#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ynf s ALA 3 N 0.00 3.11 0.15 -2.53 0.00 -1.26 -3.98 121.76 117.25 1ynf s ALA 3 Ca 0.00 0.73 0.07 0.00 0.00 0.00 0.00 51.96 52.76 1ynf s ALA 3 Cb 0.00 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1ynf s ALA 3 CO 0.00 -0.22 -0.16 -1.58 0.00 0.00 0.00 175.76 173.80 1ynf s TRP 4 N -1.60 1.62 -0.20 0.00 0.51 -0.21 -4.21 118.94 114.85 1ynf s TRP 4 Ca 0.57 -0.52 -0.19 0.00 -2.12 0.00 0.00 56.10 53.83 1ynf s TRP 4 Cb -0.23 -0.82 -0.03 0.00 -0.81 0.00 0.00 33.47 31.58 1ynf s TRP 4 CO 0.29 0.25 0.57 -2.00 -0.51 0.00 0.00 176.95 175.55 1ynf s GLU 5 N -2.82 4.19 -0.17 4.98 2.12 -1.26 -0.52 118.70 125.22 1ynf s GLU 5 Ca 0.13 0.50 -0.04 0.00 0.36 0.00 0.00 54.97 55.92 1ynf s GLU 5 Cb -0.05 -3.57 -0.03 0.00 0.26 0.00 0.00 34.13 30.74 1ynf s GLU 5 CO 0.05 -0.20 -0.02 0.08 -0.54 0.00 0.00 175.26 174.62 1ynf s VAL 6 N 1.80 3.92 -0.15 3.70 1.01 -0.18 -4.44 120.40 126.06 1ynf s VAL 6 Ca 0.26 -0.34 -0.20 0.00 0.00 0.00 0.00 61.98 61.70 1ynf s VAL 6 Cb -0.16 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1ynf s VAL 6 CO 0.10 0.47 0.59 0.20 0.00 0.00 0.00 175.10 176.46 1ynf s ASN 7 N 0.55 6.73 -0.30 3.32 0.01 -0.69 -1.11 114.94 123.45 1ynf s ASN 7 Ca -0.02 0.88 -0.06 0.00 -0.71 0.00 0.00 52.86 52.95 1ynf s ASN 7 Cb -0.14 -2.34 0.02 0.00 0.41 0.00 0.00 41.25 39.20 1ynf s ASN 7 CO 0.02 -0.16 0.06 -0.36 -1.51 0.00 0.00 177.10 175.16 1ynf s PHE 8 N 1.31 3.17 0.11 2.20 0.40 -0.39 0.08 117.98 124.87 1ynf s PHE 8 Ca 0.29 -1.20 0.02 0.00 -0.60 0.00 0.00 56.93 55.44 1ynf s PHE 8 Cb -0.16 -2.23 -0.04 0.00 0.51 0.00 0.00 43.02 41.11 1ynf s PHE 8 CO 0.12 -0.64 0.23 -0.51 0.70 0.00 0.00 175.22 175.11 1ynf s ASP 9 N 1.44 6.21 -0.19 1.36 1.11 -0.66 -0.03 116.67 125.93 1ynf s ASP 9 Ca 0.01 0.17 -0.19 0.00 0.18 0.00 0.00 52.55 52.72 1ynf s ASP 9 Cb -0.18 -1.86 -0.03 0.00 1.07 0.00 0.00 42.92 41.93 1ynf s ASP 9 CO 0.01 0.11 0.56 -0.83 1.18 0.00 0.00 175.17 176.20 1ynf s GLY 10 N -2.87 2.12 -0.36 0.21 0.00 -0.70 -0.01 107.32 105.70 1ynf s GLY 10 Ca 0.34 -0.32 -0.29 0.00 0.00 0.00 0.00 44.72 44.45 1ynf s GLY 10 CO 0.27 1.13 1.14 -2.27 0.00 0.00 0.00 173.10 173.37 1ynf s LEU 11 N 1.60 3.84 0.16 0.66 2.96 -0.02 -4.91 118.68 122.97 1ynf s LEU 11 Ca 0.26 0.92 -0.34 0.00 -0.22 0.00 0.00 54.13 54.75 1ynf s LEU 11 Cb -0.16 -3.54 -0.15 0.00 0.50 0.00 0.00 46.19 42.84 1ynf s LEU 11 CO 0.10 -1.02 1.38 0.52 -1.32 0.00 0.00 176.35 176.01 1ynf n VAL 12 N 6.21 0.39 -1.63 1.68 0.31 -1.26 -3.45 118.33 120.58 1ynf n VAL 12 Ca 0.13 -0.10 -0.30 0.00 -0.01 0.00 0.00 64.34 64.06 1ynf n VAL 12 Cb 0.48 -1.16 0.09 0.00 -0.91 0.00 0.00 33.84 32.34 1ynf n VAL 12 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1ynf s GLY 13 N 0.46 1.62 0.55 2.92 0.00 -1.26 -4.73 107.32 106.87 1ynf s GLY 13 Ca 0.77 -0.30 0.33 0.00 0.00 0.00 0.00 44.72 45.52 1ynf s GLY 13 CO 0.46 0.14 2.08 1.41 0.00 0.00 0.00 173.10 177.19 1ynf h LEU 14 N -1.07 0.00 -2.50 0.66 4.07 -1.93 -3.06 115.31 111.48 1ynf h LEU 14 Ca -0.47 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.49 1ynf h LEU 14 Cb 1.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.02 1ynf h LEU 14 CO 0.61 0.07 0.00 0.35 -1.08 0.00 0.00 178.44 178.39 1ynf n THR 15 N -3.33 1.24 -1.71 0.22 -2.24 -1.26 -4.83 114.28 102.37 1ynf n THR 15 Ca -0.01 -0.91 -0.60 0.00 -2.27 0.00 0.00 64.05 60.25 1ynf n THR 15 Cb 0.24 0.20 -0.08 0.00 -2.10 0.00 0.00 70.33 68.59 1ynf n THR 15 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1ynf n HIS 16 N 1.07 1.88 -3.91 4.78 -0.00 -1.16 -4.52 115.22 113.37 1ynf n HIS 16 Ca 0.21 0.74 -0.08 0.00 -0.00 0.00 0.00 57.72 58.59 1ynf n HIS 16 Cb 0.67 -2.37 -0.03 0.00 -0.00 0.00 0.00 29.99 28.26 1ynf n HIS 16 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 1ynf s HIS 17 N 3.07 0.04 -0.19 1.57 -3.43 -1.26 -4.51 115.29 110.57 1ynf s HIS 17 Ca 0.99 -0.48 -0.06 0.00 -0.80 0.00 0.00 55.06 54.71 1ynf s HIS 17 Cb -1.20 0.53 -0.03 0.00 -1.43 0.00 0.00 32.58 30.45 1ynf s HIS 17 CO 0.69 -1.18 0.03 0.71 -2.00 0.00 0.00 174.74 172.99 1ynf s TYR 18 N -3.81 3.14 -0.07 0.38 4.12 -1.26 -4.92 117.35 114.92 1ynf s TYR 18 Ca 0.16 -0.17 0.19 0.00 0.02 0.00 0.00 57.07 57.27 1ynf s TYR 18 Cb -0.04 -2.09 0.40 0.00 -1.52 0.00 0.00 41.96 38.71 1ynf s TYR 18 CO 0.08 -0.04 1.18 0.00 0.02 0.00 0.00 175.55 176.79 1ynf n ALA 19 N 3.90 2.77 -0.28 3.71 0.00 -1.26 -4.64 120.51 124.72 1ynf n ALA 19 Ca -0.17 -2.61 0.00 0.00 0.00 0.00 0.00 53.44 50.67 1ynf n ALA 19 Cb 0.52 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.38 1ynf n ALA 19 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1ynf n HIS 31 N -0.13 0.00 0.03 0.00 -0.00 -1.26 -5.14 115.22 108.72 1ynf n HIS 31 Ca 0.10 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.86 1ynf n HIS 31 Cb 0.96 0.00 0.08 0.00 -0.00 0.00 0.00 29.99 31.03 1ynf n HIS 31 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1ynf n ARG 32 N -1.32 1.98 -1.77 -1.40 5.12 -1.26 -5.04 116.66 112.97 1ynf n ARG 32 Ca 0.00 -1.59 -0.41 0.00 -1.93 0.00 0.00 57.85 53.93 1ynf n ARG 32 Cb 0.18 -1.18 0.01 0.00 -1.16 0.00 0.00 32.46 30.31 1ynf n ARG 32 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1ynf n PHE 33 N 0.30 2.92 0.04 -1.55 3.01 -1.26 -4.90 117.46 116.03 1ynf n PHE 33 Ca 0.07 0.44 0.01 0.00 1.01 0.00 0.00 57.45 58.98 1ynf n PHE 33 Cb 0.32 -2.51 -0.02 0.00 -0.01 0.00 0.00 39.48 37.26 1ynf n PHE 33 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1ynf n GLN 34 N 0.20 2.79 -3.62 -1.08 3.00 -1.26 -4.86 117.38 112.56 1ynf n GLN 34 Ca 0.03 -0.01 -0.38 0.00 -0.01 0.00 0.00 57.00 56.62 1ynf n GLN 34 Cb 0.40 -0.86 -0.11 0.00 0.00 0.00 0.00 30.24 29.67 1ynf n GLN 34 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1ynf s VAL 35 N -1.74 5.07 0.34 5.09 1.01 -1.26 -4.46 120.40 124.44 1ynf s VAL 35 Ca -0.00 0.01 0.07 0.00 0.00 0.00 0.00 61.98 62.06 1ynf s VAL 35 Cb 0.02 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 1ynf s VAL 35 CO 0.09 0.22 0.29 -0.94 0.00 0.00 0.00 175.10 174.76 1ynf s SER 36 N 1.72 5.27 -0.54 3.32 1.04 -0.12 -4.90 113.70 119.49 1ynf s SER 36 Ca 0.07 -0.50 0.04 0.00 0.48 0.00 0.00 55.95 56.03 1ynf s SER 36 Cb -0.16 -0.96 0.15 0.00 0.10 0.00 0.00 66.02 65.15 1ynf s SER 36 CO 0.09 -0.36 0.34 0.21 0.98 0.00 0.00 173.24 174.51 1ynf s ASN 37 N -3.99 3.90 0.17 7.02 3.84 -1.26 -1.38 114.94 123.24 1ynf s ASN 37 Ca 0.41 -3.19 -0.17 0.00 0.21 0.00 0.00 52.86 50.12 1ynf s ASN 37 Cb -0.06 -1.29 0.12 0.00 -0.55 0.00 0.00 41.25 39.47 1ynf s ASN 37 CO 0.26 -0.18 1.66 -0.65 -2.79 0.00 0.00 177.10 175.40 1ynf h PRO 38 N 6.08 -0.01 -0.28 0.43 0.11 -1.79 -0.50 132.00 136.05 1ynf h PRO 38 Ca 0.06 0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.22 1ynf h PRO 38 Cb 0.86 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.92 1ynf h PRO 38 CO 0.59 -0.01 -0.01 -0.09 -0.21 0.00 0.00 178.00 178.28 1ynf h ARG 39 N -0.01 0.07 -0.42 1.05 2.43 -1.66 -1.08 114.38 114.76 1ynf h ARG 39 Ca 0.21 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.31 1ynf h ARG 39 Cb 0.33 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 1ynf h ARG 39 CO -0.45 0.05 -0.01 1.25 -1.51 0.00 0.00 179.97 179.30 1ynf h LEU 40 N 0.07 0.65 -0.47 3.80 5.85 -1.73 -1.50 115.31 121.99 1ynf h LEU 40 Ca 0.13 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1ynf h LEU 40 Cb 0.18 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1ynf h LEU 40 CO -0.23 0.73 0.31 0.00 -0.34 0.00 0.00 178.44 178.91 1ynf h ALA 41 N 1.35 0.60 -0.22 1.25 0.00 -0.34 0.07 119.26 121.96 1ynf h ALA 41 Ca 0.13 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1ynf h ALA 41 Cb 0.41 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1ynf h ALA 41 CO 0.02 0.05 -0.03 0.00 0.00 0.00 0.00 179.25 179.28 1ynf h ALA 42 N 1.17 0.30 -0.70 0.00 0.00 -0.90 -2.70 119.26 116.43 1ynf h ALA 42 Ca 0.17 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1ynf h ALA 42 Cb -0.07 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1ynf h ALA 42 CO -0.04 0.07 0.29 0.87 0.00 0.00 0.00 179.25 180.44 1ynf h LYS 43 N 0.16 1.03 -0.78 0.00 1.57 -1.08 0.18 116.57 117.65 1ynf h LYS 43 Ca 0.06 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 1ynf h LYS 43 Cb 0.46 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 1ynf h LYS 43 CO 0.02 0.83 0.35 1.96 -0.57 0.00 0.00 179.45 182.03 1ynf h GLN 44 N 1.01 1.14 -0.40 3.15 4.20 -0.94 -0.07 115.11 123.19 1ynf h GLN 44 Ca 0.24 -0.18 -0.13 0.00 0.06 0.00 0.00 58.65 58.64 1ynf h GLN 44 Cb 0.18 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 1ynf h GLN 44 CO -0.02 0.90 -0.26 0.78 -0.67 0.00 0.00 178.83 179.55 1ynf h GLY 45 N 1.15 0.97 1.10 3.46 0.00 -1.05 -2.73 103.07 105.97 1ynf h GLY 45 Ca 0.27 -0.92 -0.06 0.00 0.00 0.00 0.00 47.33 46.62 1ynf h GLY 45 CO -0.03 0.83 0.21 1.41 0.00 0.00 0.00 176.54 178.96 1ynf h LEU 46 N 0.71 1.05 -0.47 3.11 3.38 -0.61 -2.87 115.31 119.60 1ynf h LEU 46 Ca 0.08 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.87 1ynf h LEU 46 Cb 0.84 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1ynf h LEU 46 CO 0.07 0.98 0.27 -0.07 0.09 0.00 0.00 178.44 179.79 1ynf h LEU 47 N 1.07 0.44 -1.53 1.67 3.38 -0.91 0.43 115.31 119.86 1ynf h LEU 47 Ca 0.23 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1ynf h LEU 47 Cb 0.32 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ynf h LEU 47 CO -0.00 0.31 0.00 1.17 0.09 0.00 0.00 178.44 180.01 1ynf n LYS 48 N -4.83 0.16 0.00 1.13 4.81 -1.04 -1.12 118.16 117.27 1ynf n LYS 48 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.47 1ynf n LYS 48 Cb 0.08 -1.26 0.00 0.00 0.02 0.00 0.00 35.03 33.87 1ynf n LYS 48 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1ynf n LYS 50 N 0.68 0.00 -0.10 1.64 3.00 0.14 -2.05 118.16 121.47 1ynf n LYS 50 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.25 1ynf n LYS 50 Cb 0.06 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.11 1ynf n LYS 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ynf h ALA 51 N 0.00 0.41 -0.59 3.14 0.00 -1.37 0.26 119.26 121.11 1ynf h ALA 51 Ca 0.00 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1ynf h ALA 51 Cb 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1ynf h ALA 51 CO 0.00 -0.28 0.08 -0.07 0.00 0.00 0.00 179.25 178.98 1ynf h LEU 52 N 0.25 0.94 -0.10 0.00 3.38 -1.67 -0.99 115.31 117.13 1ynf h LEU 52 Ca 0.16 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.87 1ynf h LEU 52 Cb 0.15 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1ynf h LEU 52 CO -0.18 0.97 0.04 0.00 0.09 0.00 0.00 178.44 179.37 1ynf h ALA 53 N 1.01 0.11 -0.62 1.53 0.00 -1.50 -1.27 119.26 118.52 1ynf h ALA 53 Ca 0.18 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1ynf h ALA 53 Cb 0.44 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1ynf h ALA 53 CO 0.01 -0.41 0.41 -0.44 0.00 0.00 0.00 179.25 178.82 1ynf h ASP 54 N 0.10 0.67 0.14 0.00 3.32 -0.29 -0.79 116.42 119.58 1ynf h ASP 54 Ca 0.04 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ynf h ASP 54 Cb 0.01 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.39 1ynf h ASP 54 CO -0.03 0.48 0.00 0.00 -1.72 0.00 0.00 179.24 177.97 1ynf n ALA 55 N -2.45 2.30 0.00 3.45 0.00 -0.40 -4.86 120.51 118.55 1ynf n ALA 55 Ca 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1ynf n ALA 55 Cb 0.08 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.16 1ynf n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ynf n GLY 56 N 0.51 0.80 3.53 0.00 0.00 -0.30 -5.07 105.19 104.66 1ynf n GLY 56 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1ynf n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ynf s PHE 57 N -2.00 3.18 -0.16 1.61 0.40 -0.53 -5.01 117.98 115.46 1ynf s PHE 57 Ca 0.00 -0.03 -0.41 0.00 -0.60 0.00 0.00 56.93 55.88 1ynf s PHE 57 Cb 0.00 -2.88 -0.19 0.00 0.51 0.00 0.00 43.02 40.46 1ynf s PHE 57 CO 0.00 -0.57 1.34 -2.30 0.70 0.00 0.00 175.22 174.38 1ynf n PRO 58 N 5.64 0.31 -4.04 0.24 -0.02 -1.26 -3.73 135.00 132.13 1ynf n PRO 58 Ca -0.06 0.11 -0.13 0.00 -2.02 0.00 0.00 63.50 61.40 1ynf n PRO 58 Cb 0.49 -1.65 -0.13 0.00 -0.02 0.00 0.00 33.50 32.18 1ynf n PRO 58 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1ynf s GLN 59 N 1.30 0.35 0.33 -0.52 2.00 -1.26 -1.70 119.66 120.15 1ynf s GLN 59 Ca 0.95 -0.38 0.02 0.00 -2.00 0.00 0.00 55.36 53.95 1ynf s GLN 59 Cb -1.26 -0.21 -0.01 0.00 0.80 0.00 0.00 33.01 32.32 1ynf s GLN 59 CO 0.63 0.05 0.37 0.00 -0.50 0.00 0.00 175.29 175.84 1ynf s ALA 60 N -0.66 1.24 0.06 1.58 0.00 0.11 -4.85 121.76 119.24 1ynf s ALA 60 Ca -0.05 -1.76 0.02 0.00 0.00 0.00 0.00 51.96 50.18 1ynf s ALA 60 Cb -0.05 1.31 -0.03 0.00 0.00 0.00 0.00 23.12 24.35 1ynf s ALA 60 CO -0.00 -0.72 -0.08 0.54 0.00 0.00 0.00 175.76 175.50 1ynf s VAL 61 N -3.32 0.61 -0.10 0.00 0.11 -0.30 -1.65 120.40 115.75 1ynf s VAL 61 Ca 0.35 -1.32 0.02 0.00 -2.93 0.00 0.00 61.98 58.10 1ynf s VAL 61 Cb 0.01 -0.92 0.02 0.00 -1.53 0.00 0.00 36.38 33.96 1ynf s VAL 61 CO 0.23 -0.51 -0.14 -0.63 -3.33 0.00 0.00 175.10 170.72 1ynf s ILE 62 N -1.98 1.43 0.81 7.04 1.01 0.98 -4.84 121.20 125.65 1ynf s ILE 62 Ca -0.04 -0.60 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 1ynf s ILE 62 Cb -0.06 -1.31 0.08 0.00 0.01 0.00 0.00 42.46 41.18 1ynf s ILE 62 CO -0.01 0.43 1.10 -2.16 0.00 0.00 0.00 174.94 174.30 1ynf s PRO 63 N 1.00 1.91 1.08 2.79 0.04 -1.26 -0.84 135.00 139.73 1ynf s PRO 63 Ca -0.07 1.18 -0.18 0.00 0.04 0.00 0.00 61.00 61.98 1ynf s PRO 63 Cb -0.15 -1.86 0.25 0.00 0.04 0.00 0.00 34.50 32.78 1ynf s PRO 63 CO -0.02 -1.89 1.23 -1.25 0.04 0.00 0.00 177.00 175.12 1ynf s PRO 64 N -4.87 -0.29 0.48 0.56 0.04 -1.22 -4.74 135.00 124.97 1ynf s PRO 64 Ca 0.62 -0.28 0.07 0.00 0.04 0.00 0.00 61.00 61.45 1ynf s PRO 64 Cb -0.18 -1.73 0.01 0.00 0.04 0.00 0.00 34.50 32.64 1ynf s PRO 64 CO 0.57 -3.06 0.38 -1.01 0.04 0.00 0.00 177.00 173.92 1ynf s HIS 65 N -3.50 2.12 -0.33 0.56 3.76 -1.26 -5.04 115.29 111.60 1ynf s HIS 65 Ca 0.73 -0.68 -0.28 0.00 -0.15 0.00 0.00 55.06 54.68 1ynf s HIS 65 Cb -0.06 -2.03 -0.01 0.00 1.11 0.00 0.00 32.58 31.59 1ynf s HIS 65 CO 0.54 -0.30 1.74 -2.00 -0.85 0.00 0.00 174.74 173.88 1ynf s GLU 66 N -4.20 3.38 -0.03 1.40 2.12 -1.26 -4.93 118.70 115.19 1ynf s GLU 66 Ca 0.41 1.38 -0.01 0.00 0.36 0.00 0.00 54.97 57.11 1ynf s GLU 66 Cb -0.02 -4.17 0.03 0.00 0.26 0.00 0.00 34.13 30.23 1ynf s GLU 66 CO 0.25 -1.80 0.06 1.03 -0.54 0.00 0.00 175.26 174.26 1ynf s ARG 67 N 5.53 0.01 0.71 4.30 1.81 -1.26 -3.57 118.95 126.48 1ynf s ARG 67 Ca 0.77 0.20 -0.16 0.00 -1.72 0.00 0.00 55.73 54.82 1ynf s ARG 67 Cb -0.21 -0.17 0.03 0.00 -0.45 0.00 0.00 34.95 34.14 1ynf s ARG 67 CO 0.34 -0.13 1.22 -2.14 -0.68 0.00 0.00 175.30 173.91 1ynf s PRO 68 N 0.84 2.25 -0.86 3.54 0.02 -1.26 -4.84 135.00 134.68 1ynf s PRO 68 Ca -0.07 1.81 -0.14 0.00 0.02 0.00 0.00 61.00 62.62 1ynf s PRO 68 Cb -0.10 -1.84 0.21 0.00 0.02 0.00 0.00 34.50 32.79 1ynf s PRO 68 CO -0.03 -1.77 0.85 0.12 -0.33 0.00 0.00 177.00 175.84 1ynf s PHE 69 N -1.86 3.70 0.31 6.54 5.36 0.34 -4.92 117.98 127.45 1ynf s PHE 69 Ca 0.76 -1.96 -0.01 0.00 -0.96 0.00 0.00 56.93 54.76 1ynf s PHE 69 Cb -0.31 -3.89 0.49 0.00 -0.34 0.00 0.00 43.02 38.98 1ynf s PHE 69 CO 0.44 -1.06 1.98 0.82 -1.46 0.00 0.00 175.22 175.93 1ynf h ILE 70 N 4.86 1.20 -0.97 3.12 1.08 -1.88 -3.12 117.51 121.79 1ynf h ILE 70 Ca 0.12 -0.36 0.22 0.00 -0.39 0.00 0.00 64.86 64.46 1ynf h ILE 70 Cb 1.03 0.05 -0.08 0.00 -3.07 0.00 0.00 36.82 34.75 1ynf h ILE 70 CO 0.82 0.19 0.63 -0.65 -0.69 0.00 0.00 178.15 178.45 1ynf h PRO 71 N 1.05 0.45 0.00 2.37 0.11 -1.99 0.13 132.00 134.12 1ynf h PRO 71 Ca 0.29 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 66.26 1ynf h PRO 71 Cb -0.12 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 30.88 1ynf h PRO 71 CO -0.06 0.30 -0.54 -0.24 -0.21 0.00 0.00 178.00 177.24 1ynf h VAL 72 N 0.46 1.11 -0.27 3.15 3.04 -1.98 -2.35 116.25 119.41 1ynf h VAL 72 Ca 0.53 -2.05 -0.11 0.00 -1.01 0.00 0.00 66.70 64.06 1ynf h VAL 72 Cb 1.25 2.20 -0.01 0.00 -2.01 0.00 0.00 31.29 32.72 1ynf h VAL 72 CO -0.25 0.53 -0.28 -0.07 -1.01 0.00 0.00 177.57 176.49 1ynf h LEU 73 N 0.00 0.56 -0.71 3.16 3.38 -0.88 -1.30 115.31 119.53 1ynf h LEU 73 Ca -0.01 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.64 1ynf h LEU 73 Cb 1.16 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1ynf h LEU 73 CO 0.07 0.82 -0.30 0.03 0.09 0.00 0.00 178.44 179.16 1ynf h ARG 74 N 0.48 0.67 0.00 1.13 3.08 -1.15 -2.05 114.38 116.53 1ynf h ARG 74 Ca 0.06 -0.29 -0.04 0.00 0.07 0.00 0.00 59.98 59.78 1ynf h ARG 74 Cb 0.74 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 1ynf h ARG 74 CO 0.06 0.88 -0.17 0.37 -1.07 0.00 0.00 179.97 180.04 1ynf h GLN 75 N 0.57 0.00 -0.05 0.04 4.15 -0.87 -1.46 115.11 117.49 1ynf h GLN 75 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.49 1ynf h GLN 75 Cb 0.79 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.48 1ynf h GLN 75 CO 0.07 0.17 0.00 1.28 -1.93 0.00 0.00 178.83 178.42 1ynf n LEU 76 N -3.82 0.86 0.00 -2.39 4.77 -0.54 -4.91 117.00 110.97 1ynf n LEU 76 Ca -0.02 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 1ynf n LEU 76 Cb 0.27 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1ynf n LEU 76 CO 0.33 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1ynf n GLY 77 N 1.04 0.64 3.61 -0.72 0.00 -0.55 -5.07 105.19 104.14 1ynf n GLY 77 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1ynf n GLY 77 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ynf s PHE 78 N -2.00 3.26 0.44 1.61 0.40 -1.00 -5.02 117.98 115.68 1ynf s PHE 78 Ca 0.00 0.50 0.07 0.00 -0.60 0.00 0.00 56.93 56.90 1ynf s PHE 78 Cb 0.00 -2.62 -0.02 0.00 0.51 0.00 0.00 43.02 40.89 1ynf s PHE 78 CO 0.00 -0.24 0.30 -1.54 0.70 0.00 0.00 175.22 174.45 1ynf s SER 79 N 1.58 4.71 0.00 1.36 1.04 -1.26 -3.89 113.70 117.24 1ynf s SER 79 Ca 0.17 -0.99 0.00 0.00 0.48 0.00 0.00 55.95 55.62 1ynf s SER 79 Cb -0.16 -0.32 0.00 0.00 0.10 0.00 0.00 66.02 65.64 1ynf s SER 79 CO 0.10 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.22 1ynf n GLY 80 N -1.47 0.34 3.92 7.32 0.00 -1.26 -4.19 105.19 109.85 1ynf n GLY 80 Ca 0.00 -2.25 -0.27 0.00 0.00 0.00 0.00 46.02 43.51 1ynf n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ynf s SER 81 N -4.00 5.11 0.28 1.61 1.04 -1.26 -4.76 113.70 111.72 1ynf s SER 81 Ca 0.00 0.64 0.01 0.00 0.48 0.00 0.00 55.95 57.08 1ynf s SER 81 Cb 0.00 -1.40 0.61 0.00 0.10 0.00 0.00 66.02 65.33 1ynf s SER 81 CO 0.00 -1.42 1.75 0.44 0.98 0.00 0.00 173.24 174.99 1ynf h ASP 82 N -0.50 0.52 -0.40 7.02 3.32 -1.99 0.17 116.42 124.56 1ynf h ASP 82 Ca -0.45 0.11 -0.16 0.00 0.02 0.00 0.00 57.03 56.55 1ynf h ASP 82 Cb 1.29 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.86 1ynf h ASP 82 CO 0.61 0.18 -0.37 -0.33 -1.72 0.00 0.00 179.24 177.61 1ynf h GLU 83 N 0.59 0.95 -0.42 3.56 5.08 -1.99 -1.91 114.58 120.45 1ynf h GLU 83 Ca 0.50 -0.49 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 1ynf h GLU 83 Cb 0.78 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 1ynf h GLU 83 CO -0.40 1.15 -0.17 1.96 -1.00 0.00 0.00 179.01 180.55 1ynf h GLN 84 N 0.78 0.85 -0.22 2.33 4.20 -1.56 -0.29 115.11 121.20 1ynf h GLN 84 Ca 0.07 -0.36 0.02 0.00 0.06 0.00 0.00 58.65 58.44 1ynf h GLN 84 Cb 0.96 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.69 1ynf h GLN 84 CO 0.09 0.99 0.10 0.28 -0.67 0.00 0.00 178.83 179.63 1ynf h VAL 85 N 0.67 0.98 -0.64 -0.54 2.07 -0.71 0.44 116.25 118.51 1ynf h VAL 85 Ca 0.10 -0.07 0.07 0.00 0.82 0.00 0.00 66.70 67.61 1ynf h VAL 85 Cb 0.72 0.74 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 1ynf h VAL 85 CO 0.05 0.04 0.33 0.25 0.02 0.00 0.00 177.57 178.27 1ynf h LEU 86 N 0.22 0.47 -0.27 2.57 5.85 -1.16 0.11 115.31 123.10 1ynf h LEU 86 Ca 0.09 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1ynf h LEU 86 Cb 0.03 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1ynf h LEU 86 CO -0.07 0.30 0.01 -0.08 -0.34 0.00 0.00 178.44 178.26 1ynf h GLU 87 N 0.61 0.46 -0.60 1.25 4.81 -0.34 -0.84 114.58 119.93 1ynf h GLU 87 Ca 0.30 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1ynf h GLU 87 Cb 0.23 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 1ynf h GLU 87 CO -0.21 0.61 0.34 0.87 -0.73 0.00 0.00 179.01 179.90 1ynf h LYS 88 N 0.25 0.83 -0.39 1.92 1.57 0.39 -0.82 116.57 120.33 1ynf h LYS 88 Ca 0.08 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 1ynf h LYS 88 Cb 0.40 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1ynf h LYS 88 CO 0.01 0.62 0.03 0.28 -0.57 0.00 0.00 179.45 179.82 1ynf h VAL 89 N 0.82 1.25 -0.74 0.50 2.07 -0.91 0.52 116.25 119.74 1ynf h VAL 89 Ca 0.21 -0.93 0.04 0.00 0.82 0.00 0.00 66.70 66.85 1ynf h VAL 89 Cb 0.02 1.10 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 1ynf h VAL 89 CO -0.04 0.31 0.46 0.00 0.02 0.00 0.00 177.57 178.33 1ynf h ALA 90 N 0.90 0.99 0.01 1.67 0.00 -0.88 0.35 119.26 122.31 1ynf h ALA 90 Ca 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ynf h ALA 90 Cb 0.42 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ynf h ALA 90 CO 0.01 0.22 -0.01 0.00 0.00 0.00 0.00 179.25 179.47 1ynf h ARG 91 N 0.87 -0.01 0.07 0.00 3.08 -0.91 -3.34 114.38 114.14 1ynf h ARG 91 Ca 0.31 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.24 1ynf h ARG 91 Cb 0.08 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.14 1ynf h ARG 91 CO -0.14 0.75 -0.57 1.96 -1.07 0.00 0.00 179.97 180.90 1ynf h GLN 92 N -0.82 0.15 -1.39 0.04 4.20 0.09 -3.43 115.11 113.95 1ynf h GLN 92 Ca -0.00 -0.25 -0.45 0.00 0.06 0.00 0.00 58.65 58.01 1ynf h GLN 92 Cb 0.77 0.09 -0.32 0.00 0.30 0.00 0.00 27.48 28.33 1ynf h GLN 92 CO 0.00 1.12 -0.93 0.00 -0.67 0.00 0.00 178.83 178.35 1ynf n ALA 93 N -2.73 1.23 0.23 3.87 0.00 0.48 -4.99 120.51 118.59 1ynf n ALA 93 Ca -0.15 -2.79 0.17 0.00 0.00 0.00 0.00 53.44 50.67 1ynf n ALA 93 Cb 0.68 -0.98 0.77 0.00 0.00 0.00 0.00 19.45 19.92 1ynf n ALA 93 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ynf h PRO 94 N 3.79 0.00 0.00 0.00 0.13 -0.57 -2.31 132.00 133.04 1ynf h PRO 94 Ca 0.01 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.12 1ynf h PRO 94 Cb 0.94 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.07 1ynf h PRO 94 CO 0.41 0.00 -0.07 1.12 -0.23 0.00 0.00 178.00 179.23 1ynf h HIS 95 N 0.00 0.00 -0.00 1.56 2.07 -1.93 -2.15 115.15 114.70 1ynf h HIS 95 Ca 0.08 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.49 1ynf h HIS 95 Cb 0.86 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.83 1ynf h HIS 95 CO 0.00 0.07 -0.54 -1.49 -3.07 0.00 0.00 177.93 172.91 1ynf h TRP 96 N 0.00 0.00 -0.50 6.12 4.06 -1.76 -3.21 115.95 120.67 1ynf h TRP 96 Ca -0.00 -0.00 0.10 0.00 2.06 0.00 0.00 58.89 61.05 1ynf h TRP 96 Cb 0.34 -0.00 -0.09 0.00 -1.00 0.00 0.00 29.16 28.41 1ynf h TRP 96 CO 0.00 0.54 -0.05 -0.07 -3.56 0.00 0.00 178.44 175.30 1ynf h LEU 97 N 0.00 -0.32 -0.58 -4.49 3.38 -1.58 -1.50 115.31 110.22 1ynf h LEU 97 Ca -0.01 0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1ynf h LEU 97 Cb 0.95 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 1ynf h LEU 97 CO 0.07 -0.11 0.23 -1.28 0.09 0.00 0.00 178.44 177.44 1ynf h SER 98 N 0.07 0.81 0.67 -0.43 0.87 -1.70 -2.22 113.55 111.61 1ynf h SER 98 Ca 0.25 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1ynf h SER 98 Cb 0.38 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1ynf h SER 98 CO -0.46 0.76 0.00 0.77 -0.53 0.00 0.00 176.83 177.37 1ynf h SER 99 N 0.81 0.00 -0.33 6.23 4.64 -1.36 -2.29 113.55 121.24 1ynf h SER 99 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1ynf h SER 99 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1ynf h SER 99 CO -0.02 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.27 1ynf n VAL 100 N -2.88 1.26 -1.34 0.95 0.24 -0.67 -4.39 118.33 111.49 1ynf n VAL 100 Ca -0.00 -1.18 0.06 0.00 -2.04 0.00 0.00 64.34 61.18 1ynf n VAL 100 Cb 0.22 0.35 0.08 0.00 -1.47 0.00 0.00 33.84 33.02 1ynf n VAL 100 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1ynf n SER 101 N 0.31 1.43 -4.76 -1.34 7.64 -0.86 -0.51 113.62 115.54 1ynf n SER 101 Ca 0.14 -2.59 -0.40 0.00 1.01 0.00 0.00 58.87 57.03 1ynf n SER 101 Cb 0.52 -0.31 -0.04 0.00 -1.01 0.00 0.00 64.21 63.37 1ynf n SER 101 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1ynf s SER 102 N -2.03 7.17 -0.12 6.43 0.15 -1.19 -4.58 113.70 119.52 1ynf s SER 102 Ca 0.18 2.28 0.09 0.00 0.70 0.00 0.00 55.95 59.20 1ynf s SER 102 Cb 0.16 -2.62 0.47 0.00 -1.71 0.00 0.00 66.02 62.32 1ynf s SER 102 CO 0.02 -0.21 1.25 0.00 1.20 0.00 0.00 173.24 175.49 1ynf n ALA 103 N 1.02 3.20 -0.04 5.45 0.00 -1.26 -4.54 120.51 124.34 1ynf n ALA 103 Ca -0.00 -1.08 0.25 0.00 0.00 0.00 0.00 53.44 52.60 1ynf n ALA 103 Cb 0.45 -1.06 0.71 0.00 0.00 0.00 0.00 19.45 19.55 1ynf n ALA 103 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ynf h SER 104 N 2.39 0.00 0.00 0.00 4.64 -1.94 -3.42 113.55 115.22 1ynf h SER 104 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ynf h SER 104 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1ynf h SER 104 CO 0.25 0.00 0.80 -2.65 -0.87 0.00 0.00 176.83 174.37 1ynf n PRO 105 N -3.83 0.00 -1.47 4.77 -0.02 -1.26 -4.73 135.00 128.46 1ynf n PRO 105 Ca 0.13 -0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.24 1ynf n PRO 105 Cb 0.86 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 1ynf n PRO 105 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1ynf n TRP 107 N 4.40 0.00 0.55 6.00 8.01 -1.26 -4.89 117.44 130.25 1ynf n TRP 107 Ca 0.00 0.00 0.06 0.00 -1.31 0.00 0.00 57.50 56.25 1ynf n TRP 107 Cb 0.00 0.00 0.29 0.00 -2.01 0.00 0.00 31.31 29.59 1ynf n TRP 107 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.69 178.01 1ynf n VAL 108 N -0.20 0.63 0.29 -0.99 0.24 -1.11 -1.97 118.33 115.23 1ynf n VAL 108 Ca 0.00 0.16 0.17 0.00 -2.04 0.00 0.00 64.34 62.63 1ynf n VAL 108 Cb 0.00 -0.97 0.89 0.00 -1.47 0.00 0.00 33.84 32.28 1ynf n VAL 108 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ynf h ALA 109 N 2.55 1.15 -0.11 2.33 0.00 -1.50 -0.94 119.26 122.73 1ynf h ALA 109 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ynf h ALA 109 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ynf h ALA 109 CO 0.00 0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.40 1ynf n ASN 110 N -3.36 3.09 -0.18 0.00 4.13 -0.83 -1.00 115.26 117.11 1ynf n ASN 110 Ca -0.02 -1.99 -0.08 0.00 1.68 0.00 0.00 54.58 54.18 1ynf n ASN 110 Cb 0.19 -0.06 0.02 0.00 -1.54 0.00 0.00 39.78 38.39 1ynf n ASN 110 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ynf h ALA 111 N 4.62 0.67 -2.55 5.41 0.00 -1.31 -3.40 119.26 122.70 1ynf h ALA 111 Ca 0.00 -0.12 0.14 0.00 0.00 0.00 0.00 54.91 54.92 1ynf h ALA 111 Cb 0.99 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1ynf h ALA 111 CO 0.00 0.23 0.54 0.00 0.00 0.00 0.00 179.25 180.02 1ynf n ALA 112 N -2.32 -2.50 -2.99 0.00 0.00 -1.26 -1.42 120.51 110.02 1ynf n ALA 112 Ca 0.02 -1.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.14 1ynf n ALA 112 Cb 0.12 0.58 -0.14 0.00 0.00 0.00 0.00 19.45 20.01 1ynf n ALA 112 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ynf s THR 113 N -2.09 3.02 -0.06 0.00 2.01 -0.37 -0.35 115.64 117.80 1ynf s THR 113 Ca 0.21 -0.68 -0.02 0.00 0.31 0.00 0.00 61.69 61.51 1ynf s THR 113 Cb -0.03 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.19 1ynf s THR 113 CO 0.06 0.54 0.03 -0.63 -0.69 0.00 0.00 174.62 173.93 1ynf s ILE 114 N 0.18 4.52 -0.27 1.82 -1.09 -1.26 -1.95 121.20 123.15 1ynf s ILE 114 Ca -0.08 -0.28 -0.00 0.00 -2.23 0.00 0.00 60.65 58.06 1ynf s ILE 114 Cb -0.15 -2.96 0.08 0.00 -1.58 0.00 0.00 42.46 37.85 1ynf s ILE 114 CO 0.05 0.52 0.04 0.00 -1.23 0.00 0.00 174.94 174.32 1ynf s ALA 115 N -1.00 1.68 0.70 9.38 0.00 -0.22 -5.01 121.76 127.28 1ynf s ALA 115 Ca 0.16 -1.49 -0.17 0.00 0.00 0.00 0.00 51.96 50.47 1ynf s ALA 115 Cb -0.12 -1.52 0.02 0.00 0.00 0.00 0.00 23.12 21.50 1ynf s ALA 115 CO 0.06 -1.45 1.26 -2.30 0.00 0.00 0.00 175.76 173.33 1ynf n PRO 116 N 4.78 0.82 0.30 0.00 -0.02 -1.26 -1.85 135.00 137.77 1ynf n PRO 116 Ca -0.05 0.34 0.19 0.00 -2.02 0.00 0.00 63.50 61.96 1ynf n PRO 116 Cb 0.44 -2.50 1.00 0.00 -0.02 0.00 0.00 33.50 32.42 1ynf n PRO 116 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1ynf h SER 117 N 0.07 0.00 0.78 2.55 4.64 -1.83 -0.42 113.55 119.35 1ynf h SER 117 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1ynf h SER 117 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1ynf h SER 117 CO 0.51 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.47 1ynf n ALA 118 N -2.11 1.76 0.43 5.18 0.00 -1.26 -3.06 120.51 121.45 1ynf n ALA 118 Ca -0.02 0.04 0.05 0.00 0.00 0.00 0.00 53.44 53.51 1ynf n ALA 118 Cb 0.21 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.27 1ynf n ALA 118 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ynf n ASP 119 N -2.05 0.91 -4.85 0.00 8.00 -0.17 -4.18 116.55 114.21 1ynf n ASP 119 Ca 0.03 -0.95 -0.34 0.00 0.71 0.00 0.00 54.79 54.23 1ynf n ASP 119 Cb 0.24 0.67 -0.06 0.00 -0.02 0.00 0.00 41.12 41.96 1ynf n ASP 119 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ynf s THR 120 N -1.53 4.81 0.17 -3.53 2.01 -1.17 -2.51 115.64 113.88 1ynf s THR 120 Ca 0.06 0.82 0.20 0.00 0.31 0.00 0.00 61.69 63.08 1ynf s THR 120 Cb 0.08 -3.70 0.17 0.00 