#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 3.71 0.14 -2.53 0.00 -1.26 -3.23 121.76 118.59 1ynf s ALA 3 Ca 0.00 -0.42 0.08 0.00 0.00 0.00 0.00 51.96 51.62 1ynf s ALA 3 Cb 0.00 -2.26 -0.04 0.00 0.00 0.00 0.00 23.12 20.82 1ynf s ALA 3 CO 0.00 0.59 -0.18 -1.58 0.00 0.00 0.00 175.76 174.59 1ynf s TRP 4 N -1.63 1.75 -0.21 0.00 0.51 -0.26 -4.20 118.94 114.89 1ynf s TRP 4 Ca 0.41 -0.47 -0.20 0.00 -2.12 0.00 0.00 56.10 53.71 1ynf s TRP 4 Cb -0.12 -0.90 -0.02 0.00 -0.81 0.00 0.00 33.47 31.62 1ynf s TRP 4 CO 0.22 0.27 0.62 -2.00 -0.51 0.00 0.00 176.95 175.55 1ynf s GLU 5 N -2.57 4.18 -0.18 4.98 2.12 -1.26 -0.53 118.70 125.43 1ynf s GLU 5 Ca 0.12 0.57 -0.04 0.00 0.36 0.00 0.00 54.97 55.98 1ynf s GLU 5 Cb -0.07 -3.60 -0.02 0.00 0.26 0.00 0.00 34.13 30.70 1ynf s GLU 5 CO 0.06 -0.28 -0.02 0.08 -0.54 0.00 0.00 175.26 174.55 1ynf s VAL 6 N 2.05 3.87 -0.13 3.70 1.01 -0.20 -4.43 120.40 126.27 1ynf s VAL 6 Ca 0.27 -0.35 -0.21 0.00 0.00 0.00 0.00 61.98 61.69 1ynf s VAL 6 Cb -0.16 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.47 1ynf s VAL 6 CO 0.10 0.46 0.61 0.20 0.00 0.00 0.00 175.10 176.46 1ynf s ASN 7 N 0.76 6.78 -0.28 3.32 0.01 -0.60 -1.16 114.94 123.76 1ynf s ASN 7 Ca -0.01 0.94 -0.05 0.00 -0.71 0.00 0.00 52.86 53.02 1ynf s ASN 7 Cb -0.14 -2.35 0.01 0.00 0.41 0.00 0.00 41.25 39.18 1ynf s ASN 7 CO 0.02 -0.14 0.04 -0.36 -1.51 0.00 0.00 177.10 175.15 1ynf s PHE 8 N 1.20 3.12 0.11 2.20 0.40 -0.34 0.17 117.98 124.83 1ynf s PHE 8 Ca 0.31 -1.09 0.02 0.00 -0.60 0.00 0.00 56.93 55.56 1ynf s PHE 8 Cb -0.16 -2.20 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 1ynf s PHE 8 CO 0.13 -0.60 0.21 -0.51 0.70 0.00 0.00 175.22 175.14 1ynf s ASP 9 N 1.46 6.14 -0.20 1.36 1.11 -0.65 0.13 116.67 126.02 1ynf s ASP 9 Ca 0.02 0.15 -0.19 0.00 0.18 0.00 0.00 52.55 52.71 1ynf s ASP 9 Cb -0.17 -1.82 -0.03 0.00 1.07 0.00 0.00 42.92 41.98 1ynf s ASP 9 CO 0.01 0.12 0.56 -0.83 1.18 0.00 0.00 175.17 176.20 1ynf s GLY 10 N -2.82 2.07 -0.36 0.21 0.00 -0.69 -0.16 107.32 105.57 1ynf s GLY 10 Ca 0.34 -0.35 -0.29 0.00 0.00 0.00 0.00 44.72 44.42 1ynf s GLY 10 CO 0.27 1.17 1.17 -2.27 0.00 0.00 0.00 173.10 173.43 1ynf s LEU 11 N 1.73 3.82 0.14 0.66 2.96 -0.02 -4.90 118.68 123.07 1ynf s LEU 11 Ca 0.26 0.93 -0.35 0.00 -0.22 0.00 0.00 54.13 54.75 1ynf s LEU 11 Cb -0.16 -3.54 -0.16 0.00 0.50 0.00 0.00 46.19 42.83 1ynf s LEU 11 CO 0.10 -1.06 1.34 0.52 -1.32 0.00 0.00 176.35 175.93 1ynf n VAL 12 N 6.28 0.34 -1.65 1.68 0.31 -1.26 -3.41 118.33 120.62 1ynf n VAL 12 Ca 0.13 -0.08 -0.30 0.00 -0.01 0.00 0.00 64.34 64.08 1ynf n VAL 12 Cb 0.47 -1.01 0.09 0.00 -0.91 0.00 0.00 33.84 32.49 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 0.40 1.61 0.52 2.92 0.00 -1.26 -4.73 107.32 106.77 1ynf s GLY 13 Ca 0.79 -0.36 0.30 0.00 0.00 0.00 0.00 44.72 45.44 1ynf s GLY 13 CO 0.47 0.09 2.00 1.41 0.00 0.00 0.00 173.10 177.07 1ynf h LEU 14 N -1.11 0.00 -2.81 0.66 4.07 -1.93 -3.10 115.31 111.10 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 1.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.03 1ynf h LEU 14 CO 0.62 0.11 0.00 0.35 -1.08 0.00 0.00 178.44 178.43 1ynf n THR 15 N -3.35 1.72 -1.69 0.22 -2.24 -1.26 -4.82 114.28 102.86 1ynf n THR 15 Ca -0.01 -1.04 -0.58 0.00 -2.27 0.00 0.00 64.05 60.15 1ynf n THR 15 Cb 0.30 -0.01 -0.07 0.00 -2.10 0.00 0.00 70.33 68.45 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 0.87 1.90 -3.91 4.78 -0.00 -1.17 -4.49 115.22 113.20 1ynf n HIS 16 Ca 0.22 0.65 -0.08 0.00 -0.00 0.00 0.00 57.72 58.52 1ynf n HIS 16 Cb 0.84 -2.40 -0.03 0.00 -0.00 0.00 0.00 29.99 28.40 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 2.94 0.00 -0.21 1.57 -3.43 -1.26 -4.53 115.29 110.37 1ynf s HIS 17 Ca 0.97 -0.43 -0.07 0.00 -0.80 0.00 0.00 55.06 54.74 1ynf s HIS 17 Cb -1.12 0.53 -0.03 0.00 -1.43 0.00 0.00 32.58 30.53 1ynf s HIS 17 CO 0.65 -1.15 0.06 0.71 -2.00 0.00 0.00 174.74 173.00 1ynf s TYR 18 N -3.95 3.14 -0.08 0.38 4.12 -1.26 -4.92 117.35 114.77 1ynf s TYR 18 Ca 0.15 -0.21 0.18 0.00 0.02 0.00 0.00 57.07 57.21 1ynf s TYR 18 Cb -0.04 -2.15 0.37 0.00 -1.52 0.00 0.00 41.96 38.62 1ynf s TYR 18 CO 0.08 -0.12 1.17 0.00 0.02 0.00 0.00 175.55 176.69 1ynf n ALA 19 N 4.24 2.76 -0.47 3.71 0.00 -1.26 -4.65 120.51 124.83 1ynf n ALA 19 Ca -0.16 -2.55 0.00 0.00 0.00 0.00 0.00 53.44 50.72 1ynf n ALA 19 Cb 0.52 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.41 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 -0.25 0.00 -0.77 0.00 -0.00 -1.26 -5.14 115.22 107.79 1ynf n HIS 31 Ca 0.11 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.91 1ynf n HIS 31 Cb 0.91 0.00 0.37 0.00 -0.00 0.00 0.00 29.99 31.26 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 -2.40 4.16 -2.94 -1.40 1.74 -1.26 -4.99 116.66 109.57 1ynf n ARG 32 Ca 0.00 -2.99 -0.39 0.00 -0.77 0.00 0.00 57.85 53.70 1ynf n ARG 32 Cb 0.22 -2.04 -0.06 0.00 -1.02 0.00 0.00 32.46 29.56 1ynf n ARG 32 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1ynf s PHE 33 N -2.32 3.88 -0.01 -1.55 0.40 -1.26 -4.93 117.98 112.19 1ynf s PHE 33 Ca 0.51 1.66 0.01 0.00 -0.60 0.00 0.00 56.93 58.51 1ynf s PHE 33 Cb 0.36 -2.79 -0.01 0.00 0.51 0.00 0.00 43.02 41.09 1ynf s PHE 33 CO 0.19 0.47 0.02 1.04 0.70 0.00 0.00 175.22 177.64 1ynf n GLN 34 N 1.41 1.63 -3.60 0.44 1.13 -1.26 -4.86 117.38 112.26 1ynf n GLN 34 Ca -0.04 -0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.63 1ynf n GLN 34 Cb 0.49 -0.90 -0.11 0.00 0.11 0.00 0.00 30.24 29.83 1ynf n GLN 34 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1ynf s VAL 35 N -1.81 5.16 0.33 5.09 1.01 -1.26 -4.46 120.40 124.46 1ynf s VAL 35 Ca -0.00 0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.10 1ynf s VAL 35 Cb 0.00 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 1ynf s VAL 35 CO 0.03 0.21 0.28 -0.94 0.00 0.00 0.00 175.10 174.68 1ynf s SER 36 N 1.73 5.31 -0.53 3.32 1.04 -0.04 -4.90 113.70 119.64 1ynf s SER 36 Ca 0.07 -0.47 0.04 0.00 0.48 0.00 0.00 55.95 56.07 1ynf s SER 36 Cb -0.16 -1.02 0.15 0.00 0.10 0.00 0.00 66.02 65.08 1ynf s SER 36 CO 0.10 -0.31 0.32 0.21 0.98 0.00 0.00 173.24 174.53 1ynf s ASN 37 N -3.98 3.95 0.18 7.02 3.84 -1.26 -1.45 114.94 123.24 1ynf s ASN 37 Ca 0.40 -3.09 -0.15 0.00 0.21 0.00 0.00 52.86 50.23 1ynf s ASN 37 Cb -0.06 -1.31 0.15 0.00 -0.55 0.00 0.00 41.25 39.48 1ynf s ASN 37 CO 0.26 -0.20 1.67 -0.65 -2.79 0.00 0.00 177.10 175.39 1ynf h PRO 38 N 6.24 0.04 -0.27 0.43 0.11 -1.79 -0.53 132.00 136.22 1ynf h PRO 38 Ca 0.03 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.18 1ynf h PRO 38 Cb 0.87 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 31.94 1ynf h PRO 38 CO 0.59 0.03 0.05 -0.09 -0.21 0.00 0.00 178.00 178.37 1ynf h ARG 39 N 0.04 0.14 -0.35 1.05 2.43 -1.66 -1.36 114.38 114.67 1ynf h ARG 39 Ca 0.23 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.32 1ynf h ARG 39 Cb 0.35 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1ynf h ARG 39 CO -0.45 0.09 -0.09 1.25 -1.51 0.00 0.00 179.97 179.27 1ynf h LEU 40 N 0.15 0.57 -0.45 3.80 5.85 -1.73 -1.43 115.31 122.08 1ynf h LEU 40 Ca 0.13 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1ynf h LEU 40 Cb 0.14 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1ynf h LEU 40 CO -0.17 0.70 0.28 0.00 -0.34 0.00 0.00 178.44 178.91 1ynf h ALA 41 N 1.36 0.57 -0.23 1.25 0.00 -0.45 0.09 119.26 121.84 1ynf h ALA 41 Ca 0.10 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1ynf h ALA 41 Cb 0.48 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1ynf h ALA 41 CO 0.03 0.04 -0.02 0.00 0.00 0.00 0.00 179.25 179.30 1ynf h ALA 42 N 1.14 0.31 -0.82 0.00 0.00 -1.00 -2.62 119.26 116.27 1ynf h ALA 42 Ca 0.16 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1ynf h ALA 42 Cb -0.03 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1ynf h ALA 42 CO -0.03 0.07 0.54 0.87 0.00 0.00 0.00 179.25 180.70 1ynf h LYS 43 N 0.18 1.07 -0.87 0.00 1.79 -1.06 0.63 116.57 118.31 1ynf h LYS 43 Ca 0.06 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1ynf h LYS 43 Cb 0.45 -0.24 -0.04 0.00 -1.58 0.00 0.00 32.23 30.82 1ynf h LYS 43 CO 0.02 0.71 0.51 1.96 -1.08 0.00 0.00 179.45 181.56 1ynf h GLN 44 N 1.11 1.20 -0.45 3.15 4.20 -0.93 0.18 115.11 123.56 1ynf h GLN 44 Ca 0.30 -0.12 -0.14 0.00 0.06 0.00 0.00 58.65 58.75 1ynf h GLN 44 Cb -0.12 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.40 1ynf h GLN 44 CO -0.07 0.86 -0.27 0.78 -0.67 0.00 0.00 178.83 179.46 1ynf h GLY 45 N 1.21 1.07 1.03 3.46 0.00 -0.99 -2.75 103.07 106.10 1ynf h GLY 45 Ca 0.31 -0.99 -0.06 0.00 0.00 0.00 0.00 47.33 46.59 1ynf h GLY 45 CO -0.05 0.90 0.18 1.41 0.00 0.00 0.00 176.54 178.97 1ynf h LEU 46 N 0.83 0.97 -0.65 3.11 4.07 -0.50 -2.91 115.31 120.22 1ynf h LEU 46 Ca 0.09 -0.22 0.01 0.00 0.08 0.00 0.00 57.88 57.84 1ynf h LEU 46 Cb 0.86 -0.25 -0.03 0.00 1.08 0.00 0.00 40.66 42.31 1ynf h LEU 46 CO 0.08 0.94 0.43 -0.07 -1.08 0.00 0.00 178.44 178.73 1ynf h LEU 47 N 0.95 0.74 -1.42 1.67 3.38 -0.87 0.37 115.31 120.13 1ynf h LEU 47 Ca 0.21 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1ynf h LEU 47 Cb 0.33 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1ynf h LEU 47 CO -0.00 0.53 0.00 1.17 0.09 0.00 0.00 178.44 180.23 1ynf n LYS 48 N -4.64 0.13 0.00 1.13 4.81 -1.05 -1.11 118.16 117.44 1ynf n LYS 48 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.49 1ynf n LYS 48 Cb 0.02 -1.22 0.00 0.00 0.02 0.00 0.00 35.03 33.85 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 0.64 0.00 -0.09 1.64 3.00 0.12 -1.98 118.16 121.49 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 0.05 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.09 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 0.36 -0.51 3.14 0.00 -1.36 0.28 119.26 121.17 1ynf h ALA 51 Ca 0.00 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1ynf h ALA 51 Cb 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1ynf h ALA 51 CO 0.00 -0.32 0.18 -0.07 0.00 0.00 0.00 179.25 179.03 1ynf h LEU 52 N 0.21 0.72 0.01 0.00 3.38 -1.65 -1.03 115.31 116.95 1ynf h LEU 52 Ca 0.15 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1ynf h LEU 52 Cb 0.15 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1ynf h LEU 52 CO -0.19 0.72 -0.09 0.00 0.09 0.00 0.00 178.44 178.98 1ynf h ALA 53 N 1.03 -0.10 -0.76 1.53 0.00 -1.49 -1.33 119.26 118.14 1ynf h ALA 53 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.14 1ynf h ALA 53 Cb 0.24 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 1ynf h ALA 53 CO -0.01 -0.58 0.50 -0.44 0.00 0.00 0.00 179.25 178.72 1ynf h ASP 54 N -0.16 0.72 0.13 0.00 5.19 -0.26 -0.31 116.42 121.73 1ynf h ASP 54 Ca 0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1ynf h ASP 54 Cb 0.19 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.55 1ynf h ASP 54 CO -0.08 0.47 0.00 0.00 -3.12 0.00 0.00 179.24 176.51 1ynf n ALA 55 N -2.44 2.23 0.00 3.45 0.00 -0.41 -4.86 120.51 118.49 1ynf n ALA 55 Ca 0.11 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1ynf n ALA 55 Cb 0.21 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 0.39 0.75 3.56 0.00 0.00 -0.13 -5.07 105.19 104.69 1ynf n GLY 56 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 3.20 -0.19 1.61 0.40 -0.57 -5.01 117.98 115.42 1ynf s PHE 57 Ca 0.00 0.11 -0.41 0.00 -0.60 0.00 0.00 56.93 56.03 1ynf s PHE 57 Cb 0.00 -2.76 -0.18 0.00 0.51 0.00 0.00 43.02 40.59 1ynf s PHE 57 CO 0.00 -0.45 1.45 -2.30 0.70 0.00 0.00 175.22 174.62 1ynf n PRO 58 N 5.52 0.56 -4.15 0.24 -0.02 -1.26 -3.73 135.00 132.16 1ynf n PRO 58 Ca -0.07 0.20 -0.15 0.00 -2.02 0.00 0.00 63.50 61.46 1ynf n PRO 58 Cb 0.49 -1.78 -0.13 0.00 -0.02 0.00 0.00 33.50 32.06 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 1.87 0.53 0.33 -0.52 2.00 -1.26 -1.56 119.66 121.05 1ynf s GLN 59 Ca 0.95 -0.46 0.02 0.00 -2.00 0.00 0.00 55.36 53.88 1ynf s GLN 59 Cb -1.21 -0.43 -0.02 0.00 0.80 0.00 0.00 33.01 32.15 1ynf s GLN 59 CO 0.64 0.10 0.36 0.00 -0.50 0.00 0.00 175.29 175.90 1ynf s ALA 60 N -0.66 1.33 0.06 1.58 0.00 0.13 -4.85 121.76 119.35 1ynf s ALA 60 Ca -0.02 -1.80 0.02 0.00 0.00 0.00 0.00 51.96 50.15 1ynf s ALA 60 Cb -0.06 1.33 -0.03 0.00 0.00 0.00 0.00 23.12 24.36 1ynf s ALA 60 CO 0.00 -0.72 -0.08 0.54 0.00 0.00 0.00 175.76 175.51 1ynf s VAL 61 N -3.29 0.60 -0.10 0.00 0.11 -0.29 -1.64 120.40 115.78 1ynf s VAL 61 Ca 0.36 -1.33 0.01 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 0.24 -0.51 -0.14 -0.63 -3.33 0.00 0.00 175.10 170.73 1ynf s ILE 62 N -2.00 1.36 0.81 7.04 1.01 0.77 -4.84 121.20 125.35 1ynf s ILE 62 Ca -0.04 -0.56 -0.11 0.00 0.00 0.00 0.00 60.65 59.94 1ynf s ILE 62 Cb -0.06 -1.26 0.08 0.00 0.01 0.00 0.00 42.46 41.23 1ynf s ILE 62 CO -0.01 0.41 1.09 -2.16 0.00 0.00 0.00 174.94 174.27 1ynf s PRO 63 N 1.04 1.94 1.11 2.79 0.04 -1.26 -0.84 135.00 139.83 1ynf s PRO 63 Ca -0.06 0.99 -0.19 0.00 0.04 0.00 0.00 61.00 61.79 1ynf s PRO 63 Cb -0.15 -1.87 0.26 0.00 0.04 0.00 0.00 34.50 32.78 1ynf s PRO 63 CO -0.02 -1.81 1.23 -1.25 0.04 0.00 0.00 177.00 175.19 1ynf s PRO 64 N -4.94 -0.55 0.46 0.56 0.04 -1.22 -4.73 135.00 124.62 1ynf s PRO 64 Ca 0.62 -0.33 0.07 0.00 0.04 0.00 0.00 61.00 61.40 1ynf s PRO 64 Cb -0.17 -1.70 -0.00 0.00 0.04 0.00 0.00 34.50 32.67 1ynf s PRO 64 CO 0.56 -3.22 0.37 -1.01 0.04 0.00 0.00 177.00 173.74 1ynf s HIS 65 N -3.47 2.28 -0.32 0.56 3.76 -1.26 -5.05 115.29 111.79 1ynf s HIS 65 Ca 0.74 -0.63 -0.29 0.00 -0.15 0.00 0.00 55.06 54.73 1ynf s HIS 65 Cb -0.05 -2.05 -0.02 0.00 1.11 0.00 0.00 32.58 31.57 1ynf s HIS 65 CO 0.55 -0.23 1.73 -2.00 -0.85 0.00 0.00 174.74 173.93 1ynf s GLU 66 N -4.17 3.44 -0.05 1.40 2.12 -1.26 -4.93 118.70 115.25 1ynf s GLU 66 Ca 0.43 1.42 -0.03 0.00 0.36 0.00 0.00 54.97 57.15 1ynf s GLU 66 Cb -0.02 -4.15 0.03 0.00 0.26 0.00 0.00 34.13 30.25 1ynf s GLU 66 CO 0.25 -1.73 0.12 1.03 -0.54 0.00 0.00 175.26 174.39 1ynf s ARG 67 N 5.42 0.09 0.69 4.30 1.81 -1.26 -3.62 118.95 126.38 1ynf s ARG 67 Ca 0.77 0.28 -0.17 0.00 -1.72 0.00 0.00 55.73 54.89 1ynf s ARG 67 Cb -0.22 -0.11 0.02 0.00 -0.45 0.00 0.00 34.95 34.19 1ynf s ARG 67 CO 0.33 -0.12 1.25 -2.14 -0.68 0.00 0.00 175.30 173.95 1ynf s PRO 68 N 0.80 2.31 -0.89 3.54 0.02 -1.26 -4.84 135.00 134.68 1ynf s PRO 68 Ca -0.06 1.92 -0.14 0.00 0.02 0.00 0.00 61.00 62.74 1ynf s PRO 68 Cb -0.08 -1.83 0.22 0.00 0.02 0.00 0.00 34.50 32.82 1ynf s PRO 68 CO -0.04 -1.74 0.87 0.12 -0.33 0.00 0.00 177.00 175.88 1ynf s PHE 69 N -1.68 3.76 0.28 6.54 5.36 0.19 -4.92 117.98 127.51 1ynf s PHE 69 Ca 0.79 -2.03 -0.02 0.00 -0.96 0.00 0.00 56.93 54.71 1ynf s PHE 69 Cb -0.33 -3.89 0.43 0.00 -0.34 0.00 0.00 43.02 38.89 1ynf s PHE 69 CO 0.42 -1.05 1.90 0.82 -1.46 0.00 0.00 175.22 175.85 1ynf h ILE 70 N 4.73 1.10 -1.01 3.12 1.08 -1.88 -3.08 117.51 121.57 1ynf h ILE 70 Ca 0.13 -0.40 0.24 0.00 -0.39 0.00 0.00 64.86 64.45 1ynf h ILE 70 Cb 1.01 -0.15 -0.10 0.00 -3.07 0.00 0.00 36.82 34.51 1ynf h ILE 70 CO 0.84 0.21 0.63 -0.65 -0.69 0.00 0.00 178.15 178.49 1ynf h PRO 71 N 1.15 0.50 0.00 2.37 0.11 -1.99 0.15 132.00 134.30 1ynf h PRO 71 Ca 0.41 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.39 1ynf h PRO 71 Cb 0.13 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 1ynf h PRO 71 CO -0.15 0.33 -0.46 -0.24 -0.21 0.00 0.00 178.00 177.27 1ynf h VAL 72 N 0.52 0.94 -0.27 3.15 3.04 -1.97 -2.17 116.25 119.49 1ynf h VAL 72 Ca 0.60 -1.86 -0.11 0.00 -1.01 0.00 0.00 66.70 64.32 1ynf h VAL 72 Cb 1.29 2.14 -0.01 0.00 -2.01 0.00 0.00 31.29 32.70 1ynf h VAL 72 CO -0.36 0.45 -0.30 -0.07 -1.01 0.00 0.00 177.57 176.28 1ynf h LEU 73 N 0.00 0.56 -0.61 3.16 3.38 -0.83 -1.41 115.31 119.56 1ynf h LEU 73 Ca -0.00 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.63 1ynf h LEU 73 Cb 1.10 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 1ynf h LEU 73 CO 0.06 0.84 -0.19 0.03 0.09 0.00 0.00 178.44 179.26 1ynf h ARG 74 N 0.47 0.89 0.00 1.13 3.08 -1.07 -2.05 114.38 116.84 1ynf h ARG 74 Ca 0.06 -0.36 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 1ynf h ARG 74 Cb 0.77 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.77 1ynf h ARG 74 CO 0.06 1.01 -0.06 1.96 -1.07 0.00 0.00 179.97 181.86 1ynf h GLN 75 N 0.78 0.00 -0.08 0.04 4.20 -0.87 -1.13 115.11 118.05 1ynf h GLN 75 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1ynf h GLN 75 Cb 0.74 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.52 1ynf h GLN 75 CO 0.06 0.06 0.00 1.28 -0.67 0.00 0.00 178.83 179.56 1ynf n LEU 76 N -4.29 0.92 0.00 1.46 4.77 -0.58 -4.92 117.00 114.37 1ynf n LEU 76 Ca -0.03 -0.37 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 1ynf n LEU 76 Cb 0.15 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1ynf n LEU 76 CO 0.33 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1ynf n GLY 77 N 1.01 0.63 3.62 -0.72 0.00 -0.43 -5.07 105.19 104.22 1ynf n GLY 77 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 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 3.28 0.43 1.61 0.40 -1.02 -5.02 117.98 115.67 1ynf s PHE 78 Ca 0.00 0.53 0.07 0.00 -0.60 0.00 0.00 56.93 56.94 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 -0.20 0.33 -1.54 0.70 0.00 0.00 175.22 174.51 1ynf s SER 79 N 1.49 4.82 0.00 1.36 1.04 -1.26 -3.93 113.70 117.22 1ynf s SER 79 Ca 0.18 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.71 1ynf s SER 79 Cb -0.16 -0.41 0.00 0.00 0.10 0.00 0.00 66.02 65.56 1ynf s SER 79 CO 0.09 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.23 1ynf n GLY 80 N -1.50 0.31 3.92 7.32 0.00 -1.26 -4.18 105.19 109.79 1ynf n GLY 80 Ca 0.02 -2.22 -0.27 0.00 0.00 0.00 0.00 46.02 43.55 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 5.33 0.28 1.61 1.04 -1.26 -4.77 113.70 111.93 1ynf s SER 81 Ca 0.00 0.66 0.02 0.00 0.48 0.00 0.00 55.95 57.11 1ynf s SER 81 Cb 0.00 -1.53 0.63 0.00 0.10 0.00 0.00 66.02 65.22 1ynf s SER 81 CO 0.00 -1.26 1.75 0.44 0.98 0.00 0.00 173.24 175.15 1ynf h ASP 82 N -0.35 0.55 0.20 7.02 5.19 -1.99 0.20 116.42 127.24 1ynf h ASP 82 Ca -0.45 0.11 -0.17 0.00 -0.62 0.00 0.00 57.03 55.90 1ynf h ASP 82 Cb 1.28 0.02 -0.01 0.00 0.18 0.00 0.00 39.33 40.80 1ynf h ASP 82 CO 0.61 0.19 -0.64 -0.33 -3.12 0.00 0.00 179.24 175.94 1ynf h GLU 83 N 0.61 0.43 -0.32 3.56 5.08 -1.99 -2.01 114.58 119.93 1ynf h GLU 83 Ca 0.51 -0.31 -0.15 0.00 -1.00 0.00 0.00 59.36 58.42 1ynf h GLU 83 Cb 0.80 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.10 1ynf h GLU 83 CO -0.40 0.93 -0.38 1.96 -1.00 0.00 0.00 179.01 180.11 1ynf h GLN 84 N 0.31 0.82 -0.26 2.33 4.20 -1.48 -0.69 115.11 120.35 1ynf h GLN 84 Ca -0.01 -0.46 0.01 0.00 0.06 0.00 0.00 58.65 58.25 1ynf h GLN 84 Cb 1.19 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.99 1ynf h GLN 84 CO 0.11 1.09 0.16 0.28 -0.67 0.00 0.00 178.83 179.80 1ynf h VAL 85 N 0.60 1.04 -0.77 -0.54 2.07 -0.67 0.35 116.25 118.34 1ynf h VAL 85 Ca 0.04 -0.11 0.05 0.00 0.82 0.00 0.00 66.70 67.50 1ynf h VAL 85 Cb 0.97 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.38 1ynf h VAL 85 CO 0.09 0.06 0.47 0.25 0.02 0.00 0.00 177.57 178.46 1ynf h LEU 86 N 0.32 0.75 -0.27 2.57 5.85 -1.23 -0.03 115.31 123.27 1ynf h LEU 86 Ca 0.10 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1ynf h LEU 86 Cb -0.02 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 1ynf h LEU 86 CO -0.04 0.50 -0.01 -0.33 -0.34 0.00 0.00 178.44 178.22 1ynf h GLU 87 N 0.89 0.48 -0.53 1.25 5.08 -0.42 -0.74 114.58 120.58 1ynf h GLU 87 Ca 0.32 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1ynf h GLU 87 Cb 0.10 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1ynf h GLU 87 CO -0.15 0.64 0.34 0.87 -1.00 0.00 0.00 179.01 179.72 1ynf h LYS 88 N 0.25 0.67 -0.41 2.33 1.57 0.19 -0.55 116.57 120.62 1ynf h LYS 88 Ca 0.07 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.74 1ynf h LYS 88 Cb 0.43 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1ynf h LYS 88 CO 0.01 0.44 -0.02 0.28 -0.57 0.00 0.00 179.45 179.60 1ynf h VAL 89 N 0.69 1.26 -0.61 0.50 2.07 -0.95 0.49 116.25 119.70 1ynf h VAL 89 Ca 0.20 -1.05 0.05 0.00 0.82 0.00 0.00 66.70 66.72 1ynf h VAL 89 Cb -0.06 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.79 1ynf h VAL 89 CO -0.06 0.36 0.33 0.00 0.02 0.00 0.00 177.57 178.22 1ynf h ALA 90 N 0.88 0.81 0.02 1.67 0.00 -0.81 0.38 119.26 122.21 1ynf h ALA 90 Ca 0.11 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1ynf h ALA 90 Cb 0.51 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ynf h ALA 90 CO 0.02 0.01 -0.22 0.07 0.00 0.00 0.00 179.25 179.13 1ynf h ARG 91 N 0.63 0.12 0.09 0.00 0.11 -0.89 -3.33 114.38 111.11 1ynf h ARG 91 Ca 0.27 -0.15 -0.19 0.00 0.10 0.00 0.00 59.98 60.02 1ynf h ARG 91 Cb 0.16 0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.29 1ynf h ARG 91 CO -0.17 0.96 -0.91 1.96 0.10 0.00 0.00 179.97 181.90 1ynf h GLN 92 N -0.65 0.19 -1.42 0.08 4.20 0.04 -3.43 115.11 114.12 1ynf h GLN 92 Ca -0.03 -0.33 -0.45 0.00 0.06 0.00 0.00 58.65 57.90 1ynf h GLN 92 Cb 1.05 0.12 -0.32 0.00 0.30 0.00 0.00 27.48 28.63 1ynf h GLN 92 CO 0.04 1.16 -0.94 0.00 -0.67 0.00 0.00 178.83 178.41 1ynf n ALA 93 N -2.84 1.28 0.30 3.87 0.00 0.52 -4.99 120.51 118.65 1ynf n ALA 93 Ca -0.19 -2.83 0.16 0.00 0.00 0.00 0.00 53.44 50.59 1ynf n ALA 93 Cb 0.77 -0.97 0.81 0.00 0.00 0.00 0.00 19.45 20.06 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 3.71 0.00 0.00 0.00 0.13 -0.51 -2.35 132.00 132.98 1ynf h PRO 94 Ca 0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.13 1ynf h PRO 94 Cb 0.95 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.08 1ynf h PRO 94 CO 0.41 0.00 -0.09 1.12 -0.23 0.00 0.00 178.00 179.22 1ynf h HIS 95 N 0.00 0.00 0.00 1.56 2.07 -1.92 -2.20 115.15 114.66 1ynf h HIS 95 Ca 0.03 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.45 1ynf h HIS 95 Cb 0.71 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.68 1ynf h HIS 95 CO 0.00 0.09 -0.47 -1.49 -3.07 0.00 0.00 177.93 172.98 1ynf h TRP 96 N 0.00 0.00 -0.49 6.12 -0.00 -1.77 -3.19 115.95 116.62 1ynf h TRP 96 Ca -0.00 0.00 0.08 0.00 -0.00 0.00 0.00 58.89 58.97 1ynf h TRP 96 Cb 0.38 0.00 -0.07 0.00 -0.00 0.00 0.00 29.16 29.47 1ynf h TRP 96 CO 0.00 0.47 0.10 -0.07 -0.00 0.00 0.00 178.44 178.94 1ynf h LEU 97 N 0.00 -0.00 -0.59 -4.49 3.38 -1.59 -1.56 115.31 110.45 1ynf h LEU 97 Ca -0.00 0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1ynf h LEU 97 Cb 0.92 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 1ynf h LEU 97 CO 0.06 0.03 0.22 -1.28 0.09 0.00 0.00 178.44 177.56 1ynf h SER 98 N 0.23 0.84 0.44 -0.43 0.87 -1.70 -2.26 113.55 111.54 1ynf h SER 98 Ca 0.25 -0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 1ynf h SER 98 Cb 0.33 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1ynf h SER 98 CO -0.32 0.79 -0.07 0.28 -0.53 0.00 0.00 176.83 176.98 1ynf h SER 99 N 0.83 0.00 -0.32 6.23 0.02 -1.39 -2.37 113.55 116.55 1ynf h SER 99 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1ynf h SER 99 Cb 0.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1ynf h SER 99 CO -0.01 0.07 0.00 0.55 -1.14 0.00 0.00 176.83 176.29 1ynf n VAL 100 N -3.39 1.38 -1.16 2.27 3.14 -0.67 -4.40 118.33 115.51 1ynf n VAL 100 Ca -0.02 -1.26 0.05 0.00 -2.96 0.00 0.00 64.34 60.16 1ynf n VAL 100 Cb 0.22 0.28 0.08 0.00 -1.06 0.00 0.00 33.84 33.35 1ynf n VAL 100 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1ynf n SER 101 N 0.21 1.54 -4.77 6.55 7.64 -0.88 -0.64 113.62 123.27 1ynf n SER 101 Ca 0.14 -2.52 -0.38 0.00 1.01 0.00 0.00 58.87 57.12 1ynf n SER 101 Cb 0.56 -0.28 -0.05 0.00 -1.01 0.00 0.00 64.21 63.43 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 -1.95 7.06 -0.15 6.43 0.15 -1.19 -4.59 113.70 119.46 1ynf s SER 102 Ca 0.17 2.06 0.10 0.00 0.70 0.00 0.00 55.95 58.98 1ynf s SER 102 Cb 0.15 -2.60 0.56 0.00 -1.71 0.00 0.00 66.02 62.43 1ynf s SER 102 CO 0.02 -0.28 1.37 0.00 1.20 0.00 0.00 173.24 175.55 1ynf n ALA 103 N 0.48 3.40 0.01 5.45 0.00 -1.26 -4.56 120.51 124.03 1ynf n ALA 103 Ca 0.02 -1.30 0.23 0.00 0.00 0.00 0.00 53.44 52.39 1ynf n ALA 103 Cb 0.48 -1.08 0.70 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 2.80 0.00 0.00 0.00 4.64 -1.94 -3.42 113.55 115.63 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 1.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 1ynf h SER 104 CO 0.32 0.00 0.98 -0.81 -0.87 0.00 0.00 176.83 176.45 1ynf n PRO 105 N -3.69 0.00 -1.27 4.77 -0.04 -1.26 -4.74 135.00 128.77 1ynf n PRO 105 Ca 0.11 -0.49 0.00 0.00 -0.04 0.00 0.00 63.50 63.08 1ynf n PRO 105 Cb 0.80 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 1ynf n PRO 105 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1ynf n TRP 107 N 4.93 0.00 0.58 0.54 8.01 -1.26 -4.89 117.44 125.36 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 0.31 0.00 -2.01 0.00 0.00 31.31 29.61 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 -0.14 0.66 0.28 -0.99 0.24 -1.10 -1.98 118.33 115.30 1ynf n VAL 108 Ca 0.00 0.17 0.15 0.00 -2.04 0.00 0.00 64.34 62.62 1ynf n VAL 108 Cb 0.00 -0.97 0.81 0.00 -1.47 0.00 0.00 33.84 32.22 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 2.58 1.22 -0.06 2.33 0.00 -1.52 -1.11 119.26 122.71 1ynf h ALA 109 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ynf h ALA 109 Cb 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ynf h ALA 109 CO 0.00 0.10 0.00 0.09 0.00 0.00 0.00 179.25 179.44 1ynf n ASN 110 N -3.50 2.96 -0.20 0.00 5.03 -0.84 -1.07 115.26 117.64 1ynf n ASN 110 Ca -0.02 -1.97 -0.06 0.00 0.87 0.00 0.00 54.58 53.40 1ynf n ASN 110 Cb 0.21 -0.02 0.09 0.00 -1.02 0.00 0.00 39.78 39.03 1ynf n ASN 110 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ynf h ALA 111 N 4.67 1.00 -2.45 5.41 0.00 -1.33 -3.40 119.26 123.16 1ynf h ALA 111 Ca 0.00 -0.26 0.20 0.00 0.00 0.00 0.00 54.91 54.85 1ynf h ALA 111 Cb 0.97 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1ynf h ALA 111 CO 0.00 0.63 0.65 0.00 0.00 0.00 0.00 179.25 180.54 1ynf s ALA 112 N -5.16 -1.78 -0.10 0.00 0.00 -1.26 -1.54 121.76 111.93 1ynf s ALA 112 Ca -0.11 -0.26 0.02 0.00 0.00 0.00 0.00 51.96 51.61 1ynf s ALA 112 Cb 0.15 0.79 -0.02 0.00 0.00 0.00 0.00 23.12 24.04 1ynf s ALA 112 CO 0.84 -1.08 -0.16 0.99 0.00 0.00 0.00 175.76 176.35 1ynf s THR 113 N -2.14 2.84 -0.09 0.00 2.01 -0.54 -0.43 115.64 117.30 1ynf s THR 113 Ca 0.23 -0.76 -0.03 0.00 0.31 0.00 0.00 61.69 61.45 1ynf s THR 113 Cb -0.02 -2.15 -0.03 0.00 0.01 0.00 0.00 72.50 70.31 1ynf s THR 113 CO 0.04 0.55 0.02 -0.63 -0.69 0.00 0.00 174.62 173.91 1ynf s ILE 114 N 0.03 4.47 -0.26 1.82 -1.09 -1.26 -1.92 121.20 122.98 1ynf s ILE 114 Ca -0.05 -0.19 0.00 0.00 -2.23 0.00 0.00 60.65 58.18 1ynf s ILE 114 Cb -0.15 -2.89 0.08 0.00 -1.58 0.00 0.00 42.46 37.92 1ynf s ILE 114 CO 0.05 0.61 0.01 0.00 -1.23 0.00 0.00 174.94 174.38 1ynf s ALA 115 N -0.89 1.78 0.66 9.38 0.00 -0.09 -5.02 121.76 127.59 1ynf s ALA 115 Ca 0.13 -1.46 -0.18 0.00 0.00 0.00 0.00 51.96 50.46 1ynf s ALA 115 Cb -0.11 -1.50 -0.00 0.00 0.00 0.00 0.00 23.12 21.50 1ynf s ALA 115 CO 0.02 -1.37 1.28 -2.30 0.00 0.00 0.00 175.76 173.39 1ynf n PRO 116 N 4.74 1.02 0.29 0.00 -0.02 -1.26 -1.82 135.00 137.95 1ynf n PRO 116 Ca -0.07 0.41 0.19 0.00 -2.02 0.00 0.00 63.50 62.01 1ynf n PRO 116 Cb 0.44 -2.52 1.01 0.00 -0.02 0.00 0.00 33.50 32.41 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 0.39 0.00 0.83 2.55 4.64 -1.83 -0.19 113.55 119.93 1ynf h SER 117 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1ynf h SER 117 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1ynf h SER 117 CO 0.52 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.48 1ynf n ALA 118 N -1.97 1.90 0.31 5.18 0.00 -1.26 -3.17 120.51 121.50 1ynf n ALA 118 Ca -0.02 -0.02 0.03 0.00 0.00 0.00 0.00 53.44 53.43 1ynf n ALA 118 Cb 0.11 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.17 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 -1.84 0.64 -4.87 0.00 8.00 -0.09 -4.15 116.55 114.24 1ynf n ASP 119 Ca 0.04 -0.82 -0.32 0.00 0.71 0.00 0.00 54.79 54.40 1ynf n ASP 119 Cb 0.26 0.75 -0.05 0.00 -0.02 0.00 0.00 41.12 42.06 1ynf n ASP 119 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1ynf s THR 120 N -1.38 4.90 0.07 -3.53 -4.23 -1.19 -2.60 115.64 107.68 1ynf s THR 120 Ca 0.04 0.54 0.24 