 0.00 177.57 178.26 1dgf h ARG 444 N 0.45 0.93 -0.35 1.57 2.43 -0.50 -0.94 114.38 117.96 1dgf h ARG 444 Ca 0.03 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 58.95 1dgf h ARG 444 Cb 0.96 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.36 1dgf h ARG 444 CO 0.09 0.82 -0.01 0.00 -1.51 0.00 0.00 179.97 179.35 1dgf h ALA 445 N 1.07 1.33 0.06 2.80 0.00 -1.26 -0.13 119.26 123.13 1dgf h ALA 445 Ca 0.20 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1dgf h ALA 445 Cb 0.26 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1dgf h ALA 445 CO -0.01 0.46 -0.03 0.35 0.00 0.00 0.00 179.25 180.02 1dgf h PHE 446 N 0.53 -0.07 -0.59 0.00 3.57 -0.79 0.60 116.94 120.19 1dgf h PHE 446 Ca 0.11 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 1dgf h PHE 446 Cb 0.36 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 1dgf h PHE 446 CO 0.01 0.27 0.31 -0.92 -2.23 0.00 0.00 178.31 175.75 1dgf h TYR 447 N -0.42 0.83 0.11 0.41 5.03 -0.96 -1.95 116.97 120.02 1dgf h TYR 447 Ca -0.01 -0.03 -0.22 0.00 2.58 0.00 0.00 58.73 61.05 1dgf h TYR 447 Cb 0.38 -0.26 0.01 0.00 1.55 0.00 0.00 36.73 38.40 1dgf h TYR 447 CO 0.04 0.62 -1.09 0.28 -1.32 0.00 0.00 178.16 176.69 1dgf h VAL 448 N 0.80 1.26 0.01 1.81 2.07 -1.06 -3.38 116.25 117.76 1dgf h VAL 448 Ca 0.21 -2.44 -0.41 0.00 0.82 0.00 0.00 66.70 64.87 1dgf h VAL 448 Cb 0.08 2.92 -0.06 0.00 -1.52 0.00 0.00 31.29 32.71 1dgf h VAL 448 CO -0.03 0.68 -2.38 0.59 0.02 0.00 0.00 177.57 176.45 1dgf n ASN 449 N -4.07 1.97 -0.01 0.57 5.03 0.18 -4.57 115.26 114.37 1dgf n ASN 449 Ca -0.20 0.14 -0.06 0.00 0.87 0.00 0.00 54.58 55.33 1dgf n ASN 449 Cb 0.84 -0.67 0.13 0.00 -1.02 0.00 0.00 39.78 39.06 1dgf n ASN 449 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 1dgf h VAL 450 N -0.50 1.29 -2.41 2.41 2.07 -1.15 -3.44 116.25 114.51 1dgf h VAL 450 Ca -0.60 -1.46 -0.52 0.00 0.82 0.00 0.00 66.70 64.93 1dgf h VAL 450 Cb 1.74 1.46 -0.04 0.00 -1.52 0.00 0.00 31.29 32.94 1dgf h VAL 450 CO -0.23 0.46 -0.51 -0.76 0.02 0.00 0.00 177.57 176.56 1dgf s LEU 451 N -8.59 4.02 0.00 2.57 1.43 -0.78 -5.05 118.68 112.28 1dgf s LEU 451 Ca -0.07 -0.06 0.04 0.00 -1.03 0.00 0.00 54.13 53.00 1dgf s LEU 451 Cb 0.13 -2.59 0.04 0.00 0.03 0.00 0.00 46.19 43.80 1dgf s LEU 451 CO 0.81 0.00 0.29 -0.46 0.23 0.00 0.00 176.35 177.23 1dgf n ASN 452 N -0.86 1.93 0.05 2.29 0.23 -1.26 -4.70 115.26 112.94 1dgf n ASN 452 Ca -0.08 -2.11 -0.11 0.00 -0.53 0.00 0.00 54.58 51.75 1dgf n ASN 452 Cb 0.56 -0.07 -0.04 0.00 -2.08 0.00 0.00 39.78 38.15 1dgf n ASN 452 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1dgf h GLU 453 N 0.00 -0.26 -0.30 -3.83 4.81 -1.95 -0.37 114.58 112.68 1dgf h GLU 453 Ca -0.20 