0.01 0.00 0.00 72.50 69.05 1ynf s THR 120 CO 0.29 0.08 1.77 -0.07 -0.69 0.00 0.00 174.62 176.01 1ynf h LEU 121 N 3.06 0.00 -3.06 4.42 3.38 -1.58 -3.03 115.31 118.50 1ynf h LEU 121 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1ynf h LEU 121 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1ynf h LEU 121 CO 0.67 0.32 0.00 -0.90 0.09 0.00 0.00 178.44 178.62 1ynf n ASP 122 N -3.51 3.86 -0.35 -0.43 5.68 -1.26 -4.97 116.55 115.56 1ynf n ASP 122 Ca -0.00 -2.40 -0.05 0.00 -0.50 0.00 0.00 54.79 51.84 1ynf n ASP 122 Cb 0.47 -0.44 -0.02 0.00 -1.14 0.00 0.00 41.12 39.99 1ynf n ASP 122 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ynf n GLY 123 N 0.55 0.52 3.84 6.12 0.00 -1.15 -4.99 105.19 110.08 1ynf n GLY 123 Ca 0.20 -0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 1ynf n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ynf s LYS 124 N -2.12 2.66 -0.11 1.61 1.02 -1.26 -4.76 119.74 116.77 1ynf s LYS 124 Ca 0.00 -1.35 -0.24 0.00 0.02 0.00 0.00 55.97 54.40 1ynf s LYS 124 Cb 0.00 -2.43 -0.03 0.00 -0.52 0.00 0.00 37.83 34.85 1ynf s LYS 124 CO 0.00 0.07 0.73 0.08 -0.92 0.00 0.00 175.35 175.31 1ynf s VAL 125 N -2.34 4.99 -0.08 3.17 1.01 -0.33 -3.91 120.40 122.92 1ynf s VAL 125 Ca 0.41 1.47 0.01 0.00 0.00 0.00 0.00 61.98 63.87 1ynf s VAL 125 Cb -0.05 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 1ynf s VAL 125 CO 0.26 0.16 -0.09 -1.00 0.00 0.00 0.00 175.10 174.44 1ynf s HIS 126 N 1.37 2.89 -0.08 5.22 3.76 -0.77 -0.32 115.29 127.35 1ynf s HIS 126 Ca 0.37 -0.09 -0.01 0.00 -0.15 0.00 0.00 55.06 55.17 1ynf s HIS 126 Cb -0.17 -1.73 0.03 0.00 1.11 0.00 0.00 32.58 31.82 1ynf s HIS 126 CO 0.15 0.23 -0.00 -0.51 -0.85 0.00 0.00 174.74 173.76 1ynf s LEU 127 N -0.60 0.69 -0.25 0.89 1.02 -0.28 -1.06 118.68 119.09 1ynf s LEU 127 Ca 0.09 -0.16 -0.05 0.00 0.02 0.00 0.00 54.13 54.03 1ynf s LEU 127 Cb -0.12 -0.49 -0.00 0.00 0.02 0.00 0.00 46.19 45.60 1ynf s LEU 127 CO 0.02 -0.19 0.01 -0.89 0.02 0.00 0.00 176.35 175.32 1ynf s THR 128 N 1.94 3.67 0.33 5.49 2.01 -0.82 -0.36 115.64 127.90 1ynf s THR 128 Ca 0.05 -0.56 -0.29 0.00 0.31 0.00 0.00 61.69 61.20 1ynf s THR 128 Cb -0.13 -2.77 -0.11 0.00 0.01 0.00 0.00 72.50 69.50 1ynf s THR 128 CO -0.06 0.27 1.50 -0.69 -0.69 0.00 0.00 174.62 174.96 1ynf s VAL 129 N 1.49 2.17 0.03 3.82 1.01 -0.82 -1.23 120.40 126.88 1ynf s VAL 129 Ca 0.04 0.16 -0.24 0.00 0.00 0.00 0.00 61.98 61.95 1ynf s VAL 129 Cb -0.16 -3.10 -0.05 0.00 0.00 0.00 0.00 36.38 33.07 1ynf s VAL 129 CO -0.00 0.03 0.72 0.00 0.00 0.00 0.00 175.10 175.85 1ynf s ALA 130 N -0.62 3.40 0.31 5.51 0.00 -0.51 -3.69 121.76 126.16 1ynf s ALA 130 Ca 0.57 0.21 0.13 0.00 0.00 0.00 0.00 51.96 52.87 1ynf s ALA 130 Cb -0.46 -2.92 0.62 0.00 0.00 0.00 0.00 23.12 20.36 1ynf s ALA 130 CO 0.55 0.09 1.75 -2.95 0.00 0.00 0.00 175.76 175.20 1ynf h ASN 131 N 5.67 0.00 -6.46 0.00 7.08 -1.84 -3.41 115.58 116.62 1ynf h ASN 131 Ca -0.44 0.00 -0.50 0.00 -3.08 0.00 0.00 56.30 52.28 1ynf h ASN 131 Cb 1.20 0.00 -0.08 0.00 -2.08 0.00 0.00 38.32 37.36 1ynf h ASN 131 CO 0.71 0.45 -0.82 0.18 -2.08 0.00 0.00 177.43 175.86 1ynf n LEU 132 N -3.89 -2.29 0.21 6.14 4.77 -0.23 -4.33 117.00 117.38 1ynf n LEU 132 Ca -0.01 -0.91 0.06 0.00 -0.03 0.00 0.00 56.01 55.12 1ynf n LEU 132 Cb 0.49 -2.35 0.55 0.00 -2.33 0.00 0.00 43.42 39.78 1ynf n LEU 132 CO 0.39 0.40 1.01 -1.13 -1.33 0.00 0.00 177.39 176.73 1ynf h ASN 133 N -1.82 0.07 -0.67 -1.43 -0.73 -1.91 -2.98 115.58 106.11 1ynf h ASN 133 Ca -0.60 -0.01 0.07 0.00 1.87 0.00 0.00 56.30 57.64 1ynf h ASN 133 Cb 1.38 -0.02 -0.06 0.00 0.27 0.00 0.00 38.32 39.89 1ynf h ASN 133 CO 0.68 0.13 0.35 -1.13 -0.37 0.00 0.00 177.43 177.09 1ynf h ASN 134 N 0.08 0.49 -3.57 1.15 -0.73 -1.89 -3.40 115.58 107.71 1ynf h ASN 134 Ca 0.02 0.04 -0.65 0.00 1.87 0.00 0.00 56.30 57.58 1ynf h ASN 134 Cb 0.13 -0.05 -0.24 0.00 0.27 0.00 0.00 38.32 38.43 1ynf h ASN 134 CO 0.01 0.31 -0.65 -0.54 -0.37 0.00 0.00 177.43 176.18 1ynf s LYS 135 N -6.08 3.55 0.19 6.67 -0.14 -1.23 -5.01 119.74 117.68 1ynf s LYS 135 Ca -0.13 -0.54 -0.18 0.00 -1.36 0.00 0.00 55.97 53.77 1ynf s LYS 135 Cb 0.17 -3.24 0.17 0.00 -1.68 0.00 0.00 37.83 33.24 1ynf s LYS 135 CO 0.76 -0.21 1.61 0.35 -0.76 0.00 0.00 175.35 177.10 1ynf h PHE 136 N 8.20 -0.62 0.00 3.18 3.04 -1.85 0.60 116.94 129.49 1ynf h PHE 136 Ca -0.39 0.06 -0.01 0.00 3.98 0.00 0.00 57.97 61.62 1ynf h PHE 136 Cb 1.17 0.36 -0.00 0.00 2.56 0.00 0.00 35.95 40.03 1ynf h PHE 136 CO 0.64 -0.33 -0.03 1.12 -2.02 0.00 0.00 178.31 177.70 1ynf h HIS 137 N -0.10 0.00 0.00 0.41 2.07 -1.94 -1.99 115.15 113.60 1ynf h HIS 137 Ca 0.25 0.00 -0.13 0.00 -2.85 0.00 0.00 60.37 57.64 1ynf h HIS 137 Cb 0.50 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.46 1ynf h HIS 137 CO -0.55 0.03 -1.21 0.00 -3.07 0.00 0.00 177.93 173.13 1ynf h ARG 138 N 0.00 0.00 0.00 5.12 3.08 -1.47 -3.32 114.38 117.79 1ynf h ARG 138 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ynf h ARG 138 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1ynf h ARG 138 CO 0.00 0.27 0.00 0.66 -1.07 0.00 0.00 179.97 179.84 1ynf h SER 139 N 0.00 0.00 1.14 7.04 4.64 -0.15 -1.66 113.55 124.55 1ynf h SER 139 Ca -0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1ynf h SER 139 Cb 1.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.55 1ynf h SER 139 CO 0.04 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.93 1ynf h LEU 140 N 0.00 0.00 -0.14 5.97 3.38 -1.63 -3.33 115.31 119.56 1ynf h LEU 140 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1ynf h LEU 140 Cb 0.26 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1ynf h LEU 140 CO 0.00 0.00 -0.09 -0.33 0.09 0.00 0.00 178.44 178.11 1ynf h GLU 141 N 0.00 0.31 -0.63 1.13 5.08 -1.51 -3.39 114.58 115.57 1ynf h GLU 141 Ca 0.00 -0.14 0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1ynf h GLU 141 Cb 0.57 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.73 1ynf h GLU 141 CO 0.00 0.65 -0.34 0.00 -1.00 0.00 0.00 179.01 178.32 1ynf n ALA 142 N -2.38 -0.33 -0.14 3.43 0.00 -1.25 -0.79 120.51 119.05 1ynf n ALA 142 Ca -0.06 0.56 -0.04 0.00 0.00 0.00 0.00 53.44 53.90 1ynf n ALA 142 Cb 0.31 -0.13 0.05 0.00 0.00 0.00 0.00 19.45 19.68 1ynf n ALA 142 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1ynf h PRO 143 N 0.00 0.24 -0.18 0.00 0.11 -1.87 0.96 132.00 131.27 1ynf h PRO 143 Ca 0.13 -0.01 -0.18 0.00 0.11 0.00 0.00 66.00 66.04 1ynf h PRO 143 Cb 0.29 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.34 1ynf h PRO 143 CO -0.60 0.16 -0.63 0.28 -0.21 0.00 0.00 178.00 177.00 1ynf h VAL 144 N 0.25 1.31 -0.50 3.15 2.07 -1.49 -2.71 116.25 118.33 1ynf h VAL 144 Ca 0.22 -1.89 -0.03 0.00 0.82 0.00 0.00 66.70 65.82 1ynf h VAL 144 Cb 0.27 1.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1ynf h VAL 144 CO -0.27 0.59 0.20 0.74 0.02 0.00 0.00 177.57 178.84 1ynf h THR 145 N 0.47 1.18 -0.35 2.57 2.02 -0.48 -1.07 112.91 117.26 1ynf h THR 145 Ca -0.01 -0.58 -0.03 0.00 0.77 0.00 0.00 66.41 66.56 1ynf h THR 145 Cb 1.21 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 1ynf h THR 145 CO 0.12 0.23 0.09 -0.08 0.37 0.00 0.00 175.52 176.25 1ynf h GLU 146 N 0.70 0.55 -0.69 6.66 4.81 -0.62 -1.34 114.58 124.65 1ynf h GLU 146 Ca 0.17 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1ynf h GLU 146 Cb 0.14 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 1ynf h GLU 146 CO -0.02 0.60 0.43 0.77 -0.73 0.00 0.00 179.01 180.06 1ynf h SER 147 N 0.41 0.81 -0.40 1.04 0.02 -1.11 -1.31 113.55 113.01 1ynf h SER 147 Ca 0.11 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1ynf h SER 147 Cb 0.29 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1ynf h SER 147 CO 0.00 0.62 0.13 -0.07 -1.14 0.00 0.00 176.83 176.37 1ynf h LEU 148 N 0.94 0.57 -0.93 5.07 3.38 -1.04 -1.55 115.31 121.74 1ynf h LEU 148 Ca 0.25 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 1ynf h LEU 148 Cb -0.06 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1ynf h LEU 148 CO -0.05 0.62 0.14 -0.07 0.09 0.00 0.00 178.44 179.17 1ynf h LEU 149 N 0.50 0.86 -1.27 1.67 3.38 -1.00 -0.85 115.31 118.61 1ynf h LEU 149 Ca 0.13 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1ynf h LEU 149 Cb 0.24 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1ynf h LEU 149 CO -0.01 0.84 -0.25 0.11 0.09 0.00 0.00 178.44 179.23 1ynf h LYS 150 N 0.88 0.00 0.00 1.13 1.57 -1.04 0.40 116.57 119.52 1ynf h LYS 150 Ca 0.19 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.91 1ynf h LYS 150 Cb 0.32 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1ynf h LYS 150 CO 0.00 0.25 -0.74 0.00 -0.57 0.00 0.00 179.45 178.39 1ynf h ALA 151 N 1.75 0.69 0.05 3.86 0.00 -0.62 -3.05 119.26 121.94 1ynf h ALA 151 Ca -0.00 -0.30 -0.33 0.00 0.00 0.00 0.00 54.91 54.28 1ynf h ALA 151 Cb 0.68 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1ynf h ALA 151 CO 0.03 0.35 -1.82 -0.89 0.00 0.00 0.00 179.25 176.92 1ynf n ILE 152 N -2.95 1.64 -2.95 0.00 5.41 -0.38 -4.37 119.36 115.75 1ynf n ILE 152 Ca -0.01 -0.38 -0.37 0.00 1.00 0.00 0.00 62.75 62.99 1ynf n ILE 152 Cb 0.65 -1.84 -0.01 0.00 -0.71 0.00 0.00 39.64 37.74 1ynf n ILE 152 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1ynf n PHE 153 N -3.90 2.89 0.09 1.39 3.01 0.14 -1.56 117.46 119.52 1ynf n PHE 153 Ca -0.36 -3.03 -0.04 0.00 1.01 0.00 0.00 57.45 55.03 1ynf n PHE 153 Cb 0.89 -1.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.35 1ynf n PHE 153 CO 0.00 0.00 0.00 -0.97 1.01 0.00 0.00 176.76 176.80 1ynf h ASN 154 N 4.50 0.00 -2.11 4.37 -0.00 -1.73 -3.43 115.58 117.18 1ynf h ASN 154 Ca 0.30 0.00 -0.51 0.00 -0.00 0.00 0.00 56.30 56.08 1ynf h ASN 154 Cb 0.51 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 38.81 1ynf h ASN 154 CO 1.13 0.83 1.37 -0.62 -0.00 0.00 0.00 177.43 180.15 1ynf s ASP 155 N -6.75 5.31 0.15 1.15 -1.08 -1.26 -4.85 116.67 109.34 1ynf s ASP 155 Ca 0.00 0.70 0.18 0.00 -0.52 0.00 0.00 52.55 52.91 1ynf s ASP 155 Cb 0.11 -2.52 0.79 0.00 -1.46 0.00 0.00 42.92 39.84 1ynf s ASP 155 CO 0.79 -2.27 1.56 -0.62 0.52 0.00 0.00 175.17 175.15 1ynf n GLU 156 N 8.96 0.10 0.22 4.34 1.02 -1.26 -0.60 120.64 133.43 1ynf n GLU 156 Ca 0.23 0.39 0.12 0.00 -0.02 0.00 0.00 57.16 57.89 1ynf n GLU 156 Cb 0.51 -1.72 0.20 0.00 -0.02 0.00 0.00 31.44 30.41 1ynf n GLU 156 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1ynf h GLU 157 N 0.00 0.00 0.00 3.49 5.08 -1.99 -3.35 114.58 117.82 1ynf h GLU 157 Ca 0.00 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.17 1ynf h GLU 157 Cb 0.26 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 1ynf h GLU 157 CO 0.00 0.00 -1.71 1.63 -1.00 0.00 0.00 179.01 177.94 1ynf n LYS 158 N -3.10 1.80 -4.73 2.33 4.76 -0.73 -4.91 118.16 113.58 1ynf n LYS 158 Ca 0.04 0.02 -0.26 0.00 -2.87 0.00 0.00 58.31 55.24 1ynf n LYS 158 Cb 0.52 -1.26 -0.14 0.00 -1.84 0.00 0.00 35.03 32.31 1ynf n LYS 158 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1ynf s PHE 159 N -2.25 1.79 -0.23 2.13 0.40 0.23 -1.18 117.98 118.87 1ynf s PHE 159 Ca -0.08 -0.36 -0.01 0.00 -0.60 0.00 0.00 56.93 55.88 1ynf s PHE 159 Cb 0.03 -1.09 0.07 0.00 0.51 0.00 0.00 43.02 42.54 1ynf s PHE 159 CO 0.38 0.06 0.00 -1.12 0.70 0.00 0.00 175.22 175.24 1ynf s SER 160 N -0.98 3.56 -0.24 1.36 0.01 0.56 -4.26 113.70 113.72 1ynf s SER 160 Ca 0.07 -1.14 -0.12 0.00 1.31 0.00 0.00 55.95 56.06 1ynf s SER 160 Cb -0.08 -0.94 -0.05 0.00 0.21 0.00 0.00 66.02 65.16 1ynf s SER 160 CO 0.01 -0.29 0.25 -0.69 0.41 0.00 0.00 173.24 172.93 1ynf s VAL 161 N 1.58 5.29 -0.03 3.43 1.01 -1.26 -1.13 120.40 129.29 1ynf s VAL 161 Ca -0.01 0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.33 1ynf s VAL 161 Cb -0.18 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1ynf s VAL 161 CO -0.09 0.29 0.01 -1.00 0.00 0.00 0.00 175.10 174.30 1ynf s HIS 162 N 1.34 3.13 0.72 5.22 3.76 0.51 -4.98 115.29 125.00 1ynf s HIS 162 Ca 0.11 0.14 -0.13 0.00 -0.15 0.00 0.00 55.06 55.03 1ynf s HIS 162 Cb -0.14 -1.72 0.03 0.00 1.11 0.00 0.00 32.58 31.86 1ynf s HIS 162 CO 0.07 0.48 1.11 -1.12 -0.85 0.00 0.00 174.74 174.43 1ynf s SER 163 N -1.37 4.72 0.71 1.40 0.01 -1.26 -1.93 113.70 115.97 1ynf s SER 163 Ca 0.18 1.97 -0.16 0.00 1.31 0.00 0.00 55.95 59.26 1ynf s SER 163 Cb -0.12 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.60 1ynf s SER 163 CO 0.08 -1.90 1.21 0.00 0.41 0.00 0.00 173.24 173.05 1ynf s ALA 164 N -2.53 2.18 0.85 1.44 0.00 -1.24 -4.54 121.76 117.92 1ynf s ALA 164 Ca 0.65 0.91 -0.10 0.00 0.00 0.00 0.00 51.96 53.42 1ynf s ALA 164 Cb -0.20 -3.47 0.10 0.00 0.00 0.00 0.00 23.12 19.55 1ynf s ALA 164 CO 0.48 -1.78 1.12 -0.51 0.00 0.00 0.00 175.76 175.07 1ynf s LEU 165 N -4.99 2.93 0.34 0.00 1.02 -1.26 -4.92 118.68 111.81 1ynf s LEU 165 Ca 0.75 2.02 -0.26 0.00 0.02 0.00 0.00 54.13 56.66 1ynf s LEU 165 Cb -0.30 -4.55 -0.13 0.00 0.02 0.00 0.00 46.19 41.24 1ynf s LEU 165 CO 0.44 -2.60 0.89 -2.65 0.02 0.00 0.00 176.35 172.45 1ynf n PRO 166 N -3.90 1.12 -2.69 1.29 -0.02 -1.26 -4.69 135.00 124.85 1ynf n PRO 166 Ca 0.11 0.40 -0.43 0.00 -2.02 0.00 0.00 63.50 61.55 1ynf n PRO 166 Cb 0.52 -1.78 -0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1ynf n PRO 166 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1ynf s GLN 167 N -1.65 4.01 0.01 -0.52 -1.52 -1.26 -4.72 119.66 114.02 1ynf s GLN 167 Ca 0.61 -2.16 -0.06 0.00 -1.95 0.00 0.00 55.36 51.79 1ynf s GLN 167 Cb -0.66 -5.39 -0.00 0.00 -0.22 0.00 0.00 33.01 26.73 1ynf s GLN 167 CO 0.59 -2.11 0.12 0.14 -0.25 0.00 0.00 175.29 173.77 1ynf s VAL 168 N 3.44 0.10 0.47 1.09 -7.23 -1.26 -5.05 120.40 111.96 1ynf s VAL 168 Ca 0.50 -0.82 0.18 0.00 -1.81 0.00 0.00 61.98 60.04 1ynf s VAL 168 Cb 0.02 -0.55 0.35 0.00 0.56 0.00 0.00 36.38 36.76 1ynf s VAL 168 CO 0.05 -0.45 1.99 0.00 -0.31 0.00 0.00 175.10 176.38 1ynf h ALA 169 N 4.11 2.20 0.00 1.32 0.00 -1.93 -0.80 119.26 124.16 1ynf h ALA 169 Ca -0.31 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1ynf h ALA 169 Cb 1.19 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ynf h ALA 169 CO 0.43 -0.34 -0.04 1.25 0.00 0.00 0.00 179.25 180.55 1ynf h LEU 170 N 0.24 0.00 -3.38 0.00 5.85 -1.96 -2.77 115.31 113.29 1ynf h LEU 170 Ca 0.27 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.71 1ynf h LEU 170 Cb 0.72 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 41.54 1ynf h LEU 170 CO -0.05 0.04 -0.59 0.18 -0.34 0.00 0.00 178.44 177.67 1ynf n LEU 171 N -4.14 3.91 -4.69 2.25 4.77 -0.32 -4.40 117.00 114.39 1ynf n LEU 171 Ca -0.03 -4.29 -0.44 0.00 -0.03 0.00 0.00 56.01 51.22 1ynf n LEU 171 Cb 0.12 -0.46 -0.04 0.00 -2.33 0.00 0.00 43.42 40.72 1ynf n LEU 171 CO 0.31 1.72 1.42 0.61 -1.33 0.00 0.00 177.39 