#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 3.62 0.15 -2.53 0.00 -1.26 -3.02 121.76 118.72 1ynf s ALA 3 Ca 0.00 -0.20 0.08 0.00 0.00 0.00 0.00 51.96 51.84 1ynf s ALA 3 Cb 0.00 -2.45 -0.04 0.00 0.00 0.00 0.00 23.12 20.63 1ynf s ALA 3 CO 0.00 0.49 -0.17 -1.58 0.00 0.00 0.00 175.76 174.50 1ynf s TRP 4 N -1.44 1.70 -0.21 0.00 0.51 -0.22 -4.21 118.94 115.07 1ynf s TRP 4 Ca 0.36 -0.49 -0.20 0.00 -2.12 0.00 0.00 56.10 53.65 1ynf s TRP 4 Cb -0.15 -0.86 -0.03 0.00 -0.81 0.00 0.00 33.47 31.63 1ynf s TRP 4 CO 0.19 0.28 0.59 -2.00 -0.51 0.00 0.00 176.95 175.50 1ynf s GLU 5 N -2.76 4.18 -0.17 4.98 2.12 -1.26 -0.47 118.70 125.32 1ynf s GLU 5 Ca 0.14 0.53 -0.03 0.00 0.36 0.00 0.00 54.97 55.97 1ynf s GLU 5 Cb -0.05 -3.59 -0.02 0.00 0.26 0.00 0.00 34.13 30.72 1ynf s GLU 5 CO 0.06 -0.25 -0.05 0.08 -0.54 0.00 0.00 175.26 174.56 1ynf s VAL 6 N 1.95 3.70 -0.14 3.70 1.01 -0.08 -4.42 120.40 126.13 1ynf s VAL 6 Ca 0.27 -0.42 -0.21 0.00 0.00 0.00 0.00 61.98 61.62 1ynf s VAL 6 Cb -0.16 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 1ynf s VAL 6 CO 0.10 0.48 0.63 0.20 0.00 0.00 0.00 175.10 176.51 1ynf s ASN 7 N 0.60 6.80 -0.27 3.32 0.01 -0.57 -1.17 114.94 123.65 1ynf s ASN 7 Ca -0.03 0.96 -0.04 0.00 -0.71 0.00 0.00 52.86 53.04 1ynf s ASN 7 Cb -0.15 -2.36 0.01 0.00 0.41 0.00 0.00 41.25 39.17 1ynf s ASN 7 CO 0.03 -0.17 0.01 -0.36 -1.51 0.00 0.00 177.10 175.10 1ynf s PHE 8 N 1.27 3.10 0.11 2.20 0.40 -0.44 0.28 117.98 124.91 1ynf s PHE 8 Ca 0.31 -1.20 0.02 0.00 -0.60 0.00 0.00 56.93 55.46 1ynf s PHE 8 Cb -0.16 -2.16 -0.04 0.00 0.51 0.00 0.00 43.02 41.17 1ynf s PHE 8 CO 0.13 -0.63 0.22 -0.51 0.70 0.00 0.00 175.22 175.13 1ynf s ASP 9 N 1.43 6.18 -0.21 1.36 1.11 -0.64 -0.02 116.67 125.88 1ynf s ASP 9 Ca 0.02 0.16 -0.19 0.00 0.18 0.00 0.00 52.55 52.71 1ynf s ASP 9 Cb -0.17 -1.84 -0.03 0.00 1.07 0.00 0.00 42.92 41.96 1ynf s ASP 9 CO -0.01 0.11 0.57 -0.83 1.18 0.00 0.00 175.17 176.18 1ynf s GLY 10 N -2.89 2.03 -0.38 0.21 0.00 -0.67 -0.17 107.32 105.44 1ynf s GLY 10 Ca 0.34 -0.37 -0.29 0.00 0.00 0.00 0.00 44.72 44.40 1ynf s GLY 10 CO 0.27 1.20 1.18 -2.27 0.00 0.00 0.00 173.10 173.48 1ynf s LEU 11 N 1.84 3.77 0.14 0.66 2.96 -0.03 -4.90 118.68 123.12 1ynf s LEU 11 Ca 0.26 0.85 -0.35 0.00 -0.22 0.00 0.00 54.13 54.67 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 -1.12 1.33 0.52 -1.32 0.00 0.00 176.35 175.86 1ynf n VAL 12 N 6.43 0.36 -1.65 1.68 0.31 -1.26 -3.41 118.33 120.79 1ynf n VAL 12 Ca 0.13 -0.09 -0.30 0.00 -0.01 0.00 0.00 64.34 64.07 1ynf n VAL 12 Cb 0.48 -1.00 0.09 0.00 -0.91 0.00 0.00 33.84 32.50 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 0.38 1.61 0.53 2.92 0.00 -1.26 -4.74 107.32 106.76 1ynf s GLY 13 Ca 0.79 -0.34 0.30 0.00 0.00 0.00 0.00 44.72 45.47 1ynf s GLY 13 CO 0.47 0.11 2.04 1.41 0.00 0.00 0.00 173.10 177.13 1ynf h LEU 14 N -1.08 0.00 -2.66 0.66 4.07 -1.93 -3.07 115.31 111.30 1ynf h LEU 14 Ca -0.47 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.49 1ynf h LEU 14 Cb 1.