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 58.99 1dgf h GLU 453 Cb 0.77 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.19 1dgf h GLU 453 CO 0.31 -0.17 -0.05 1.05 -0.73 0.00 0.00 179.01 179.42 1dgf h GLU 454 N -0.27 0.47 -0.25 1.92 4.11 -2.00 -1.87 114.58 116.70 1dgf h GLU 454 Ca 0.06 -0.11 -0.18 0.00 0.07 0.00 0.00 59.36 59.21 1dgf h GLU 454 Cb 0.35 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1dgf h GLU 454 CO -0.18 0.53 -0.55 1.96 0.07 0.00 0.00 179.01 180.84 1dgf h GLN 455 N 0.44 0.75 -0.59 1.06 4.20 -1.89 -2.40 115.11 116.69 1dgf h GLN 455 Ca 0.09 -0.48 -0.07 0.00 0.06 0.00 0.00 58.65 58.26 1dgf h GLN 455 Cb 0.37 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 1dgf h GLN 455 CO 0.02 1.10 0.10 0.00 -0.67 0.00 0.00 178.83 179.38 1dgf h ARG 456 N 0.58 0.94 -0.03 1.46 3.08 -0.76 -0.77 114.38 118.88 1dgf h ARG 456 Ca 0.01 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 1dgf h ARG 456 Cb 1.13 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 31.06 1dgf h ARG 456 CO 0.12 0.86 0.01 -0.22 -1.07 0.00 0.00 179.97 179.67 1dgf h LYS 457 N 0.89 0.04 -0.82 0.04 3.64 -1.23 -1.38 116.57 117.74 1dgf h LYS 457 Ca 0.18 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.53 1dgf h LYS 457 Cb 0.38 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.16 1dgf h LYS 457 CO 0.01 0.12 0.39 0.00 -2.27 0.00 0.00 179.45 177.70 1dgf h ARG 458 N -0.06 1.18 -0.27 1.90 3.08 -1.28 -1.35 114.38 117.58 1dgf h ARG 458 Ca 0.01 -0.17 0.03 0.00 0.07 0.00 0.00 59.98 59.92 1dgf h ARG 458 Cb 0.10 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 1dgf h ARG 458 CO -0.00 0.91 0.06 1.25 -1.07 0.00 0.00 179.97 181.12 1dgf h LEU 459 N 1.16 0.03 -0.81 3.04 5.85 -0.86 0.19 115.31 123.92 1dgf h LEU 459 Ca 0.28 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.95 1dgf h LEU 459 Cb 0.12 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1dgf h LEU 459 CO -0.03 0.05 -0.06 0.00 -0.34 0.00 0.00 178.44 178.06 1dgf h GLU 461 N 0.77 0.96 -0.35 0.00 5.08 -0.70 -1.05 114.58 119.28 1dgf h GLU 461 Ca 0.14 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.15 1dgf h GLU 461 Cb 0.54 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1dgf h GLU 461 CO 0.03 0.97 0.07 -0.91 -1.00 0.00 0.00 179.01 178.17 1dgf h ASN 462 N 0.84 0.56 0.15 1.42 2.35 -0.45 -0.57 115.58 119.89 1dgf h ASN 462 Ca 0.15 -0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.64 1dgf h ASN 462 Cb 0.53 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1dgf h ASN 462 CO 0.03 0.67 -0.07 0.40 -1.65 0.00 0.00 177.43 176.80 1dgf h ILE 463 N 0.42 0.92 -0.92 2.81 2.04 -1.24 -3.04 117.51 118.50 1dgf h ILE 463 Ca 0.11 