180.12 1ynf n GLY 172 N -0.93 1.53 2.88 -0.72 0.00 -1.05 -4.73 105.19 102.17 1ynf n GLY 172 Ca 0.32 0.72 -0.22 0.00 0.00 0.00 0.00 46.02 46.85 1ynf n GLY 172 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ynf s ASP 173 N 2.50 1.32 -0.02 1.61 2.15 -1.24 -1.97 116.67 121.02 1ynf s ASP 173 Ca 0.83 -0.16 0.11 0.00 0.43 0.00 0.00 52.55 53.76 1ynf s ASP 173 Cb -0.56 -0.53 0.33 0.00 -0.30 0.00 0.00 42.92 41.86 1ynf s ASP 173 CO 0.39 -0.08 1.27 -0.62 -0.17 0.00 0.00 175.17 175.96 1ynf n GLU 174 N 4.38 2.89 0.00 4.34 -0.58 -1.26 -1.06 120.64 129.34 1ynf n GLU 174 Ca -0.19 -2.14 0.00 0.00 -0.42 0.00 0.00 57.16 54.41 1ynf n GLU 174 Cb 0.51 -1.34 0.00 0.00 -0.57 0.00 0.00 31.44 30.04 1ynf n GLU 174 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ynf n GLY 175 N 0.35 0.37 0.45 0.62 0.00 -1.26 -3.89 105.19 101.83 1ynf n GLY 175 Ca 0.13 -0.84 0.27 0.00 0.00 0.00 0.00 46.02 45.57 1ynf n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ynf h ALA 176 N -0.54 2.71 -0.16 4.61 0.00 -0.25 -1.26 119.26 124.37 1ynf h ALA 176 Ca 0.00 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.94 1ynf h ALA 176 Cb 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1ynf h ALA 176 CO 0.00 -0.97 0.41 0.00 0.00 0.00 0.00 179.25 178.69 1ynf h ALA 177 N 1.57 1.66 -0.24 0.00 0.00 -1.18 0.52 119.26 121.59 1ynf h ALA 177 Ca 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1ynf h ALA 177 Cb 1.59 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1ynf h ALA 177 CO -0.04 -0.50 0.00 0.09 0.00 0.00 0.00 179.25 178.80 1ynf n ASN 178 N -3.17 2.97 -4.79 0.00 3.02 -0.48 -1.61 115.26 111.20 1ynf n ASN 178 Ca 0.02 -2.34 -0.23 0.00 -0.03 0.00 0.00 54.58 51.99 1ynf n ASN 178 Cb 0.51 -0.29 -0.05 0.00 -0.61 0.00 0.00 39.78 39.34 1ynf n ASN 178 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1ynf s HIS 179 N -1.61 3.07 0.00 3.10 2.46 0.18 -1.15 115.29 121.33 1ynf s HIS 179 Ca 0.25 -0.10 -0.17 0.00 0.47 0.00 0.00 55.06 55.51 1ynf s HIS 179 Cb 0.17 -1.40 0.03 0.00 -0.13 0.00 0.00 32.58 31.24 1ynf s HIS 179 CO 0.10 0.53 0.36 -0.80 -2.47 0.00 0.00 174.74 172.46 1ynf s ASN 180 N -3.62 -0.23 -0.09 9.88 0.01 -0.53 -4.92 114.94 115.43 1ynf s ASN 180 Ca 0.32 0.08 -0.03 0.00 -0.71 0.00 0.00 52.86 52.52 1ynf s ASN 180 Cb -0.08 0.36 0.05 0.00 0.41 0.00 0.00 41.25 41.98 1ynf s ASN 180 CO 0.24 -0.53 0.11 -0.60 -1.51 0.00 0.00 177.10 174.81 1ynf s ARG 181 N -1.71 -0.00 0.03 -0.60 3.52 -1.26 -1.13 118.95 117.79 1ynf s ARG 181 Ca -0.11 0.33 0.07 0.00 -0.13 0.00 0.00 55.73 55.89 1ynf s ARG 181 Cb -0.03 -0.75 -0.03 0.00 -1.56 0.00 0.00 34.95 32.58 1ynf s ARG 181 CO 0.02 -0.41 -0.18 -0.51 -0.81 0.00 0.00 175.30 173.41 1ynf s LEU 182 N 2.21 2.60 0.00 -0.88 1.43 -1.26 -4.10 118.68 118.68 1ynf s LEU 182 Ca 0.04 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1ynf s LEU 182 Cb -0.13 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.57 1ynf s LEU 182 CO -0.06 0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.40 1ynf n GLY 183 N 1.67 -1.54 0.00 -3.19 0.00 0.98 -4.57 105.19 98.54 1ynf n GLY 183 Ca -0.16 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1ynf n GLY 183 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ynf n GLY 184 N -0.13 0.61 3.79 -0.02 0.00 -1.26 -2.37 105.19 105.81 1ynf n GLY 184 Ca 0.00 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1ynf n GLY 184 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ynf s HIS 185 N 0.00 3.36 0.27 1.61 3.76 -1.26 -4.62 115.29 118.41 1ynf s HIS 185 Ca 0.00 1.67 -0.00 0.00 -0.15 0.00 0.00 55.06 56.58 1ynf s HIS 185 Cb 0.00 -3.03 0.62 0.00 1.11 0.00 0.00 32.58 31.29 1ynf s HIS 185 CO 0.00 -0.34 1.67 1.88 -0.85 0.00 0.00 174.74 177.09 1ynf h TYR 186 N 2.51 0.37 0.00 1.40 0.99 -1.91 -0.77 116.97 119.56 1ynf h TYR 186 Ca -0.48 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.30 1ynf h TYR 186 Cb 1.20 -0.03 0.00 0.00 1.00 0.00 0.00 36.73 38.90 1ynf h TYR 186 CO 0.59 -0.14 0.00 0.41 -0.00 0.00 0.00 178.16 179.02 1ynf n GLY 187 N -1.37 -1.15 3.89 3.88 0.00 -1.26 -4.77 105.19 104.41 1ynf n GLY 187 Ca 0.19 0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 1ynf n GLY 187 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ynf s GLU 188 N -3.22 3.67 0.16 1.61 2.02 -0.30 -4.71 118.70 117.93 1ynf s GLU 188 Ca 0.05 0.34 -0.34 0.00 0.02 0.00 0.00 54.97 55.04 1ynf s GLU 188 Cb 0.09 -2.39 -0.14 0.00 0.10 0.00 0.00 34.13 31.79 1ynf s GLU 188 CO 0.33 -0.11 1.61 -2.30 0.02 0.00 0.00 175.26 174.82 1ynf n PRO 189 N -1.71 2.23 0.00 0.39 -0.02 -1.26 -4.88 135.00 129.75 1ynf n PRO 189 Ca 0.01 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1ynf n PRO 189 Cb 0.54 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 1ynf n PRO 189 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ynf n GLY 190 N 3.53 1.36 3.64 -1.23 0.00 -1.26 -4.76 105.19 106.47 1ynf n GLY 190 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 1ynf n GLY 190 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ynf s GLN 192 N 3.08 0.62 -0.25 1.61 -0.21 0.64 -4.80 119.66 120.35 1ynf s GLN 192 Ca 0.00 1.04 0.01 0.00 0.02 0.00 0.00 55.36 56.42 1ynf s GLN 192 Cb 0.00 0.15 0.04 0.00 1.00 0.00 0.00 33.01 34.20 1ynf s GLN 192 CO 0.00 -0.12 -0.09 -1.17 -2.12 0.00 0.00 175.29 171.79 1ynf s LEU 193 N 1.41 3.29 -0.27 2.90 2.96 -0.29 -0.36 118.68 128.33 1ynf s LEU 193 Ca -0.08 -1.14 -0.12 0.00 -0.22 0.00 0.00 54.13 52.57 1ynf s LEU 193 Cb -0.05 -1.60 -0.05 0.00 0.50 0.00 0.00 46.19 45.00 1ynf s LEU 193 CO -0.17 -0.16 0.22 -0.36 -1.32 0.00 0.00 176.35 174.57 1ynf s PHE 194 N 1.21 3.25 -0.16 5.38 0.40 0.40 -1.45 117.98 127.01 1ynf s PHE 194 Ca -0.04 0.21 -0.05 0.00 -0.60 0.00 0.00 56.93 56.45 1ynf s PHE 194 Cb -0.18 -2.39 -0.03 0.00 0.51 0.00 0.00 43.02 40.92 1ynf s PHE 194 CO -0.05 -0.12 0.01 0.08 0.70 0.00 0.00 175.22 175.84 1ynf s VAL 195 N 1.65 4.34 0.26 -0.44 1.01 -0.30 -0.82 120.40 126.10 1ynf s VAL 195 Ca 0.09 -0.20 0.06 0.00 0.00 0.00 0.00 61.98 61.93 1ynf s VAL 195 Cb -0.15 -2.92 -0.06 0.00 0.00 0.00 0.00 36.38 33.25 1ynf s VAL 195 CO 0.09 0.49 -0.06 -0.72 0.00 0.00 0.00 175.10 174.90 1ynf s TYR 196 N 0.20 1.88 -0.07 5.22 -0.85 -0.80 -4.80 117.35 118.13 1ynf s TYR 196 Ca 0.01 -0.70 0.17 0.00 -0.52 0.00 0.00 57.07 56.03 1ynf s TYR 196 Cb -0.13 -1.05 -0.25 0.00 0.38 0.00 0.00 41.96 40.91 1ynf s TYR 196 CO 0.02 0.26 0.28 0.41 -1.52 0.00 0.00 175.55 174.99 1ynf n GLY 197 N -0.54 -0.82 3.35 5.49 0.00 -0.09 -0.08 105.19 112.50 1ynf n GLY 197 Ca -0.06 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.48 1ynf n GLY 197 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ynf s ARG 198 N -2.95 1.13 -0.03 1.61 1.70 -0.95 -4.46 118.95 114.99 1ynf s ARG 198 Ca -0.07 -0.72 -0.16 0.00 -0.47 0.00 0.00 55.73 54.31 1ynf s ARG 198 Cb 0.09 0.48 0.03 0.00 -0.57 0.00 0.00 34.95 34.99 1ynf s ARG 198 CO 0.72 -0.45 0.35 -1.83 -1.08 0.00 0.00 175.30 173.02 1ynf s GLU 199 N -3.81 0.68 0.33 3.89 -1.05 -1.26 -0.57 118.70 116.91 1ynf s GLU 199 Ca 0.04 -0.06 -0.29 0.00 -0.15 0.00 0.00 54.97 54.51 1ynf s GLU 199 Cb 0.01 0.31 -0.11 0.00 -0.44 0.00 0.00 34.13 33.90 1ynf s GLU 199 CO -0.11 -0.18 1.45 -1.21 0.95 0.00 0.00 175.26 176.16 1ynf s GLU 200 N -1.12 4.21 0.00 -4.83 0.41 -1.26 -2.33 118.70 113.77 1ynf s GLU 200 Ca -0.12 2.43 0.00 0.00 -0.41 0.00 0.00 54.97 56.87 1ynf s GLU 200 Cb -0.04 -3.03 0.00 0.00 -1.78 0.00 0.00 34.13 29.28 1ynf s GLU 200 CO 0.04 -0.43 0.00 0.41 -0.49 0.00 0.00 175.26 174.79 1ynf n GLY 201 N 1.13 3.03 3.55 -1.39 0.00 -1.26 -4.98 105.19 105.26 1ynf n GLY 201 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1ynf n GLY 201 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ynf s ASN 202 N -0.53 6.42 0.21 1.61 2.47 -0.98 -4.90 114.94 119.23 1ynf s ASN 202 Ca 0.00 -0.06 0.20 0.00 0.42 0.00 0.00 52.86 53.42 1ynf s ASN 202 Cb 0.00 -2.37 0.89 0.00 -1.45 0.00 0.00 41.25 38.32 1ynf s ASN 202 CO 0.00 -0.83 1.61 -0.90 -3.72 0.00 0.00 177.10 173.26 1ynf n ASP 203 N 6.52 0.49 -4.56 -4.21 5.68 -1.26 -4.55 116.55 114.66 1ynf n ASP 203 Ca 0.01 0.65 -0.43 0.00 -0.50 0.00 0.00 54.79 54.52 1ynf n ASP 203 Cb 0.48 -0.74 -0.03 0.00 -1.14 0.00 0.00 41.12 39.69 1ynf n ASP 203 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1ynf s THR 204 N -3.29 4.31 0.02 2.12 2.01 -1.26 -4.97 115.64 114.57 1ynf s THR 204 Ca 0.03 0.69 -0.28 0.00 0.31 0.00 0.00 61.69 62.44 1ynf s THR 204 Cb 0.08 -4.55 0.10 0.00 0.01 0.00 0.00 72.50 68.13 1ynf s THR 204 CO 0.30 -1.06 0.84 0.00 -0.69 0.00 0.00 174.62 174.01 1ynf s ARG 205 N 4.17 0.89 0.50 4.92 1.70 -1.26 -4.76 118.95 125.11 1ynf s ARG 205 Ca 0.38 -0.31 -0.21 0.00 -0.47 0.00 0.00 55.73 55.11 1ynf s ARG 205 Cb -0.10 0.41 -0.10 0.00 -0.57 0.00 0.00 34.95 34.60 1ynf s ARG 205 CO 0.25 -0.39 0.73 -2.30 -1.08 0.00 0.00 175.30 172.51 1ynf n PRO 206 N -0.23 0.81 0.00 3.89 -0.02 -1.26 -4.94 135.00 133.25 1ynf n PRO 206 Ca -0.10 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 1ynf n PRO 206 Cb 0.62 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 1ynf n PRO 206 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1ynf n SER 207 N 0.51 1.12 0.00 2.55 7.64 -1.26 -4.77 113.62 119.40 1ynf n SER 207 Ca 0.11 -1.31 0.00 0.00 1.01 0.00 0.00 58.87 58.69 1ynf n SER 207 Cb 0.43 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.63 1ynf n SER 207 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1ynf n ARG 208 N -0.15 1.09 -3.87 1.43 0.00 -1.26 -4.98 116.66 108.91 1ynf n ARG 208 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.55 1ynf n ARG 208 Cb 0.14 -0.78 -0.15 0.00 0.00 0.00 0.00 32.46 31.67 1ynf n ARG 208 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1ynf s TYR 209 N -1.55 2.56 0.33 -0.14 4.12 -1.26 -5.07 117.35 116.34 1ynf s TYR 209 Ca 0.00 -2.19 -0.26 0.00 0.02 0.00 0.00 57.07 54.64 1ynf s TYR 209 Cb 0.00 -2.13 -0.14 0.00 -1.52 0.00 0.00 41.96 38.18 1ynf s TYR 209 CO 0.00 -0.88 0.74 -0.35 0.02 0.00 0.00 175.55 175.08 1ynf n PRO 210 N 4.60 0.80 -2.59 -1.71 -0.04 -1.26 -4.71 135.00 130.10 1ynf n PRO 210 Ca -0.02 0.28 -0.43 0.00 -0.04 0.00 0.00 63.50 63.30 1ynf n PRO 210 Cb 0.42 -1.57 -0.02 0.00 -0.04 0.00 0.00 33.50 32.29 1ynf n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ynf s ALA 211 N -1.22 3.57 -0.17 0.55 0.00 -1.26 -4.92 121.76 118.30 1ynf s ALA 211 Ca 0.62 0.37 0.19 0.00 0.00 0.00 0.00 51.96 53.14 1ynf s ALA 211 Cb -0.69 -3.52 0.33 0.00 0.00 0.00 0.00 23.12 19.23 1ynf s ALA 211 CO 0.58 -0.89 1.57 0.00 0.00 0.00 0.00 175.76 177.02 1ynf h ARG 212 N 7.49 0.00 -5.18 0.00 3.08 -1.90 -3.44 114.38 114.43 1ynf h ARG 212 Ca -0.27 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.15 1ynf h ARG 212 Cb 1.11 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.95 1ynf h ARG 212 CO 0.92 0.31 -0.63 -1.14 -1.07 0.00 0.00 179.97 178.36 1ynf s GLN 213 N -3.17 3.72 0.12 0.04 2.00 -1.26 -3.61 119.66 117.50 1ynf s GLN 213 Ca 0.04 -0.47 0.06 0.00 -2.00 0.00 0.00 55.36 52.98 1ynf s GLN 213 Cb 0.07 -3.10 -0.04 0.00 0.80 0.00 0.00 33.01 30.74 1ynf s GLN 213 CO 0.70 0.11 0.00 0.95 -0.50 0.00 0.00 175.29 176.55 1ynf s THR 214 N 0.77 3.95 0.27 -0.34 -4.23 -0.83 -0.92 115.64 114.31 1ynf s THR 214 Ca 0.01 -1.11 -0.02 0.00 -1.18 0.00 0.00 61.69 59.39 1ynf s THR 214 Cb -0.14 -2.91 0.17 0.00 1.34 0.00 0.00 72.50 70.95 1ynf s THR 214 CO 0.02 0.05 1.83 -0.09 -0.54 0.00 0.00 174.62 175.90 1ynf h ARG 215 N 3.20 0.90 -0.99 3.99 2.43 -1.17 -2.16 114.38 120.58 1ynf h ARG 215 Ca -0.48 -0.17 0.08 0.00 -0.81 0.00 0.00 59.98 58.61 1ynf h ARG 215 Cb 1.18 -0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 30.51 1ynf h ARG 215 CO 0.59 0.77 0.63 0.93 -1.51 0.00 0.00 179.97 181.39 1ynf h GLU 216 N 0.88 1.06 -0.15 0.20 3.07 -1.82 0.41 114.58 118.23 1ynf h GLU 216 Ca 0.20 -0.06 -0.05 0.00 -0.50 0.00 0.00 59.36 58.94 1ynf h GLU 216 Cb 0.24 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1ynf h GLU 216 CO -0.01 0.70 -0.10 0.00 -1.40 0.00 0.00 179.01 178.20 1ynf h ALA 217 N 1.48 0.22 -0.55 3.43 0.00 -1.62 -2.49 119.26 119.74 1ynf h ALA 217 Ca 0.45 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1ynf h ALA 217 Cb 0.28 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 1ynf h ALA 217 CO -0.21 0.06 0.24 0.77 0.00 0.00 0.00 179.25 180.11 1ynf h SER 218 N -0.00 0.31 -0.18 0.00 0.02 -0.78 -0.59 113.55 112.32 1ynf h SER 218 Ca 0.03 0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 60.97 1ynf h SER 218 Cb 0.60 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 1ynf h SER 218 CO 0.03 0.20 -0.06 -0.33 -1.14 0.00 0.00 176.83 175.53 1ynf h GLU 219 N 0.46 0.50 -0.35 3.45 5.08 -0.94 -1.24 114.58 121.53 1ynf h GLU 219 Ca 0.26 -0.12 -0.15 0.00 -1.00 0.00 0.00 59.36 58.35 1ynf h GLU 219 Cb 0.23 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1ynf h GLU 219 CO -0.22 0.58 -0.35 0.00 -1.00 0.00 0.00 179.01 178.02 1ynf h ALA 220 N 1.46 0.52 -0.65 3.43 0.00 -0.84 -2.05 119.26 121.13 1ynf h ALA 220 Ca 0.10 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1ynf h ALA 220 Cb 0.41 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1ynf h ALA 220 CO 0.02 0.59 0.10 0.28 0.00 0.00 0.00 179.25 180.25 1ynf h VAL 221 N 0.66 1.26 -0.95 0.00 2.07 -0.90 0.59 116.25 118.97 1ynf h VAL 221 Ca 0.06 -1.03 0.06 0.00 0.82 0.00 0.00 66.70 66.61 1ynf h VAL 221 Cb 0.94 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.31 1ynf h VAL 221 CO 0.09 0.38 0.61 0.00 0.02 0.00 0.00 177.57 178.67 1ynf h ALA 222 N 1.04 1.31 -0.01 1.67 0.00 -1.05 0.12 119.26 122.35 1ynf h ALA 222 Ca 0.20 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ynf h ALA 222 Cb 0.44 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1ynf h ALA 222 CO 0.01 0.40 -0.00 0.00 0.00 0.00 0.00 179.25 179.66 1ynf h ARG 223 N 1.12 0.03 -1.00 0.00 3.08 -0.82 -2.48 114.38 114.30 1ynf h ARG 223 Ca 0.41 -0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.54 1ynf h ARG 223 Cb 0.15 -0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.12 1ynf h ARG 223 CO -0.17 0.41 0.64 -0.07 -1.07 0.00 0.00 179.97 179.71 1ynf h LEU 224 N -0.36 0.99 -0.32 3.04 3.38 -0.35 -1.24 115.31 120.45 1ynf h LEU 224 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1ynf h LEU 224 Cb 0.40 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1ynf h LEU 224 CO 0.00 0.59 0.00 0.59 0.09 0.00 0.00 178.44 179.71 1ynf n ASN 225 N -4.55 0.43 -4.06 -0.43 3.02 0.38 -4.89 115.26 105.17 1ynf n ASN 225 Ca 0.17 -2.01 -0.32 0.00 -0.03 0.00 0.00 54.58 52.39 1ynf n ASN 225 Cb 0.26 -0.09 -0.01 0.00 -0.61 0.00 0.00 39.78 39.33 1ynf n ASN 225 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ynf n GLN 226 N -0.28 -3.98 -2.54 3.52 1.13 -0.47 -4.76 117.38 110.00 1ynf n GLN 226 Ca 0.02 0.46 -0.42 0.00 -1.94 0.00 0.00 57.00 55.12 1ynf n GLN 226 Cb 0.08 -5.11 -0.03 0.00 0.11 0.00 0.00 30.24 25.29 1ynf n GLN 226 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1ynf s VAL 227 N -3.44 4.32 0.08 5.09 1.01 -0.94 -1.53 120.40 124.99 1ynf s VAL 227 Ca 0.54 1.71 -0.31 0.00 0.00 0.00 0.00 61.98 63.92 1ynf s VAL 227 Cb -0.29 -4.09 -0.10 0.00 0.00 0.00 0.00 36.38 31.90 1ynf s VAL 227 CO 0.89 0.15 1.91 -3.20 0.00 0.00 0.00 175.10 174.85 1ynf n ASN 228 N 3.71 4.11 -0.39 3.32 2.85 -1.04 -4.84 115.26 122.98 1ynf n ASN 228 Ca 0.07 0.95 0.35 0.00 -0.11 0.00 0.00 54.58 55.84 1ynf n ASN 228 Cb 0.48 -1.54 0.70 0.00 1.24 0.00 0.00 39.78 40.66 1ynf n ASN 228 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ynf h PRO 229 N 9.54 0.09 -0.00 1.20 0.11 -1.94 0.35 132.00 141.35 1ynf h PRO 229 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ynf h PRO 229 Cb 1.23 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ynf h PRO 229 CO 0.94 0.06 -0.18 1.04 -0.21 0.00 0.00 178.00 179.66 1ynf n GLN 230 N -4.31 0.36 -0.79 1.05 3.00 -1.26 -3.65 117.38 111.78 1ynf n GLN 230 Ca 0.29 -0.13 -0.03 0.00 -0.01 0.00 0.00 57.00 57.12 1ynf n GLN 230 Cb 1.29 -1.50 0.23 0.00 0.00 0.00 0.00 30.24 30.26 1ynf n GLN 230 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1ynf n GLN 231 N -1.21 2.47 -4.04 -1.09 6.02 0.12 -4.97 117.38 114.68 1ynf n GLN 231 Ca 0.10 -3.06 -0.14 0.00 -0.01 0.00 0.00 57.00 53.90 1ynf n GLN 231 Cb 0.31 -1.93 -0.14 0.00 1.02 0.00 0.00 30.24 29.50 1ynf n GLN 231 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1ynf s VAL 232 N -3.10 0.26 -0.03 5.09 0.11 -1.23 -0.26 120.40 121.25 1ynf s VAL 232 Ca 0.47 -0.25 0.01 0.00 -2.93 0.00 0.00 61.98 59.28 1ynf s VAL 232 Cb 0.40 -0.25 0.02 0.00 -1.53 0.00 0.00 36.38 35.02 1ynf s VAL 232 CO 0.06 0.01 -0.02 -0.63 -3.33 0.00 0.00 175.10 171.18 1ynf s ILE 233 N -0.24 0.29 -0.21 7.04 1.01 0.52 -4.95 121.20 124.67 1ynf s ILE 233 Ca -0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.56 1ynf s ILE 233 Cb -0.02 -0.34 -0.03 0.00 0.01 0.00 0.00 42.46 42.08 1ynf s ILE 233 CO -0.00 0.15 0.03 -0.36 0.00 0.00 0.00 174.94 174.76 1ynf s PHE 234 N 0.71 3.09 0.01 3.97 0.40 -1.26 -0.45 117.98 124.44 1ynf s PHE 234 Ca -0.08 -0.34 0.05 0.00 -0.60 0.00 0.00 56.93 55.97 1ynf s PHE 234 Cb -0.11 -2.12 -0.02 0.00 0.51 0.00 0.00 43.02 41.28 1ynf s PHE 234 CO -0.01 -0.19 -0.15 0.00 0.70 0.00 0.00 175.22 175.57 1ynf s ALA 235 N 1.02 1.29 0.01 5.36 0.00 0.00 -4.97 121.76 124.48 1ynf s ALA 235 Ca 0.03 -0.75 -0.20 0.00 0.00 0.00 0.00 51.96 51.04 1ynf s ALA 235 Cb -0.14 -0.28 -0.06 0.00 0.00 0.00 0.00 23.12 22.64 1ynf s ALA 235 CO 0.02 0.29 0.58 -1.14 0.00 0.00 0.00 175.76 175.52 1ynf s GLN 236 N -0.66 4.28 0.55 0.00 0.74 -1.26 -1.91 119.66 121.39 1ynf s GLN 236 Ca 0.05 0.72 -0.19 0.00 0.05 0.00 0.00 55.36 55.99 1ynf s GLN 236 Cb -0.07 -3.32 -0.05 0.00 1.10 0.00 0.00 33.01 30.67 1ynf s GLN 236 CO 0.00 0.44 1.12 -1.14 -0.55 0.00 0.00 175.29 175.16 1ynf s GLN 237 N -0.42 3.33 -0.06 1.67 2.00 0.89 -1.83 119.66 125.24 1ynf s GLN 237 Ca 0.30 1.57 -0.30 0.00 -2.00 0.00 0.00 55.36 54.93 1ynf s GLN 237 Cb -0.18 -2.01 -0.05 0.00 0.80 0.00 0.00 33.01 31.57 1ynf s GLN 237 CO 0.17 -0.86 1.61 1.21 -0.50 0.00 0.00 175.29 176.92 1ynf s ASN 238 N -1.88 6.70 0.52 6.67 2.47 -0.55 -4.27 114.94 124.61 1ynf s ASN 238 Ca 0.72 2.18 0.17 0.00 0.42 0.00 0.00 52.86 56.35 1ynf s ASN 238 Cb -0.23 -2.54 1.29 0.00 -1.45 0.00 0.00 41.25 38.32 1ynf s ASN 238 CO 0.28 -0.90 2.13 1.55 -3.72 0.00 0.00 177.10 176.44 1ynf h PRO 239 N 9.32 0.00 0.00 0.43 0.13 -1.91 -2.25 132.00 137.72 1ynf h PRO 239 Ca -0.38 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.64 1ynf h PRO 239 Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1ynf h PRO 239 CO 0.95 0.00 -0.51 -0.44 -0.23 0.00 0.00 178.00 177.77 1ynf h ASP 240 N 0.00 0.00 0.72 1.44 3.32 -1.93 -2.60 116.42 117.36 1ynf h ASP 240 Ca 0.03 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.88 1ynf h ASP 240 Cb 0.11 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1ynf h ASP 240 CO -0.00 0.51 -0.93 1.62 -1.72 0.00 0.00 179.24 178.72 1ynf h VAL 241 N 0.00 1.56 -0.41 -1.35 3.04 -1.67 -3.17 116.25 114.25 1ynf h VAL 241 Ca -0.01 -2.85 -0.05 0.00 -1.01 0.00 0.00 66.70 62.78 1ynf h VAL 241 Cb 0.94 2.60 -0.02 0.00 -2.01 0.00 0.00 31.29 32.80 1ynf h VAL 241 CO 0.07 0.82 0.05 0.40 -1.01 0.00 0.00 177.57 177.90 1ynf h ILE 242 N 0.06 1.25 0.00 3.17 2.04 -1.35 -1.75 117.51 120.93 1ynf h ILE 242 Ca -0.04 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 64.91 1ynf h ILE 242 Cb 1.59 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 38.71 1ynf h ILE 242 CO 0.13 0.31 0.00 0.47 0.00 0.00 0.00 178.15 179.07 1ynf n ASP 243 N -4.49 0.00 -0.87 1.72 8.00 -1.00 -1.74 116.55 118.17 1ynf n ASP 243 Ca -0.00 0.46 0.11 0.00 0.71 0.00 0.00 54.79 56.06 1ynf n ASP 243 Cb 0.25 -0.47 0.09 0.00 -0.02 0.00 0.00 41.12 40.97 1ynf n ASP 243 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ynf n GLN 244 N -1.47 2.03 0.00 -1.24 6.02 -0.69 -4.81 117.38 117.21 1ynf n GLN 244 Ca 0.02 -1.80 0.00 0.00 -0.01 0.00 0.00 57.00 55.21 1ynf n GLN 244 Cb 0.09 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 29.93 1ynf n GLN 244 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ynf n GLY 245 N 1.23 0.88 3.49 1.08 0.00 -0.71 -4.91 105.19 106.25 1ynf n GLY 245 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1ynf n GLY 245 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ynf s VAL 246 N -1.59 4.66 -0.98 1.61 1.01 -0.97 -4.80 120.40 119.33 1ynf s VAL 246 Ca 0.00 -1.97 0.28 0.00 0.00 0.00 0.00 61.98 60.30 1ynf s VAL 246 Cb 0.00 -4.94 0.21 0.00 0.00 0.00 0.00 36.38 31.65 1ynf s VAL 246 CO 0.00 -1.69 1.84 2.22 0.00 0.00 0.00 175.10 177.47 1ynf n PHE 247 N 6.77 0.05 -3.87 5.22 1.16 -1.26 -4.18 117.46 121.35 1ynf n PHE 247 Ca 0.34 0.01 -0.10 0.00 -1.87 0.00 0.00 57.45 55.83 1ynf n PHE 247 Cb 0.46 -0.49 -0.09 0.00 -1.61 0.00 0.00 39.48 37.75 1ynf n PHE 247 CO 0.00 0.00 0.00 -1.01 -1.87 0.00 0.00 176.76 173.88 1ynf s HIS 248 N -3.01 0.08 0.48 2.97 3.76 -1.26 -4.69 115.29 113.63 1ynf s HIS 248 Ca 0.13 -0.28 0.14 0.00 -0.15 0.00 0.00 55.06 54.90 1ynf s HIS 248 Cb 0.18 -0.06 1.14 0.00 1.11 0.00 0.00 32.58 34.95 1ynf s HIS 248 CO 0.56 -0.37 2.11 -0.97 -0.85 0.00 0.00 174.74 175.22 1ynf h ASN 249 N 3.76 0.12 0.00 1.40 -1.24 -1.87 -2.64 115.58 115.11 1ynf h ASN 249 Ca -0.32 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.69 1ynf h ASN 249 Cb 1.19 -0.03 0.00 0.00 0.73 0.00 0.00 38.32 40.21 1ynf h ASN 249 CO 0.46 0.11 0.00 -0.90 -1.29 0.00 0.00 177.43 175.81 1ynf n ASP 250 N -4.50 0.54 -0.04 1.15 5.75 -0.63 -1.19 116.55 117.62 1ynf n ASP 250 Ca -0.01 -1.34 0.01 0.00 -0.01 0.00 0.00 54.79 53.44 1ynf n ASP 250 Cb 0.10 -0.27 -0.00 0.00 -1.03 0.00 0.00 41.12 39.92 1ynf n ASP 250 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1ynf n VAL 251 N 0.03 0.00 -0.19 2.12 0.31 -1.00 -3.06 118.33 116.56 1ynf n VAL 251 Ca 0.00 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 1ynf n VAL 251 Cb 0.13 1.02 0.00 0.00 -0.91 0.00 0.00 33.84 34.09 1ynf n VAL 251 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ynf n ILE 252 N -0.56 0.00 -3.55 2.52 0.13 -0.60 -4.39 119.36 112.90 1ynf n ILE 252 Ca 0.01 -0.14 -0.13 0.00 -1.10 0.00 0.00 62.75 61.39 1ynf n ILE 252 Cb 0.05 1.19 -0.05 0.00 -0.84 0.00 0.00 39.64 39.98 1ynf n ILE 252 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1ynf s ALA 253 N -0.20 -1.87 -0.11 1.51 0.00 -0.33 -2.02 121.76 118.74 1ynf s ALA 253 Ca 0.00 1.47 -0.12 0.00 0.00 0.00 0.00 51.96 53.32 1ynf s ALA 253 Cb 0.00 -0.42 0.03 0.00 0.00 0.00 0.00 23.12 22.73 1ynf s ALA 253 CO 0.00 -0.34 0.32 0.54 0.00 0.00 0.00 175.76 176.27 1ynf s VAL 254 N -1.21 0.01 0.32 0.00 0.11 0.20 -3.99 120.40 115.84 1ynf s VAL 254 Ca -0.05 -0.06 0.10 0.00 -2.93 0.00 0.00 61.98 59.04 1ynf s VAL 254 Cb -0.00 -0.47 -0.05 0.00 -1.53 0.00 0.00 36.38 34.32 1ynf s VAL 254 CO 0.04 -0.03 -0.05 -0.94 -3.33 0.00 0.00 175.10 170.78 1ynf s SER 255 N -0.02 4.00 -0.30 3.54 1.04 -1.26 -0.71 113.70 119.99 1ynf s SER 255 Ca -0.02 -1.02 -0.16 0.00 0.48 0.00 0.00 55.95 55.24 1ynf s SER 255 Cb -0.03 -0.48 0.18 0.00 0.10 0.00 0.00 66.02 65.79 1ynf s SER 255 CO 0.01 -0.16 1.09 0.21 0.98 0.00 0.00 173.24 175.37 1ynf s ASN 256 N -3.65 -0.40 1.95 7.02 2.47 -0.20 -4.78 114.94 117.35 1ynf s ASN 256 Ca 0.33 0.47 0.00 0.00 0.42 0.00 0.00 52.86 54.08 1ynf s ASN 256 Cb -0.01 1.43 0.00 0.00 -1.45 0.00 0.00 41.25 41.22 1ynf s ASN 256 CO 0.18 -0.08 0.00 0.54 -3.72 0.00 0.00 177.10 174.02 1ynf n ARG 257 N 4.97 0.00 0.00 0.43 5.12 -1.26 -1.30 116.66 124.63 1ynf n ARG 257 Ca -0.08 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 55.97 1ynf n ARG 257 Cb 0.54 0.00 0.32 0.00 -1.16 0.00 0.00 32.46 32.16 1ynf n ARG 257 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ynf n GLN 258 N 13.66 1.93 -4.10 5.56 0.00 -1.00 -0.01 117.38 133.42 1ynf n GLN 258 Ca 0.00 -1.39 -0.36 0.00 0.00 0.00 0.00 57.00 55.25 1ynf n GLN 258 Cb 0.00 -1.47 -0.08 0.00 0.00 0.00 0.00 30.24 28.69 1ynf n GLN 258 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1ynf s VAL 259 N -2.02 4.93 -0.29 -0.39 1.01 -0.42 -4.31 120.40 118.91 1ynf s VAL 259 Ca 0.33 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.31 1ynf s VAL 259 Cb 0.20 -3.13 0.09 0.00 0.00 0.00 0.00 36.38 33.54 1ynf s VAL 259 CO 0.33 0.60 0.03 -0.22 0.00 0.00 0.00 175.10 175.84 1ynf s LEU 260 N -0.81 3.10 -0.45 3.92 2.96 -1.26 -1.03 118.68 125.10 1ynf s LEU 260 Ca 0.13 -1.63 -0.21 0.00 -0.22 0.00 0.00 54.13 52.20 1ynf s LEU 260 Cb -0.12 -1.19 0.03 0.00 0.50 0.00 0.00 46.19 45.41 1ynf s LEU 260 CO 0.03 -0.35 0.67 0.12 -1.32 0.00 0.00 176.35 175.50 1ynf s PHE 261 N 1.33 3.05 0.13 5.38 5.36 0.11 -1.40 117.98 131.94 1ynf s PHE 261 Ca 0.05 -0.07 -0.05 0.00 -0.96 0.00 0.00 56.93 55.90 1ynf s PHE 261 Cb -0.18 -3.42 -0.02 0.00 -0.34 0.00 0.00 43.02 39.05 1ynf s PHE 261 CO -0.13 -0.91 0.15 0.00 -1.46 0.00 0.00 175.22 172.86 1ynf s HIS 263 N -3.98 3.41 0.49 0.00 2.46 -0.86 -0.70 115.29 116.11 1ynf s HIS 263 Ca 0.17 1.22 0.23 0.00 0.47 0.00 0.00 55.06 57.15 1ynf s HIS 263 Cb 0.06 -2.56 1.40 0.00 -0.13 0.00 0.00 32.58 31.35 1ynf s HIS 263 CO -0.02 -0.04 2.11 -0.56 -2.47 0.00 0.00 174.74 173.76 1ynf h GLN 264 N 1.75 0.00 -0.65 2.88 3.07 -1.65 -2.11 115.11 118.39 1ynf h GLN 264 Ca -0.48 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.25 1ynf h GLN 264 Cb 1.18 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.73 1ynf h GLN 264 CO 0.64 0.09 0.02 1.04 0.09 0.00 0.00 178.83 180.71 1ynf n GLN 265 N -4.01 4.30 0.03 0.06 6.02 -1.26 -4.60 117.38 117.92 1ynf n GLN 265 Ca -0.02 -2.71 -0.13 0.00 -0.01 0.00 0.00 57.00 54.13 1ynf n GLN 265 Cb 0.18 -2.16 -0.09 0.00 1.02 0.00 0.00 30.24 29.19 1ynf n GLN 265 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ynf h ALA 266 N 3.65 -0.10 -3.66 -1.58 0.00 -1.70 -3.42 119.26 112.45 1ynf h ALA 266 Ca 0.02 -0.21 -0.67 0.00 0.00 0.00 0.00 54.91 54.05 1ynf h ALA 266 Cb 1.80 0.04 -0.17 0.00 0.00 0.00 0.00 17.79 19.46 1ynf h ALA 266 CO 0.44 -0.34 -0.76 -0.06 0.00 0.00 0.00 179.25 178.53 1ynf s PHE 267 N -4.45 2.68 0.13 0.00 0.40 -1.26 -1.48 117.98 113.99 1ynf s PHE 267 Ca -0.15 -0.19 -0.29 0.00 -0.60 0.00 0.00 56.93 55.70 1ynf s PHE 267 Cb 0.02 -1.43 -0.07 0.00 0.51 0.00 0.00 43.02 42.05 1ynf s PHE 267 CO 0.63 0.39 1.58 0.00 0.70 0.00 0.00 175.22 178.52 1ynf h ALA 268 N 3.84 -0.63 -1.78 5.36 0.00 -1.54 -2.89 119.26 121.62 1ynf h ALA 268 Ca -0.49 -0.03 -0.64 0.00 0.00 0.00 0.00 54.91 53.75 1ynf h ALA 268 Cb 1.17 0.76 -0.38 0.00 0.00 0.00 0.00 17.79 19.34 1ynf h ALA 268 CO 0.50 -0.94 -0.24 0.54 0.00 0.00 0.00 179.25 179.12 1ynf n ARG 269 N -5.44 3.60 -0.22 0.00 1.74 -1.26 -4.91 116.66 110.17 1ynf n ARG 269 Ca -0.05 -4.60 -0.06 0.00 -0.77 0.00 0.00 57.85 52.37 1ynf n ARG 269 Cb 0.36 -2.28 -0.01 0.00 -1.02 0.00 0.00 32.46 29.52 1ynf n ARG 269 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 1ynf h GLN 270 N 3.06 -0.17 -0.53 5.56 4.15 -1.88 -1.15 115.11 124.15 1ynf h GLN 270 Ca 0.29 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.82 1ynf h GLN 270 Cb 0.54 0.04 -0.10 0.00 0.21 0.00 0.00 27.48 28.17 1ynf h GLN 270 CO 0.95 -0.11 -0.12 1.03 -1.93 0.00 0.00 178.83 178.64 1ynf h SER 271 N -0.17 -0.47 -0.67 -0.69 0.87 -1.91 0.03 113.55 110.53 1ynf h SER 271 Ca 0.22 0.16 -0.08 0.00 -1.23 0.00 0.00 61.79 60.86 1ynf h SER 271 Cb 0.56 0.32 -0.03 0.00 -0.44 0.00 0.00 62.40 62.81 1ynf h SER 271 CO -0.71 -0.17 0.10 -0.61 -0.53 0.00 0.00 176.83 174.92 1ynf h GLN 272 N 0.01 1.12 0.16 2.24 4.15 -1.77 -2.22 115.11 118.80 1ynf h GLN 272 Ca 0.26 -0.31 -0.01 0.00 0.77 0.00 0.00 58.65 59.36 1ynf h GLN 272 Cb 0.39 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.95 1ynf h GLN 272 CO -0.54 1.03 -0.08 1.25 -1.93 0.00 0.00 178.83 178.56 1ynf h LEU 273 N 1.05 -0.18 -0.79 -2.39 5.85 -0.05 -1.65 115.31 117.15 1ynf h LEU 273 Ca 0.20 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1ynf h LEU 273 Cb 0.45 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1ynf h LEU 273 CO 0.01 -0.05 0.44 -0.07 -0.34 0.00 0.00 178.44 178.44 1ynf h LEU 274 N -0.30 0.98 -0.83 2.25 3.38 -1.01 -0.75 115.31 119.03 1ynf h LEU 274 Ca -0.02 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1ynf h LEU 274 Cb 0.24 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1ynf h LEU 274 CO 0.04 0.79 0.50 0.00 0.09 0.00 0.00 178.44 179.85 1ynf h ALA 275 N 1.23 1.06 -0.67 1.53 0.00 -1.31 0.05 119.26 121.15 1ynf h ALA 275 Ca 0.28 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1ynf h ALA 275 Cb 0.02 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1ynf h ALA 275 CO -0.05 0.53 0.13 -0.97 0.00 0.00 0.00 179.25 178.89 1ynf h ASN 276 N 1.14 1.05 -0.61 0.00 -0.73 -0.65 -1.69 115.58 114.10 1ynf h ASN 276 Ca 0.30 -0.25 -0.07 0.00 1.87 0.00 0.00 56.30 58.15 1ynf h ASN 276 Cb -0.04 -0.28 -0.03 0.00 0.27 0.00 0.00 38.32 38.25 1ynf h ASN 276 CO -0.06 1.03 0.11 -0.07 -0.37 0.00 0.00 177.43 178.08 1ynf h LEU 277 N 1.02 0.97 -1.15 0.34 4.07 -0.61 -1.39 115.31 118.57 1ynf h LEU 277 Ca 0.21 -0.22 -0.00 0.00 0.08 0.00 0.00 57.88 57.95 1ynf h LEU 277 Cb 0.42 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 41.86 1ynf h LEU 277 CO 0.01 0.96 0.48 0.03 -1.08 0.00 0.00 178.44 178.84 1ynf h ARG 278 N 0.96 1.06 0.00 1.13 3.08 -0.55 0.54 114.38 120.60 1ynf h ARG 278 Ca 0.20 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 60.04 1ynf h ARG 278 Cb 0.40 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1ynf h ARG 278 CO 