0.00 -1.18 0.00 0.00 61.69 61.33 1ynf s THR 120 Cb 0.05 -3.62 0.23 0.00 1.34 0.00 0.00 72.50 70.50 1ynf s THR 120 CO 0.23 -0.08 1.78 -0.07 -0.54 0.00 0.00 174.62 175.95 1ynf h LEU 121 N 2.54 0.00 -3.00 4.79 3.38 -1.60 -3.01 115.31 118.40 1ynf h LEU 121 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1ynf h LEU 121 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1ynf h LEU 121 CO 0.69 0.23 0.00 -0.90 0.09 0.00 0.00 178.44 178.54 1ynf n ASP 122 N -3.34 3.60 -0.29 -0.43 5.75 -1.26 -4.98 116.55 115.60 1ynf n ASP 122 Ca 0.01 -2.30 -0.04 0.00 -0.01 0.00 0.00 54.79 52.44 1ynf n ASP 122 Cb 0.46 -0.39 -0.02 0.00 -1.03 0.00 0.00 41.12 40.14 1ynf n ASP 122 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ynf n GLY 123 N 0.53 0.46 3.85 6.12 0.00 -1.14 -5.00 105.19 110.02 1ynf n GLY 123 Ca 0.18 -0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.99 2.63 -0.13 1.61 1.02 -1.26 -4.76 119.74 116.85 1ynf s LYS 124 Ca 0.00 -1.39 -0.23 0.00 0.02 0.00 0.00 55.97 54.36 1ynf s LYS 124 Cb 0.00 -2.42 -0.03 0.00 -0.52 0.00 0.00 37.83 34.87 1ynf s LYS 124 CO 0.00 0.01 0.72 0.08 -0.92 0.00 0.00 175.35 175.23 1ynf s VAL 125 N -2.37 4.99 -0.09 3.17 1.01 -0.38 -3.96 120.40 122.77 1ynf s VAL 125 Ca 0.43 1.43 0.01 0.00 0.00 0.00 0.00 61.98 63.84 1ynf s VAL 125 Cb -0.05 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 1ynf s VAL 125 CO 0.27 0.14 -0.09 -1.00 0.00 0.00 0.00 175.10 174.42 1ynf s HIS 126 N 1.52 2.89 -0.08 5.22 3.76 -0.76 -0.20 115.29 127.64 1ynf s HIS 126 Ca 0.35 -0.15 -0.01 0.00 -0.15 0.00 0.00 55.06 55.11 1ynf s HIS 126 Cb -0.17 -1.75 0.03 0.00 1.11 0.00 0.00 32.58 31.80 1ynf s HIS 126 CO 0.14 0.18 -0.02 -0.51 -0.85 0.00 0.00 174.74 173.68 1ynf s LEU 127 N -0.47 0.79 -0.24 0.89 1.02 -0.37 -0.92 118.68 119.38 1ynf s LEU 127 Ca 0.07 -0.14 -0.04 0.00 0.02 0.00 0.00 54.13 54.04 1ynf s LEU 127 Cb -0.12 -0.53 -0.00 0.00 0.02 0.00 0.00 46.19 45.56 1ynf s LEU 127 CO 0.02 -0.16 -0.01 -0.89 0.02 0.00 0.00 176.35 175.32 1ynf s THR 128 N 1.82 3.48 0.34 5.49 2.01 -0.81 -0.31 115.64 127.66 1ynf s THR 128 Ca 0.03 -0.61 -0.29 0.00 0.31 0.00 0.00 61.69 61.14 1ynf s THR 128 Cb -0.12 -2.66 -0.11 0.00 0.01 0.00 0.00 72.50 69.61 1ynf s THR 128 CO -0.05 0.30 1.50 -0.69 -0.69 0.00 0.00 174.62 174.99 1ynf s VAL 129 N 1.47 2.18 0.00 3.82 1.01 -0.74 -1.46 120.40 126.67 1ynf s VAL 129 Ca 0.04 0.17 -0.23 0.00 0.00 0.00 0.00 61.98 61.96 1ynf s VAL 129 Cb -0.15 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.07 1ynf s VAL 129 CO -0.02 0.03 0.68 0.00 0.00 0.00 0.00 175.10 175.80 1ynf s ALA 130 N -0.69 3.41 0.23 5.51 0.00 -0.59 -3.67 121.76 125.96 1ynf s ALA 130 Ca 0.56 0.15 0.21 0.00 0.00 0.00 0.00 51.96 52.87 1ynf s ALA 130 Cb -0.46 -2.88 0.86 0.00 0.00 0.00 0.00 23.12 20.64 1ynf s ALA 130 CO 0.56 0.08 1.82 -2.95 0.00 0.00 0.00 175.76 175.27 1ynf h ASN 131 N 5.84 0.00 -6.55 0.00 7.08 -1.83 -3.41 115.58 116.71 1ynf h ASN 131 Ca -0.44 0.00 -0.51 0.00 -3.08 0.00 0.00 56.30 52.27 1ynf h ASN 131 Cb 1.20 0.00 -0.11 0.00 -2.08 0.00 0.00 38.32 37.34 1ynf h ASN 131 CO 0.71 0.30 -0.84 0.18 -2.08 0.00 0.00 177.43 175.70 1ynf n LEU 132 N -3.58 -2.11 0.16 6.14 4.77 -0.19 -4.33 117.00 117.85 1ynf n LEU 132 Ca -0.01 -0.97 0.05 0.00 -0.03 0.00 0.00 56.01 55.06 1ynf n LEU 132 Cb 0.44 -2.24 0.49 0.00 -2.33 0.00 0.00 43.42 39.77 1ynf n LEU 132 CO 0.35 0.38 0.99 -1.13 -1.33 0.00 0.00 177.39 176.65 1ynf h ASN 133 N -1.75 0.16 -0.88 -1.43 -0.73 -1.91 -2.97 115.58 106.07 1ynf h ASN 133 Ca -0.61 -0.02 0.09 0.00 1.87 0.00 0.00 56.30 57.63 1ynf h ASN 133 Cb 1.38 -0.04 -0.07 0.00 0.27 0.00 0.00 38.32 39.85 1ynf h ASN 133 CO 0.69 0.23 0.53 -1.13 -0.37 0.00 0.00 177.43 177.38 1ynf h ASN 134 N 0.18 0.79 -3.55 1.15 -0.73 -1.89 -3.40 115.58 108.13 1ynf h ASN 134 Ca 0.04 0.04 -0.65 0.00 1.87 0.00 0.00 56.30 57.60 1ynf h ASN 134 Cb 0.19 -0.12 -0.24 0.00 0.27 0.00 0.00 38.32 38.41 1ynf h ASN 134 CO 0.01 0.46 -0.66 -0.54 -0.37 0.00 0.00 177.43 176.33 1ynf s LYS 135 N -6.03 3.57 0.18 6.67 -0.14 -1.23 -5.02 119.74 117.75 1ynf s LYS 135 Ca -0.12 -0.53 -0.19 0.00 -1.36 0.00 0.00 55.97 53.77 1ynf s LYS 135 Cb 0.20 -3.21 0.13 0.00 -1.68 0.00 0.00 37.83 33.27 1ynf s LYS 135 CO 0.79 -0.17 1.62 0.35 -0.76 0.00 0.00 175.35 177.17 1ynf h PHE 136 N 8.13 -0.60 0.00 3.18 3.04 -1.85 0.81 116.94 129.65 1ynf h PHE 136 Ca -0.39 0.06 -0.01 0.00 3.98 0.00 0.00 57.97 61.60 1ynf h PHE 136 Cb 1.17 0.34 -0.00 0.00 2.56 0.00 0.00 35.95 40.02 1ynf h PHE 136 CO 0.64 -0.32 -0.04 1.12 -2.02 0.00 0.00 178.31 177.69 1ynf h HIS 137 N -0.13 0.00 0.00 0.41 2.07 -1.94 -2.20 115.15 113.36 1ynf h HIS 137 Ca 0.23 0.00 -0.17 0.00 -2.85 0.00 0.00 60.37 57.57 1ynf h HIS 137 Cb 0.48 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.43 1ynf h HIS 137 CO -0.51 0.04 -1.38 0.00 -3.07 0.00 0.00 177.93 173.01 1ynf h ARG 138 N 0.00 0.00 0.00 5.12 3.08 -1.50 -3.32 114.38 117.76 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 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1ynf h ARG 138 CO 0.01 0.32 0.00 0.66 -1.07 0.00 0.00 179.97 179.88 1ynf h SER 139 N 0.00 0.00 1.05 7.04 4.64 -0.24 -1.55 113.55 124.49 1ynf h SER 139 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1ynf h SER 139 Cb 1.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 1ynf h SER 139 CO 0.05 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.94 1ynf h LEU 140 N 0.00 0.00 -0.14 5.97 3.38 -1.64 -3.32 115.31 119.57 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 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ynf h LEU 140 CO 0.00 0.00 -0.07 -0.33 0.09 0.00 0.00 178.44 178.13 1ynf h GLU 141 N 0.00 0.28 -0.65 1.13 5.08 -1.49 -3.39 114.58 115.54 1ynf h GLU 141 Ca 0.00 -0.12 0.07 0.00 -1.00 0.00 0.00 59.36 58.30 1ynf h GLU 141 Cb 0.53 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.68 1ynf h GLU 141 CO 0.00 0.62 -0.35 0.00 -1.00 0.00 0.00 179.01 178.27 1ynf n ALA 142 N -2.37 -0.34 -0.13 3.43 0.00 -1.25 -0.74 120.51 119.12 1ynf n ALA 142 Ca -0.06 0.57 -0.04 0.00 0.00 0.00 0.00 53.44 53.91 1ynf n ALA 142 Cb 0.29 -0.14 0.04 0.00 0.00 0.00 0.00 19.45 19.64 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 0.16 -0.16 0.00 0.11 -1.87 0.12 132.00 130.36 1ynf h PRO 143 Ca 0.13 -0.01 -0.18 0.00 0.11 0.00 0.00 66.00 66.05 1ynf h PRO 143 Cb 0.29 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.37 1ynf h PRO 143 CO -0.62 0.10 -0.64 0.28 -0.21 0.00 0.00 178.00 176.91 1ynf h VAL 144 N 0.16 1.33 -0.64 3.15 2.07 -1.51 -2.69 116.25 118.11 1ynf h VAL 144 Ca 0.20 -1.93 -0.03 0.00 0.82 0.00 0.00 66.70 65.77 1ynf h VAL 144 Cb 0.27 1.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.91 1ynf h VAL 144 CO -0.30 0.60 0.29 0.74 0.02 0.00 0.00 177.57 178.91 1ynf h THR 145 N 0.42 1.21 -0.35 2.57 2.02 -0.46 -1.19 112.91 117.14 1ynf h THR 145 Ca -0.01 -0.63 -0.03 0.00 0.77 0.00 0.00 66.41 66.51 1ynf h THR 145 Cb 1.22 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 1ynf h THR 145 CO 0.12 0.26 0.12 -0.08 0.37 0.00 0.00 175.52 176.31 1ynf h GLU 146 N 0.91 0.54 -0.52 6.66 4.81 -0.60 -1.28 114.58 125.10 1ynf h GLU 146 Ca 0.22 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 1ynf h GLU 146 Cb 0.13 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 1ynf h GLU 146 CO -0.03 0.55 0.31 0.77 -0.73 0.00 0.00 179.01 179.89 1ynf h SER 147 N 0.42 0.50 -0.28 1.04 0.02 -1.11 -1.46 113.55 112.69 1ynf h SER 147 Ca 0.12 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1ynf h SER 147 Cb 0.23 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1ynf h SER 147 CO -0.01 0.35 0.16 -0.07 -1.14 0.00 0.00 176.83 176.13 1ynf h LEU 148 N 0.62 0.35 -1.00 5.07 3.38 -1.03 -1.57 115.31 121.12 1ynf h LEU 148 Ca 0.21 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1ynf h LEU 148 Cb 0.03 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1ynf h LEU 148 CO -0.10 0.32 0.39 -0.07 0.09 0.00 0.00 178.44 179.07 1ynf h LEU 149 N 0.35 0.99 -1.18 1.67 3.38 -0.97 -0.85 115.31 118.69 1ynf h LEU 149 Ca 0.10 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1ynf h LEU 149 Cb 0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1ynf h LEU 149 CO -0.02 0.82 -0.23 0.11 0.09 0.00 0.00 178.44 179.22 1ynf h LYS 150 N 1.09 0.00 0.00 1.13 1.57 -1.01 0.40 116.57 119.75 1ynf h LYS 150 Ca 0.27 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.98 1ynf h LYS 150 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1ynf h LYS 150 CO -0.04 0.23 -0.77 0.00 -0.57 0.00 0.00 179.45 178.30 1ynf h ALA 151 N 1.77 0.69 0.04 3.86 0.00 -0.52 -3.06 119.26 122.04 1ynf h ALA 151 Ca -0.00 -0.32 -0.31 0.00 0.00 0.00 0.00 54.91 54.28 1ynf h ALA 151 Cb 0.72 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1ynf h ALA 151 CO 0.03 0.38 -1.69 -0.89 0.00 0.00 0.00 179.25 177.08 1ynf n ILE 152 N -2.96 1.61 -3.00 0.00 5.41 -0.40 -4.37 119.36 115.66 1ynf n ILE 152 Ca -0.01 -0.29 -0.37 0.00 1.00 0.00 0.00 62.75 63.07 1ynf n ILE 152 Cb 0.66 -1.90 -0.01 0.00 -0.71 0.00 0.00 39.64 37.68 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 -4.05 2.85 0.09 1.39 3.01 0.14 -1.59 117.46 119.30 1ynf n PHE 153 Ca -0.35 -3.06 -0.05 0.00 1.01 0.00 0.00 57.45 55.00 1ynf n PHE 153 Cb 0.84 -1.01 0.01 0.00 -0.01 0.00 0.00 39.48 39.31 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 4.62 0.05 -2.22 4.37 -1.24 -1.73 -3.43 115.58 116.00 1ynf h ASN 154 Ca 0.27 -0.04 -0.52 0.00 0.71 0.00 0.00 56.30 56.72 1ynf h ASN 154 Cb 0.54 -0.02 -0.03 0.00 0.73 0.00 0.00 38.32 39.55 1ynf h ASN 154 CO 1.14 0.86 1.33 -0.62 -1.29 0.00 0.00 177.43 178.85 1ynf s ASP 155 N -6.81 5.45 0.17 1.15 -1.08 -1.26 -4.85 116.67 109.44 1ynf s ASP 155 Ca -0.01 0.67 0.19 0.00 -0.52 0.00 0.00 52.55 52.88 1ynf s ASP 155 Cb 0.11 -2.53 0.83 0.00 -1.46 0.00 0.00 42.92 39.87 1ynf s ASP 155 CO 0.80 -2.17 1.58 -0.62 0.52 0.00 0.00 175.17 175.28 1ynf n GLU 156 N 8.91 0.12 0.15 4.34 1.02 -1.26 -0.56 120.64 133.36 1ynf n GLU 156 Ca 0.22 0.40 0.12 0.00 -0.02 0.00 0.00 57.16 57.88 1ynf n GLU 156 Cb 0.51 -1.75 0.24 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 4.39 -1.99 -3.35 114.58 117.12 1ynf h GLU 157 Ca 0.00 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.54 1ynf h GLU 157 Cb 0.26 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.88 1ynf h GLU 157 CO 0.00 0.00 -1.60 1.63 -1.16 0.00 0.00 179.01 177.88 1ynf n LYS 158 N -2.65 2.26 -4.70 2.33 4.76 -0.77 -4.90 118.16 114.49 1ynf n LYS 158 Ca 0.04 0.01 -0.26 0.00 -2.87 0.00 0.00 58.31 55.23 1ynf n LYS 158 Cb 0.49 -1.22 -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 -2.21 1.80 -0.23 2.13 0.40 0.28 -1.25 117.98 118.90 1ynf s PHE 159 Ca -0.06 -0.37 -0.01 0.00 -0.60 0.00 0.00 56.93 55.89 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 0.34 0.07 0.02 0.45 0.70 0.00 0.00 175.22 176.80 1ynf s SER 160 N -1.04 3.44 -0.23 1.36 0.15 0.72 -4.26 113.70 113.84 1ynf s SER 160 Ca 0.07 -1.10 -0.14 0.00 0.70 0.00 0.00 55.95 55.49 1ynf s SER 160 Cb -0.09 -0.84 -0.04 0.00 -1.71 0.00 0.00 66.02 63.34 1ynf s SER 160 CO 0.01 -0.30 0.30 -0.69 1.20 0.00 0.00 173.24 173.76 1ynf s VAL 161 N 1.65 5.26 -0.06 4.45 1.01 -1.26 -1.23 120.40 130.22 1ynf s VAL 161 Ca -0.00 0.48 -0.02 0.00 0.00 0.00 0.00 61.98 62.44 1ynf s VAL 161 Cb -0.18 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1ynf s VAL 161 CO -0.10 0.27 0.03 -1.00 0.00 0.00 0.00 175.10 174.30 1ynf s HIS 162 N 1.35 3.22 0.74 5.22 3.76 0.58 -4.98 115.29 125.19 1ynf s HIS 162 Ca 0.14 0.22 -0.13 0.00 -0.15 0.00 0.00 55.06 55.14 1ynf s HIS 162 Cb -0.14 -1.78 0.05 0.00 1.11 0.00 0.00 32.58 31.81 1ynf s HIS 162 CO 0.07 0.52 1.12 -1.12 -0.85 0.00 0.00 174.74 174.47 1ynf s SER 163 N -1.16 4.49 0.71 1.40 0.01 -1.26 -1.80 113.70 116.09 1ynf s SER 163 Ca 0.16 1.99 -0.16 0.00 1.31 0.00 0.00 55.95 59.26 1ynf s SER 163 Cb -0.12 -2.55 0.03 0.00 0.21 0.00 0.00 66.02 63.60 1ynf s SER 163 CO 0.06 -2.05 1.21 0.00 0.41 0.00 0.00 173.24 172.87 1ynf s ALA 164 N -2.57 2.19 0.83 1.44 0.00 -1.24 -4.51 121.76 117.90 1ynf s ALA 164 Ca 0.65 0.91 -0.11 0.00 0.00 0.00 0.00 51.96 53.42 1ynf s ALA 164 Cb -0.20 -3.47 0.09 0.00 0.00 0.00 0.00 23.12 19.54 1ynf s ALA 164 CO 0.50 -1.78 1.12 -0.51 0.00 0.00 0.00 175.76 175.09 1ynf s LEU 165 N -4.99 2.97 0.34 0.00 1.02 -1.26 -4.92 118.68 111.84 1ynf s LEU 165 Ca 0.75 2.01 -0.26 0.00 0.02 0.00 0.00 54.13 56.65 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 -2.51 0.88 -2.65 0.02 0.00 0.00 176.35 172.53 1ynf n PRO 166 N -3.78 1.10 -2.58 1.29 -0.02 -1.26 -4.68 135.00 125.07 1ynf n PRO 166 Ca 0.11 0.39 -0.43 0.00 -2.02 0.00 0.00 63.50 61.54 1ynf n PRO 166 Cb 0.52 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 1ynf n PRO 166 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1ynf n GLN 167 N 0.58 3.20 -3.86 -0.52 1.13 -1.26 -4.71 117.38 111.95 1ynf n GLN 167 Ca 0.10 -3.31 -0.11 0.00 -1.94 0.00 0.00 57.00 51.74 1ynf n GLN 167 Cb 0.35 -3.43 -0.09 0.00 0.11 0.00 0.00 30.24 27.17 1ynf n GLN 167 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1ynf s VAL 168 N 3.85 0.09 0.45 5.09 -7.23 -1.26 -5.04 120.40 116.34 1ynf s VAL 168 Ca 0.52 -0.71 0.19 0.00 -1.81 0.00 0.00 61.98 60.18 1ynf s VAL 168 Cb 0.04 -0.53 0.38 0.00 0.56 0.00 0.00 36.38 36.82 1ynf s VAL 168 CO 0.06 -0.39 1.91 0.00 -0.31 0.00 0.00 175.10 176.37 1ynf h ALA 169 N 4.09 2.26 0.00 1.32 0.00 -1.93 -0.93 119.26 124.07 1ynf h ALA 169 Ca -0.31 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 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 0.42 -0.48 -0.05 1.25 0.00 0.00 0.00 179.25 180.39 1ynf h LEU 170 N 0.32 0.00 -3.41 0.00 5.85 -1.96 -2.80 115.31 113.31 1ynf h LEU 170 Ca 0.39 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.82 1ynf h LEU 170 Cb 1.04 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 41.86 1ynf h LEU 170 CO -0.11 0.05 -0.52 0.18 -0.34 0.00 0.00 178.44 177.70 1ynf n LEU 171 N -4.23 4.06 -4.68 2.25 4.77 -0.36 -4.41 117.00 114.39 1ynf n LEU 171 Ca -0.03 -4.27 -0.44 0.00 -0.03 0.00 0.00 56.01 51.24 1ynf n LEU 171 Cb 0.13 -0.48 -0.04 0.00 -2.33 0.00 0.00 43.42 40.70 1ynf n LEU 171 CO 0.32 1.69 1.44 0.61 -1.33 0.00 0.00 177.39 180.13 1ynf n GLY 172 N -0.94 1.55 2.90 -0.72 0.00 -1.06 -4.74 105.19 102.18 1ynf n GLY 172 Ca 0.33 0.75 -0.23 0.00 0.00 0.00 0.00 46.02 46.88 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 2.89 1.43 -0.07 1.61 2.15 -1.24 -2.00 116.67 121.45 1ynf s ASP 173 Ca 0.85 -0.18 0.12 0.00 0.43 0.00 0.00 52.55 53.76 1ynf s ASP 173 Cb -0.56 -0.59 0.35 0.00 -0.30 0.00 0.00 42.92 41.82 1ynf s ASP 173 CO 0.41 -0.07 1.28 -0.62 -0.17 0.00 0.00 175.17 176.00 1ynf n GLU 174 N 4.35 2.80 0.00 4.34 -0.58 -1.26 -1.02 120.64 129.27 1ynf n GLU 174 Ca -0.19 -2.30 0.00 0.00 -0.42 0.00 0.00 57.16 54.25 1ynf n GLU 174 Cb 0.51 -1.45 0.00 0.00 -0.57 0.00 0.00 31.44 29.92 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 -0.09 0.77 0.46 0.62 0.00 -1.26 -3.87 105.19 101.82 1ynf n GLY 175 Ca 0.14 -0.74 0.28 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.67 2.72 -0.04 4.61 0.00 -0.26 -1.22 119.26 124.41 1ynf h ALA 176 Ca 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ynf h ALA 176 Cb 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ynf h ALA 176 CO 0.00 -1.03 0.31 0.00 0.00 0.00 0.00 179.25 178.53 1ynf h ALA 177 N 1.54 1.38 -0.23 0.00 0.00 -1.21 0.58 119.26 121.33 1ynf h ALA 177 Ca 0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1ynf h ALA 177 Cb 1.