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.68 1dgf h ILE 463 Cb 0.34 1.11 -0.05 0.00 -0.74 0.00 0.00 36.82 37.48 1dgf h ILE 463 CO 0.01 0.07 0.61 0.00 0.00 0.00 0.00 178.15 178.83 1dgf h ALA 464 N 0.47 1.38 -0.28 1.87 0.00 -1.16 0.21 119.26 121.75 1dgf h ALA 464 Ca -0.02 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1dgf h ALA 464 Cb 0.28 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1dgf h ALA 464 CO 0.03 0.55 0.19 0.78 0.00 0.00 0.00 179.25 180.81 1dgf h GLY 465 N 1.20 0.29 0.21 0.00 0.00 -1.00 -1.17 103.07 102.59 1dgf h GLY 465 Ca 0.35 -0.10 -0.36 0.00 0.00 0.00 0.00 47.33 47.22 1dgf h GLY 465 CO -0.09 0.09 -2.05 1.57 0.00 0.00 0.00 176.54 176.06 1dgf n HIS 466 N -4.49 0.67 0.29 5.60 -0.00 -0.82 -4.39 115.22 112.07 1dgf n HIS 466 Ca 0.02 0.19 0.15 0.00 -0.00 0.00 0.00 57.72 58.08 1dgf n HIS 466 Cb 0.17 -1.08 0.85 0.00 -0.00 0.00 0.00 29.99 29.93 1dgf n HIS 466 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 1dgf h LEU 467 N -0.40 0.00 -2.51 0.27 5.85 -0.52 -2.96 115.31 115.04 1dgf h LEU 467 Ca -0.50 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.23 1dgf h LEU 467 Cb 1.75 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.78 1dgf h LEU 467 CO -0.12 0.06 0.04 0.07 -0.34 0.00 0.00 178.44 178.15 1dgf h LYS 468 N 0.00 0.00 -0.00 1.25 2.10 -1.41 -1.35 116.57 117.15 1dgf h LYS 468 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1dgf h LYS 468 Cb 0.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.50 1dgf h LYS 468 CO 0.01 0.00 -0.12 -0.25 -2.00 0.00 0.00 179.45 177.09 1dgf n ASP 469 N -3.69 0.44 -4.88 7.07 10.43 -1.12 -4.84 116.55 119.97 1dgf n ASP 469 Ca -0.02 -0.50 -0.29 0.00 2.57 0.00 0.00 54.79 56.54 1dgf n ASP 469 Cb 0.13 -0.08 -0.02 0.00 1.84 0.00 0.00 41.12 42.98 1dgf n ASP 469 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1dgf s ALA 470 N -2.52 3.38 0.80 2.24 0.00 -0.51 -4.69 121.76 120.46 1dgf s ALA 470 Ca 0.27 -0.30 -0.14 0.00 0.00 0.00 0.00 51.96 51.80 1dgf s ALA 470 Cb 0.20 -2.65 0.07 0.00 0.00 0.00 0.00 23.12 20.74 1dgf s ALA 470 CO 0.49 -0.08 1.16 1.04 0.00 0.00 0.00 175.76 178.37 1dgf n GLN 471 N -1.51 0.23 -0.27 0.00 6.02 -1.26 -4.71 117.38 115.88 1dgf n GLN 471 Ca 0.02 0.15 0.02 0.00 -0.01 0.00 0.00 57.00 57.18 1dgf n GLN 471 Cb 0.54 -2.41 0.15 0.00 1.02 0.00 0.00 30.24 29.54 1dgf n GLN 471 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1dgf h ILE 472 N -0.81 0.91 -0.31 5.09 1.08 -1.96 -0.61 117.51 120.91 1dgf h ILE 472 Ca -0.46 -0.25 -0.01 0.00 -0.39 0.00 0.00 64.86 63.74 1dgf h ILE 472 Cb 1.30 0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 1dgf h ILE 472 CO 0.46 0.14 0.15 2.19 -0.69 0.00 0.00 178.15 180.40 1dgf h PHE 473 N 