0.01 0.74 -0.57 0.00 -1.07 0.00 0.00 179.97 179.08 1ynf h ALA 279 N 1.45 0.81 0.00 0.04 0.00 -0.83 -3.34 119.26 117.38 1ynf h ALA 279 Ca 0.28 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1ynf h ALA 279 Cb -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1ynf h ALA 279 CO -0.06 0.71 -1.83 0.54 0.00 0.00 0.00 179.25 178.61 1ynf n ARG 280 N -3.49 0.58 -3.96 0.00 5.12 -0.57 -4.89 116.66 109.45 1ynf n ARG 280 Ca 0.00 -0.17 -0.34 0.00 -1.93 0.00 0.00 57.85 55.41 1ynf n ARG 280 Cb 0.66 -1.45 -0.14 0.00 -1.16 0.00 0.00 32.46 30.37 1ynf n ARG 280 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1ynf s VAL 281 N -3.29 2.85 0.18 1.55 1.01 0.18 -5.07 120.40 117.80 1ynf s VAL 281 Ca -0.06 -1.13 -0.32 0.00 0.00 0.00 0.00 61.98 60.47 1ynf s VAL 281 Cb 0.12 -2.49 -0.11 0.00 0.00 0.00 0.00 36.38 33.90 1ynf s VAL 281 CO 0.79 0.13 1.72 0.21 0.00 0.00 0.00 175.10 177.95 1ynf s ASN 282 N 1.30 6.42 0.00 3.32 2.47 -1.26 -1.52 114.94 125.67 1ynf s ASN 282 Ca -0.01 2.80 0.00 0.00 0.42 0.00 0.00 52.86 56.07 1ynf s ASN 282 Cb -0.17 -2.59 0.00 0.00 -1.45 0.00 0.00 41.25 37.04 1ynf s ASN 282 CO -0.04 -0.96 0.00 0.61 -3.72 0.00 0.00 177.10 172.99 1ynf n GLY 283 N 4.01 0.45 3.02 1.21 0.00 -1.26 -4.75 105.19 107.87 1ynf n GLY 283 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 1ynf n GLY 283 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1ynf n PHE 284 N -2.39 -2.44 -3.62 1.61 -0.00 -0.58 -4.88 117.46 105.16 1ynf n PHE 284 Ca 0.00 -0.05 -0.03 0.00 -0.00 0.00 0.00 57.45 57.37 1ynf n PHE 284 Cb 0.11 -1.38 -0.05 0.00 -0.00 0.00 0.00 39.48 38.16 1ynf n PHE 284 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1ynf s ALA 286 N -2.07 -2.07 -0.50 3.13 0.00 -1.26 -4.92 121.76 114.06 1ynf s ALA 286 Ca 0.37 2.34 -0.09 0.00 0.00 0.00 0.00 51.96 54.58 1ynf s ALA 286 Cb -0.06 -1.70 0.13 0.00 0.00 0.00 0.00 23.12 21.48 1ynf s ALA 286 CO 0.34 -0.75 0.38 0.42 0.00 0.00 0.00 175.76 176.14 1ynf s ILE 287 N 2.44 4.26 -0.16 0.00 1.01 -0.49 -4.98 121.20 123.28 1ynf s ILE 287 Ca -0.07 -1.92 -0.16 0.00 0.00 0.00 0.00 60.65 58.51 1ynf s ILE 287 Cb -0.09 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.54 1ynf s ILE 287 CO -0.19 -0.80 0.38 -1.61 0.00 0.00 0.00 174.94 172.72 1ynf s GLU 288 N 1.18 4.27 -0.42 2.79 2.02 -1.25 -1.53 118.70 125.76 1ynf s GLU 288 Ca 0.07 0.23 -0.19 0.00 0.02 0.00 0.00 54.97 55.11 1ynf s GLU 288 Cb -0.25 -3.46 0.02 0.00 0.10 0.00 0.00 34.13 30.54 1ynf s GLU 288 CO -0.01 0.15 0.54 0.08 0.02 0.00 0.00 175.26 176.03 1ynf s VAL 289 N 0.72 4.96 0.45 2.63 1.01 0.13 -4.85 120.40 125.46 1ynf s VAL 289 Ca 0.20 -0.04 -0.24 0.00 0.00 0.00 0.00 61.98 61.89 1ynf s VAL 289 Cb -0.14 -4.10 -0.07 0.00 0.00 0.00 0.00 36.38 32.07 1ynf s VAL 289 CO 0.07 -0.47 1.28 -2.16 0.00 0.00 0.00 175.10 173.82 1ynf s PRO 290 N 2.47 3.72 0.47 2.72 0.04 -1.26 -1.67 135.00 141.49 1ynf s PRO 290 Ca 0.18 2.08 0.16 0.00 0.04 0.00 0.00 61.00 63.46 1ynf s PRO 290 Cb -0.16 -2.55 1.14 0.00 0.04 0.00 0.00 34.50 32.98 1ynf s PRO 290 CO 0.16 -0.67 2.02 0.00 0.04 0.00 0.00 177.00 178.54 1ynf h ALA 291 N 2.23 2.10 -0.63 8.56 0.00 -1.97 -1.59 119.26 127.96 1ynf h ALA 291 Ca -0.50 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.47 1ynf h ALA 291 Cb 1.26 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.94 1ynf h ALA 291 CO 0.61 -0.20 0.31 1.79 0.00 0.00 0.00 179.25 181.75 1ynf h THR 292 N 0.25 0.89 0.02 0.00 1.35 -2.00 -2.92 112.91 110.51 1ynf h THR 292 Ca 0.21 -0.19 -0.14 0.00 -0.55 0.00 0.00 66.41 65.74 1ynf h THR 292 Cb 0.50 0.28 0.01 0.00 -1.73 0.00 0.00 68.15 67.22 1ynf h THR 292 CO -0.04 0.10 -0.55 1.56 -0.25 0.00 0.00 175.52 176.34 1ynf h GLN 293 N 0.56 0.33 -3.39 4.72 4.20 -1.69 -3.44 115.11 116.40 1ynf h GLN 293 Ca 0.30 -0.39 -0.40 0.00 0.06 0.00 0.00 58.65 58.22 1ynf h GLN 293 Cb 0.26 0.12 -0.39 0.00 0.30 0.00 0.00 27.48 27.77 1ynf h GLN 293 CO -0.22 1.09 -0.75 0.08 -0.67 0.00 0.00 178.83 178.35 1ynf s VAL 294 N -3.03 0.03 0.81 -0.54 1.01 -0.84 -4.85 120.40 112.99 1ynf s VAL 294 Ca -0.14 0.27 -0.12 0.00 0.00 0.00 0.00 61.98 61.99 1ynf s VAL 294 Cb 0.02 -0.31 0.08 0.00 0.00 0.00 0.00 36.38 36.17 1ynf s VAL 294 CO 0.80 0.14 1.14 -0.94 0.00 0.00 0.00 175.10 176.24 1ynf s SER 295 N 2.11 4.48 0.22 3.32 1.04 -1.19 -4.07 113.70 119.61 1ynf s SER 295 Ca 0.05 1.00 -0.06 0.00 0.48 0.00 0.00 55.95 57.41 1ynf s SER 295 Cb -0.13 -1.63 0.19 0.00 0.10 0.00 0.00 66.02 64.56 1ynf s SER 295 CO -0.04 -1.94 1.74 0.58 0.98 0.00 0.00 173.24 174.56 1ynf h VAL 296 N -1.08 1.26 -0.17 5.02 2.07 -1.98 -1.13 116.25 120.24 1ynf h VAL 296 Ca -0.47 -0.95 0.03 0.00 0.82 0.00 0.00 66.70 66.13 1ynf h VAL 296 Cb 1.30 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 1ynf h VAL 296 CO 0.63 0.36 -0.04 0.28 0.02 0.00 0.00 177.57 178.82 1ynf h SER 297 N 1.00 -0.16 -0.78 0.57 0.02 -1.92 0.70 113.55 112.98 1ynf h SER 297 Ca 0.21 0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.25 1ynf h SER 297 Cb 0.37 0.10 -0.05 0.00 0.14 0.00 0.00 62.40 62.96 1ynf h SER 297 CO 0.00 -0.05 0.49 0.44 -1.14 0.00 0.00 176.83 176.56 1ynf h ASP 298 N 0.00 0.78 -0.17 3.07 3.45 -1.85 -1.28 116.42 120.42 1ynf h ASP 298 Ca 0.08 0.01 0.03 0.00 0.43 0.00 0.00 57.03 57.58 1ynf h ASP 298 Cb 0.12 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 38.71 1ynf h ASP 298 CO -0.17 0.52 0.01 0.74 -1.57 0.00 0.00 179.24 178.77 1ynf h THR 299 N 0.92 0.90 -0.46 0.35 2.02 -0.20 -0.86 112.91 115.58 1ynf h THR 299 Ca 0.33 -0.03 -0.09 0.00 0.77 0.00 0.00 66.41 67.39 1ynf h THR 299 Cb 0.09 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1ynf h THR 299 CO -0.14 0.01 -0.09 0.58 0.37 0.00 0.00 175.52 176.25 1ynf h VAL 300 N 0.07 1.26 0.03 3.16 2.07 -0.48 0.44 116.25 122.80 1ynf h VAL 300 Ca 0.08 -1.17 -0.22 0.00 0.82 0.00 0.00 66.70 66.21 1ynf h VAL 300 Cb 0.09 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1ynf h VAL 300 CO -0.12 0.40 -0.97 0.77 0.02 0.00 0.00 177.57 177.68 1ynf h SER 301 N 0.75 0.29 0.50 0.57 4.64 -1.07 -3.33 113.55 115.89 1ynf h SER 301 Ca 0.13 -0.26 -0.16 0.00 -0.47 0.00 0.00 61.79 61.03 1ynf h SER 301 Cb 0.59 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 62.56 1ynf h SER 301 CO 0.04 1.10 -1.63 0.35 -0.87 0.00 0.00 176.83 175.81 1ynf n THR 302 N -3.61 0.97 -3.03 2.95 -2.24 -0.34 -4.97 114.28 104.01 1ynf n THR 302 Ca -0.04 -0.67 -0.16 0.00 -2.27 0.00 0.00 64.05 60.90 1ynf n THR 302 Cb 0.86 -0.54 0.04 0.00 -2.10 0.00 0.00 70.33 68.60 1ynf n THR 302 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1ynf n TYR 303 N -2.74 -1.70 -0.36 4.78 4.02 0.14 -4.12 117.16 117.18 1ynf n TYR 303 Ca -0.12 0.54 0.10 0.00 -0.01 0.00 0.00 57.90 58.41 1ynf n TYR 303 Cb 0.82 -3.65 0.28 0.00 -0.02 0.00 0.00 39.34 36.77 1ynf n TYR 303 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1ynf h LEU 304 N -1.44 0.86 -0.68 7.72 5.85 -1.85 -1.60 115.31 124.17 1ynf h LEU 304 Ca -0.39 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1ynf h LEU 304 Cb 1.26 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1ynf h LEU 304 CO 0.40 0.39 -0.12 0.49 -0.34 0.00 0.00 178.44 179.25 1ynf n PHE 305 N -4.69 0.00 -0.59 1.25 3.01 -1.26 -3.65 117.46 111.53 1ynf n PHE 305 Ca 0.21 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.50 1ynf n PHE 305 Cb 0.46 -0.07 0.12 0.00 -0.01 0.00 0.00 39.48 39.99 1ynf n PHE 305 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1ynf n ASN 306 N -0.30 3.65 -4.94 4.37 2.85 -0.60 -4.36 115.26 115.93 1ynf n ASN 306 Ca 0.16 -3.15 -0.24 0.00 -0.11 0.00 0.00 54.58 51.25 1ynf n ASN 306 Cb 0.34 -0.75 -0.00 0.00 1.24 0.00 0.00 39.78 40.61 1ynf n ASN 306 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1ynf s SER 307 N -0.63 6.16 -0.20 1.20 1.04 -1.24 -1.26 113.70 118.77 1ynf s SER 307 Ca 0.40 0.40 -0.12 0.00 0.48 0.00 0.00 55.95 57.12 1ynf s SER 307 Cb 0.34 -1.88 -0.05 0.00 0.10 0.00 0.00 66.02 64.53 1ynf s SER 307 CO 0.07 -0.42 0.23 -1.10 0.98 0.00 0.00 173.24 173.00 1ynf s GLN 308 N -4.39 4.18 -0.48 4.02 -0.21 -0.68 -4.66 119.66 117.44 1ynf s GLN 308 Ca 0.43 -0.07 -0.11 0.00 0.02 0.00 0.00 55.36 55.62 1ynf s GLN 308 Cb -0.10 -3.47 0.11 0.00 1.00 0.00 0.00 33.01 30.56 1ynf s GLN 308 CO 0.37 0.17 0.37 -1.17 -2.12 0.00 0.00 175.29 172.91 1ynf s LEU 309 N 0.70 5.72 0.24 2.90 2.96 -1.26 -0.55 118.68 129.40 1ynf s LEU 309 Ca 0.12 -1.77 0.03 0.00 -0.22 0.00 0.00 54.13 52.29 1ynf s LEU 309 Cb -0.13 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.46 1ynf s LEU 309 CO 0.03 -0.71 0.40 -0.76 -1.32 0.00 0.00 176.35 173.99 1ynf s LEU 310 N 1.45 4.24 -0.06 -0.68 1.43 -1.26 -4.75 118.68 119.05 1ynf s LEU 310 Ca 0.04 0.23 0.04 0.00 -1.03 0.00 0.00 54.13 53.41 1ynf s LEU 310 Cb -0.26 -3.02 -0.02 0.00 0.03 0.00 0.00 46.19 42.91 1ynf s LEU 310 CO 0.01 -0.10 -0.16 -0.44 0.23 0.00 0.00 176.35 175.89 1ynf s SER 311 N -3.74 3.85 0.50 2.29 0.01 -1.26 -4.83 113.70 110.53 1ynf s SER 311 Ca 0.36 -0.27 0.09 0.00 1.31 0.00 0.00 55.95 57.44 1ynf s SER 311 Cb -0.10 -0.95 0.05 0.00 0.21 0.00 0.00 66.02 65.24 1ynf s SER 311 CO 0.30 0.30 0.68 -0.13 0.41 0.00 0.00 173.24 174.81 1ynf s ARG 312 N -0.47 2.55 0.39 12.44 0.52 0.44 -5.01 118.95 129.81 1ynf s ARG 312 Ca 0.06 -1.46 0.12 0.00 -0.52 0.00 0.00 55.73 53.92 1ynf s ARG 312 Cb -0.12 -2.69 0.80 0.00 0.52 0.00 0.00 34.95 33.46 1ynf s ARG 312 CO 0.02 -0.58 1.89 -0.44 0.02 0.00 0.00 175.30 176.21 1ynf h ASP 313 N 0.40 0.10 0.04 0.23 3.32 -1.99 -2.59 116.42 115.93 1ynf h ASP 313 Ca -0.35 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1ynf h ASP 313 Cb 1.28 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1ynf h ASP 313 CO 0.43 0.34 0.00 -0.90 -1.72 0.00 0.00 179.24 177.39 1ynf n ASP 314 N -4.22 0.00 0.00 6.45 3.85 -1.26 -4.87 116.55 116.51 1ynf n ASP 314 Ca -0.02 -0.86 0.00 0.00 -0.71 0.00 0.00 54.79 53.20 1ynf n ASP 314 Cb 0.32 -0.02 0.00 0.00 -1.35 0.00 0.00 41.12 40.07 1ynf n ASP 314 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ynf n GLY 315 N 0.86 0.62 0.81 6.12 0.00 -0.97 -5.24 105.19 107.39 1ynf n GLY 315 Ca 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.17 1ynf n GLY 315 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ynf n SER 316 N 0.00 -0.87 -3.67 1.61 3.41 -1.26 -4.76 113.62 108.09 1ynf n SER 316 Ca 0.00 -0.79 -0.14 0.00 -0.26 0.00 0.00 58.87 57.68 1ynf n SER 316 Cb 0.00 -0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 63.59 1ynf n SER 316 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ynf s LEU 319 N 0.00 -0.23 -0.33 1.04 1.43 -0.30 -0.42 118.68 119.87 1ynf s LEU 319 Ca 0.16 0.53 -0.14 0.00 -1.03 0.00 0.00 54.13 53.65 1ynf s LEU 319 Cb -0.01 0.60 -0.02 0.00 0.03 0.00 0.00 46.19 46.79 1ynf s LEU 319 CO 0.12 -0.24 0.33 -0.69 0.23 0.00 0.00 176.35 176.10 1ynf s VAL 320 N 2.36 5.20 0.24 -1.59 1.01 0.29 -0.42 120.40 127.48 1ynf s VAL 320 Ca 0.01 0.07 0.10 0.00 0.00 0.00 0.00 61.98 62.17 1ynf s VAL 320 Cb -0.12 -3.76 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 1ynf s VAL 320 CO -0.08 -0.02 -0.19 -0.76 0.00 0.00 0.00 175.10 174.05 1ynf s LEU 321 N 1.95 2.54 0.49 3.92 1.02 0.13 -1.69 118.68 127.04 1ynf s LEU 321 Ca 0.11 -0.99 -0.13 0.00 0.02 0.00 0.00 54.13 53.14 1ynf s LEU 321 Cb -0.17 -0.98 -0.07 0.00 0.02 0.00 0.00 46.19 45.00 1ynf s LEU 321 CO 0.11 -0.01 0.91 -2.16 0.02 0.00 0.00 176.35 175.22 1ynf s PRO 322 N -3.35 3.83 0.41 1.29 0.04 -1.26 -1.18 135.00 134.78 1ynf s PRO 322 Ca 0.25 0.74 0.22 0.00 0.04 0.00 0.00 61.00 62.25 1ynf s PRO 322 Cb -0.04 -2.22 1.21 0.00 0.04 0.00 0.00 34.50 33.48 1ynf s PRO 322 CO 0.11 -0.23 1.73 1.96 0.04 0.00 0.00 177.00 180.62 1ynf h GLN 323 N 0.85 0.28 -0.52 4.56 4.20 -1.66 -1.43 115.11 121.40 1ynf h GLN 323 Ca -0.47 -0.02 0.15 0.00 0.06 0.00 0.00 58.65 58.38 1ynf h GLN 323 Cb 1.19 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.88 1ynf h GLN 323 CO 0.62 0.19 0.42 0.93 -0.67 0.00 0.00 178.83 180.32 1ynf h GLU 324 N 0.29 0.00 -0.01 1.46 3.07 -1.89 -0.47 114.58 117.03 1ynf h GLU 324 Ca 0.66 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 59.38 1ynf h GLU 324 Cb 1.83 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.72 1ynf h GLU 324 CO -0.33 0.00 -0.66 0.00 -1.40 0.00 0.00 179.01 176.62 1ynf h ARG 326 N 0.04 0.01 0.00 0.00 2.43 -1.26 -3.06 114.38 112.53 1ynf h ARG 326 Ca -0.01 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1ynf h ARG 326 Cb 1.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1ynf h ARG 326 CO 0.09 0.92 0.00 0.39 -1.51 0.00 0.00 179.97 179.86 1ynf n GLU 327 N -3.30 0.09 -3.51 0.20 1.02 -0.82 -4.54 120.64 109.78 1ynf n GLU 327 Ca -0.03 0.02 -0.42 0.00 -0.02 0.00 0.00 57.16 56.71 1ynf n GLU 327 Cb 0.96 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.80 1ynf n GLU 327 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1ynf s HIS 328 N -2.91 3.33 0.25 -0.32 2.46 -1.05 -4.97 115.29 112.08 1ynf s HIS 328 Ca 0.16 -1.46 -0.06 0.00 0.47 0.00 0.00 55.06 54.18 1ynf s HIS 328 Cb 0.18 -3.26 0.47 0.00 -0.13 0.00 0.00 32.58 29.85 1ynf s HIS 328 CO 0.49 -0.90 1.65 0.00 -2.47 0.00 0.00 174.74 173.50 1ynf h ALA 329 N 8.56 0.87 -0.41 1.58 0.00 -1.86 0.13 119.26 128.14 1ynf h ALA 329 Ca -0.25 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1ynf h ALA 329 Cb 1.09 0.37 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 1ynf h ALA 329 CO 0.85 -0.42 0.23 0.78 0.00 0.00 0.00 179.25 180.69 1ynf h GLY 330 N 0.14 0.60 0.83 0.00 0.00 -1.93 0.33 103.07 103.04 1ynf h GLY 330 Ca 0.43 -0.27 -0.12 0.00 0.00 0.00 0.00 47.33 47.37 1ynf h GLY 330 CO -0.63 0.26 -0.39 -2.08 0.00 0.00 0.00 176.54 173.69 1ynf h VAL 331 N 0.53 1.37 -0.99 4.60 2.07 -1.60 -2.48 116.25 119.74 1ynf h VAL 331 Ca 0.14 -1.69 0.02 0.00 0.82 0.00 0.00 66.70 65.99 1ynf h VAL 331 Cb 0.04 2.