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1ynf h ALA 177 CO -0.08 -0.33 0.00 0.09 0.00 0.00 0.00 179.25 178.93 1ynf n ASN 178 N -3.00 2.98 -4.80 0.00 3.02 -0.46 -1.59 115.26 111.41 1ynf n ASN 178 Ca -0.01 -2.41 -0.24 0.00 -0.03 0.00 0.00 54.58 51.89 1ynf n ASN 178 Cb 0.37 -0.30 -0.05 0.00 -0.61 0.00 0.00 39.78 39.19 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 -1.73 3.10 0.01 3.10 2.46 0.20 -1.14 115.29 121.29 1ynf s HIS 179 Ca 0.26 -0.08 -0.17 0.00 0.47 0.00 0.00 55.06 55.54 1ynf s HIS 179 Cb 0.18 -1.43 0.03 0.00 -0.13 0.00 0.00 32.58 31.23 1ynf s HIS 179 CO 0.10 0.52 0.36 -0.80 -2.47 0.00 0.00 174.74 172.45 1ynf s ASN 180 N -3.54 -0.23 -0.12 9.88 0.01 -0.62 -4.92 114.94 115.39 1ynf s ASN 180 Ca 0.32 0.06 -0.04 0.00 -0.71 0.00 0.00 52.86 52.49 1ynf s ASN 180 Cb -0.09 0.36 0.06 0.00 0.41 0.00 0.00 41.25 41.99 1ynf s ASN 180 CO 0.24 -0.54 0.16 -0.60 -1.51 0.00 0.00 177.10 174.85 1ynf s ARG 181 N -1.82 0.07 0.07 -0.60 3.52 -1.26 -1.17 118.95 117.75 1ynf s ARG 181 Ca -0.10 0.39 0.07 0.00 -0.13 0.00 0.00 55.73 55.97 1ynf s ARG 181 Cb -0.03 -0.69 -0.04 0.00 -1.56 0.00 0.00 34.95 32.64 1ynf s ARG 181 CO 0.02 -0.43 -0.16 -0.51 -0.81 0.00 0.00 175.30 173.40 1ynf s LEU 182 N 2.28 2.73 0.00 -0.88 1.43 -1.26 -4.11 118.68 118.87 1ynf s LEU 182 Ca 0.04 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 1ynf s LEU 182 Cb -0.13 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.50 1ynf s LEU 182 CO -0.07 0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.34 1ynf n GLY 183 N 1.22 -1.66 0.00 -3.19 0.00 0.14 -4.57 105.19 97.14 1ynf n GLY 183 Ca -0.16 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.20 0.68 3.78 -0.02 0.00 -1.26 -2.39 105.19 105.79 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 3.31 0.27 1.61 3.76 -1.26 -4.62 115.29 118.35 1ynf s HIS 185 Ca 0.00 1.65 -0.01 0.00 -0.15 0.00 0.00 55.06 56.55 1ynf s HIS 185 Cb 0.00 -3.10 0.59 0.00 1.11 0.00 0.00 32.58 31.18 1ynf s HIS 185 CO 0.00 -0.54 1.68 1.88 -0.85 0.00 0.00 174.74 176.91 1ynf h TYR 186 N 2.55 0.39 0.00 1.40 0.99 -1.91 -0.53 116.97 119.85 1ynf h TYR 186 Ca -0.48 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.29 1ynf h TYR 186 Cb 1.21 -0.04 0.00 0.00 1.00 0.00 0.00 36.73 38.90 1ynf h TYR 186 CO 0.58 -0.10 0.00 0.41 -0.00 0.00 0.00 178.16 179.05 1ynf n GLY 187 N -1.36 -1.07 3.90 3.88 0.00 -1.26 -4.77 105.19 104.51 1ynf n GLY 187 Ca 0.18 0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.12 3.65 0.14 1.61 2.02 -0.21 -4.72 118.70 118.06 1ynf s GLU 188 Ca 0.05 0.21 -0.34 0.00 0.02 0.00 0.00 54.97 54.92 1ynf s GLU 188 Cb 0.09 -2.47 -0.14 0.00 0.10 0.00 0.00 34.13 31.71 1ynf s GLU 188 CO 0.30 -0.02 1.59 -0.35 0.02 0.00 0.00 175.26 176.80 1ynf n PRO 189 N -1.56 2.11 0.00 0.39 -0.04 -1.26 -4.89 135.00 129.75 1ynf n PRO 189 Ca 0.00 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.22 1ynf n PRO 189 Cb 0.54 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 1ynf n PRO 189 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ynf n GLY 190 N 3.45 1.29 3.64 0.55 0.00 -1.26 -4.77 105.19 108.10 1ynf n GLY 190 Ca 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.14 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 3.03 0.59 -0.25 1.61 -0.21 0.60 -4.80 119.66 120.23 1ynf s GLN 192 Ca 0.00 1.01 -0.00 0.00 0.02 0.00 0.00 55.36 56.39 1ynf s GLN 192 Cb 0.00 0.12 0.04 0.00 1.00 0.00 0.00 33.01 34.17 1ynf s GLN 192 CO 0.00 -0.12 -0.08 -1.17 -2.12 0.00 0.00 175.29 171.80 1ynf s LEU 193 N 1.48 3.27 -0.24 2.90 2.96 -0.31 -0.50 118.68 128.23 1ynf s LEU 193 Ca -0.09 -1.07 -0.12 0.00 -0.22 0.00 0.00 54.13 52.63 1ynf s LEU 193 Cb -0.04 -1.62 -0.05 0.00 0.50 0.00 0.00 46.19 44.98 1ynf s LEU 193 CO -0.17 -0.16 0.25 -0.36 -1.32 0.00 0.00 176.35 174.59 1ynf s PHE 194 N 1.25 3.30 -0.16 5.38 0.40 0.41 -1.59 117.98 126.97 1ynf s PHE 194 Ca -0.03 0.31 -0.05 0.00 -0.60 0.00 0.00 56.93 56.56 1ynf s PHE 194 Cb -0.18 -2.39 -0.03 0.00 0.51 0.00 0.00 43.02 40.93 1ynf s PHE 194 CO -0.05 -0.04 0.01 0.08 0.70 0.00 0.00 175.22 175.92 1ynf s VAL 195 N 1.42 4.35 0.26 -0.44 1.01 -0.29 -0.88 120.40 125.82 1ynf s VAL 195 Ca 0.11 -0.20 0.06 0.00 0.00 0.00 0.00 61.98 61.96 1ynf s VAL 195 Cb -0.15 -2.92 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 1ynf s VAL 195 CO 0.07 0.49 -0.06 -0.72 0.00 0.00 0.00 175.10 174.88 1ynf s TYR 196 N 0.22 1.84 -0.07 5.22 -0.85 -0.78 -4.80 117.35 118.13 1ynf s TYR 196 Ca 0.01 -0.72 0.17 0.00 -0.52 0.00 0.00 57.07 56.01 1ynf s TYR 196 Cb -0.13 -1.02 -0.25 0.00 0.38 0.00 0.00 41.96 40.94 1ynf s TYR 196 CO 0.02 0.24 0.29 0.41 -1.52 0.00 0.00 175.55 174.98 1ynf n GLY 197 N -0.52 -0.81 3.32 5.49 0.00 -0.09 -0.12 105.19 112.47 1ynf n GLY 197 Ca -0.06 -0.38 -0.11 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 -2.97 1.05 -0.03 1.61 1.70 -0.97 -4.47 118.95 114.87 1ynf s ARG 198 Ca -0.07 -0.64 -0.16 0.00 -0.47 0.00 0.00 55.73 54.39 1ynf s ARG 198 Cb 0.09 0.46 0.03 0.00 -0.57 0.00 0.00 34.95 34.96 1ynf s ARG 198 CO 0.72 -0.40 0.34 -1.83 -1.08 0.00 0.00 175.30 173.05 1ynf s GLU 199 N -3.57 0.66 0.31 3.89 -1.05 -1.26 -0.50 118.70 117.19 1ynf s GLU 199 Ca 0.01 -0.08 -0.29 0.00 -0.15 0.00 0.00 54.97 54.46 1ynf s GLU 199 Cb 0.01 0.30 -0.11 0.00 -0.44 0.00 0.00 34.13 33.89 1ynf s GLU 199 CO -0.10 -0.18 1.47 -1.21 0.95 0.00 0.00 175.26 176.19 1ynf s GLU 200 N -1.14 4.19 0.00 -4.83 0.41 -1.26 -2.34 118.70 113.73 1ynf s GLU 200 Ca -0.12 2.45 0.00 0.00 -0.41 0.00 0.00 54.97 56.89 1ynf s GLU 200 Cb -0.05 -3.04 0.00 0.00 -1.78 0.00 0.00 34.13 29.27 1ynf s GLU 200 CO 0.04 -0.47 0.00 0.41 -0.49 0.00 0.00 175.26 174.75 1ynf n GLY 201 N 1.44 3.05 3.55 -1.39 0.00 -1.26 -4.98 105.19 105.60 1ynf n GLY 201 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.61 6.42 0.18 1.61 2.47 -0.99 -4.91 114.94 119.11 1ynf s ASN 202 Ca 0.00 -0.07 0.19 0.00 0.42 0.00 0.00 52.86 53.40 1ynf s ASN 202 Cb 0.00 -2.38 0.84 0.00 -1.45 0.00 0.00 41.25 38.27 1ynf s ASN 202 CO 0.00 -0.86 1.60 -0.90 -3.72 0.00 0.00 177.10 173.21 1ynf n ASP 203 N 6.60 0.43 -4.56 -4.21 5.68 -1.26 -4.55 116.55 114.68 1ynf n ASP 203 Ca 0.02 0.62 -0.43 0.00 -0.50 0.00 0.00 54.79 54.50 1ynf n ASP 203 Cb 0.48 -0.71 -0.04 0.00 -1.14 0.00 0.00 41.12 39.72 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 -3.24 4.36 0.01 2.12 2.01 -1.26 -4.97 115.64 114.67 1ynf s THR 204 Ca 0.04 0.74 -0.28 0.00 0.31 0.00 0.00 61.69 62.50 1ynf s THR 204 Cb 0.08 -4.52 0.10 0.00 0.01 0.00 0.00 72.50 68.18 1ynf s THR 204 CO 0.31 -0.98 0.85 0.00 -0.69 0.00 0.00 174.62 174.11 1ynf s ARG 205 N 4.04 0.88 0.51 4.92 1.70 -1.26 -4.76 118.95 124.98 1ynf s ARG 205 Ca 0.38 -0.27 -0.21 0.00 -0.47 0.00 0.00 55.73 55.16 1ynf s ARG 205 Cb -0.10 0.41 -0.09 0.00 -0.57 0.00 0.00 34.95 34.60 1ynf s ARG 205 CO 0.26 -0.37 0.74 -2.30 -1.08 0.00 0.00 175.30 172.54 1ynf n PRO 206 N -0.15 0.81 0.00 3.89 -0.02 -1.26 -4.94 135.00 133.33 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 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 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 0.41 1.12 0.00 2.55 7.64 -1.26 -4.78 113.62 119.31 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 0.44 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 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 1.06 -3.87 1.43 0.00 -1.26 -4.98 116.66 108.89 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 -0.80 -0.15 0.00 0.00 0.00 0.00 32.46 31.65 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 -1.60 2.56 0.34 -0.14 4.12 -1.26 -5.07 117.35 116.31 1ynf s TYR 209 Ca 0.00 -2.21 -0.25 0.00 0.02 0.00 0.00 57.07 54.63 1ynf s TYR 209 Cb 0.00 -2.15 -0.14 0.00 -1.52 0.00 0.00 41.96 38.15 1ynf s TYR 209 CO 0.00 -0.89 0.65 -2.30 0.02 0.00 0.00 175.55 173.03 1ynf n PRO 210 N 4.60 0.65 -2.62 -1.71 -0.02 -1.26 -4.71 135.00 129.93 1ynf n PRO 210 Ca -0.01 0.23 -0.43 0.00 -2.02 0.00 0.00 63.50 61.28 1ynf n PRO 210 Cb 0.42 -1.48 -0.02 0.00 -0.02 0.00 0.00 33.50 32.40 1ynf n PRO 210 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ynf s ALA 211 N -1.28 3.57 -0.27 3.55 0.00 -1.26 -4.93 121.76 121.16 1ynf s ALA 211 Ca 0.62 0.32 0.22 0.00 0.00 0.00 0.00 51.96 53.12 1ynf s ALA 211 Cb -0.69 -3.52 0.40 0.00 0.00 0.00 0.00 23.12 19.31 1ynf s ALA 211 CO 0.58 -0.89 1.61 0.00 0.00 0.00 0.00 175.76 177.06 1ynf h ARG 212 N 7.43 0.00 -5.26 0.00 3.08 -1.90 -3.44 114.38 114.29 1ynf h ARG 212 Ca -0.25 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.16 1ynf h ARG 212 Cb 1.10 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 30.93 1ynf h ARG 212 CO 0.93 0.16 -0.68 -1.14 -1.07 0.00 0.00 179.97 178.17 1ynf s GLN 213 N -3.22 3.62 0.13 0.04 2.00 -1.26 -3.59 119.66 117.38 1ynf s GLN 213 Ca 0.05 -0.54 0.06 0.00 -2.00 0.00 0.00 55.36 52.93 1ynf s GLN 213 Cb 0.06 -2.92 -0.04 0.00 0.80 0.00 0.00 33.01 30.92 1ynf s GLN 213 CO 0.68 0.18 -0.02 0.95 -0.50 0.00 0.00 175.29 176.57 1ynf s THR 214 N 0.52 3.75 0.29 -0.34 -4.23 -0.85 -0.91 115.64 113.87 1ynf s THR 214 Ca -0.03 -1.22 -0.00 0.00 -1.18 0.00 0.00 61.69 59.25 1ynf s THR 214 Cb -0.14 -2.82 0.16 0.00 1.34 0.00 0.00 72.50 71.04 1ynf s THR 214 CO 0.03 0.03 1.85 -0.09 -0.54 0.00 0.00 174.62 175.89 1ynf h ARG 215 N 3.19 0.80 -1.00 3.99 2.43 -1.13 -2.17 114.38 120.49 1ynf h ARG 215 Ca -0.48 -0.15 0.08 0.00 -0.81 0.00 0.00 59.98 58.62 1ynf h ARG 215 Cb 1.18 -0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 30.53 1ynf h ARG 215 CO 0.57 0.71 0.64 0.93 -1.51 0.00 0.00 179.97 181.31 1ynf h GLU 216 N 0.78 1.08 0.01 0.20 3.07 -1.82 0.06 114.58 117.96 1ynf h GLU 216 Ca 0.17 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.97 1ynf h GLU 216 Cb 0.26 -0.24 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 1ynf h GLU 216 CO -0.00 0.71 -0.00 0.00 -1.40 0.00 0.00 179.01 178.31 1ynf h ALA 217 N 1.48 -0.01 -0.64 3.43 0.00 -1.62 -2.43 119.26 119.45 1ynf h ALA 217 Ca 0.45 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.28 1ynf h ALA 217 Cb 0.26 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 1ynf h ALA 217 CO -0.20 -0.34 0.30 0.77 0.00 0.00 0.00 179.25 179.77 1ynf h SER 218 N -0.34 0.38 -0.10 0.00 0.02 -0.83 -0.98 113.55 111.69 1ynf h SER 218 Ca -0.00 0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 60.94 1ynf h SER 218 Cb 0.33 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 1ynf h SER 218 CO 0.00 0.23 -0.14 -0.33 -1.14 0.00 0.00 176.83 175.45 1ynf h GLU 219 N 0.53 0.46 -0.27 3.45 5.08 -0.99 -1.21 114.58 121.63 1ynf h GLU 219 Ca 0.31 -0.13 -0.17 0.00 -1.00 0.00 0.00 59.36 58.36 1ynf h GLU 219 Cb 0.32 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1ynf h GLU 219 CO -0.26 0.60 -0.52 0.00 -1.00 0.00 0.00 179.01 177.83 1ynf h ALA 220 N 1.43 0.56 -0.59 3.43 0.00 -0.81 -2.19 119.26 121.09 1ynf h ALA 220 Ca 0.08 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 1ynf h ALA 220 Cb 0.50 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1ynf h ALA 220 CO 0.03 0.68 0.09 0.28 0.00 0.00 0.00 179.25 180.33 1ynf h VAL 221 N 0.61 1.26 -0.88 0.00 2.07 -0.96 0.57 116.25 118.90 1ynf h VAL 221 Ca 0.02 -1.00 0.08 0.00 0.82 0.00 0.00 66.70 66.62 1ynf h VAL 221 Cb 1.11 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 31.57 1ynf h VAL 221 CO 0.11 0.37 0.54 0.00 0.02 0.00 0.00 177.57 178.61 1ynf h ALA 222 N 1.01 1.25 0.25 1.67 0.00 -1.07 0.12 119.26 122.48 1ynf h ALA 222 Ca 0.18 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1ynf h ALA 222 Cb 0.43 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ynf h ALA 222 CO 0.01 0.24 -0.12 -0.09 0.00 0.00 0.00 179.25 179.29 1ynf h ARG 223 N 0.95 -0.32 -0.90 0.00 2.43 -0.87 -2.44 114.38 113.22 1ynf h ARG 223 Ca 0.40 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.66 1ynf h ARG 223 Cb 0.27 0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.83 1ynf h ARG 223 CO -0.21 -0.03 0.58 -0.07 -1.51 0.00 0.00 179.97 178.73 1ynf h LEU 224 N -0.60 0.89 -0.46 3.80 3.38 -0.38 -1.22 115.31 120.72 1ynf h LEU 224 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1ynf h LEU 224 Cb 0.43 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1ynf h LEU 224 CO 0.06 0.57 0.00 0.59 0.09 0.00 0.00 178.44 179.74 1ynf n ASN 225 N -4.49 0.63 -4.11 -0.43 3.02 0.37 -4.89 115.26 105.36 1ynf n ASN 225 Ca 0.14 -2.01 -0.31 0.00 -0.03 0.00 0.00 54.58 52.37 1ynf n ASN 225 Cb 0.21 -0.12 -0.03 0.00 -0.61 0.00 0.00 39.78 39.23 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 -0.19 -3.05 -2.68 3.52 6.02 -0.46 -4.74 117.38 115.79 1ynf n GLN 226 Ca 0.03 0.36 -0.42 0.00 -0.01 0.00 0.00 57.00 56.97 1ynf n GLN 226 Cb 0.11 -4.71 -0.04 0.00 1.02 0.00 0.00 30.24 26.63 1ynf n GLN 226 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1ynf s VAL 227 N -3.70 4.60 0.01 