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.02 1ynf h LEU 14 CO 0.61 0.10 0.00 0.35 -1.08 0.00 0.00 178.44 178.42 1ynf n THR 15 N -3.40 1.45 -1.69 0.22 -2.24 -1.26 -4.82 114.28 102.54 1ynf n THR 15 Ca -0.01 -0.98 -0.59 0.00 -2.27 0.00 0.00 64.05 60.20 1ynf n THR 15 Cb 0.27 0.12 -0.08 0.00 -2.10 0.00 0.00 70.33 68.54 1ynf n THR 15 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1ynf n HIS 16 N 1.01 1.83 -3.89 4.78 -0.00 -1.16 -4.49 115.22 113.29 1ynf n HIS 16 Ca 0.22 0.70 -0.08 0.00 -0.00 0.00 0.00 57.72 58.57 1ynf n HIS 16 Cb 0.74 -2.37 -0.03 0.00 -0.00 0.00 0.00 29.99 28.34 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 2.78 -0.04 -0.21 1.57 -3.43 -1.26 -4.53 115.29 110.17 1ynf s HIS 17 Ca 0.97 -0.41 -0.06 0.00 -0.80 0.00 0.00 55.06 54.76 1ynf s HIS 17 Cb -1.15 0.59 -0.03 0.00 -1.43 0.00 0.00 32.58 30.56 1ynf s HIS 17 CO 0.66 -1.20 0.03 0.71 -2.00 0.00 0.00 174.74 172.94 1ynf s TYR 18 N -3.85 3.10 -0.09 0.38 4.12 -1.26 -4.92 117.35 114.83 1ynf s TYR 18 Ca 0.14 -0.30 0.16 0.00 0.02 0.00 0.00 57.07 57.09 1ynf s TYR 18 Cb -0.05 -2.12 0.35 0.00 -1.52 0.00 0.00 41.96 38.62 1ynf s TYR 18 CO 0.08 -0.17 1.16 0.00 0.02 0.00 0.00 175.55 176.64 1ynf n ALA 19 N 4.23 2.74 0.00 3.71 0.00 -1.26 -4.65 120.51 125.28 1ynf n ALA 19 Ca -0.17 -2.52 0.00 0.00 0.00 0.00 0.00 53.44 50.75 1ynf n ALA 19 Cb 0.52 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 19.44 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 -0.35 -1.17 -0.68 0.00 -0.00 -1.26 -5.14 115.22 106.61 1ynf n HIS 31 Ca 0.11 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.90 1ynf n HIS 31 Cb 0.87 0.00 0.24 0.00 -0.00 0.00 0.00 29.99 31.10 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 -0.23 3.04 -3.04 -1.40 1.74 -1.26 -5.02 116.66 110.49 1ynf n ARG 32 Ca 0.00 -2.59 -0.39 0.00 -0.77 0.00 0.00 57.85 54.10 1ynf n ARG 32 Cb 0.00 -1.67 -0.06 0.00 -1.02 0.00 0.00 32.46 29.71 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 -2.13 3.87 -0.01 -1.55 0.40 -1.26 -4.93 117.98 112.37 1ynf s PHE 33 Ca 0.37 1.55 0.01 0.00 -0.60 0.00 0.00 56.93 58.26 1ynf s PHE 33 Cb 0.27 -2.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.07 1ynf s PHE 33 CO 0.13 0.51 0.03 1.04 0.70 0.00 0.00 175.22 177.63 1ynf n GLN 34 N 1.54 1.03 -3.65 0.44 3.00 -1.26 -4.86 117.38 113.62 1ynf n GLN 34 Ca -0.06 -0.01 -0.38 0.00 -0.01 0.00 0.00 57.00 56.54 1ynf n GLN 34 Cb 0.49 -0.96 -0.12 0.00 0.00 0.00 0.00 30.24 29.65 1ynf n GLN 34 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1ynf s VAL 35 N -1.95 4.91 0.32 5.09 1.01 -1.26 -4.47 120.40 124.05 1ynf s VAL 35 Ca -0.00 0.01 0.07 0.00 0.00 0.00 0.00 61.98 62.06 1ynf s VAL 35 Cb 0.01 -3.