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.86 1ynf h VAL 331 CO -0.02 0.51 0.65 -0.25 0.02 0.00 0.00 177.57 178.47 1ynf h TRP 332 N 0.08 1.23 -0.33 1.57 -0.00 -0.67 -0.30 115.95 117.53 1ynf h TRP 332 Ca -0.01 0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 58.90 1ynf h TRP 332 Cb 1.01 -0.42 -0.02 0.00 -0.00 0.00 0.00 29.16 29.74 1ynf h TRP 332 CO 0.11 0.75 0.19 0.78 -0.00 0.00 0.00 178.44 180.27 1ynf h GLY 333 N 1.31 0.49 1.01 2.65 0.00 -0.89 -1.54 103.07 106.10 1ynf h GLY 333 Ca 0.37 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.48 1ynf h GLY 333 CO -0.10 0.21 0.43 -1.82 0.00 0.00 0.00 176.54 175.26 1ynf h TYR 334 N 0.42 0.96 -0.69 5.60 3.20 -0.90 -2.34 116.97 123.23 1ynf h TYR 334 Ca 0.12 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 1ynf h TYR 334 Cb 0.04 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 37.96 1ynf h TYR 334 CO -0.03 0.66 0.42 -0.07 -1.64 0.00 0.00 178.16 177.49 1ynf h LEU 335 N 0.99 0.82 -1.30 2.82 3.38 -0.73 0.84 115.31 122.13 1ynf h LEU 335 Ca 0.26 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 1ynf h LEU 335 Cb -0.02 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1ynf h LEU 335 CO -0.05 0.64 0.03 0.78 0.09 0.00 0.00 178.44 179.93 1ynf h ASN 336 N 0.93 0.47 -0.27 -0.43 2.35 -1.04 0.83 115.58 118.42 1ynf h ASN 336 Ca 0.25 -0.08 -0.14 0.00 -0.55 0.00 0.00 56.30 55.78 1ynf h ASN 336 Cb -0.03 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.21 1ynf h ASN 336 CO -0.05 0.51 -0.40 -0.08 -1.65 0.00 0.00 177.43 175.77 1ynf h GLU 337 N 0.49 0.74 -0.79 0.81 4.81 -0.83 -2.87 114.58 116.94 1ynf h GLU 337 Ca 0.11 -0.44 -0.02 0.00 -0.13 0.00 0.00 59.36 58.88 1ynf h GLU 337 Cb 0.27 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.65 1ynf h GLU 337 CO 0.00 1.06 0.42 1.25 -0.73 0.00 0.00 179.01 181.02 1ynf h LEU 338 N 0.48 1.00 -1.34 1.64 5.85 -0.27 -0.98 115.31 121.70 1ynf h LEU 338 Ca 0.03 -0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 1ynf h LEU 338 Cb 0.99 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1ynf h LEU 338 CO 0.09 0.82 0.04 0.25 -0.34 0.00 0.00 178.44 179.29 1ynf h LEU 339 N 1.11 0.44 0.00 2.25 5.85 -0.73 -2.71 115.31 121.53 1ynf h LEU 339 Ca 0.28 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1ynf h LEU 339 Cb 0.05 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1ynf h LEU 339 CO -0.04 0.49 -0.78 0.00 -0.34 0.00 0.00 178.44 177.76 1ynf h ALA 340 N 1.58 0.52 -2.37 1.25 0.00 -1.20 -3.44 119.26 115.59 1ynf h ALA 340 Ca 0.11 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.56 1ynf h ALA 340 Cb 0.25 0.00 0.15 0.00 0.00 0.00 0.00 17.79 18.20 1ynf h ALA 340 CO 0.00 0.00 0.21 0.00 0.00 0.00 0.00 179.25 179.46 1ynf s ALA 341 N -3.22 1.09 -1.13 0.00 0.00 -0.42 -4.92 121.76 113.16 1ynf s ALA 341 Ca 0.04 -0.35 -0.21 0.00 0.00 0.00 0.00 51.96 51.44 1ynf s ALA 341 Cb 0.12 -3.11 0.05 0.00 0.00 0.00 0.00 23.12 20.18 1ynf s ALA 341 CO 0.75 -2.74 1.59 0.34 0.00 0.00 0.00 175.76 175.71 1ynf s ASP 342 N -3.52 6.54 0.26 0.00 2.15 -1.26 -4.89 116.67 115.95 1ynf s ASP 342 Ca 0.65 -1.82 -0.22 0.00 0.43 0.00 0.00 52.55 51.60 1ynf s ASP 342 Cb -0.18 -2.57 0.03 0.00 -0.30 0.00 0.00 42.92 39.89 1ynf s ASP 342 CO 0.57 -1.47 0.72 0.54 -0.17 0.00 0.00 175.17 175.36 1ynf s ASN 343 N 4.84 -0.29 0.57 -0.34 2.20 -1.26 -5.06 114.94 115.60 1ynf s ASN 343 Ca 0.51 -0.52 0.33 0.00 -0.94 0.00 0.00 52.86 52.23 1ynf s ASN 343 Cb 0.01 0.70 1.72 0.00 -2.00 0.00 0.00 41.25 41.68 1ynf s ASN 343 CO -0.02 -1.28 2.15 -0.65 -2.94 0.00 0.00 177.10 174.36 1ynf h PRO 344 N 2.00 0.00 -6.27 3.55 0.11 -1.91 -3.43 132.00 126.05 1ynf h PRO 344 Ca -0.21 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.32 1ynf h PRO 344 Cb 1.26 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 1ynf h PRO 344 CO 0.25 0.06 1.28 0.42 -0.21 0.00 0.00 178.00 179.80 1ynf s ILE 345 N -4.14 3.47 -0.70 4.15 1.01 -1.26 -4.60 121.20 119.12 1ynf s ILE 345 Ca -0.03 0.48 0.08 0.00 0.00 0.00 0.00 60.65 61.17 1ynf s ILE 345 Cb 0.13 -3.63 -0.00 0.00 0.01 0.00 0.00 42.46 38.96 1ynf s ILE 345 CO 0.53 -0.40 0.55 -1.54 0.00 0.00 0.00 174.94 174.08 1ynf n SER 346 N 10.27 1.06 -3.73 3.58 3.41 -1.26 -4.60 113.62 122.35 1ynf n SER 346 Ca 0.23 -1.03 -0.14 0.00 -0.26 0.00 0.00 58.87 57.67 1ynf n SER 346 Cb 0.47 0.46 -0.09 0.00 -0.26 0.00 0.00 64.21 64.79 1ynf n SER 346 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1ynf s GLU 347 N -1.14 0.62 -0.11 4.33 2.12 -1.26 -5.09 118.70 118.17 1ynf s GLU 347 Ca 0.06 0.12 0.02 0.00 0.36 0.00 0.00 54.97 55.54 1ynf s GLU 347 Cb 0.06 0.29 -0.01 0.00 0.26 0.00 0.00 34.13 34.73 1ynf s GLU 347 CO 0.19 -0.15 -0.20 -0.51 -0.54 0.00 0.00 175.26 174.06 1ynf s LEU 348 N -0.75 2.35 -0.10 2.70 1.43 -1.26 -1.15 118.68 121.91 1ynf s LEU 348 Ca -0.08 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.56 1ynf s LEU 348 Cb -0.04 -1.49 0.02 0.00 0.03 0.00 0.00 46.19 44.71 1ynf s LEU 348 CO 0.03 0.16 -0.11 -0.75 0.23 0.00 0.00 176.35 175.92 1ynf s LYS 349 N 0.33 1.77 -0.07 1.70 2.20 0.44 -4.95 119.74 121.15 1ynf s LYS 349 Ca -0.15 -0.39 0.00 0.00 -0.36 0.00 0.00 55.97 55.07 1ynf s LYS 349 Cb -0.17 -1.60 -0.03 0.00 -1.51 0.00 0.00 37.83 34.52 1ynf s LYS 349 CO 0.08 -0.11 -0.05 0.08 -0.36 0.00 0.00 175.35 174.98 1ynf s VAL 350 N 1.16 3.84 0.05 4.02 1.01 -1.26 0.18 120.40 129.40 1ynf s VAL 350 Ca -0.05 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.56 1ynf s VAL 350 Cb -0.14 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.63 1ynf s VAL 350 CO -0.03 0.60 -0.15 -0.36 0.00 0.00 0.00 175.10 175.16 1ynf s PHE 351 N -0.80 1.33 -0.47 5.22 0.40 -0.33 -4.95 117.98 118.38 1ynf s PHE 351 Ca 0.12 -0.39 -0.25 0.00 -0.60 0.00 0.00 56.93 55.82 1ynf s PHE 351 Cb -0.11 -0.77 0.03 0.00 0.51 0.00 0.00 43.02 42.67 1ynf s PHE 351 CO 0.02 0.06 0.88 0.34 0.70 0.00 0.00 175.22 177.22 1ynf s ASP 352 N -1.35 6.45 -0.32 1.36 2.15 -1.26 -1.58 116.67 122.11 1ynf s ASP 352 Ca 0.02 -0.01 0.13 0.00 0.43 0.00 0.00 52.55 53.12 1ynf s ASP 352 Cb -0.09 -2.43 0.47 0.00 -0.30 0.00 0.00 42.92 40.57 1ynf s ASP 352 CO 0.02 -1.02 1.10 0.18 -0.17 0.00 0.00 175.17 175.27 1ynf n LEU 353 N 7.04 3.17 -0.30 -1.34 4.77 -1.26 -4.86 117.00 124.22 1ynf n LEU 353 Ca 0.04 -4.14 0.03 0.00 -0.03 0.00 0.00 56.01 51.92 1ynf n LEU 353 Cb 0.48 0.03 0.18 0.00 -2.33 0.00 0.00 43.42 41.78 1ynf n LEU 353 CO 0.62 1.71 1.16 0.03 -1.33 0.00 0.00 177.39 179.58 1ynf h ARG 354 N 2.57 0.81 0.09 3.23 3.08 -1.95 -2.86 114.38 119.34 1ynf h ARG 354 Ca 0.11 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1ynf h ARG 354 Cb 1.25 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 31.11 1ynf h ARG 354 CO 0.56 0.53 -0.08 0.93 -1.07 0.00 0.00 179.97 180.84 1ynf h GLU 355 N 0.83 -0.18 -1.71 0.04 4.39 -1.94 0.24 114.58 116.24 1ynf h GLU 355 Ca 0.41 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.12 1ynf h GLU 355 Cb 0.38 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1ynf h GLU 355 CO -0.25 -0.12 0.00 0.45 -1.16 0.00 0.00 179.01 177.93 1ynf n SER 356 N -5.19 1.24 0.00 1.42 2.88 -1.08 -3.56 113.62 109.32 1ynf n SER 356 Ca -0.07 -0.87 0.00 0.00 -1.33 0.00 0.00 58.87 56.60 1ynf n SER 356 Cb 0.12 -0.22 0.00 0.00 -0.75 0.00 0.00 64.21 63.36 1ynf n SER 356 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ynf n ALA 358 N 1.02 0.00 -0.31 -1.46 0.00 0.07 -1.09 120.51 118.73 1ynf n ALA 358 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1ynf n ALA 358 Cb 0.18 0.00 0.27 0.00 0.00 0.00 0.00 19.45 19.89 1ynf n ALA 358 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ynf n ASN 359 N 0.00 3.63 0.00 0.00 3.02 -1.23 -4.94 115.26 115.73 1ynf n ASN 359 Ca 0.00 -2.01 0.00 0.00 -0.03 0.00 0.00 54.58 52.54 1ynf n ASN 359 Cb 0.00 -0.40 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 1ynf n ASN 359 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ynf n GLY 360 N 1.24 1.12 3.05 7.41 0.00 -0.99 -5.09 105.19 111.94 1ynf n GLY 360 Ca 0.20 -0.33 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 1ynf n GLY 360 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ynf s GLY 361 N -2.34 1.04 0.00 -0.02 0.00 -0.25 -5.05 107.32 100.71 1ynf s GLY 361 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 44.72 43.98 1ynf s GLY 361 CO 0.00 0.26 0.00 0.61 0.00 0.00 0.00 173.10 173.97 1ynf n GLY 362 N 4.25 2.24 0.28 0.20 0.00 -1.26 -4.63 105.19 106.26 1ynf n GLY 362 Ca -0.19 -2.13 0.05 0.00 0.00 0.00 0.00 46.02 43.75 1ynf n GLY 362 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ynf h PRO 363 N 0.00 0.45 -0.20 1.61 0.11 -1.89 -2.30 132.00 129.78 1ynf h PRO 363 Ca 0.00 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 65.92 1ynf h PRO 363 Cb 0.00 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.00 1ynf h PRO 363 CO 0.00 0.30 -0.56 0.00 -0.21 0.00 0.00 178.00 177.53 1ynf h ALA 364 N 1.53 0.65 -0.32 -0.75 0.00 -1.45 -3.11 119.26 115.82 1ynf h ALA 364 Ca 0.41 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ynf h ALA 364 Cb 0.60 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1ynf h ALA 364 CO -0.39 0.69 0.21 0.00 0.00 0.00 0.00 179.25 179.76 1ynf n LEU 366 N -4.49 0.31 -4.08 0.00 4.77 -1.09 -2.27 117.00 110.15 1ynf n LEU 366 Ca 0.02 -0.12 -0.14 0.00 -0.03 0.00 0.00 56.01 55.74 1ynf n LEU 366 Cb 0.07 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.03 1ynf n LEU 366 CO 0.35 0.06 -0.41 0.00 -1.33 0.00 0.00 177.39 176.05 1ynf s ARG 367 N -1.98 0.59 -0.17 3.23 1.04 -0.62 -1.72 118.95 119.32 1ynf s ARG 367 Ca 0.38 -0.78 0.01 0.00 -1.04 0.00 0.00 55.73 54.30 1ynf s ARG 367 Cb 0.18 -0.42 0.02 0.00 -2.04 0.00 0.00 34.95 32.69 1ynf s ARG 367 CO 0.30 0.08 -0.17 -1.17 -0.04 0.00 0.00 175.30 174.30 1ynf s LEU 368 N -1.56 2.03 -0.19 -1.89 2.96 0.96 -3.56 118.68 117.43 1ynf s LEU 368 Ca -0.08 -0.63 -0.27 0.00 -0.22 0.00 0.00 54.13 52.93 1ynf s LEU 368 Cb -0.10 -1.36 -0.01 0.00 0.50 0.00 0.00 46.19 45.23 1ynf s LEU 368 CO 0.01 -0.04 0.91 -0.13 -1.32 0.00 0.00 176.35 175.78 1ynf s ARG 369 N 1.36 4.28 -0.27 1.98 0.52 -1.26 -1.26 118.95 124.30 1ynf s ARG 369 Ca 0.04 1.15 0.00 0.00 -0.52 0.00 0.00 55.73 56.40 1ynf s ARG 369 Cb -0.13 -3.60 0.08 0.00 0.52 0.00 0.00 34.95 31.81 1ynf s ARG 369 CO -0.12 -0.45 0.03 0.08 0.02 0.00 0.00 175.30 174.87 1ynf s VAL 370 N 2.57 1.25 -0.10 3.52 1.01 -0.27 -4.83 120.40 123.56 1ynf s VAL 370 Ca 0.40 -1.37 -0.30 0.00 0.00 0.00 0.00 61.98 60.72 1ynf s VAL 370 Cb -0.16 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 1ynf s VAL 370 CO 0.10 -0.42 1.27 -0.69 0.00 0.00 0.00 175.10 175.36 1ynf s VAL 371 N 1.47 4.19 -0.00 2.92 1.01 -1.26 -1.01 120.40 127.71 1ynf s VAL 371 Ca 0.03 1.48 0.03 0.00 0.00 0.00 0.00 61.98 63.53 1ynf s VAL 371 Cb -0.18 -3.96 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 1ynf s VAL 371 CO -0.14 -0.07 -0.11 -0.76 0.00 0.00 0.00 175.10 174.02 1ynf s LEU 372 N 2.91 2.04 0.93 3.92 1.43 0.32 -4.64 118.68 125.59 1ynf s LEU 372 Ca 0.57 -0.23 -0.13 0.00 -1.03 0.00 0.00 54.13 53.31 1ynf s LEU 372 Cb -0.24 -0.56 0.15 0.00 0.03 0.00 0.00 46.19 45.57 1ynf s LEU 372 CO 0.19 0.12 1.15 0.42 0.23 0.00 0.00 176.35 178.46 1ynf s THR 373 N -0.33 1.98 0.25 5.49 -4.23 -1.26 -1.04 115.64 116.49 1ynf s THR 373 Ca 0.04 0.00 -0.06 0.00 -1.18 0.00 0.00 61.69 60.49 1ynf s THR 373 Cb -0.05 -2.76 0.26 0.00 1.34 0.00 0.00 72.50 71.29 1ynf s THR 373 CO -0.00 0.00 1.92 -0.08 -0.54 0.00 0.00 174.62 175.92 1ynf h GLU 374 N -1.55 1.29 -0.34 3.99 4.81 -1.96 0.18 114.58 120.99 1ynf h GLU 374 Ca -0.50 -0.08 -0.14 0.00 -0.13 0.00 0.00 59.36 58.52 1ynf h GLU 374 Cb 1.32 -0.29 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 1ynf h GLU 374 CO 0.59 0.86 -0.35 0.93 -0.73 0.00 0.00 179.01 180.31 1ynf h GLU 375 N 1.33 0.77 -0.29 1.92 5.08 -1.95 -2.48 114.58 118.97 1ynf h GLU 375 Ca 0.38 -0.37 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 1ynf h GLU 375 Cb -0.11 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1ynf h GLU 375 CO -0.09 1.00 -0.43 0.93 -1.00 0.00 0.00 179.01 179.42 1ynf h GLU 376 N 0.64 0.73 -0.71 2.33 5.08 -1.77 -2.26 114.58 118.62 1ynf h GLU 376 Ca 0.06 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.02 1ynf h GLU 376 Cb 0.89 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 1ynf h GLU 376 CO 0.08 1.01 0.39 0.00 -1.00 0.00 0.00 179.01 179.49 1ynf h ARG 377 N 0.59 0.99 0.00 2.33 3.08 -0.54 -1.52 114.38 119.30 1ynf h ARG 377 Ca 0.04 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 59.89 1ynf h ARG 377 Cb 0.98 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 1ynf h ARG 377 CO 0.09 0.73 -0.44 -0.09 -1.07 0.00 0.00 179.97 179.19 1ynf h ARG 378 N 1.00 0.00 0.00 0.04 2.43 -1.19 -2.97 114.38 113.69 1ynf h ARG 378 Ca 0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 1ynf h ARG 378 Cb 0.03 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1ynf h ARG 378 CO -0.04 0.44 0.00 0.00 -1.51 0.00 0.00 179.97 178.86 1ynf h ALA 379 N 1.56 1.00 -2.71 2.80 0.00 -0.69 -3.46 119.26 117.76 1ynf h ALA 379 Ca -0.00 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.40 1ynf h ALA 379 Cb 0.79 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.62 1ynf h ALA 379 CO 0.06 0.00 0.48 0.08 0.00 0.00 0.00 179.25 179.87 1ynf s VAL 380 N -3.29 3.34 -0.38 0.00 1.01 -1.00 -4.49 120.40 115.60 1ynf s VAL 380 Ca 0.06 1.17 -0.37 0.00 0.00 0.00 0.00 61.98 62.85 1ynf s VAL 380 Cb 0.09 -3.68 -0.13 0.00 0.00 0.00 0.00 36.38 32.66 1ynf s VAL 380 CO 0.58 0.15 2.19 -3.20 0.00 0.00 0.00 175.10 174.82 1ynf n ASN 381 N 0.38 1.90 0.23 3.32 2.85 -0.60 -4.79 115.26 118.54 1ynf n ASN 381 Ca 0.03 0.45 0.17 0.00 -0.11 0.00 0.00 54.58 55.11 1ynf n ASN 381 Cb 0.46 -1.20 0.85 0.00 1.24 0.00 0.00 39.78 41.13 1ynf n ASN 381 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ynf h PRO 382 N 11.89 0.00 0.00 1.20 0.11 -1.90 -2.67 132.00 140.63 1ynf h PRO 382 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1ynf h PRO 382 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 1ynf h PRO 382 CO 1.03 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.82 1ynf n ALA 383 N -2.32 1.52 -3.57 -0.75 0.00 -1.26 -5.10 120.51 109.03 1ynf n ALA 383 Ca 0.01 -0.03 -0.36 0.00 0.00 0.00 0.00 53.44 53.05 1ynf n ALA 383 Cb 0.27 -1.20 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 1ynf n ALA 383 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1ynf n VAL 384 N -1.55 3.22 0.00 0.00 0.24 -1.01 -4.68 118.33 114.54 1ynf n VAL 384 Ca 0.03 -5.19 0.00 0.00 -2.04 0.00 0.00 64.34 57.14 1ynf n VAL 384 Cb 0.14 -2.36 0.00 0.00 -1.47 0.00 0.00 33.84 30.15 1ynf n VAL 384 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1ynf n ASN 387 N 2.17 0.00 -0.28 -1.34 0.23 -1.26 -1.15 115.26 113.63 1ynf n ASN 387 Ca 0.23 0.00 0.04 0.00 -0.53 0.00 0.00 54.58 54.32 1ynf n ASN 387 Cb 0.37 0.00 0.18 0.00 -2.08 0.00 0.00 39.78 38.25 1ynf n ASN 387 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1ynf h ASP 388 N 0.00 0.55 -0.13 0.53 3.32 -2.00 -0.59 116.42 118.10 1ynf h ASP 388 Ca 0.00 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1ynf h ASP 388 Cb 0.00 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1ynf h ASP 388 CO 0.00 0.28 0.06 0.74 -1.72 0.00 0.00 179.24 178.60 1ynf h THR 389 N 0.67 1.15 -0.45 0.35 2.02 -2.05 -0.79 112.91 113.81 1ynf h THR 389 Ca 0.41 -0.44 -0.05 0.00 0.77 0.00 0.00 66.41 67.10 1ynf h THR 389 Cb 0.48 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 1ynf h THR 389 CO -0.30 0.13 0.07 0.25 0.37 0.00 0.00 175.52 176.04 1ynf h LEU 390 N 0.06 0.71 -0.27 2.58 5.85 -1.90 -1.18 115.31 121.17 1ynf h LEU 390 