5.09 1.01 -0.93 -1.60 120.40 124.89 1ynf s VAL 227 Ca 0.34 1.99 -0.32 0.00 0.00 0.00 0.00 61.98 63.99 1ynf s VAL 227 Cb -0.18 -4.28 -0.11 0.00 0.00 0.00 0.00 36.38 31.81 1ynf s VAL 227 CO 0.92 0.22 1.88 -3.20 0.00 0.00 0.00 175.10 174.92 1ynf n ASN 228 N 3.38 3.76 -0.32 3.32 4.05 -1.07 -4.84 115.26 123.54 1ynf n ASN 228 Ca 0.05 0.96 0.31 0.00 0.45 0.00 0.00 54.58 56.35 1ynf n ASN 228 Cb 0.50 -1.46 0.67 0.00 1.23 0.00 0.00 39.78 40.72 1ynf n ASN 228 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 1ynf h PRO 229 N 9.28 0.12 -0.00 1.20 0.11 -1.94 0.31 132.00 141.07 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 1.25 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ynf h PRO 229 CO 0.94 0.08 -0.13 1.04 -0.21 0.00 0.00 178.00 179.72 1ynf n GLN 230 N -4.33 0.76 -0.74 1.05 6.02 -1.26 -3.63 117.38 115.25 1ynf n GLN 230 Ca 0.25 -0.31 -0.02 0.00 -0.01 0.00 0.00 57.00 56.92 1ynf n GLN 230 Cb 1.13 -1.49 0.22 0.00 1.02 0.00 0.00 30.24 31.11 1ynf n GLN 230 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1ynf n GLN 231 N -0.85 2.29 -4.06 -1.09 6.02 0.11 -4.97 117.38 114.83 1ynf n GLN 231 Ca 0.14 -3.06 -0.14 0.00 -0.01 0.00 0.00 57.00 53.94 1ynf n GLN 231 Cb 0.29 -1.88 -0.14 0.00 1.02 0.00 0.00 30.24 29.54 1ynf n GLN 231 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1ynf s VAL 232 N -3.11 0.30 -0.02 5.09 -7.23 -1.23 -0.29 120.40 113.91 1ynf s VAL 232 Ca 0.45 -0.32 0.01 0.00 -1.81 0.00 0.00 61.98 60.31 1ynf s VAL 232 Cb 0.39 -0.29 0.02 0.00 0.56 0.00 0.00 36.38 37.06 1ynf s VAL 232 CO 0.04 -0.02 -0.01 -0.63 -0.31 0.00 0.00 175.10 174.18 1ynf s ILE 233 N -0.34 0.19 -0.20 -0.62 1.01 0.34 -4.95 121.20 116.64 1ynf s ILE 233 Ca -0.01 0.03 -0.05 0.00 0.00 0.00 0.00 60.65 60.62 1ynf s ILE 233 Cb -0.03 -0.25 -0.02 0.00 0.01 0.00 0.00 42.46 42.16 1ynf s ILE 233 CO -0.00 0.13 -0.00 -0.36 0.00 0.00 0.00 174.94 174.70 1ynf s PHE 234 N 0.75 3.04 0.01 3.97 0.40 -1.26 -0.44 117.98 124.45 1ynf s PHE 234 Ca -0.08 -0.44 0.05 0.00 -0.60 0.00 0.00 56.93 55.87 1ynf s PHE 234 Cb -0.11 -2.07 -0.02 0.00 0.51 0.00 0.00 43.02 41.34 1ynf s PHE 234 CO -0.01 -0.22 -0.16 0.00 0.70 0.00 0.00 175.22 175.53 1ynf s ALA 235 N 0.93 1.34 0.00 5.36 0.00 -0.06 -4.97 121.76 124.36 1ynf s ALA 235 Ca 0.01 -0.78 -0.19 0.00 0.00 0.00 0.00 51.96 51.00 1ynf s ALA 235 Cb -0.14 -0.29 -0.06 0.00 0.00 0.00 0.00 23.12 22.63 1ynf s ALA 235 CO 0.02 0.31 0.56 -1.14 0.00 0.00 0.00 175.76 175.50 1ynf s GLN 236 N -0.71 4.25 0.59 0.00 0.74 -1.26 -1.86 119.66 121.41 1ynf s GLN 236 Ca 0.05 0.67 -0.18 0.00 0.05 0.00 0.00 55.36 55.95 1ynf s GLN 236 Cb -0.07 -3.32 -0.04 0.00 1.10 0.00 0.00 33.01 30.69 1ynf s GLN 236 CO 0.00 0.44 1.11 -1.14 -0.55 0.00 0.00 175.29 175.15 1ynf s GLN 237 N -0.40 3.18 -0.08 1.67 2.00 0.83 -1.91 119.66 124.96 1ynf s GLN 237 Ca 0.29 1.48 -0.30 0.00 -2.00 0.00 0.00 55.36 54.83 1ynf s GLN 237 Cb -0.18 -1.99 -0.05 0.00 0.80 0.00 0.00 33.01 31.59 1ynf s GLN 237 CO 0.16 -0.96 1.61 1.21 -0.50 0.00 0.00 175.29 176.82 1ynf s ASN 238 N -2.17 6.67 0.53 6.67 2.47 -0.47 -4.27 114.94 124.36 1ynf s ASN 238 Ca 0.69 2.13 0.19 0.00 0.42 0.00 0.00 52.86 56.29 1ynf s ASN 238 Cb -0.21 -2.53 1.34 0.00 -1.45 0.00 0.00 41.25 38.39 1ynf s ASN 238 CO 0.33 -0.94 2.13 1.55 -3.72 0.00 0.00 177.10 176.44 1ynf h PRO 239 N 9.52 0.00 0.00 0.43 0.13 -1.91 -2.14 132.00 138.04 1ynf h PRO 239 Ca -0.37 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 32.28 1ynf h PRO 239 CO 0.96 0.00 -0.55 -0.44 -0.23 0.00 0.00 178.00 177.74 1ynf h ASP 240 N 0.00 0.00 0.59 1.44 3.32 -1.93 -2.60 116.42 117.24 1ynf h ASP 240 Ca 0.05 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.89 1ynf h ASP 240 Cb 0.19 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1ynf h ASP 240 CO -0.00 0.55 -0.93 1.62 -1.72 0.00 0.00 179.24 178.76 1ynf h VAL 241 N 0.00 1.50 -0.51 -1.35 3.04 -1.66 -3.16 116.25 114.12 1ynf h VAL 241 Ca -0.01 -2.69 -0.07 0.00 -1.01 0.00 0.00 66.70 62.92 1ynf h VAL 241 Cb 1.00 2.53 -0.02 0.00 -2.01 0.00 0.00 31.29 32.79 1ynf h VAL 241 CO 0.07 0.79 0.05 0.40 -1.01 0.00 0.00 177.57 177.87 1ynf h ILE 242 N 0.11 1.26 0.00 3.17 2.04 -1.35 -1.57 117.51 121.17 1ynf h ILE 242 Ca -0.05 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 64.81 1ynf h ILE 242 Cb 1.57 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 1ynf h ILE 242 CO 0.14 0.35 0.00 0.47 0.00 0.00 0.00 178.15 179.12 1ynf n ASP 243 N -4.37 0.00 -0.87 1.72 10.43 -0.99 -1.80 116.55 120.67 1ynf n ASP 243 Ca 0.01 0.46 0.11 0.00 2.57 0.00 0.00 54.79 57.94 1ynf n ASP 243 Cb 0.28 -0.47 0.09 0.00 1.84 0.00 0.00 41.12 42.85 1ynf n ASP 243 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1ynf n GLN 244 N -1.47 2.04 0.00 -1.24 6.02 -0.63 -4.80 117.38 117.30 1ynf n GLN 244 Ca 0.03 -1.78 0.00 0.00 -0.01 0.00 0.00 57.00 55.23 1ynf n GLN 244 Cb 0.10 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 29.94 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 1.25 0.83 3.49 1.08 0.00 -0.74 -4.91 105.19 106.19 1ynf n GLY 245 Ca 0.13 0.00 -0.44 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 -1.58 4.70 -1.11 1.61 1.01 -0.98 -4.80 120.40 119.25 1ynf s VAL 246 Ca 0.00 -2.04 0.29 0.00 0.00 0.00 0.00 61.98 60.23 1ynf s VAL 246 Cb 0.00 -4.93 0.28 0.00 0.00 0.00 0.00 36.38 31.73 1ynf s VAL 246 CO 0.00 -1.68 1.90 2.22 0.00 0.00 0.00 175.10 177.54 1ynf n PHE 247 N 6.64 0.00 -3.85 5.22 1.16 -1.26 -4.18 117.46 121.18 1ynf n PHE 247 Ca 0.34 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.82 1ynf n PHE 247 Cb 0.46 -0.42 -0.09 0.00 -1.61 0.00 0.00 39.48 37.82 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 -2.89 0.04 0.48 2.97 3.76 -1.26 -4.69 115.29 113.70 1ynf s HIS 248 Ca 0.17 -0.21 0.13 0.00 -0.15 0.00 0.00 55.06 55.00 1ynf s HIS 248 Cb 0.19 -0.03 1.12 0.00 1.11 0.00 0.00 32.58 34.97 1ynf s HIS 248 CO 0.53 -0.39 2.11 -0.97 -0.85 0.00 0.00 174.74 175.18 1ynf h ASN 249 N 3.71 0.16 0.00 1.40 -1.24 -1.87 -2.65 115.58 115.10 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 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 40.20 1ynf h ASN 249 CO 0.46 0.12 0.00 -0.90 -1.29 0.00 0.00 177.43 175.82 1ynf n ASP 250 N -4.51 0.45 -0.04 1.15 5.75 -0.62 -1.22 116.55 117.50 1ynf n ASP 250 Ca -0.01 -1.27 0.01 0.00 -0.01 0.00 0.00 54.79 53.51 1ynf n ASP 250 Cb 0.08 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 39.95 1ynf n ASP 250 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 1ynf n VAL 251 N -0.01 0.00 -0.13 2.12 3.14 -1.00 -3.07 118.33 119.39 1ynf n VAL 251 Ca 0.00 -0.48 0.00 0.00 -2.96 0.00 0.00 64.34 60.90 1ynf n VAL 251 Cb 0.11 1.02 0.00 0.00 -1.06 0.00 0.00 33.84 33.92 1ynf n VAL 251 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ynf n ILE 252 N -0.37 0.00 -3.55 1.55 0.13 -0.56 -4.38 119.36 112.18 1ynf n ILE 252 Ca 0.01 -0.16 -0.13 0.00 -1.10 0.00 0.00 62.75 61.37 1ynf n ILE 252 Cb 0.04 1.13 -0.05 0.00 -0.84 0.00 0.00 39.64 39.91 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 -0.26 -1.86 -0.10 1.51 0.00 -0.36 -2.06 121.76 118.63 1ynf s ALA 253 Ca 0.00 1.42 -0.13 0.00 0.00 0.00 0.00 51.96 53.25 1ynf s ALA 253 Cb 0.00 -0.34 0.03 0.00 0.00 0.00 0.00 23.12 22.81 1ynf s ALA 253 CO 0.00 -0.38 0.33 0.54 0.00 0.00 0.00 175.76 176.25 1ynf s VAL 254 N -1.39 0.02 0.31 0.00 0.11 0.17 -4.01 120.40 115.60 1ynf s VAL 254 Ca -0.04 -0.13 0.10 0.00 -2.93 0.00 0.00 61.98 58.98 1ynf s VAL 254 Cb -0.00 -0.51 -0.05 0.00 -1.53 0.00 0.00 36.38 34.28 1ynf s VAL 254 CO 0.03 -0.07 -0.09 -0.94 -3.33 0.00 0.00 175.10 170.69 1ynf s SER 255 N -0.24 3.93 -0.30 3.54 1.04 -1.26 -0.54 113.70 119.87 1ynf s SER 255 Ca -0.04 -0.99 -0.15 0.00 0.48 0.00 0.00 55.95 55.26 1ynf s SER 255 Cb -0.03 -0.46 0.18 0.00 0.10 0.00 0.00 66.02 65.80 1ynf s SER 255 CO 0.02 -0.08 1.06 0.21 0.98 0.00 0.00 173.24 175.42 1ynf s ASN 256 N -3.61 -0.45 1.99 7.02 2.47 -0.26 -4.78 114.94 117.32 1ynf s ASN 256 Ca 0.32 0.47 0.00 0.00 0.42 0.00 0.00 52.86 54.07 1ynf s ASN 256 Cb -0.03 1.45 0.00 0.00 -1.45 0.00 0.00 41.25 41.23 1ynf s ASN 256 CO 0.17 -0.09 0.00 0.54 -3.72 0.00 0.00 177.10 174.01 1ynf n ARG 257 N 5.08 0.00 -0.06 0.43 5.12 -1.26 -1.27 116.66 124.71 1ynf n ARG 257 Ca -0.08 0.00 0.12 0.00 -1.93 0.00 0.00 57.85 55.97 1ynf n ARG 257 Cb 0.54 0.00 0.24 0.00 -1.16 0.00 0.00 32.46 32.07 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 10.76 2.19 -4.12 5.56 0.00 -1.01 0.28 117.38 131.04 1ynf n GLN 258 Ca 0.00 -1.76 -0.36 0.00 0.00 0.00 0.00 57.00 54.88 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 -1.84 4.90 -0.29 -0.39 1.01 -0.39 -4.31 120.40 119.08 1ynf s VAL 259 Ca 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.29 1ynf s VAL 259 Cb 0.21 -3.10 0.09 0.00 0.00 0.00 0.00 36.38 33.57 1ynf s VAL 259 CO 0.31 0.61 0.05 -0.22 0.00 0.00 0.00 175.10 175.85 1ynf s LEU 260 N -0.89 2.79 -0.48 3.92 2.96 -1.26 -1.10 118.68 124.63 1ynf s LEU 260 Ca 0.14 -1.61 -0.22 0.00 -0.22 0.00 0.00 54.13 52.22 1ynf s LEU 260 Cb -0.12 -1.08 0.03 0.00 0.50 0.00 0.00 46.19 45.53 1ynf s LEU 260 CO 0.03 -0.36 0.77 0.12 -1.32 0.00 0.00 176.35 175.58 1ynf s PHE 261 N 1.43 2.97 0.12 5.38 5.36 0.30 -1.52 117.98 132.02 1ynf s PHE 261 Ca 0.06 -0.01 -0.04 0.00 -0.96 0.00 0.00 56.93 55.98 1ynf s PHE 261 Cb -0.18 -3.67 -0.03 0.00 -0.34 0.00 0.00 43.02 38.80 1ynf s PHE 261 CO -0.16 -1.05 0.11 0.00 -1.46 0.00 0.00 175.22 172.66 1ynf s HIS 263 N -3.99 3.43 0.46 0.00 2.46 -0.88 -0.82 115.29 115.95 1ynf s HIS 263 Ca 0.18 1.24 0.18 0.00 0.47 0.00 0.00 55.06 57.12 1ynf s HIS 263 Cb 0.06 -2.59 1.16 0.00 -0.13 0.00 0.00 32.58 31.09 1ynf s HIS 263 CO -0.02 -0.12 2.04 -0.56 -2.47 0.00 0.00 174.74 173.61 1ynf h GLN 264 N 1.48 0.00 -0.71 2.88 3.07 -1.64 -2.30 115.11 117.89 1ynf h GLN 264 Ca -0.47 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.23 1ynf h GLN 264 Cb 1.18 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.72 1ynf h GLN 264 CO 0.63 0.14 0.04 1.04 0.09 0.00 0.00 178.83 180.78 1ynf n GLN 265 N -4.20 3.83 0.01 0.06 6.02 -1.26 -4.59 117.38 117.25 1ynf n GLN 265 Ca -0.02 -2.41 -0.13 0.00 -0.01 0.00 0.00 57.00 54.43 1ynf n GLN 265 Cb 0.22 -2.08 -0.10 0.00 1.02 0.00 0.00 30.24 29.30 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 3.34 -0.07 -3.53 -1.58 0.00 -1.73 -3.42 119.26 112.27 1ynf h ALA 266 Ca 0.04 -0.25 -0.67 0.00 0.00 0.00 0.00 54.91 54.04 1ynf h ALA 266 Cb 1.71 0.03 -0.15 0.00 0.00 0.00 0.00 17.79 19.37 1ynf h ALA 266 CO 0.42 -0.28 -0.71 -0.06 0.00 0.00 0.00 179.25 178.62 1ynf s PHE 267 N -4.09 2.84 0.12 0.00 0.40 -1.26 -1.37 117.98 114.61 1ynf s PHE 267 Ca -0.15 -0.09 -0.28 0.00 -0.60 0.00 0.00 56.93 55.80 1ynf s PHE 267 Cb 0.01 -1.51 -0.07 0.00 0.51 0.00 0.00 43.02 41.96 1ynf s PHE 267 CO 0.64 0.42 1.61 0.00 0.70 0.00 0.00 175.22 178.58 1ynf h ALA 268 N 3.86 -0.55 -1.66 5.36 0.00 -1.56 -2.99 119.26 121.72 1ynf h ALA 268 Ca -0.48 -0.04 -0.66 0.00 0.00 0.00 0.00 54.91 53.73 1ynf h ALA 268 Cb 1.17 0.58 -0.37 0.00 0.00 0.00 0.00 17.79 19.17 1ynf h ALA 268 CO 0.54 -0.87 -0.09 0.54 0.00 0.00 0.00 179.25 179.37 1ynf n ARG 269 N -5.43 3.63 -0.18 0.00 1.74 -1.26 -4.91 116.66 110.25 1ynf n ARG 269 Ca -0.06 -4.51 -0.09 0.00 -0.77 0.00 0.00 57.85 52.42 1ynf n ARG 269 Cb 0.34 -2.29 -0.04 0.00 -1.02 0.00 0.00 32.46 29.45 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 3.09 -0.25 -0.56 5.56 4.15 -1.90 -0.99 115.11 124.22 1ynf h GLN 270 Ca 0.33 0.02 0.11 0.00 0.77 0.00 0.00 58.65 59.87 1ynf h GLN 270 Cb 0.52 0.06 -0.11 0.00 0.21 0.00 0.00 27.48 28.16 1ynf h GLN 270 CO 0.99 -0.16 -0.16 1.03 -1.93 0.00 0.00 178.83 178.59 1ynf h SER 271 N -0.26 -0.60 -0.55 -0.69 0.87 -1.91 0.08 113.55 110.50 1ynf h SER 271 Ca 0.17 0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.90 1ynf h SER 271 Cb 0.57 0.37 -0.03 0.00 -0.44 0.00 0.00 62.40 62.88 1ynf h SER 271 CO -0.65 -0.20 0.31 1.56 -0.53 0.00 0.00 176.83 177.32 1ynf h GLN 272 N -0.03 0.76 0.18 2.24 4.20 -1.78 -2.11 115.11 118.57 1ynf h GLN 272 Ca 0.27 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.89 1ynf h GLN 272 Cb 0.43 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1ynf h GLN 272 CO -0.59 0.57 -0.09 1.25 -0.67 0.00 0.00 178.83 179.31 1ynf h LEU 273 N 0.74 -0.20 -0.58 1.46 5.85 0.10 -1.56 115.31 121.12 1ynf h LEU 273 Ca 0.19 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1ynf h LEU 273 Cb 0.02 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1ynf h LEU 273 CO -0.03 -0.12 0.37 -0.07 -0.34 0.00 0.00 178.44 178.25 1ynf h LEU 274 N -0.26 0.62 -0.74 2.25 3.38 -0.99 -0.54 115.31 119.03 1ynf h LEU 274 Ca -0.02 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.97 1ynf h LEU 274 Cb 0.20 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1ynf h LEU 274 CO 0.04 0.44 0.46 0.00 0.09 0.00 0.00 178.44 179.48 1ynf h ALA 275 N 1.23 0.98 -0.55 1.53 0.00 -1.28 0.49 119.26 121.66 1ynf h ALA 275 Ca 0.22 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1ynf h ALA 275 Cb -0.04 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1ynf h ALA 275 CO -0.07 0.24 0.27 -0.97 0.00 0.00 0.00 179.25 178.72 1ynf h ASN 276 N 0.90 0.71 -0.56 0.00 -0.73 -0.62 -1.72 115.58 113.56 1ynf h ASN 276 Ca 0.30 -0.12 -0.07 0.00 1.87 0.00 0.00 56.30 58.28 1ynf h ASN 276 Cb 0.05 -0.18 -0.02 0.00 0.27 0.00 0.00 38.32 38.43 1ynf h ASN 276 CO -0.12 0.63 0.08 -0.07 -0.37 0.00 0.00 177.43 177.58 1ynf h LEU 277 N 0.74 0.94 -1.23 0.34 4.07 -0.41 -1.40 115.31 118.36 1ynf h LEU 277 Ca 0.19 -0.22 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1ynf h LEU 277 Cb 0.10 -0.25 -0.04 0.00 1.08 0.00 0.00 40.66 41.56 1ynf h LEU 277 CO -0.03 0.95 0.48 0.03 -1.08 0.00 0.00 178.44 178.79 1ynf h ARG 278 N 0.92 0.99 0.00 1.13 3.08 -0.50 0.67 114.38 120.67 1ynf h ARG 278 Ca 0.18 -0.07 -0.13 0.00 0.07 0.00 0.00 59.98 60.03 1ynf h ARG 278 Cb 0.43 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1ynf h ARG 278 CO 0.01 0.68 -0.62 0.00 -1.07 0.00 0.00 179.97 178.97 1ynf h ALA 279 N 1.51 0.81 0.00 0.04 0.00 -0.83 -3.34 119.26 117.45 1ynf h ALA 279 Ca 0.27 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1ynf h ALA 279 