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 1ynf s VAL 35 CO 0.06 0.27 0.28 -0.94 0.00 0.00 0.00 175.10 174.77 1ynf s SER 36 N 1.70 5.34 -0.54 3.32 1.04 -0.03 -4.89 113.70 119.63 1ynf s SER 36 Ca 0.07 -0.45 0.04 0.00 0.48 0.00 0.00 55.95 56.08 1ynf s SER 36 Cb -0.16 -1.05 0.15 0.00 0.10 0.00 0.00 66.02 65.06 1ynf s SER 36 CO 0.08 -0.31 0.33 0.21 0.98 0.00 0.00 173.24 174.54 1ynf s ASN 37 N -3.97 4.01 0.17 7.02 3.84 -1.26 -1.36 114.94 123.40 1ynf s ASN 37 Ca 0.40 -3.16 -0.17 0.00 0.21 0.00 0.00 52.86 50.13 1ynf s ASN 37 Cb -0.06 -1.35 0.12 0.00 -0.55 0.00 0.00 41.25 39.40 1ynf s ASN 37 CO 0.26 -0.19 1.65 -0.65 -2.79 0.00 0.00 177.10 175.38 1ynf h PRO 38 N 6.15 -0.05 -0.35 0.43 0.11 -1.79 -0.42 132.00 136.08 1ynf h PRO 38 Ca 0.04 0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.20 1ynf h PRO 38 Cb 0.86 0.01 -0.05 0.00 0.11 0.00 0.00 31.00 31.94 1ynf h PRO 38 CO 0.61 -0.04 0.07 -0.09 -0.21 0.00 0.00 178.00 178.35 1ynf h ARG 39 N -0.06 0.19 -0.30 1.05 2.43 -1.66 -1.17 114.38 114.86 1ynf h ARG 39 Ca 0.21 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.28 1ynf h ARG 39 Cb 0.38 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 1ynf h ARG 39 CO -0.48 0.13 -0.17 1.25 -1.51 0.00 0.00 179.97 179.19 1ynf h LEU 40 N 0.20 0.54 -0.47 3.80 5.85 -1.71 -1.46 115.31 122.06 1ynf h LEU 40 Ca 0.17 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ynf h LEU 40 Cb 0.18 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1ynf h LEU 40 CO -0.21 0.73 0.30 0.00 -0.34 0.00 0.00 178.44 178.91 1ynf h ALA 41 N 1.32 0.60 -0.18 1.25 0.00 -0.37 0.11 119.26 121.98 1ynf h ALA 41 Ca 0.08 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1ynf h ALA 41 Cb 0.59 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1ynf h ALA 41 CO 0.04 0.07 -0.00 0.00 0.00 0.00 0.00 179.25 179.36 1ynf h ALA 42 N 1.15 0.25 -0.83 0.00 0.00 -0.98 -2.64 119.26 116.21 1ynf h ALA 42 Ca 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1ynf h ALA 42 Cb -0.03 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1ynf h ALA 42 CO -0.03 -0.04 0.43 0.87 0.00 0.00 0.00 179.25 180.48 1ynf h LYS 43 N 0.07 1.16 -0.84 0.00 1.57 -1.06 0.46 116.57 117.94 1ynf h LYS 43 Ca 0.05 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1ynf h LYS 43 Cb 0.39 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 1ynf h LYS 43 CO 0.01 0.86 0.53 1.96 -0.57 0.00 0.00 179.45 182.24 1ynf h GLN 44 N 1.16 1.13 -0.40 3.15 4.20 -0.93 0.03 115.11 123.46 1ynf h GLN 44 Ca 0.29 -0.09 -0.13 0.00 0.06 0.00 0.00 58.65 58.78 1ynf h GLN 44 Cb 0.05 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 1ynf h GLN 44 CO -0.04 0.78 -0.24 0.78 -0.67 0.00 0.00 178.83 179.43 1ynf h GLY 45 N 1.15 0.95 1.12 3.46 0.00 -1.00 -2.77 103.07 105.99 1ynf h GLY 45 Ca 0.31 -0.89 -0.07 0.00 0.00 0.00 0.00 47.33 46.68 1ynf h GLY 45 CO -0.06 0.81 0.17 1.41 0.00 0.00 0.00 176.54 178.86 1ynf h LEU 46 N 0.69 1.03 -0.65 3.11 3.38 -0.57 -2.88 115.31 119.42 1ynf h LEU 46 Ca 0.08 