0.74 0.41 -0.09 1.37 -5.15 -1.99 0.18 116.94 112.41 1dgf h PHE 473 Ca 0.37 -0.00 -0.24 0.00 -0.20 0.00 0.00 57.97 57.90 1dgf h PHE 473 Cb 0.32 -0.13 0.01 0.00 0.22 0.00 0.00 35.95 36.37 1dgf h PHE 473 CO -0.07 0.30 -0.86 0.82 -2.00 0.00 0.00 178.31 176.50 1dgf h ILE 474 N 0.43 1.28 -0.73 0.88 2.04 -1.65 -2.54 117.51 117.23 1dgf h ILE 474 Ca 0.11 -2.07 0.01 0.00 1.00 0.00 0.00 64.86 63.91 1dgf h ILE 474 Cb 0.04 2.16 -0.04 0.00 -0.74 0.00 0.00 36.82 38.24 1dgf h ILE 474 CO -0.02 0.65 0.48 1.56 0.00 0.00 0.00 178.15 180.82 1dgf h GLN 475 N 0.46 0.96 -0.34 2.37 4.20 -0.12 -1.03 115.11 121.60 1dgf h GLN 475 Ca -0.08 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1dgf h GLN 475 Cb 1.51 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 29.06 1dgf h GLN 475 CO 0.17 0.64 0.18 0.87 -0.67 0.00 0.00 178.83 180.03 1dgf h LYS 476 N 0.99 0.48 -0.43 1.46 1.79 -0.64 -0.66 116.57 119.55 1dgf h LYS 476 Ca 0.27 -0.06 -0.13 0.00 -2.18 0.00 0.00 60.65 58.55 1dgf h LYS 476 Cb -0.10 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.44 1dgf h LYS 476 CO -0.06 0.41 -0.24 -0.22 -1.08 0.00 0.00 179.45 178.26 1dgf h LYS 477 N 0.42 0.89 -0.34 3.15 3.64 -1.19 -1.24 116.57 121.90 1dgf h LYS 477 Ca 0.12 -0.39 -0.01 0.00 -1.27 0.00 0.00 60.65 59.10 1dgf h LYS 477 Cb 0.08 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1dgf h LYS 477 CO -0.02 1.04 0.16 0.00 -2.27 0.00 0.00 179.45 178.36 1dgf h ALA 478 N 0.95 0.45 -0.46 5.00 0.00 -1.06 -2.37 119.26 121.76 1dgf h ALA 478 Ca 0.10 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1dgf h ALA 478 Cb 0.80 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1dgf h ALA 478 CO 0.07 0.01 0.16 0.28 0.00 0.00 0.00 179.25 179.77 1dgf h VAL 479 N 0.42 1.18 -0.90 0.00 2.07 -0.99 -1.80 116.25 116.24 1dgf h VAL 479 Ca 0.12 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1dgf h VAL 479 Cb 0.13 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 1dgf h VAL 479 CO -0.01 0.23 0.49 0.50 0.02 0.00 0.00 177.57 178.80 1dgf h LYS 480 N 0.66 1.25 -0.25 1.57 3.64 -0.84 0.12 116.57 122.72 1dgf h LYS 480 Ca 0.16 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1dgf h LYS 480 Cb 0.17 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1dgf h LYS 480 CO -0.01 0.91 0.01 -0.91 -2.27 0.00 0.00 179.45 177.18 1dgf h ASN 481 N 1.25 0.43 -0.58 4.20 2.35 -0.86 -2.24 115.58 120.13 1dgf h ASN 481 Ca 0.32 -0.30 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 1dgf h ASN 481 Cb 0.02 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 1dgf h ASN 481 CO -0.05 0.62 0.22 -0.26 -1.65 0.00 0.00 177.43 176.31 1dgf h PHE 482 N 0.22 0.93 -0.53 1.19 0.04 -1.02 -2.36 116.94 115.41 1dgf h PHE 