Cb -0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1ynf h ALA 279 CO -0.06 0.78 -1.94 0.54 0.00 0.00 0.00 179.25 178.57 1ynf n ARG 280 N -3.57 0.64 -3.87 0.00 1.74 -0.57 -4.90 116.66 106.13 1ynf n ARG 280 Ca -0.00 -0.16 -0.36 0.00 -0.77 0.00 0.00 57.85 56.56 1ynf n ARG 280 Cb 0.67 -1.47 -0.13 0.00 -1.02 0.00 0.00 32.46 30.50 1ynf n ARG 280 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ynf s VAL 281 N -3.29 3.27 0.10 1.55 1.01 0.23 -5.07 120.40 118.20 1ynf s VAL 281 Ca -0.07 -1.07 -0.33 0.00 0.00 0.00 0.00 61.98 60.51 1ynf s VAL 281 Cb 0.12 -2.76 -0.12 0.00 0.00 0.00 0.00 36.38 33.63 1ynf s VAL 281 CO 0.82 0.03 1.76 0.59 0.00 0.00 0.00 175.10 178.30 1ynf n ASN 282 N 4.72 3.65 0.00 3.32 3.02 -1.26 -1.35 115.26 127.36 1ynf n ASN 282 Ca -0.15 1.02 0.00 0.00 -0.03 0.00 0.00 54.58 55.42 1ynf n ASN 282 Cb 0.46 -1.48 0.00 0.00 -0.61 0.00 0.00 39.78 38.15 1ynf n ASN 282 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ynf n GLY 283 N 4.00 0.40 3.02 7.41 0.00 -1.26 -4.74 105.19 114.02 1ynf n GLY 283 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.38 -2.42 -3.61 1.61 -0.00 -0.46 -4.88 117.46 105.32 1ynf n PHE 284 Ca 0.00 -0.04 -0.03 0.00 -0.00 0.00 0.00 57.45 57.38 1ynf n PHE 284 Cb 0.13 -1.38 -0.05 0.00 -0.00 0.00 0.00 39.48 38.18 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 -2.11 -0.53 3.13 0.00 -1.26 -4.91 121.76 114.00 1ynf s ALA 286 Ca 0.36 2.32 -0.08 0.00 0.00 0.00 0.00 51.96 54.56 1ynf s ALA 286 Cb -0.06 -1.71 0.14 0.00 0.00 0.00 0.00 23.12 21.49 1ynf s ALA 286 CO 0.33 -0.72 0.40 0.42 0.00 0.00 0.00 175.76 176.20 1ynf s ILE 287 N 2.33 4.22 -0.13 0.00 1.01 -0.58 -4.98 121.20 123.08 1ynf s ILE 287 Ca -0.07 -2.08 -0.17 0.00 0.00 0.00 0.00 60.65 58.33 1ynf s ILE 287 Cb -0.08 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 1ynf s ILE 287 CO -0.19 -0.82 0.42 -1.61 0.00 0.00 0.00 174.94 172.74 1ynf s GLU 288 N 0.98 4.31 -0.40 2.79 2.02 -1.25 -1.69 118.70 125.45 1ynf s GLU 288 Ca 0.09 0.34 -0.18 0.00 0.02 0.00 0.00 54.97 55.24 1ynf s GLU 288 Cb -0.23 -3.43 0.01 0.00 0.10 0.00 0.00 34.13 30.58 1ynf s GLU 288 CO -0.02 0.19 0.48 0.08 0.02 0.00 0.00 175.26 176.01 1ynf s VAL 289 N 0.55 5.03 0.46 2.63 1.01 -0.00 -4.85 120.40 125.22 1ynf s VAL 289 Ca 0.23 -0.06 -0.24 0.00 0.00 0.00 0.00 61.98 61.91 1ynf s VAL 289 Cb -0.14 -4.03 -0.07 0.00 0.00 0.00 0.00 36.38 32.14 1ynf s VAL 289 CO 0.08 -0.37 1.27 -2.16 0.00 0.00 0.00 175.10 173.92 1ynf s PRO 290 N 2.31 3.69 0.51 2.72 0.04 -1.26 -1.64 135.00 141.37 1ynf s PRO 290 Ca 0.16 2.04 0.16 0.00 0.04 0.00 0.00 61.00 63.40 1ynf s PRO 290 Cb -0.16 -2.51 1.24 0.00 0.04 0.00 0.00 34.50 33.12 1ynf s PRO 290 CO 0.14 -0.69 2.11 0.00 0.04 0.00 0.00 177.00 178.61 1ynf h ALA 291 N 2.15 2.05 -0.54 8.56 0.00 -1.97 -1.72 119.26 127.78 1ynf h ALA 291 Ca -0.50 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.48 1ynf h ALA 291 Cb 1.26 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 1ynf h ALA 291 CO 0.60 -0.07 0.21 1.15 0.00 0.00 0.00 179.25 181.14 1ynf h THR 292 N 0.06 0.83 0.23 0.00 2.02 -2.00 -2.98 112.91 111.07 1ynf h THR 292 Ca 0.06 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 1ynf h THR 292 Cb 0.16 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 66.96 1ynf h THR 292 CO -0.01 0.07 -0.11 1.56 0.37 0.00 0.00 175.52 177.41 1ynf h GLN 293 N 0.40 -0.30 -3.62 6.66 1.08 -1.71 -3.44 115.11 114.18 1ynf h GLN 293 Ca 0.26 0.02 -0.40 0.00 -1.45 0.00 0.00 58.65 57.08 1ynf h GLN 293 Cb 0.28 0.07 -0.37 0.00 -0.05 0.00 0.00 27.48 27.41 1ynf h GLN 293 CO -0.26 0.07 -0.76 0.08 -0.95 0.00 0.00 178.83 177.02 1ynf s VAL 294 N -4.01 0.22 0.82 -0.54 1.01 -0.87 -4.86 120.40 112.17 1ynf s VAL 294 Ca -0.13 0.18 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 1ynf s VAL 294 Cb 0.01 -0.39 0.09 0.00 0.00 0.00 0.00 36.38 36.09 1ynf s VAL 294 CO 0.51 0.22 1.14 -0.94 0.00 0.00 0.00 175.10 176.03 1ynf s SER 295 N 1.82 4.35 0.18 3.32 1.04 -1.19 -4.06 113.70 119.15 1ynf s SER 295 Ca 0.02 0.97 -0.11 0.00 0.48 0.00 0.00 55.95 57.31 1ynf s SER 295 Cb -0.12 -1.57 0.09 0.00 0.10 0.00 0.00 66.02 64.51 1ynf s SER 295 CO -0.04 -2.03 1.74 0.58 0.98 0.00 0.00 173.24 174.48 1ynf h VAL 296 N -1.13 1.23 -0.31 5.02 2.07 -1.98 -1.05 116.25 120.09 1ynf h VAL 296 Ca -0.47 -0.70 0.05 0.00 0.82 0.00 0.00 66.70 66.39 1ynf h VAL 296 Cb 1.31 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 1ynf h VAL 296 CO 0.63 0.28 0.03 0.28 0.02 0.00 0.00 177.57 178.82 1ynf h SER 297 N 0.87 -0.05 -0.88 0.57 0.02 -1.93 0.77 113.55 112.93 1ynf h SER 297 Ca 0.21 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.21 1ynf h SER 297 Cb 0.18 0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.77 1ynf h SER 297 CO -0.02 0.01 0.52 0.44 -1.14 0.00 0.00 176.83 176.64 1ynf h ASP 298 N 0.13 1.08 -0.26 3.07 3.45 -1.85 -1.31 116.42 120.73 1ynf h ASP 298 Ca 0.15 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.54 1ynf h ASP 298 Cb 0.18 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.66 1ynf h ASP 298 CO -0.22 0.84 0.17 0.74 -1.57 0.00 0.00 179.24 179.20 1ynf h THR 299 N 1.23 1.07 -0.39 0.35 2.02 -0.01 -1.05 112.91 116.13 1ynf h THR 299 Ca 0.32 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 67.25 1ynf h THR 299 Cb -0.03 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 1ynf h THR 299 CO -0.06 0.07 -0.19 0.58 0.37 0.00 0.00 175.52 176.30 1ynf h VAL 300 N 0.34 1.27 0.02 3.16 2.07 -0.51 0.35 116.25 122.96 1ynf h VAL 300 Ca 0.09 -1.28 -0.21 0.00 0.82 0.00 0.00 66.70 66.13 1ynf h VAL 300 Cb -0.03 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1ynf h VAL 300 CO -0.02 0.43 -0.93 0.77 0.02 0.00 0.00 177.57 177.83 1ynf h SER 301 N 0.67 0.23 0.39 0.57 4.64 -1.10 -3.34 113.55 115.61 1ynf h SER 301 Ca 0.10 -0.20 -0.13 0.00 -0.47 0.00 0.00 61.79 61.09 1ynf h SER 301 Cb 0.68 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.68 1ynf h SER 301 CO 0.05 1.04 -1.73 0.35 -0.87 0.00 0.00 176.83 175.67 1ynf n THR 302 N -3.60 0.77 -3.13 2.95 -2.24 -0.41 -4.97 114.28 103.65 1ynf n THR 302 Ca -0.04 -0.64 -0.17 0.00 -2.27 0.00 0.00 64.05 60.93 1ynf n THR 302 Cb 0.85 -0.39 0.05 0.00 -2.10 0.00 0.00 70.33 68.73 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 -2.63 -1.86 -0.33 4.78 4.02 0.11 -4.13 117.16 117.12 1ynf n TYR 303 Ca -0.11 0.62 0.08 0.00 -0.01 0.00 0.00 57.90 58.47 1ynf n TYR 303 Cb 0.78 -3.77 0.24 0.00 -0.02 0.00 0.00 39.34 36.56 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 -1.65 0.77 -0.77 7.72 5.85 -1.85 -1.76 115.31 123.63 1ynf h LEU 304 Ca -0.40 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1ynf h LEU 304 Cb 1.26 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1ynf h LEU 304 CO 0.40 0.37 -0.06 0.49 -0.34 0.00 0.00 178.44 179.31 1ynf n PHE 305 N -4.72 0.00 -0.85 1.25 3.01 -1.26 -3.69 117.46 111.19 1ynf n PHE 305 Ca 0.18 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.44 1ynf n PHE 305 Cb 0.40 -0.03 0.13 0.00 -0.01 0.00 0.00 39.48 39.96 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 -0.13 4.31 -4.96 4.37 4.05 -0.66 -4.35 115.26 117.89 1ynf n ASN 306 Ca 0.18 -3.33 -0.22 0.00 0.45 0.00 0.00 54.58 51.66 1ynf n ASN 306 Cb 0.33 -0.82 -0.01 0.00 1.23 0.00 0.00 39.78 40.52 1ynf n ASN 306 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1ynf s SER 307 N -0.87 6.12 -0.20 1.20 1.04 -1.24 -1.35 113.70 118.39 1ynf s SER 307 Ca 0.47 0.18 -0.12 0.00 0.48 0.00 0.00 55.95 56.96 1ynf s SER 307 Cb 0.39 -1.70 -0.05 0.00 0.10 0.00 0.00 66.02 64.76 1ynf s SER 307 CO 0.07 -0.37 0.22 -1.10 0.98 0.00 0.00 173.24 173.04 1ynf s GLN 308 N -4.26 4.18 -0.48 4.02 -0.21 -0.67 -4.65 119.66 117.57 1ynf s GLN 308 Ca 0.42 -0.09 -0.12 0.00 0.02 0.00 0.00 55.36 55.58 1ynf s GLN 308 Cb -0.10 -3.47 0.11 0.00 1.00 0.00 0.00 33.01 30.55 1ynf s GLN 308 CO 0.34 0.17 0.39 -1.17 -2.12 0.00 0.00 175.29 172.89 1ynf s LEU 309 N 0.71 5.73 0.20 2.90 2.96 -1.26 -0.59 118.68 129.32 1ynf s LEU 309 Ca 0.12 -1.68 0.02 0.00 -0.22 0.00 0.00 54.13 52.36 1ynf s LEU 309 Cb -0.13 -2.10 -0.04 0.00 0.50 0.00 0.00 46.19 44.43 1ynf s LEU 309 CO 0.03 -0.71 0.34 -0.76 -1.32 0.00 0.00 176.35 173.94 1ynf s LEU 310 N 1.50 4.29 -0.06 -0.68 1.43 -1.26 -4.76 118.68 119.14 1ynf s LEU 310 Ca 0.04 0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.40 1ynf s LEU 310 Cb -0.26 -2.99 -0.02 0.00 0.03 0.00 0.00 46.19 42.94 1ynf s LEU 310 CO 0.02 -0.02 -0.15 -0.44 0.23 0.00 0.00 176.35 175.99 1ynf s SER 311 N -3.44 3.96 0.52 2.29 0.01 -1.26 -4.83 113.70 110.94 1ynf s SER 311 Ca 0.36 -0.23 0.05 0.00 1.31 0.00 0.00 55.95 57.43 1ynf s SER 311 Cb -0.10 -0.92 0.04 0.00 0.21 0.00 0.00 66.02 65.25 1ynf s SER 311 CO 0.29 0.32 0.72 -0.13 0.41 0.00 0.00 173.24 174.85 1ynf s ARG 312 N -0.58 2.53 0.36 12.44 1.81 0.39 -5.01 118.95 130.89 1ynf s ARG 312 Ca 0.08 -1.10 0.11 0.00 -1.72 0.00 0.00 55.73 53.10 1ynf s ARG 312 Cb -0.11 -2.60 0.68 0.00 -0.45 0.00 0.00 34.95 32.47 1ynf s ARG 312 CO 0.01 -0.64 1.82 -0.44 -0.68 0.00 0.00 175.30 175.37 1ynf h ASP 313 N 0.24 0.08 0.01 0.23 3.32 -1.99 -2.56 116.42 115.75 1ynf h ASP 313 Ca -0.39 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1ynf h ASP 313 Cb 1.29 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1ynf h ASP 313 CO 0.47 0.42 0.00 -0.90 -1.72 0.00 0.00 179.24 177.51 1ynf n ASP 314 N -4.11 0.00 0.00 6.45 3.85 -1.26 -4.86 116.55 116.61 1ynf n ASP 314 Ca -0.02 -0.88 0.00 0.00 -0.71 0.00 0.00 54.79 53.18 1ynf n ASP 314 Cb 0.40 -0.01 0.00 0.00 -1.35 0.00 0.00 41.12 40.16 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 0.80 0.71 0.40 6.12 0.00 -0.96 -5.24 105.19 107.03 1ynf n GLY 315 Ca 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.67 -3.62 1.61 3.41 -1.26 -4.75 113.62 108.34 1ynf n SER 316 Ca 0.00 -0.76 -0.13 0.00 -0.26 0.00 0.00 58.87 57.72 1ynf n SER 316 Cb 0.00 -0.11 -0.12 0.00 -0.26 0.00 0.00 64.21 63.72 1ynf n SER 316 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1ynf s LEU 319 N 0.00 -0.36 -0.32 1.04 0.20 -0.25 -0.46 118.68 118.52 1ynf s LEU 319 Ca 0.08 0.55 -0.15 0.00 0.69 0.00 0.00 54.13 55.29 1ynf s LEU 319 Cb -0.01 0.81 -0.02 0.00 -0.43 0.00 0.00 46.19 46.54 1ynf s LEU 319 CO 0.06 -0.25 0.37 -0.69 -0.29 0.00 0.00 176.35 175.55 1ynf s VAL 320 N 2.45 5.16 0.24 1.68 1.01 0.24 -0.50 120.40 130.69 1ynf s VAL 320 Ca 0.02 0.24 0.10 0.00 0.00 0.00 0.00 61.98 62.34 1ynf s VAL 320 Cb -0.13 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1ynf s VAL 320 CO -0.10 -0.02 -0.18 -0.76 0.00 0.00 0.00 175.10 174.04 1ynf s LEU 321 N 2.06 2.57 0.49 3.92 1.02 0.14 -1.68 118.68 127.21 1ynf s LEU 321 Ca 0.13 -1.02 -0.13 0.00 0.02 0.00 0.00 54.13 53.13 1ynf s LEU 321 Cb -0.16 -0.92 -0.07 0.00 0.02 0.00 0.00 46.19 45.06 1ynf s LEU 321 CO 0.11 -0.05 0.91 -2.16 0.02 0.00 0.00 176.35 175.18 1ynf s PRO 322 N -3.53 3.83 0.52 1.29 0.04 -1.26 -1.27 135.00 134.61 1ynf s PRO 322 Ca 0.26 0.73 0.31 0.00 0.04 0.00 0.00 61.00 62.34 1ynf s PRO 322 Cb -0.03 -2.23 1.44 0.00 0.04 0.00 0.00 34.50 33.72 1ynf s PRO 322 CO 0.11 -0.23 1.85 0.37 0.04 0.00 0.00 177.00 179.15 1ynf h GLN 323 N 0.84 0.06 -0.06 4.56 5.75 -1.65 -1.36 115.11 123.25 1ynf h GLN 323 Ca -0.47 -0.00 0.02 0.00 -0.15 0.00 0.00 58.65 58.05 1ynf h GLN 323 Cb 1.19 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.72 1ynf h GLN 323 CO 0.62 0.04 0.07 0.93 -2.65 0.00 0.00 178.83 177.84 1ynf h GLU 324 N 0.07 0.00 0.00 1.69 4.39 -1.89 -1.13 114.58 117.71 1ynf h GLU 324 Ca 0.48 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 60.04 1ynf h GLU 324 Cb 1.80 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.43 1ynf h GLU 324 CO -0.04 0.00 -0.65 0.00 -1.16 0.00 0.00 179.01 177.15 1ynf h ARG 326 N 0.00 0.06 0.00 0.00 2.43 -1.38 -3.04 114.38 112.44 1ynf h ARG 326 Ca -0.01 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1ynf h ARG 326 Cb 1.16 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1ynf h ARG 326 CO 0.08 0.97 0.00 0.39 -1.51 0.00 0.00 179.97 179.90 1ynf n GLU 327 N -3.34 0.17 -3.53 0.20 1.02 -0.82 -4.54 120.64 109.81 1ynf n GLU 327 Ca -0.05 0.04 -0.42 0.00 -0.02 0.00 0.00 57.16 56.71 1ynf n GLU 327 Cb 0.97 -1.50 -0.09 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 -2.81 3.31 0.23 -0.32 2.46 -1.04 -4.97 115.29 112.16 1ynf s HIS 328 Ca 0.19 -1.37 -0.08 0.00 0.47 0.00 0.00 55.06 54.26 1ynf s HIS 328 Cb 0.18 -3.08 0.38 0.00 -0.13 0.00 0.00 32.58 29.93 1ynf s HIS 328 CO 0.45 -0.85 1.65 0.00 -2.47 0.00 0.00 174.74 173.52 1ynf h ALA 329 N 8.52 0.71 -0.35 1.58 0.00 -1.86 0.14 119.26 128.02 1ynf h ALA 329 Ca -0.25 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ynf h ALA 329 Cb 1.09 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 1ynf h ALA 329 CO 0.81 -0.41 0.23 0.78 0.00 0.00 0.00 179.25 180.66 1ynf h GLY 330 N 0.11 0.49 0.85 0.00 0.00 -1.93 0.72 103.07 103.32 1ynf h GLY 330 Ca 0.38 -0.18 -0.13 0.00 0.00 0.00 0.00 47.33 47.39 1ynf h GLY 330 CO -0.61 0.18 -0.44 -0.24 0.00 0.00 0.00 176.54 175.44 1ynf h VAL 331 N 0.47 1.37 -0.94 4.60 3.04 -1.64 -2.49 116.25 120.66 1ynf h VAL 331 Ca 0.13 -1.74 0.04 0.00 -1.01 0.00 0.00 66.70 64.11 1ynf h VAL 331 Cb -0.05 2.13 -0.06 0.00 -2.01 0.00 0.00 31.29 31.30 1ynf h VAL 331 CO -0.03 0.52 0.61 -0.25 -1.01 0.00 0.00 177.57 177.41 1ynf h TRP 332 N 0.11 1.14 -0.27 3.17 -0.00 -0.63 -0.01 115.95 119.46 1ynf h TRP 332 Ca -0.02 0.03 0.00 0.00 -0.00 0.00 0.00 58.89 58.90 1ynf h TRP 332 Cb 1.07 -0.38 -0.01 0.00 -0.00 0.00 0.00 29.16 29.83 1ynf h TRP 332 CO 0.11 0.65 0.18 0.78 -0.00 0.00 0.00 178.44 180.15 1ynf h GLY 333 N 1.17 0.38 0.98 2.65 0.00 -0.80 -1.58 103.07 105.87 1ynf h GLY 333 Ca 0.38 -0.14 0.01 0.00 0.00 0.00 0.00 47.33 47.57 1ynf h GLY 333 CO -0.13 0.14 0.38 -1.82 0.00 0.00 0.00 176.54 175.11 1ynf h TYR 334 N 0.36 0.72 -0.74 5.60 3.20 -0.87 -2.31 116.97 122.93 1ynf h TYR 334 Ca 0.10 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.99 1ynf h TYR 334 Cb -0.03 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 37.96 1ynf h TYR 334 CO -0.06 0.44 0.46 -0.07 -1.64 0.00 0.00 178.16 177.30 1ynf h LEU 335 N 0.77 0.88 -1.35 2.82 3.38 -0.70 0.11 115.31 121.22 1ynf h LEU 335 Ca 0.22 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 1ynf h LEU 335 Cb -0.07 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1ynf h LEU 335 CO -0.06 0.67 -0.23 0.78 0.09 0.00 0.00 178.44 179.69 1ynf h ASN 336 N 1.01 0.14 -0.22 -0.43 2.35 -1.01 0.82 115.58 118.25 1ynf h ASN 336 Ca 0.27 -0.04 -0.10 0.00 -0.55 0.00 0.00 56.30 55.88 1ynf h ASN 336 Cb -0.06 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 1ynf h ASN 336 CO -0.05 0.38 -0.25 -0.08 -1.65 0.00 0.00 177.43 175.78 1ynf h GLU 337 N 0.14 0.55 -0.64 0.81 4.81 -0.81 -2.82 114.58 116.62 1ynf h GLU 337 Ca 0.02 -0.30 -0.02 0.00 -0.13 0.00 0.00 59.36 58.93 1ynf h GLU 337 Cb 0.49 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.85 1ynf h GLU 337 CO 0.03 0.89 0.30 1.25 -0.73 0.00 0.00 179.01 180.76 1ynf h LEU 338 N 0.24 0.82 -1.18 1.64 5.85 -0.23 -1.00 115.31 121.45 1ynf h LEU 338 Ca 0.03 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1ynf h LEU 338 Cb 0.81 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1ynf h LEU 338 CO 0.06 0.70 0.39 0.25 -0.34 0.00 0.00 178.44 179.50 1ynf h LEU 339 N 0.91 0.85 0.00 2.25 5.85 -0.72 -2.71 115.31 121.73 1ynf h LEU 339 Ca 0.22 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1ynf h LEU 339 Cb 0.10 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.92 1ynf h LEU 339 CO -0.03 0.68 -0.73 0.00 -0.34 0.00 0.00 178.44 178.01 1ynf h ALA 340 N 1.47 0.59 -2.33 1.25 0.00 -1.18 -3.44 119.26 115.60 1ynf h ALA 340 Ca 0.25 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.71 1ynf h ALA 340 Cb 0.01 0.00 0.16 0.00 0.00 0.00 0.00 17.79 17.96 1ynf h ALA 340 CO -0.04 0.00 0.18 0.00 0.00 0.00 0.00 179.25 179.39 1ynf s ALA 341 N -3.26 0.82 -1.16 0.00 0.00 -0.43 -4.92 121.76 112.82 1ynf s ALA 341 Ca 0.03 -0.43 -0.21 0.00 0.00 0.00 0.00 51.96 51.36 1ynf s ALA 341 Cb 0.11 -3.10 0.05 0.00 0.00 0.00 0.00 23.12 20.18 1ynf s ALA 341 CO 0.75 -2.98 1.65 0.34 0.00 0.00 0.00 175.76 175.51 1ynf s ASP 342 N -3.47 6.50 0.23 0.00 2.15 -1.26 -4.89 116.67 115.93 1ynf s ASP 342 Ca 0.66 -1.90 -0.22 0.00 0.43 0.00 0.00 52.55 51.52 1ynf s ASP 342 Cb -0.18 -2.58 0.04 0.00 -0.30 0.00 0.00 42.92 39.90 1ynf s ASP 342 CO 0.58 -1.51 0.79 0.54 -0.17 0.00 0.00 175.17 175.39 1ynf s ASN 343 N 4.88 -0.25 0.56 -0.34 2.20 -1.26 -5.06 114.94 115.67 1ynf s ASN 343 Ca 0.53 -0.50 0.31 0.00 -0.94 0.00 0.00 52.86 52.25 1ynf s ASN 343 Cb 0.02 0.65 1.69 0.00 -2.00 0.00 0.00 41.25 41.60 1ynf s ASN 343 CO 0.01 -1.18 2.16 -0.65 -2.94 0.00 0.00 177.10 174.50 1ynf h PRO 344 N 2.00 0.00 -6.10 3.55 0.11 -1.91 -3.43 132.00 126.22 1ynf h PRO 344 Ca -0.21 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.34 1ynf h PRO 344 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 1ynf h PRO 344 CO 0.25 0.06 1.37 0.42 -0.21 0.00 0.00 178.00 179.89 1ynf s ILE 345 N -4.30 3.31 -0.82 4.15 1.01 -1.26 -4.60 121.20 118.69 1ynf s ILE 345 Ca -0.04 0.29 0.08 0.00 0.00 0.00 0.00 60.65 60.99 1ynf s ILE 345 Cb 0.13 -3.50 0.03 0.00 0.01 0.00 0.00 42.46 39.14 1ynf s ILE 345 CO 0.55 -0.37 0.64 -1.54 0.00 0.00 0.00 174.94 174.22 1ynf n SER 346 N 11.55 1.32 -3.70 3.58 3.41 -1.26 -4.59 113.62 123.92 1ynf n SER 346 Ca 0.25 -1.16 -0.14 0.00 -0.26 0.00 0.00 58.87 57.56 1ynf n SER 346 Cb 0.48 0.25 -0.08 0.00 -0.26 0.00 0.00 64.21 64.60 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 -0.92 0.70 -0.09 4.33 2.12 -1.26 -5.09 118.70 118.49 1ynf s GLU 347 Ca 0.08 0.13 0.04 0.00 0.36 0.00 0.00 54.97 55.57 1ynf s GLU 347 Cb 0.06 0.32 -0.01 0.00 0.26 0.00 0.00 34.13 34.77 1ynf s GLU 347 CO 0.15 -0.17 -0.22 -0.51 -0.54 0.00 0.00 175.26 173.97 1ynf s LEU 348 N -0.85 2.24 -0.08 2.70 1.43 -1.26 -1.09 118.68 121.77 1ynf s LEU 348 Ca -0.09 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.54 1ynf s LEU 348 Cb -0.04 -1.45 0.02 0.00 0.03 0.00 0.00 46.19 44.75 1ynf s LEU 348 CO 0.04 0.19 -0.10 -0.75 0.23 0.00 0.00 176.35 175.96 1ynf s LYS 349 N 0.17 1.60 -0.05 1.70 2.20 0.35 -4.94 119.74 120.77 1ynf s LYS 349 Ca -0.12 -0.35 0.02 0.00 -0.36 0.00 0.00 55.97 55.16 1ynf s LYS 349 Cb -0.16 -1.43 -0.03 0.00 -1.51 0.00 0.00 37.83 34.70 1ynf s LYS 349 CO 0.07 -0.07 -0.07 0.08 -0.36 0.00 0.00 175.35 175.00 1ynf s VAL 350 N 1.00 3.67 0.05 4.02 1.01 -1.26 0.27 120.40 129.16 1ynf s VAL 350 Ca -0.08 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.38 1ynf s VAL 350 Cb -0.15 -2.53 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 1ynf s VAL 350 CO -0.00 0.54 -0.15 -0.36 0.00 0.00 0.00 175.10 175.13 1ynf s PHE 351 N -0.86 1.26 -0.46 5.22 0.40 -0.40 -4.95 117.98 118.19 1ynf s PHE 351 Ca 0.14 -0.38 -0.24 0.00 -0.60 0.00 0.00 56.93 55.85 1ynf s PHE 351 Cb -0.11 -0.74 0.03 0.00 0.51 0.00 0.00 43.02 42.71 1ynf s PHE 351 CO 0.03 0.05 0.85 0.34 0.70 0.00 0.00 175.22 177.18 1ynf s ASP 352 N -1.28 6.43 -0.31 1.36 2.15 -1.26 -1.57 116.67 122.19 1ynf s ASP 352 Ca 0.01 -0.07 0.13 0.00 0.43 0.00 0.00 52.55 53.06 1ynf s ASP 352 Cb -0.08 -2.41 0.47 0.00 -0.30 0.00 0.00 42.92 40.59 1ynf s ASP 352 CO 0.02 -0.99 1.11 0.18 -0.17 0.00 0.00 175.17 175.31 1ynf n LEU 353 N 6.94 3.26 -0.24 -1.34 4.77 -1.26 -4.86 117.00 124.28 1ynf n LEU 353 Ca 0.03 -4.12 0.02 0.00 -0.03 0.00 0.00 56.01 51.91 1ynf n LEU 353 Cb 0.48 0.02 0.14 0.00 -2.33 0.00 0.00 43.42 41.73 1ynf n LEU 353 CO 0.61 1.71 1.03 0.08 -1.33 0.00 0.00 177.39 179.49 1ynf h ARG 354 N 2.52 0.49 0.09 3.23 0.11 -1.95 -2.87 114.38 116.01 1ynf h ARG 354 Ca 0.12 -0.03 0.01 0.00 0.10 0.00 0.00 59.98 60.18 1ynf h ARG 354 Cb 1.28 -0.11 -0.02 0.00 1.11 0.00 0.00 29.97 32.23 1ynf h ARG 354 CO 0.55 0.33 -0.14 0.93 0.10 0.00 0.00 179.97 181.74 1ynf h GLU 355 N 0.51 -0.27 -1.75 0.08 4.39 -1.94 0.23 114.58 115.83 1ynf h GLU 355 Ca 0.35 0.02 0.00 0.00 0.34 0.00 0.00 59.36 60.07 1ynf h GLU 355 Cb 0.43 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1ynf h GLU 355 CO -0.31 -0.18 0.00 0.45 -1.16 0.00 0.00 179.01 177.81 1ynf n SER 356 N -5.26 1.22 0.00 1.42 2.88 -1.08 -3.55 113.62 109.25 1ynf n SER 356 Ca -0.07 -0.89 0.00 0.00 -1.33 0.00 0.00 58.87 56.59 1ynf n SER 356 Cb 0.18 -0.22 0.00 0.00 -0.75 0.00 0.00 64.21 63.42 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 1.09 0.00 -0.19 -1.46 0.00 0.07 -1.12 120.51 118.90 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 0.17 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.87 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 3.55 0.00 0.00 5.03 -1.23 -4.85 115.26 117.76 1ynf n ASN 359 Ca 0.00 -1.98 0.00 0.00 0.87 0.00 0.00 54.58 53.47 1ynf n ASN 359 Cb 0.00 -0.37 0.00 0.00 -1.02 0.00 0.00 39.78 38.39 1ynf n ASN 359 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ynf n GLY 360 N 1.30 1.11 3.06 7.41 0.00 -0.97 -5.09 105.19 112.01 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 -2.33 1.06 0.00 -0.02 0.00 -0.28 -5.05 107.32 100.71 1ynf s GLY 361 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 43.96 1ynf s GLY 361 CO 0.00 0.21 0.00 0.61 0.00 0.00 0.00 173.10 173.92 1ynf n GLY 362 N 4.20 2.26 0.29 0.20 0.00 -1.26 -4.63 105.19 106.24 1ynf n GLY 362 Ca -0.19 -2.14 0.06 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 0.55 -0.07 1.61 0.11 -1.89 -2.30 132.00 130.01 1ynf h PRO 363 Ca 0.00 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 65.90 1ynf h PRO 363 Cb 0.00 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 1ynf h PRO 363 CO 0.00 0.36 -0.73 0.00 -0.21 0.00 0.00 178.00 177.43 1ynf h ALA 364 N 1.53 0.62 -0.31 -0.75 0.00 -1.48 -3.11 119.26 115.76 1ynf h ALA 364 Ca 0.43 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1ynf h ALA 364 Cb 0.60 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1ynf h ALA 364 CO -0.36 0.77 0.20 0.00 0.00 0.00 0.00 179.25 179.87 1ynf n LEU 366 N -4.49 0.47 -4.10 0.00 4.77 -1.09 -2.29 117.00 110.26 1ynf n LEU 366 Ca 0.02 -0.17 -0.15 0.00 -0.03 0.00 0.00 56.01 55.67 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 0.08 -0.42 0.00 -1.33 0.00 0.00 177.39 176.07 1ynf s ARG 367 N -1.98 0.65 -0.18 3.23 1.04 -0.59 -1.70 118.95 119.43 1ynf s ARG 367 Ca 0.39 -0.80 0.01 0.00 -1.04 0.00 0.00 55.73 54.29 1ynf s ARG 367 Cb 0.19 -0.52 0.02 0.00 -2.04 0.00 0.00 34.95 32.60 1ynf s ARG 367 CO 0.31 0.11 -0.18 -1.17 -0.04 0.00 0.00 175.30 174.33 1ynf s LEU 368 N -1.54 2.13 -0.19 -1.89 2.96 0.12 -3.61 118.68 116.66 1ynf s LEU 368 Ca -0.06 -0.67 -0.26 0.00 -0.22 0.00 0.00 54.13 52.92 1ynf s LEU 368 Cb -0.10 -1.43 -0.01 0.00 0.50 0.00 0.00 46.19 45.15 1ynf s LEU 368 CO 0.01 -0.02 0.88 -0.13 -1.32 0.00 0.00 176.35 175.77 1ynf s ARG 369 N 1.31 4.28 -0.27 1.98 0.52 -1.26 -1.20 118.95 124.31 1ynf s ARG 369 Ca 0.04 1.08 -0.00 0.00 -0.52 0.00 0.00 55.73 56.33 1ynf s ARG 369 Cb -0.13 -3.59 0.08 0.00 0.52 0.00 0.00 34.95 31.82 1ynf s ARG 369 CO -0.12 -0.41 0.03 0.08 0.02 0.00 0.00 175.30 174.91 1ynf s VAL 370 N 2.42 1.19 -0.10 3.52 1.01 -0.31 -4.83 120.40 123.30 1ynf s VAL 370 Ca 0.39 -1.31 -0.30 0.00 0.00 0.00 0.00 61.98 60.76 1ynf s VAL 370 Cb -0.16 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 1ynf s VAL 370 CO 0.11 -0.41 1.27 -0.69 0.00 0.00 0.00 175.10 175.38 1ynf s VAL 371 N 1.50 4.19 -0.00 2.92 1.01 -1.26 -1.03 120.40 127.72 1ynf s VAL 371 Ca 0.03 1.48 0.04 0.00 0.00 0.00 0.00 61.98 63.53 1ynf s VAL 371 Cb -0.18 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.24 1ynf s VAL 371 CO -0.14 -0.07 -0.12 -0.76 0.00 0.00 0.00 175.10 174.01 1ynf s LEU 372 N 2.92 2.04 0.91 3.92 1.43 0.31 -4.64 118.68 125.56 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 -0.60 0.14 0.00 0.03 0.00 0.00 46.19 45.52 1ynf s LEU 372 CO 0.19 0.13 1.15 0.42 0.23 0.00 0.00 176.35 178.47 1ynf s THR 373 N -0.33 1.99 0.23 5.49 -4.23 -1.26 -1.11 115.64 116.43 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 -2.77 0.20 0.00 1.34 0.00 0.00 72.50 71.22 1ynf s THR 373 CO -0.00 0.00 1.85 -0.08 -0.54 0.00 0.00 174.62 175.85 1ynf h GLU 374 N -1.49 0.93 -0.17 3.99 4.81 -1.95 0.19 114.58 120.90 1ynf h GLU 374 Ca -0.50 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 58.52 1ynf h GLU 374 Cb 1.33 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1ynf h GLU 374 CO 0.61 0.62 -0.54 1.49 -0.73 0.00 0.00 179.01 180.46 1ynf h GLU 375 N 0.96 0.48 -0.32 1.92 4.81 -1.92 -2.58 114.58 117.94 1ynf h GLU 375 Ca 0.35 -0.30 -0.15 0.00 -0.13 0.00 0.00 59.36 59.13 1ynf h GLU 375 Cb 0.13 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1ynf h GLU 375 CO -0.16 0.90 -0.41 0.93 -0.73 0.00 0.00 179.01 179.54 1ynf h GLU 376 N 0.37 0.79 -0.91 1.92 5.08 -1.75 -2.34 114.58 117.75 1ynf h GLU 376 Ca 0.01 -0.42 0.02 0.00 -1.00 0.00 0.00 59.36 57.97 1ynf h GLU 376 Cb 1.06 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.28 1ynf h GLU 376 CO 0.10 1.05 0.60 0.00 -1.00 0.00 0.00 179.01 179.76 1ynf h ARG 377 N 0.64 1.16 0.00 2.33 3.08 -0.52 -1.41 114.38 119.66 1ynf h ARG 377 Ca 0.05 -0.07 -0.10 0.00 0.07 0.00 0.00 59.98 59.93 1ynf h ARG 377 Cb 0.98 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 1ynf h ARG 377 CO 0.09 0.77 -0.46 -0.09 -1.07 0.00 0.00 179.97 179.21 1ynf h ARG 378 N 1.19 0.00 0.00 0.04 2.43 -1.23 -3.01 114.38 113.80 1ynf h ARG 378 Ca 0.34 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.51 1ynf h ARG 378 Cb -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1ynf h ARG 378 CO -0.09 0.46 0.00 0.00 -1.51 0.00 0.00 179.97 178.83 1ynf h ALA 379 N 1.54 1.00 -2.72 2.80 0.00 -0.72 -3.46 119.26 117.70 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 0.83 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.66 1ynf h ALA 379 CO 0.06 0.00 0.49 0.08 0.00 0.00 0.00 179.25 179.88 1ynf s VAL 380 N -3.27 3.29 -0.35 0.00 1.01 -1.00 -4.49 120.40 115.59 1ynf s VAL 380 Ca 0.07 1.12 -0.36 0.00 0.00 0.00 0.00 61.98 62.81 1ynf s VAL 380 Cb 0.08 -3.64 -0.12 0.00 0.00 0.00 0.00 36.38 32.70 1ynf s VAL 380 CO 0.60 0.13 2.18 -3.20 0.00 0.00 0.00 175.10 174.81 1ynf n ASN 381 N 0.32 2.06 0.28 3.32 2.85 -0.62 -4.79 115.26 118.68 1ynf n ASN 381 Ca 0.03 0.44 0.17 0.00 -0.11 0.00 0.00 54.58 55.12 1ynf n ASN 381 Cb 0.46 -1.24 0.95 0.00 1.24 0.00 0.00 39.78 41.20 1ynf n ASN 381 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1ynf h PRO 382 N 12.06 0.00 0.00 1.20 0.13 -1.89 -2.63 132.00 140.87 1ynf h PRO 382 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1ynf h PRO 382 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1ynf h PRO 382 CO 1.02 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.79 1ynf n ALA 383 N -2.26 1.46 -3.38 -0.56 0.00 -1.26 -5.10 120.51 109.41 1ynf n ALA 383 Ca -0.02 0.01 -0.38 0.00 0.00 0.00 0.00 53.44 53.05 1ynf n ALA 383 Cb 0.16 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 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 -1.69 3.83 0.00 0.00 0.24 -0.99 -4.69 118.33 115.03 1ynf n VAL 384 Ca 0.02 -5.40 0.00 0.00 -2.04 0.00 0.00 64.34 56.92 1ynf n VAL 384 Cb 0.13 -2.30 0.00 0.00 -1.47 0.00 0.00 33.84 30.20 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 1.90 0.00 -0.31 -1.34 0.23 -1.26 -1.14 115.26 113.34 1ynf n ASN 387 Ca 0.25 0.00 0.06 0.00 -0.53 0.00 0.00 54.58 54.36 1ynf n ASN 387 Cb 0.37 0.00 0.21 0.00 -2.08 0.00 0.00 39.78 38.28 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 0.66 -0.04 0.53 5.19 -2.00 -0.49 116.42 120.27 1ynf h ASP 388 Ca 0.00 0.07 -0.00 0.00 -0.62 0.00 0.00 57.03 56.48 1ynf h ASP 388 Cb 0.00 -0.05 -0.00 0.00 0.18 0.00 0.00 39.33 39.46 1ynf h ASP 388 CO 0.00 0.32 0.01 0.74 -3.12 0.00 0.00 179.24 177.20 1ynf h THR 389 N 0.75 1.16 -0.50 0.35 2.02 -2.05 -1.01 112.91 113.63 1ynf h THR 389 Ca 0.45 -0.47 -0.07 0.00 0.77 0.00 0.00 66.41 67.10 1ynf h THR 389 Cb 0.55 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.33 1ynf h THR 389 CO -0.31 0.13 0.05 0.25 0.37 0.00 0.00 175.52 176.01 1ynf h LEU 390 N -0.11 0.82 -0.23 2.58 5.85 -1.89 -1.28 115.31 121.04 1ynf h LEU 390 Ca 0.01 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.51 1ynf h LEU 390 Cb 0.19 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1ynf h LEU 390 CO -0.00 0.89 -0.07 0.15 -0.34 0.00 0.00 178.44 