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1ynf h LEU 46 Cb 0.82 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1ynf h LEU 46 CO 0.07 0.99 0.42 -0.07 0.09 0.00 0.00 178.44 179.94 1ynf h LEU 47 N 1.04 0.76 -1.35 1.67 3.38 -0.90 0.59 115.31 120.49 1ynf h LEU 47 Ca 0.22 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1ynf h LEU 47 Cb 0.36 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1ynf h LEU 47 CO 0.00 0.56 0.00 1.17 0.09 0.00 0.00 178.44 180.27 1ynf n LYS 48 N -4.62 0.12 0.00 1.13 0.00 -1.05 -1.12 118.16 112.63 1ynf n LYS 48 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.36 1ynf n LYS 48 Cb 0.03 -1.19 0.00 0.00 0.00 0.00 0.00 35.03 33.86 1ynf n LYS 48 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1ynf n LYS 50 N 0.61 0.00 -0.10 1.64 3.00 0.20 -2.06 118.16 121.46 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 0.04 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 0.39 -0.53 3.14 0.00 -1.37 0.30 119.26 121.20 1ynf h ALA 51 Ca 0.00 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1ynf h ALA 51 Cb 0.00 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1ynf h ALA 51 CO 0.00 -0.30 0.18 -0.07 0.00 0.00 0.00 179.25 179.06 1ynf h LEU 52 N 0.23 0.76 0.01 0.00 3.38 -1.67 -0.91 115.31 117.12 1ynf h LEU 52 Ca 0.16 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1ynf h LEU 52 Cb 0.16 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1ynf h LEU 52 CO -0.19 0.75 -0.06 0.00 0.09 0.00 0.00 178.44 179.03 1ynf h ALA 53 N 1.04 -0.08 -0.65 1.53 0.00 -1.47 -1.15 119.26 118.48 1ynf h ALA 53 Ca 0.17 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.12 1ynf h ALA 53 Cb 0.25 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1ynf h ALA 53 CO -0.01 -0.56 0.43 -0.44 0.00 0.00 0.00 179.25 178.67 1ynf h ASP 54 N -0.12 0.66 0.13 0.00 3.32 -0.21 -0.53 116.42 119.68 1ynf h ASP 54 Ca 0.02 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1ynf h ASP 54 Cb 0.14 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1ynf h ASP 54 CO -0.05 0.46 0.00 0.00 -1.72 0.00 0.00 179.24 177.92 1ynf n ALA 55 N -2.45 2.24 0.00 3.45 0.00 -0.36 -4.86 120.51 118.53 1ynf n ALA 55 Ca 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1ynf n ALA 55 Cb 0.13 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.23 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 0.42 0.74 3.55 0.00 0.00 -0.21 -5.07 105.19 104.62 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 3.18 -0.20 1.61 0.40 -0.49 -5.01 117.98 115.47 1ynf s PHE 57 Ca 0.00 0.13 -0.42 0.00 -0.60 0.00 0.00 56.93 56.04 1ynf s PHE 57 Cb 0.00 -2.88 -0.18 0.00 0.51 0.00 0.00 43.02 40.46 1ynf s PHE 57 CO 0.00 -0.53 1.44 -2.30 0.70 0.00 0.00 175.22 174.53 1ynf n PRO 58 N 5.68 0.47 -4.13 0.24 -0.02 -1.26 -3.74 135.00 132.23 1ynf n PRO 58 Ca -0.06 0.17 -0.15 0.00 -2.02 0.00 0.00 63.50 61.45 1ynf n PRO 58 Cb 0.49 -1.74 -0.13 0.00 -0.02 0.00 0.00 33.50 