482 Ca 0.07 -0.07 -0.06 0.00 2.80 0.00 0.00 57.97 60.71 1dgf h PHE 482 Cb 0.40 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 1dgf h PHE 482 CO 0.03 0.73 0.07 1.15 -0.60 0.00 0.00 178.31 179.70 1dgf h THR 483 N 0.90 1.24 0.00 -1.55 2.02 -0.86 -1.39 112.91 113.26 1dgf h THR 483 Ca 0.21 -0.92 -0.06 0.00 0.77 0.00 0.00 66.41 66.41 1dgf h THR 483 Cb 0.21 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1dgf h THR 483 CO -0.01 0.33 -0.29 -0.08 0.37 0.00 0.00 175.52 175.84 1dgf h GLU 484 N 0.79 0.00 -0.03 6.66 4.81 -0.89 -2.30 114.58 123.62 1dgf h GLU 484 Ca 0.17 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1dgf h GLU 484 Cb 0.37 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 1dgf h GLU 484 CO 0.01 0.29 -0.05 0.28 -0.73 0.00 0.00 179.01 178.81 1dgf h VAL 485 N 0.00 1.42 -1.64 0.32 2.07 -1.04 -3.47 116.25 113.91 1dgf h VAL 485 Ca -0.00 -1.32 0.09 0.00 0.82 0.00 0.00 66.70 66.29 1dgf h VAL 485 Cb 0.51 2.23 -0.26 0.00 -1.52 0.00 0.00 31.29 32.26 1dgf h VAL 485 CO 0.04 0.35 0.31 -2.28 0.02 0.00 0.00 177.57 176.01 1dgf s HIS 486 N -4.04 -0.68 0.43 1.57 2.46 -0.59 -4.58 115.29 109.85 1dgf s HIS 486 Ca -0.16 1.36 0.16 0.00 0.47 0.00 0.00 55.06 56.89 1dgf s HIS 486 Cb 0.02 0.41 1.06 0.00 -0.13 0.00 0.00 32.58 33.94 1dgf s HIS 486 CO 0.70 -0.33 1.91 -1.00 -2.47 0.00 0.00 174.74 173.54 1dgf h PRO 487 N 6.20 0.40 -0.42 2.88 0.13 -1.75 -1.04 132.00 138.40 1dgf h PRO 487 Ca -0.29 -0.02 -0.13 0.00 -0.87 0.00 0.00 66.00 64.70 1dgf h PRO 487 Cb 1.20 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1dgf h PRO 487 CO 0.19 0.26 -0.24 0.22 -0.23 0.00 0.00 178.00 178.20 1dgf h ASP 488 N 0.41 0.88 0.25 1.44 1.82 -1.91 -0.61 116.42 118.69 1dgf h ASP 488 Ca 0.39 -0.33 -0.01 0.00 -0.39 0.00 0.00 57.03 56.68 1dgf h ASP 488 Cb 0.91 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 40.68 1dgf h ASP 488 CO -0.13 1.08 -0.12 0.22 -1.61 0.00 0.00 179.24 178.68 1dgf h TYR 489 N 0.74 -0.32 -0.39 0.28 -0.00 -1.48 -1.52 116.97 114.28 1dgf h TYR 489 Ca 0.10 -0.01 -0.07 0.00 -0.00 0.00 0.00 58.73 58.75 1dgf h TYR 489 Cb 0.78 0.10 -0.01 0.00 -0.00 0.00 0.00 36.73 37.60 1dgf h TYR 489 CO 0.04 -0.14 -0.02 0.78 -0.00 0.00 0.00 178.16 178.82 1dgf h GLY 490 N -0.41 0.76 1.24 1.82 0.00 -1.36 -2.87 103.07 102.25 1dgf h GLY 490 Ca -0.03 -0.58 -0.09 0.00 0.00 0.00 0.00 47.33 46.62 1dgf h GLY 490 CO 0.06 0.53 -0.06 1.48 0.00 0.00 0.00 176.54 178.55 1dgf h SER 491 N 0.52 0.89 -0.43 0.19 4.64 -1.10 -1.02 113.55 117.24 1dgf h SER 491 Ca 0.11 -0.26 -0.04 0.00 -0.47 0.00 0.00 61.79 61.13 1dgf h SER 491 Cb 0.51 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 1dgf h SER 491 CO 0.02 0.98 0.11 -0.74 -0.87 0.00 