179.07 1ynf h PHE 391 N 0.72 -0.16 -0.48 1.25 3.57 -1.00 0.12 116.94 120.96 1ynf h PHE 391 Ca 0.15 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 1ynf h PHE 391 Cb 0.44 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.27 1ynf h PHE 391 CO 0.03 -0.12 -0.08 -0.91 -2.23 0.00 0.00 178.31 175.00 1ynf h ASN 392 N -0.02 0.84 -0.29 0.41 2.35 -1.09 -1.49 115.58 116.29 1ynf h ASN 392 Ca 0.12 -0.25 -0.03 0.00 -0.55 0.00 0.00 56.30 55.59 1ynf h ASN 392 Cb 0.20 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1ynf h ASN 392 CO -0.25 0.95 0.06 0.00 -1.65 0.00 0.00 177.43 176.54 1ynf h ALA 393 N 1.13 0.38 -0.48 -0.83 0.00 -0.73 -1.94 119.26 116.79 1ynf h ALA 393 Ca 0.13 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1ynf h ALA 393 Cb 0.58 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1ynf h ALA 393 CO 0.04 0.06 0.09 -0.07 0.00 0.00 0.00 179.25 179.36 1ynf h LEU 394 N 0.30 0.76 -1.02 0.00 3.38 -0.68 -1.16 115.31 116.89 1ynf h LEU 394 Ca 0.09 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.82 1ynf h LEU 394 Cb 0.31 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1ynf h LEU 394 CO 0.00 0.82 0.66 0.78 0.09 0.00 0.00 178.44 180.79 1ynf h ASN 395 N 0.67 1.14 -0.34 -0.43 2.35 -1.20 0.54 115.58 118.31 1ynf h ASN 395 Ca 0.15 -0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 55.78 1ynf h ASN 395 Cb 0.37 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 1ynf h ASN 395 CO 0.01 0.82 -0.14 0.44 -1.65 0.00 0.00 177.43 176.91 1ynf h ASP 396 N 1.35 0.72 -0.59 5.81 3.32 -1.13 -1.52 116.42 124.37 1ynf h ASP 396 Ca 0.37 -0.39 0.03 0.00 0.02 0.00 0.00 57.03 57.06 1ynf h ASP 396 Cb -0.14 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.18 1ynf h ASP 396 CO -0.09 0.95 0.35 -0.25 -1.72 0.00 0.00 179.24 178.48 1ynf h TRP 397 N 0.48 0.65 -0.30 4.55 7.01 -0.64 -1.53 115.95 126.17 1ynf h TRP 397 Ca 0.08 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 1ynf h TRP 397 Cb 0.67 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 27.51 1ynf h TRP 397 CO 0.06 0.36 0.13 0.28 -2.79 0.00 0.00 178.44 176.48 1ynf h VAL 398 N 0.68 1.16 0.00 2.65 2.07 -0.74 -1.95 116.25 120.13 1ynf h VAL 398 Ca 0.24 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1ynf h VAL 398 Cb 0.06 0.94 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 1ynf h VAL 398 CO -0.12 0.17 -0.05 0.44 0.02 0.00 0.00 177.57 178.03 1ynf h ASP 399 N 0.34 0.00 0.02 0.57 3.32 -0.91 0.46 116.42 120.21 1ynf h ASP 399 Ca 0.10 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.06 1ynf h ASP 399 Cb 0.15 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.70 1ynf h ASP 399 CO -0.01 0.05 -0.36 -0.09 -1.72 0.00 0.00 179.24 177.10 1ynf h ARG 400 N 0.00 0.21 0.00 3.56 9.65 -0.90 -3.41 114.38 123.50 1ynf h ARG 400 Ca -0.00 -0.26 -0.14 0.00 -1.10 0.00 0.00 59.98 58.48 1ynf h ARG 400 Cb 0.09 0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.72 1ynf h ARG 400 CO 0.01 1.01 -2.06 0.66 2.80 0.00 0.00 179.97 182.39 1ynf n TYR 401 N -4.41 0.00 -2.93 2.20 4.02 -0.77 -5.00 117.16 110.27 1ynf n TYR 401 Ca -0.10 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.39 1ynf n TYR 401 Cb 0.58 -0.64 -0.06 0.00 -0.02 0.00 0.00 39.34 39.20 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 -2.99 3.87 0.38 -0.72 1.51 0.14 -4.96 117.35 114.57 1ynf s TYR 402 Ca -0.08 1.65 -0.09 0.00 -1.01 0.00 0.00 57.07 57.53 1ynf s TYR 402 Cb 0.10 -2.83 -0.06 0.00 -0.11 0.00 0.00 41.96 39.05 1ynf s TYR 402 CO 0.80 0.42 0.72 1.03 -1.11 0.00 0.00 175.55 177.41 1ynf s ARG 403 N -0.77 3.75 0.13 -0.62 0.52 -1.26 -4.71 118.95 116.00 1ynf s ARG 403 Ca 0.38 0.38 0.24 0.00 -0.52 0.00 0.00 55.73 56.20 1ynf s ARG 403 Cb -0.23 -2.44 0.22 0.00 0.52 0.00 0.00 34.95 33.01 1ynf s ARG 403 CO 0.26 0.02 1.21 -0.44 0.02 0.00 0.00 175.30 176.37 1ynf h ASP 404 N 1.36 0.00 -3.76 0.23 3.45 -1.94 -2.09 116.42 113.66 1ynf h ASP 404 Ca -0.47 -0.19 -0.26 0.00 0.43 0.00 0.00 57.03 56.55 1ynf h ASP 404 Cb 1.19 0.00 -0.28 0.00 -0.56 0.00 0.00 39.33 39.67 1ynf h ASP 404 CO 0.64 0.09 -0.73 -0.13 -1.57 0.00 0.00 179.24 177.55 1ynf s ARG 405 N -3.22 0.10 -0.13 3.56 0.52 -1.26 -4.25 118.95 114.28 1ynf s ARG 405 Ca 0.04 -0.04 -0.25 0.00 -0.52 0.00 0.00 55.73 54.96 1ynf s ARG 405 Cb 0.13 -0.11 0.06 0.00 0.52 0.00 0.00 34.95 35.55 1ynf s ARG 405 CO 0.75 0.02 0.62 -1.17 0.02 0.00 0.00 175.30 175.54 1ynf s LEU 406 N 0.00 -0.38 0.12 2.53 2.96 -0.53 -4.93 118.68 118.45 1ynf s LEU 406 Ca 0.00 0.91 -0.00 0.00 -0.22 0.00 0.00 54.13 54.81 1ynf s LEU 406 Cb -0.01 2.23 -0.04 0.00 0.50 0.00 0.00 46.19 48.87 1ynf s LEU 406 CO -0.00 -0.41 0.02 0.42 -1.32 0.00 0.00 176.35 175.06 1ynf s THR 407 N -0.50 0.28 0.49 3.68 -4.23 -1.26 -0.86 115.64 113.23 1ynf s THR 407 Ca -0.06 -1.90 0.19 0.00 -1.18 0.00 0.00 61.69 58.74 1ynf s THR 407 Cb -0.03 -1.92 0.35 0.00 1.34 0.00 0.00 72.50 72.24 1ynf s THR 407 CO 0.05 -0.61 2.01 0.00 -0.54 0.00 0.00 174.62 175.54 1ynf h ALA 408 N 2.90 2.24 0.00 3.99 0.00 -1.83 -0.84 119.26 125.73 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 18.96 1ynf h ALA 408 CO 0.62 -0.36 -0.12 0.00 0.00 0.00 0.00 179.25 179.38 1ynf h ALA 409 N 1.76 1.46 0.00 0.00 0.00 -1.96 -2.26 119.26 118.26 1ynf h ALA 409 Ca 0.22 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ynf h ALA 409 Cb 0.68 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1ynf h ALA 409 CO -0.03 0.15 0.00 -0.25 0.00 0.00 0.00 179.25 179.12 1ynf n ASP 410 N -3.90 0.08 0.21 0.00 8.00 -0.32 -3.51 116.55 117.13 1ynf n ASP 410 Ca -0.02 0.51 0.15 0.00 0.71 0.00 0.00 54.79 56.14 1ynf n ASP 410 Cb 0.22 -0.53 0.69 0.00 -0.02 0.00 0.00 41.12 41.48 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 -0.08 0.64 3.38 -1.50 -2.04 115.31 115.71 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 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1ynf h LEU 411 CO 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 178.44 178.19 1ynf n ALA 412 N -1.91 3.18 -2.19 1.53 0.00 -1.23 -4.87 120.51 115.02 1ynf n ALA 412 Ca 0.00 -0.30 -0.43 0.00 0.00 0.00 0.00 53.44 52.71 1ynf n ALA 412 Cb 0.18 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.39 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 -2.89 6.45 0.53 0.00 3.68 -0.77 -4.80 116.67 118.87 1ynf s ASP 413 Ca 0.15 1.52 0.21 0.00 2.13 0.00 0.00 52.55 56.55 1ynf s ASP 413 Cb 0.18 -2.53 1.35 0.00 -1.45 0.00 0.00 42.92 40.47 1ynf s ASP 413 CO 0.62 -1.21 2.08 -0.65 0.13 0.00 0.00 175.17 176.14 1ynf h PRO 414 N 10.37 0.00 -0.14 4.34 0.11 -1.89 -1.33 132.00 143.47 1ynf h PRO 414 Ca -0.32 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.65 1ynf h PRO 414 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1ynf h PRO 414 CO 1.01 0.00 -0.52 0.37 -0.21 0.00 0.00 178.00 178.65 1ynf h GLN 415 N 0.00 0.38 -0.63 1.05 4.15 -1.95 -1.46 115.11 116.64 1ynf h GLN 415 Ca 0.12 -0.22 -0.06 0.00 0.77 0.00 0.00 58.65 59.25 1ynf h GLN 415 Cb 0.48 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.16 1ynf h GLN 415 CO -0.00 0.81 0.14 1.25 -1.93 0.00 0.00 178.83 179.10 1ynf h LEU 416 N 0.30 0.96 -0.05 -2.39 5.85 -1.57 -0.44 115.31 117.97 1ynf h LEU 416 Ca 0.01 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.51 1ynf h LEU 416 Cb 1.01 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1ynf h LEU 416 CO 0.09 0.95 -0.05 0.25 -0.34 0.00 0.00 178.44 179.34 1ynf h LEU 417 N 0.93 -0.15 -0.86 2.25 5.85 -1.24 -1.01 115.31 121.09 1ynf h LEU 417 Ca 0.20 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 1ynf h LEU 417 Cb 0.37 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 1ynf h LEU 417 CO 0.00 -0.07 0.43 0.03 -0.34 0.00 0.00 178.44 178.50 1ynf h ARG 418 N -0.06 1.22 -0.39 1.25 3.08 -1.03 -1.72 114.38 116.73 1ynf h ARG 418 Ca 0.04 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1ynf h ARG 418 Cb 0.12 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1ynf h ARG 418 CO -0.09 0.92 0.18 0.93 -1.07 0.00 0.00 179.97 180.84 1ynf h GLU 419 N 1.21 0.57 -0.52 0.04 5.08 -0.80 -2.15 114.58 118.01 1ynf h GLU 419 Ca 0.30 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.53 1ynf h GLU 419 Cb 0.09 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1ynf h GLU 419 CO -0.04 0.52 0.16 0.78 -1.00 0.00 0.00 179.01 179.43 1ynf h GLY 420 N 0.49 0.83 0.73 -3.84 0.00 -0.87 -0.61 103.07 99.80 1ynf h GLY 420 Ca 0.13 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1ynf h GLY 420 CO -0.01 0.42 -0.02 3.21 0.00 0.00 0.00 176.54 180.14 1ynf h ARG 421 N 0.76 0.21 -0.19 4.80 2.47 -1.09 -1.31 114.38 120.04 1ynf h ARG 421 Ca 0.17 -0.08 -0.00 0.00 -1.26 0.00 0.00 59.98 58.81 1ynf h ARG 421 Cb 0.23 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.52 1ynf h ARG 421 CO -0.01 0.50 0.11 1.49 0.56 0.00 0.00 179.97 182.62 1ynf h GLU 422 N -0.10 0.26 -0.32 0.04 4.81 -1.26 -0.79 114.58 117.22 1ynf h GLU 422 Ca 0.03 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1ynf h GLU 422 Cb 0.42 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.68 1ynf h GLU 422 CO 0.01 0.23 -0.14 0.00 -0.73 0.00 0.00 179.01 178.38 1ynf h ALA 423 N 1.01 0.12 -0.20 2.92 0.00 -1.06 0.30 119.26 122.35 1ynf h ALA 423 Ca 0.07 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1ynf h ALA 423 Cb 0.05 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1ynf h ALA 423 CO -0.01 -0.53 -0.19 -0.07 0.00 0.00 0.00 179.25 178.45 1ynf h LEU 424 N -0.09 0.33 -0.45 0.00 3.38 -1.02 0.32 115.31 117.78 1ynf h LEU 424 Ca 0.16 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1ynf h LEU 424 Cb 0.34 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1ynf h LEU 424 CO -0.38 0.54 -0.16 -0.78 0.09 0.00 0.00 178.44 177.75 1ynf h ASP 425 N 0.31 0.92 -0.43 -0.43 3.58 -0.17 -0.72 116.42 119.48 1ynf h ASP 425 Ca 0.06 -0.38 -0.12 0.00 0.42 0.00 0.00 57.03 57.01 1ynf h ASP 425 Cb 0.52 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.31 1ynf h ASP 425 CO 0.03 1.09 -0.19 0.58 -2.88 0.00 0.00 179.24 177.88 1ynf h VAL 426 N 0.74 1.28 -0.70 2.25 2.07 -0.63 -2.98 116.25 118.28 1ynf h VAL 426 Ca 0.11 -1.33 -0.04 0.00 0.82 0.00 0.00 66.70 66.26 1ynf h VAL 426 Cb 0.72 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1ynf h VAL 426 CO 0.05 0.45 0.27 0.25 0.02 0.00 0.00 177.57 178.61 1ynf h LEU 427 N 0.71 0.96 -2.04 2.57 5.85 -0.81 -1.20 115.31 121.36 1ynf h LEU 427 Ca 0.10 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1ynf h LEU 427 Cb 0.75 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.53 1ynf h LEU 427 CO 0.06 0.87 -0.09 0.77 -0.34 0.00 0.00 178.44 179.70 1ynf h SER 428 N 1.02 0.00 0.09 1.25 4.64 -1.01 0.13 113.55 119.67 1ynf h SER 428 Ca 0.24 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.42 1ynf h SER 428 Cb 0.21 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.32 1ynf h SER 428 CO -0.02 0.09 -0.57 1.56 -0.87 0.00 0.00 176.83 177.03 1ynf h GLN 429 N 0.00 0.23 -0.76 4.77 4.20 -1.18 0.57 115.11 122.95 1ynf h GLN 429 Ca -0.00 -0.37 0.03 0.00 0.06 0.00 0.00 58.65 58.37 1ynf h GLN 429 Cb 0.24 0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.11 1ynf h GLN 429 CO 0.01 1.15 0.48 1.25 -0.67 0.00 0.00 178.83 181.06 1ynf h LEU 430 N -0.50 0.80 -0.94 1.46 5.85 -0.51 -1.78 115.31 119.69 1ynf h LEU 430 Ca -0.10 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1ynf h LEU 430 Cb 1.42 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1ynf h LEU 430 CO 0.11 0.56 0.00 0.18 -0.34 0.00 0.00 178.44 178.94 1ynf n LEU 431 N -4.62 1.42 -3.70 2.25 4.77 0.39 -4.94 117.00 112.58 1ynf n LEU 431 Ca 0.08 -0.58 -0.25 0.00 -0.03 0.00 0.00 56.01 55.23 1ynf n LEU 431 Cb 0.08 -0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1ynf n LEU 431 CO 0.34 0.29 -0.09 -3.20 -1.33 0.00 0.00 177.39 173.39 1ynf n ASN 432 N 0.15 -2.82 -0.00 -1.43 5.15 -0.67 -4.60 115.26 111.05 1ynf n ASN 432 Ca 0.16 -0.91 0.06 0.00 -0.60 0.00 0.00 54.58 53.29 1ynf n ASN 432 Cb 0.30 -3.74 -0.08 0.00 -0.53 0.00 0.00 39.78 35.74 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 -4.18 0.53 0.00 1.20 4.77 0.16 -5.01 117.00 114.47 1ynf n LEU 433 Ca -0.21 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 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 0.68 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.49 1ynf n GLY 434 N 1.35 -0.72 3.29 -0.72 0.00 -1.20 -4.12 105.19 103.07 1ynf n GLY 434 Ca 0.02 -1.14 -0.40 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.08 4.09 0.10 1.61 7.64 -1.26 -4.67 113.62 120.05 1ynf n SER 435 Ca 0.00 -2.84 0.12 0.00 1.01 0.00 0.00 58.87 57.16 1ynf n SER 435 Cb 0.00 -1.66 0.02 0.00 -1.01 0.00 0.00 64.21 61.57 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 5.10 0.00 -3.09 0.44 3.04 -1.94 -3.45 116.25 116.34 1ynf h VAL 436 Ca 0.45 -0.93 -0.59 0.00 -1.01 0.00 0.00 66.70 64.61 1ynf h VAL 436 Cb 0.79 1.45 -0.04 0.00 -2.01 0.00 0.00 31.29 31.49 1ynf h VAL 436 CO 1.60 0.00 -0.36 -0.31 -1.01 0.00 0.00 177.57 177.49 1ynf s TYR 437 N -3.34 3.49 0.24 3.17 1.51 -1.26 -4.80 117.35 116.37 1ynf s TYR 437 Ca 0.00 0.48 -0.05 0.00 -1.01 0.00 0.00 57.07 56.50 1ynf s TYR 437 Cb 0.10 -1.94 0.44 0.00 -0.11 0.00 0.00 41.96 40.44 1ynf s TYR 437 CO 0.78 0.48 1.72 -1.35 -1.11 0.00 0.00 175.55 176.08 1ynf h PRO 438 N 2.97 0.39 0.00 -1.71 0.11 -2.00 -0.53 132.00 131.23 1ynf h PRO 438 Ca -0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1ynf h PRO 438 Cb 1.17 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1ynf h PRO 438 CO 0.73 0.26 -0.03 0.27 -0.21 0.00 0.00 178.00 179.02 1ynf h PHE 439 N 0.40 0.00 -0.00 0.65 -5.15 -1.99 -0.45 116.94 110.40 1ynf h PHE 439 Ca 0.40 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.17 1ynf h PHE 439 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.78 1ynf h PHE 439 CO -0.18 0.03 -0.19 1.04 -2.00 0.00 0.00 178.31 177.01 1ynf n GLN 440 N -3.39 0.35 0.00 6.09 6.02 -0.22 -5.19 117.38 121.04 1ynf n GLN 440 Ca -0.02 -0.13 0.09 0.00 -0.01 0.00 0.00 57.00 56.93 1ynf n GLN 440 Cb 0.14 -1.50 0.07 0.00 1.02 0.00 0.00 30.24 29.98 1ynf n GLN 440 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59