32.10 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 1.82 0.50 0.33 -0.52 2.00 -1.26 -1.52 119.66 121.01 1ynf s GLN 59 Ca 0.96 -0.47 0.01 0.00 -2.00 0.00 0.00 55.36 53.86 1ynf s GLN 59 Cb -1.24 -0.39 -0.01 0.00 0.80 0.00 0.00 33.01 32.16 1ynf s GLN 59 CO 0.65 0.09 0.37 0.00 -0.50 0.00 0.00 175.29 175.91 1ynf s ALA 60 N -0.71 1.22 0.06 1.58 0.00 0.14 -4.85 121.76 119.20 1ynf s ALA 60 Ca -0.03 -1.75 0.02 0.00 0.00 0.00 0.00 51.96 50.20 1ynf s ALA 60 Cb -0.06 1.30 -0.03 0.00 0.00 0.00 0.00 23.12 24.33 1ynf s ALA 60 CO 0.00 -0.73 -0.07 0.54 0.00 0.00 0.00 175.76 175.51 1ynf s VAL 61 N -3.29 0.53 -0.10 0.00 0.11 -0.27 -1.63 120.40 115.76 1ynf s VAL 61 Ca 0.35 -1.39 0.02 0.00 -2.93 0.00 0.00 61.98 58.03 1ynf s VAL 61 Cb 0.01 -0.99 0.01 0.00 -1.53 0.00 0.00 36.38 33.89 1ynf s VAL 61 CO 0.23 -0.59 -0.15 -0.63 -3.33 0.00 0.00 175.10 170.63 1ynf s ILE 62 N -2.28 1.42 0.80 7.04 1.01 0.76 -4.84 121.20 125.10 1ynf s ILE 62 Ca -0.02 -0.61 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 1ynf s ILE 62 Cb -0.04 -1.30 0.07 0.00 0.01 0.00 0.00 42.46 41.21 1ynf s ILE 62 CO -0.02 0.42 1.09 -2.16 0.00 0.00 0.00 174.94 174.27 1ynf s PRO 63 N 0.91 2.03 1.12 2.79 0.04 -1.26 -0.85 135.00 139.78 1ynf s PRO 63 Ca -0.09 0.95 -0.18 0.00 0.04 0.00 0.00 61.00 61.72 1ynf s PRO 63 Cb -0.15 -1.89 0.25 0.00 0.04 0.00 0.00 34.50 32.75 1ynf s PRO 63 CO 0.00 -1.74 1.18 -1.25 0.04 0.00 0.00 177.00 175.23 1ynf s PRO 64 N -4.97 -0.56 0.45 0.56 0.04 -1.22 -4.74 135.00 124.56 1ynf s PRO 64 Ca 0.61 -0.17 0.07 0.00 0.04 0.00 0.00 61.00 61.56 1ynf s PRO 64 Cb -0.16 -1.68 -0.01 0.00 0.04 0.00 0.00 34.50 32.68 1ynf s PRO 64 CO 0.56 -3.25 0.36 -1.01 0.04 0.00 0.00 177.00 173.69 1ynf s HIS 65 N -3.30 2.38 -0.29 0.56 3.76 -1.26 -5.05 115.29 112.10 1ynf s HIS 65 Ca 0.72 -0.61 -0.29 0.00 -0.15 0.00 0.00 55.06 54.73 1ynf s HIS 65 Cb -0.08 -2.07 -0.02 0.00 1.11 0.00 0.00 32.58 31.52 1ynf s HIS 65 CO 0.55 -0.18 1.75 -2.00 -0.85 0.00 0.00 174.74 174.01 1ynf s GLU 66 N -4.14 3.50 -0.06 1.40 2.12 -1.26 -4.93 118.70 115.33 1ynf s GLU 66 Ca 0.44 1.54 -0.04 0.00 0.36 0.00 0.00 54.97 57.26 1ynf s GLU 66 Cb -0.02 -4.15 0.03 0.00 0.26 0.00 0.00 34.13 30.26 1ynf s GLU 66 CO 0.25 -1.66 0.15 1.03 -0.54 0.00 0.00 175.26 174.49 1ynf s ARG 67 N 5.32 0.12 0.70 4.30 1.81 -1.26 -3.62 118.95 126.32 1ynf s ARG 67 Ca 0.78 0.32 -0.16 0.00 -1.72 0.00 0.00 55.73 54.94 1ynf s ARG 67 Cb -0.24 -0.09 0.02 0.00 -0.45 0.00 0.00 34.95 34.19 1ynf s ARG 67 CO 0.33 -0.11 1.23 -2.14 -0.68 0.00 0.00 175.30 173.92 1ynf s PRO 68 N 0.80 2.31 -0.88 3.54 0.02 -1.26 -4.84 135.00 134.68 1ynf s PRO 68 Ca -0.06 1.84 -0.14 0.00 0.02 0.00 0.00 61.00 62.65 1ynf s PRO 68 Cb -0.08 -1.84 0.21 0.00 0.02 0.00 0.00 34.50 32.81 1ynf s PRO 68 CO -0.04 -1.72 0.87 0.12 -0.33 0.00 0.00 177.00 175.89 1ynf s PHE 69 N -1.81 3.71 0.27 6.54 5.36 0.24 -4.92 117.98 127.37 1ynf s PHE 69 Ca 0.76 -1.97 -0.02 0.00 -0.96 0.00 0.00 56.93 54.74 1ynf s PHE 69 Cb -0.31 -3.90 0.41 0.00 -0.34 0.00 0.00 43.02 38.88 1ynf s PHE 69 CO 0.43 -1.07 1.90 0.82 -1.46 0.00 0.00 175.22 175.83 1ynf h ILE 70 N 4.83 1.11 -0.98 3.12 1.08 -1.88 -3.10 117.51 121.69 1ynf h ILE 70 Ca 0.13 -0.41 0.22 0.00 -0.39 0.00 0.00 64.86 64.41 1ynf h ILE 70 Cb 1.02 -0.18 -0.09 0.00 -3.07 0.00 0.00 36.82 34.51 1ynf h ILE 70 CO 0.84 0.22 0.63 -0.65 -0.69 0.00 0.00 178.15 178.49 1ynf h PRO 71 N 1.19 0.49 0.00 2.37 0.11 -1.99 0.13 132.00 134.29 1ynf h PRO 71 Ca 0.42 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.40 1ynf h PRO 71 Cb 0.12 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 1ynf h PRO 71 CO -0.15 0.32 -0.47 -0.24 -0.21 0.00 0.00 178.00 177.25 1ynf h VAL 72 N 0.50 0.96 -0.31 3.15 3.04 -1.97 -2.25 116.25 119.36 1ynf h VAL 72 Ca 0.54 -1.90 -0.11 0.00 -1.01 0.00 0.00 66.70 64.23 1ynf h VAL 72 Cb 1.21 2.16 -0.01 0.00 -2.01 0.00 0.00 31.29 32.64 1ynf h VAL 72 CO -0.27 0.46 -0.25 -0.07 -1.01 0.00 0.00 177.57 176.43 1ynf h LEU 73 N 0.00 0.62 -0.59 3.16 3.38 -0.87 -1.36 115.31 119.65 1ynf h LEU 73 Ca -0.00 -0.22 -0.13 0.00 0.09 0.00 0.00 57.88 57.61 1ynf h LEU 73 Cb 1.12 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1ynf h LEU 73 CO 0.06 0.86 -0.28 0.03 0.09 0.00 0.00 178.44 179.20 1ynf h ARG 74 N 0.54 0.83 0.00 1.13 3.08 -1.11 -2.12 114.38 116.72 1ynf h ARG 74 Ca 0.07 -0.37 -0.02 0.00 0.07 0.00 0.00 59.98 59.73 1ynf h ARG 74 Cb 0.72 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.74 1ynf h ARG 74 CO 0.06 1.00 -0.11 1.96 -1.07 0.00 0.00 179.97 181.81 1ynf h GLN 75 N 0.71 0.00 -0.09 0.04 4.20 -0.90 -1.20 115.11 117.88 1ynf h GLN 75 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1ynf h GLN 75 Cb 0.82 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.60 1ynf h GLN 75 CO 0.07 0.11 0.00 1.28 -0.67 0.00 0.00 178.83 179.62 1ynf n LEU 76 N -4.11 0.92 0.00 1.46 4.77 -0.56 -4.92 117.00 114.56 1ynf n LEU 76 Ca -0.02 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 1ynf n LEU 76 Cb 0.19 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 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 0.99 0.63 3.62 -0.72 0.00 -0.45 -5.07 105.19 104.18 1ynf n GLY 77 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 3.27 0.44 1.61 0.40 -1.02 -5.02 117.98 115.66 1ynf s PHE 78 Ca 0.00 0.58 0.07 0.00 -0.60 0.00 0.00 56.93 56.99 1ynf s PHE 78 Cb 0.00 -2.68 -0.02 0.00 0.51 0.00 0.00 43.02 40.83 1ynf s PHE 78 CO 0.00 -0.26 0.31 -1.54 0.70 0.00 0.00 175.22 174.43 1ynf s SER 79 N 1.55 4.74 0.00 1.36 1.04 -1.26 -3.91 113.70 117.22 1ynf s SER 79 Ca 0.20 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 55.66 1ynf s SER 79 Cb -0.16 -0.32 0.00 0.00 0.10 0.00 0.00 66.02 65.64 1ynf s SER 79 CO 0.09 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.21 1ynf n GLY 80 N -1.49 0.28 3.92 7.32 0.00 -1.26 -4.18 105.19 109.78 