0.00 176.83 176.33 1dgf h HIS 492 N 0.82 0.72 -0.51 4.77 6.17 -1.29 -0.62 115.15 125.21 1dgf h HIS 492 Ca 0.14 -0.08 -0.03 0.00 0.71 0.00 0.00 60.37 61.11 1dgf h HIS 492 Cb 0.57 -0.20 -0.02 0.00 2.52 0.00 0.00 27.41 30.28 1dgf h HIS 492 CO 0.03 0.67 0.21 0.82 0.71 0.00 0.00 177.93 180.38 1dgf h ILE 493 N 0.56 1.21 -0.76 6.26 2.04 -1.36 -2.45 117.51 123.00 1dgf h ILE 493 Ca 0.13 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.35 1dgf h ILE 493 Cb 0.31 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 1dgf h ILE 493 CO 0.00 0.24 0.48 -0.61 0.00 0.00 0.00 178.15 178.27 1dgf h GLN 494 N 0.68 1.02 -0.90 2.37 5.75 -0.92 0.29 115.11 123.40 1dgf h GLN 494 Ca 0.17 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 58.58 1dgf h GLN 494 Cb 0.18 -0.22 -0.04 0.00 1.07 0.00 0.00 27.48 28.47 1dgf h GLN 494 CO -0.02 0.70 0.51 0.00 -2.65 0.00 0.00 178.83 177.38 1dgf h ALA 495 N 1.26 1.16 -0.40 3.38 0.00 -0.92 0.66 119.26 124.39 1dgf h ALA 495 Ca 0.28 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 1dgf h ALA 495 Cb -0.07 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 1dgf h ALA 495 CO -0.06 0.65 -0.35 -0.07 0.00 0.00 0.00 179.25 179.42 1dgf h LEU 496 N 1.26 1.00 -0.73 0.00 3.38 -0.95 -2.79 115.31 116.48 1dgf h LEU 496 Ca 0.32 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1dgf h LEU 496 Cb 0.00 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 1dgf h LEU 496 CO -0.05 1.24 0.32 -0.07 0.09 0.00 0.00 178.44 179.97 1dgf h LEU 497 N 0.78 0.98 -0.74 1.67 3.38 -0.44 -1.90 115.31 119.04 1dgf h LEU 497 Ca 0.07 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 57.93 1dgf h LEU 497 Cb 0.94 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.39 1dgf h LEU 497 CO 0.09 0.86 0.46 0.44 0.09 0.00 0.00 178.44 180.37 1dgf h ASP 498 N 1.03 0.74 -0.20 -0.43 3.32 -0.78 0.30 116.42 120.40 1dgf h ASP 498 Ca 0.25 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.30 1dgf h ASP 498 Cb 0.16 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1dgf h ASP 498 CO -0.03 0.50 0.10 0.50 -1.72 0.00 0.00 179.24 178.60 1dgf h LYS 499 N 0.88 0.28 -0.21 3.56 3.64 -1.18 -3.03 116.57 120.51 1dgf h LYS 499 Ca 0.30 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.64 1dgf h LYS 499 Cb 0.06 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1dgf h LYS 499 CO -0.13 0.28 0.10 1.88 -2.27 0.00 0.00 179.45 179.32 1dgf h TYR 500 N 0.21 0.29 0.00 1.91 0.05 -0.76 -3.52 116.97 115.15 1dgf h TYR 500 Ca 0.07 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.84 1dgf h TYR 500 Cb 0.08 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 37.73 1dgf h TYR 500 CO -0.03 0.29 0.00 0.09 -1.05 0.00 0.00 178.16 177.46