Ca 0.04 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1ynf h LEU 390 Cb 0.16 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1ynf h LEU 390 CO -0.00 0.80 -0.02 0.15 -0.34 0.00 0.00 178.44 179.02 1ynf h PHE 391 N 0.60 -0.06 -0.37 1.25 3.57 -0.98 0.12 116.94 121.07 1ynf h PHE 391 Ca 0.13 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.55 1ynf h PHE 391 Cb 0.39 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1ynf h PHE 391 CO 0.03 -0.07 -0.21 -0.91 -2.23 0.00 0.00 178.31 174.91 1ynf h ASN 392 N 0.05 0.73 -0.32 0.41 2.35 -1.04 -1.53 115.58 116.24 1ynf h ASN 392 Ca 0.13 -0.26 -0.04 0.00 -0.55 0.00 0.00 56.30 55.58 1ynf h ASN 392 Cb 0.18 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1ynf h ASN 392 CO -0.24 0.93 0.05 0.00 -1.65 0.00 0.00 177.43 176.52 1ynf h ALA 393 N 1.13 0.42 -0.46 -0.83 0.00 -0.69 -1.92 119.26 116.90 1ynf h ALA 393 Ca 0.09 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1ynf h ALA 393 Cb 0.71 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1ynf h ALA 393 CO 0.05 0.12 -0.02 -0.07 0.00 0.00 0.00 179.25 179.33 1ynf h LEU 394 N 0.35 0.81 -1.03 0.00 3.38 -0.70 -1.17 115.31 116.96 1ynf h LEU 394 Ca 0.10 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1ynf h LEU 394 Cb 0.35 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1ynf h LEU 394 CO 0.01 0.94 0.50 0.78 0.09 0.00 0.00 178.44 180.75 1ynf h ASN 395 N 0.67 1.04 -0.38 -0.43 2.35 -1.22 0.06 115.58 117.67 1ynf h ASN 395 Ca 0.13 -0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.70 1ynf h ASN 395 Cb 0.54 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 1ynf h ASN 395 CO 0.03 0.81 -0.18 0.44 -1.65 0.00 0.00 177.43 176.88 1ynf h ASP 396 N 1.19 0.82 -0.62 5.81 3.32 -1.15 -1.54 116.42 124.24 1ynf h ASP 396 Ca 0.31 -0.40 0.02 0.00 0.02 0.00 0.00 57.03 56.98 1ynf h ASP 396 Cb -0.02 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.27 1ynf h ASP 396 CO -0.05 1.04 0.39 -0.25 -1.72 0.00 0.00 179.24 178.64 1ynf h TRP 397 N 0.59 0.73 -0.20 4.55 7.01 -0.73 -1.46 115.95 126.44 1ynf h TRP 397 Ca 0.09 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.10 1ynf h TRP 397 Cb 0.73 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.54 1ynf h TRP 397 CO 0.06 0.42 0.12 0.28 -2.79 0.00 0.00 178.44 176.53 1ynf h VAL 398 N 0.77 1.10 -0.20 2.65 2.07 -0.84 -1.92 116.25 119.87 1ynf h VAL 398 Ca 0.25 -0.26 0.02 0.00 0.82 0.00 0.00 66.70 67.53 1ynf h VAL 398 Cb -0.00 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1ynf h VAL 398 CO -0.09 0.10 0.14 0.44 0.02 0.00 0.00 177.57 178.17 1ynf h ASP 399 N 0.23 0.15 0.04 0.57 3.45 -0.91 0.93 116.42 120.89 1ynf h ASP 399 Ca 0.07 -0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.38 1ynf h ASP 399 Cb 0.05 -0.04 0.01 0.00 -0.56 0.00 0.00 39.33 38.80 1ynf h ASP 399 CO -0.01 0.11 -0.62 0.03 -1.57 0.00 0.00 179.24 177.17 1ynf h ARG 400 N 0.18 0.35 0.00 3.56 3.08 -0.83 -3.41 114.38 117.30 1ynf h ARG 400 Ca 0.08 -0.43 -0.05 0.00 0.07 0.00 0.00 59.98 59.65 1ynf h ARG 400 Cb 0.12 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1ynf h ARG 400 CO -0.01 1.13 -1.82 0.66 -1.07 0.00 0.00 179.97 178.85 1ynf n TYR 401 N -4.22 0.00 -2.97 3.04 4.02 -0.76 -5.01 117.16 111.25 1ynf n TYR 401 Ca -0.11 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.38 1ynf n TYR 401 Cb 0.70 -0.45 -0.06 0.00 -0.02 0.00 0.00 39.34 39.51 1ynf n TYR 401 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1ynf s TYR 402 N -3.02 3.86 0.37 -0.72 1.51 0.31 -4.97 117.35 114.69 1ynf s TYR 402 Ca -0.06 1.59 -0.10 0.00 -1.01 0.00 0.00 57.07 57.49 1ynf s TYR 402 Cb 0.10 -2.79 -0.06 0.00 -0.11 0.00 0.00 41.96 39.09 1ynf s TYR 402 CO 0.69 0.43 0.72 1.03 -1.11 0.00 0.00 175.55 177.31 1ynf s ARG 403 N -0.78 3.78 0.12 -0.62 0.52 -1.26 -4.71 118.95 116.00 1ynf s ARG 403 Ca 0.37 0.41 0.24 0.00 -0.52 0.00 0.00 55.73 56.23 1ynf s ARG 403 Cb -0.22 -2.44 0.31 0.00 0.52 0.00 0.00 34.95 33.12 1ynf s ARG 403 CO 0.25 0.03 1.30 -0.44 0.02 0.00 0.00 175.30 176.47 1ynf h ASP 404 N 1.47 0.00 -3.74 0.23 3.45 -1.94 -2.09 116.42 113.80 1ynf h ASP 404 Ca -0.47 -0.20 -0.22 0.00 0.43 0.00 0.00 57.03 56.56 1ynf h ASP 404 Cb 1.19 0.00 -0.28 0.00 -0.56 0.00 0.00 39.33 39.68 1ynf h ASP 404 CO 0.64 0.10 -0.66 -0.60 -1.57 0.00 0.00 179.24 177.15 1ynf s ARG 405 N -3.18 0.05 -0.12 3.56 3.52 -1.26 -4.23 118.95 117.29 1ynf s ARG 405 Ca 0.06 0.08 -0.27 0.00 -0.13 0.00 0.00 55.73 55.47 1ynf s ARG 405 Cb 0.13 0.02 0.06 0.00 -1.56 0.00 0.00 34.95 33.60 1ynf s ARG 405 CO 0.73 -0.01 0.65 -1.17 -0.81 0.00 0.00 175.30 174.68 1ynf s LEU 406 N 0.08 -0.50 0.12 -0.88 2.96 -0.48 -4.93 118.68 115.05 1ynf s LEU 406 Ca -0.00 0.91 -0.01 0.00 -0.22 0.00 0.00 54.13 54.81 1ynf s LEU 406 Cb -0.01 2.34 -0.04 0.00 0.50 0.00 0.00 46.19 48.98 1ynf s LEU 406 CO -0.00 -0.45 0.03 0.42 -1.32 0.00 0.00 176.35 175.02 1ynf s THR 407 N -0.62 0.21 0.51 3.68 -4.23 -1.26 -0.95 115.64 112.98 1ynf s THR 407 Ca -0.07 -1.90 0.21 0.00 -1.18 0.00 0.00 61.69 58.75 1ynf s THR 407 Cb -0.02 -1.93 0.36 0.00 1.34 0.00 0.00 72.50 72.25 1ynf s THR 407 CO 0.06 -0.59 2.01 0.00 -0.54 0.00 0.00 174.62 175.56 1ynf h ALA 408 N 2.91 2.31 0.00 3.99 0.00 -1.82 -0.79 119.26 125.86 1ynf h ALA 408 Ca -0.35 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 1ynf h ALA 408 Cb 1.19 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1ynf h ALA 408 CO 0.61 -0.44 -0.13 0.00 0.00 0.00 0.00 179.25 179.29 1ynf h ALA 409 N 1.77 1.44 0.00 0.00 0.00 -1.96 -2.31 119.26 118.19 1ynf h ALA 409 Ca 0.22 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ynf h ALA 409 Cb 0.75 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1ynf h ALA 409 CO -0.02 0.16 0.00 -0.25 0.00 0.00 0.00 179.25 179.14 1ynf n ASP 410 N -3.88 0.32 0.16 0.00 8.00 -0.30 -3.51 116.55 117.33 1ynf n ASP 410 Ca -0.02 0.54 0.13 0.00 0.71 0.00 0.00 54.79 56.14 1ynf n ASP 410 Cb 0.23 -0.62 0.55 0.00 -0.02 0.00 0.00 41.12 41.26 1ynf n ASP 410 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1ynf h LEU 411 N 0.00 0.00 0.00 0.64 3.38 -1.51 -2.14 115.31 115.68 1ynf h LEU 411 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ynf h LEU 411 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1ynf h LEU 411 CO 0.00 0.00 -0.45 0.00 0.09 0.00 0.00 178.44 178.08 1ynf n ALA 412 N -1.82 3.33 -2.13 1.53 0.00 -1.23 -4.87 120.51 115.32 1ynf n ALA 412 Ca 0.01 -0.31 -0.43 0.00 0.00 0.00 0.00 53.44 52.72 1ynf n ALA 412 Cb 0.19 -1.17 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 1ynf n ALA 412 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ynf s ASP 413 N -3.12 6.56 0.53 0.00 -1.08 -0.81 -4.79 116.67 113.96 1ynf s ASP 413 Ca 0.11 1.83 0.18 0.00 -0.52 0.00 0.00 52.55 54.15 1ynf s ASP 413 Cb 0.17 -2.53 1.32 0.00 -1.46 0.00 0.00 42.92 40.42 1ynf s ASP 413 CO 0.68 -1.07 2.14 -0.65 0.52 0.00 0.00 175.17 176.79 1ynf h PRO 414 N 9.94 0.00 -0.15 4.34 0.11 -1.89 -1.76 132.00 142.58 1ynf h PRO 414 Ca -0.34 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.62 1ynf h PRO 414 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1ynf h PRO 414 CO 0.98 0.00 -0.55 0.37 -0.21 0.00 0.00 178.00 178.60 1ynf h GLN 415 N 0.00 0.45 -0.68 1.05 4.15 -1.96 -1.57 115.11 116.56 1ynf h GLN 415 Ca 0.03 -0.28 -0.06 0.00 0.77 0.00 0.00 58.65 59.10 1ynf h GLN 415 Cb 0.11 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.80 1ynf h GLN 415 CO -0.00 0.88 0.20 1.25 -1.93 0.00 0.00 178.83 179.23 1ynf h LEU 416 N 0.35 1.01 -0.02 -2.39 6.46 -1.64 -0.44 115.31 118.64 1ynf h LEU 416 Ca 0.01 -0.22 0.01 0.00 -0.12 0.00 0.00 57.88 57.56 1ynf h LEU 416 Cb 1.07 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.71 1ynf h LEU 416 CO 0.10 0.96 -0.07 0.25 -0.62 0.00 0.00 178.44 179.06 1ynf h LEU 417 N 1.01 -0.19 -0.94 2.25 5.85 -1.26 -1.08 115.31 120.94 1ynf h LEU 417 Ca 0.22 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.93 1ynf h LEU 417 Cb 0.32 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 1ynf h LEU 417 CO -0.00 -0.10 0.31 0.03 -0.34 0.00 0.00 178.44 178.34 1ynf h ARG 418 N -0.11 1.08 -0.45 1.25 3.08 -1.05 -1.82 114.38 116.35 1ynf h ARG 418 Ca 0.03 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 1ynf h ARG 418 Cb 0.15 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1ynf h ARG 418 CO -0.08 0.86 0.19 0.93 -1.07 0.00 0.00 179.97 180.80 1ynf h GLU 419 N 1.06 0.67 -0.51 0.04 5.08 -0.80 -2.32 114.58 117.80 1ynf h GLU 419 Ca 0.25 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.44 1ynf h GLU 419 Cb 0.18 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1ynf h GLU 419 CO -0.02 0.60 0.09 0.78 -1.00 0.00 0.00 179.01 179.46 1ynf h GLY 420 N 0.59 0.86 0.76 -3.84 0.00 -0.88 -0.66 103.07 99.89 1ynf h GLY 420 Ca 0.15 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 1ynf h GLY 420 CO -0.01 0.48 -0.00 3.21 0.00 0.00 0.00 176.54 180.21 1ynf h ARG 421 N 0.76 0.22 -0.31 4.80 2.47 -1.16 -1.08 114.38 120.08 1ynf h ARG 421 Ca 0.16 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.80 1ynf h ARG 421 Cb 0.33 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.62 1ynf h ARG 421 CO 0.00 0.47 0.16 1.49 0.56 0.00 0.00 179.97 182.65 1ynf h GLU 422 N -0.05 0.45 -0.24 0.04 4.81 -1.31 -1.01 114.58 117.26 1ynf h GLU 422 Ca 0.03 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.26 1ynf h GLU 422 Cb 0.37 -0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.62 1ynf h GLU 422 CO 0.01 0.41 -0.12 0.00 -0.73 0.00 0.00 179.01 178.58 1ynf h ALA 423 N 1.01 0.08 -0.20 2.92 0.00 -1.05 -0.10 119.26 121.93 1ynf h ALA 423 Ca 0.11 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1ynf h ALA 423 Cb 0.11 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1ynf h ALA 423 CO -0.01 -0.53 -0.18 -0.07 0.00 0.00 0.00 179.25 178.46 1ynf h LEU 424 N -0.09 0.33 -0.42 0.00 3.38 -1.01 0.42 115.31 117.91 1ynf h LEU 424 Ca 0.13 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1ynf h LEU 424 Cb 0.28 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1ynf h LEU 424 CO -0.30 0.53 -0.07 -0.78 0.09 0.00 0.00 178.44 177.90 1ynf h ASP 425 N 0.31 0.80 -0.45 -0.43 3.58 -0.44 -0.58 116.42 119.21 1ynf h ASP 425 Ca 0.06 -0.35 -0.10 0.00 0.42 0.00 0.00 57.03 57.06 1ynf h ASP 425 Cb 0.50 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.32 1ynf h ASP 425 CO 0.03 0.96 -0.11 0.58 -2.88 0.00 0.00 179.24 177.83 1ynf h VAL 426 N 0.63 1.27 -0.54 2.25 2.07 -0.68 -2.95 116.25 118.29 1ynf h VAL 426 Ca 0.11 -1.22 -0.05 0.00 0.82 0.00 0.00 66.70 66.36 1ynf h VAL 426 Cb 0.60 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 1ynf h VAL 426 CO 0.04 0.42 0.13 0.25 0.02 0.00 0.00 177.57 178.43 1ynf h LEU 427 N 0.70 0.77 -1.90 2.57 5.85 -0.76 -1.16 115.31 121.38 1ynf h LEU 427 Ca 0.11 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1ynf h LEU 427 Cb 0.65 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 1ynf h LEU 427 CO 0.04 0.76 -0.12 0.77 -0.34 0.00 0.00 178.44 179.55 1ynf h SER 428 N 0.80 0.00 0.06 1.25 4.64 -0.94 0.14 113.55 119.49 1ynf h SER 428 Ca 0.18 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.38 1ynf h SER 428 Cb 0.29 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.39 1ynf h SER 428 CO -0.00 0.12 -0.49 1.56 -0.87 0.00 0.00 176.83 177.15 1ynf h GLN 429 N 0.00 0.23 -0.83 4.77 4.20 -1.18 0.76 115.11 123.06 1ynf h GLN 429 Ca -0.00 -0.32 0.03 0.00 0.06 0.00 0.00 58.65 58.42 1ynf h GLN 429 Cb 0.25 0.11 -0.05 0.00 0.30 0.00 0.00 27.48 28.09 1ynf h GLN 429 CO 0.02 1.10 0.53 1.25 -0.67 0.00 0.00 178.83 181.06 1ynf h LEU 430 N -0.48 0.89 -1.27 1.46 6.46 -0.56 -1.73 115.31 120.08 1ynf h LEU 430 Ca -0.08 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.68 1ynf h LEU 430 Cb 1.32 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 41.05 1ynf h LEU 430 CO 0.09 0.61 0.00 0.18 -0.62 0.00 0.00 178.44 178.70 1ynf n LEU 431 N -4.57 1.89 -3.75 2.25 4.77 0.43 -4.94 117.00 113.09 1ynf n LEU 431 Ca 0.10 -0.84 -0.25 0.00 -0.03 0.00 0.00 56.01 54.99 1ynf n LEU 431 Cb 0.09 -0.16 0.02 0.00 -2.33 0.00 0.00 43.42 41.04 1ynf n LEU 431 CO 0.34 0.42 -0.11 -3.20 -1.33 0.00 0.00 177.39 173.50 1ynf n ASN 432 N 0.48 -2.45 -0.00 -1.43 5.15 -0.65 -4.61 115.26 111.76 1ynf n ASN 432 Ca 0.15 -0.93 0.07 0.00 -0.60 0.00 0.00 54.58 53.27 1ynf n ASN 432 Cb 0.35 -3.60 -0.09 0.00 -0.53 0.00 0.00 39.78 35.90 1ynf n ASN 432 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1ynf n LEU 433 N -4.23 0.43 0.00 1.20 4.77 0.23 -5.01 117.00 114.39 1ynf n LEU 433 Ca -0.23 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 1ynf n LEU 433 Cb 0.65 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1ynf n LEU 433 CO 0.69 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1ynf n GLY 434 N 1.45 -0.91 3.46 -0.72 0.00 -1.20 -4.13 105.19 103.14 1ynf n GLY 434 Ca 0.01 -1.18 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 1ynf n GLY 434 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ynf n SER 435 N -0.87 4.70 0.12 1.61 7.64 -1.26 -4.68 113.62 120.87 1ynf n SER 435 Ca 0.00 -2.90 0.11 0.00 1.01 0.00 0.00 58.87 57.09 1ynf n SER 435 Cb 0.00 -1.73 0.02 0.00 -1.01 0.00 0.00 64.21 61.49 1ynf n SER 435 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 1ynf h VAL 436 N 5.37 0.02 -3.05 0.44 3.04 -1.94 -3.45 116.25 116.68 1ynf h VAL 436 Ca 0.46 -1.03 -0.60 0.00 -1.01 0.00 0.00 66.70 64.52 1ynf h VAL 436 Cb 0.84 1.58 -0.04 0.00 -2.01 0.00 0.00 31.29 31.66 1ynf h VAL 436 CO 1.51 0.01 -0.40 -0.31 -1.01 0.00 0.00 177.57 177.37 1ynf s TYR 437 N -3.33 3.50 0.25 3.17 1.51 -1.26 -4.79 117.35 116.39 1ynf s TYR 437 Ca 0.00 0.42 -0.04 0.00 -1.01 0.00 0.00 57.07 56.44 1ynf s TYR 437 Cb 0.09 -1.89 0.47 0.00 -0.11 0.00 0.00 41.96 40.52 1ynf s TYR 437 CO 0.78 0.51 1.73 -1.35 -1.11 0.00 0.00 175.55 176.10 1ynf h PRO 438 N 2.95 0.45 0.00 -1.71 0.11 -2.00 -0.44 132.00 131.36 1ynf h PRO 438 Ca -0.46 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1ynf h PRO 438 Cb 1.16 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1ynf h PRO 438 CO 0.74 0.30 -0.04 0.27 -0.21 0.00 0.00 178.00 179.05 1ynf h PHE 439 N 0.46 0.00 -0.00 0.65 -5.15 -1.99 -0.69 116.94 110.21 1ynf h PHE 439 Ca 0.42 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.19 1ynf h PHE 439 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.81 1ynf h PHE 439 CO -0.16 0.04 -0.16 1.04 -2.00 0.00 0.00 178.31 177.08 1ynf n GLN 440 N -3.56 0.61 0.00 6.09 6.02 -0.18 -5.19 117.38 121.18 1ynf n GLN 440 Ca -0.02 -0.24 0.09 0.00 -0.01 0.00 0.00 57.00 56.82 1ynf n GLN 440 Cb 0.15 -1.49 0.08 0.00 1.02 0.00 0.00 30.24 29.99 1ynf n GLN 440 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59