1ynf n GLY 80 Ca 0.01 -2.21 -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 5.31 0.29 1.61 1.04 -1.26 -4.76 113.70 111.93 1ynf s SER 81 Ca 0.00 0.67 0.03 0.00 0.48 0.00 0.00 55.95 57.13 1ynf s SER 81 Cb 0.00 -1.52 0.65 0.00 0.10 0.00 0.00 66.02 65.25 1ynf s SER 81 CO 0.00 -1.27 1.77 0.44 0.98 0.00 0.00 173.24 175.16 1ynf h ASP 82 N -0.37 0.70 0.27 7.02 3.32 -1.99 0.20 116.42 125.58 1ynf h ASP 82 Ca -0.45 0.09 -0.18 0.00 0.02 0.00 0.00 57.03 56.51 1ynf h ASP 82 Cb 1.28 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 1ynf h ASP 82 CO 0.61 0.27 -0.71 -0.33 -1.72 0.00 0.00 179.24 177.36 1ynf h GLU 83 N 0.73 0.39 -0.33 3.56 5.08 -1.99 -1.97 114.58 120.05 1ynf h GLU 83 Ca 0.53 -0.31 -0.13 0.00 -1.00 0.00 0.00 59.36 58.46 1ynf h GLU 83 Cb 0.79 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 1ynf h GLU 83 CO -0.37 0.95 -0.29 1.96 -1.00 0.00 0.00 179.01 180.26 1ynf h GLN 84 N 0.27 0.78 -0.14 2.33 4.20 -1.49 -0.76 115.11 120.30 1ynf h GLN 84 Ca -0.03 -0.39 0.02 0.00 0.06 0.00 0.00 58.65 58.30 1ynf h GLN 84 Cb 1.28 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.05 1ynf h GLN 84 CO 0.12 1.02 0.03 0.28 -0.67 0.00 0.00 178.83 179.61 1ynf h VAL 85 N 0.55 0.95 -0.72 -0.54 2.07 -0.66 0.34 116.25 118.23 1ynf h VAL 85 Ca 0.06 -0.03 0.07 0.00 0.82 0.00 0.00 66.70 67.62 1ynf h VAL 85 Cb 0.86 0.85 -0.06 0.00 -1.52 0.00 0.00 31.29 31.42 1ynf h VAL 85 CO 0.07 0.02 0.40 0.25 0.02 0.00 0.00 177.57 178.33 1ynf h LEU 86 N 0.09 0.59 -0.35 2.57 5.85 -1.24 0.08 115.31 122.90 1ynf h LEU 86 Ca 0.06 0.04 -0.17 0.00 0.84 0.00 0.00 57.88 58.65 1ynf h LEU 86 Cb 0.05 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.00 1ynf h LEU 86 CO -0.08 0.37 -0.44 -0.33 -0.34 0.00 0.00 178.44 177.62 1ynf h GLU 87 N 0.72 0.92 -0.56 1.25 4.39 -0.46 -0.90 114.58 119.94 1ynf h GLU 87 Ca 0.33 -0.52 -0.01 0.00 0.34 0.00 0.00 59.36 59.50 1ynf h GLU 87 Cb 0.24 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.90 1ynf h GLU 87 CO -0.20 1.17 0.31 0.87 -1.16 0.00 0.00 179.01 179.99 1ynf h LYS 88 N 0.73 0.78 -0.38 2.33 1.57 0.24 -0.63 116.57 121.21 1ynf h LYS 88 Ca 0.05 -0.09 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 1ynf h LYS 88 Cb 1.04 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 1ynf h LYS 88 CO 0.10 0.59 0.01 0.28 -0.57 0.00 0.00 179.45 179.87 1ynf h VAL 89 N 0.75 1.26 -0.67 0.50 2.07 -0.93 0.51 116.25 119.74 1ynf h VAL 89 Ca 0.20 -0.96 0.05 0.00 0.82 0.00 0.00 66.70 66.81 1ynf h VAL 89 Cb 0.04 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 1ynf h VAL 89 CO -0.03 0.32 0.38 0.00 0.02 0.00 0.00 177.57 178.26 1ynf h ALA 90 N 0.88 0.89 0.02 1.67 0.00 -0.90 0.39 119.26 122.21 1ynf h ALA 90 Ca 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ynf h ALA 90 Cb 0.44 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ynf h ALA 90 CO 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 179.25 179.32 1ynf h ARG 91 N 0.70 -0.03 0.09 0.00 2.47 -0.89 -3.33 114.38 113.40 1ynf h ARG 91 Ca 0.29 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.86 1ynf h ARG 91 Cb 0.16 0.01 0.01 0.00 -1.65 0.00 0.00 29.97 28.50 1ynf h ARG 91 CO -0.17 0.69 -0.71 1.96 0.56 0.00 0.00 179.97 182.30 1ynf h GLN 92 N -0.81 0.19 -1.31 0.04 4.20 0.07 -3.43 115.11 114.06 1ynf h GLN 92 Ca -0.00 -0.32 -0.43 0.00 0.06 0.00 0.00 58.65 57.96 1ynf h GLN 92 Cb 0.73 0.12 -0.31 0.00 0.30 0.00 0.00 27.48 28.32 1ynf h GLN 92 CO 0.00 1.15 -0.91 0.00 -0.67 0.00 0.00 178.83 178.41 1ynf n ALA 93 N -2.75 1.08 0.20 3.87 0.00 0.49 -4.99 120.51 118.41 1ynf n ALA 93 Ca -0.16 -2.72 0.18 0.00 0.00 0.00 0.00 53.44 50.74 1ynf n ALA 93 Cb 0.73 -1.00 0.74 0.00 0.00 0.00 0.00 19.45 19.92 1ynf n ALA 93 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ynf h PRO 94 N 3.67 0.00 0.00 0.00 0.13 -0.50 -2.30 132.00 133.00 1ynf h PRO 94 Ca 0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 1ynf h PRO 94 Cb 0.96 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.09 1ynf h PRO 94 CO 0.40 0.00 -0.07 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 -2.09 115.15 114.76 1ynf h HIS 95 Ca 0.11 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.52 1ynf h HIS 95 Cb 0.98 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.95 1ynf h HIS 95 CO 0.00 0.07 -0.49 -1.49 -3.07 0.00 0.00 177.93 172.95 1ynf h TRP 96 N 0.00 0.00 -0.49 6.12 4.06 -1.76 -3.20 115.95 120.68 1ynf h TRP 96 Ca -0.00 0.00 0.09 0.00 2.06 0.00 0.00 58.89 61.04 1ynf h TRP 96 Cb 0.29 0.00 -0.07 0.00 -1.00 0.00 0.00 29.16 28.38 1ynf h TRP 96 CO 0.00 0.49 0.07 -0.07 -3.56 0.00 0.00 178.44 175.38 1ynf h LEU 97 N 0.00 -0.05 -0.64 -4.49 3.38 -1.57 -1.45 115.31 110.48 1ynf h LEU 97 Ca -0.00 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 1ynf h LEU 97 Cb 0.91 0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 1ynf h LEU 97 CO 0.06 0.00 0.16 -1.28 0.09 0.00 0.00 178.44 177.47 1ynf h SER 98 N 0.20 0.97 0.48 -0.43 0.87 -1.70 -2.32 113.55 111.61 1ynf h SER 98 Ca 0.25 -0.23 -0.01 0.00 -1.23 0.00 0.00 61.79 60.56 1ynf h SER 98 Cb 0.35 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1ynf h SER 98 CO -0.35 0.95 -0.07 0.28 -0.53 0.00 0.00 176.83 177.11 1ynf h SER 99 N 0.94 0.00 -0.35 6.23 0.02 -1.37 -2.29 113.55 116.73 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 0.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1ynf h SER 99 CO 0.00 0.07 0.00 1.33 -1.14 0.00 0.00 176.83 177.09 1ynf n VAL 100 N -3.36 1.50 -1.39 2.27 0.24 -0.64 -4.41 118.33 112.55 1ynf n VAL 100 Ca -0.01 -1.31 0.06 0.00 -2.04 0.00 0.00 64.34 61.03 1ynf n VAL 100 Cb 0.22 0.22 0.08 0.00 -1.47 0.00 0.00 33.84 32.89 1ynf n VAL 100 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1ynf n SER 101 N 0.23 1.40 -4.77 -1.34 7.64 -0.87 -0.59 113.62 115.32 1ynf n SER 101 Ca 0.16 -2.60 -0.38 0.00 1.01 0.00 0.00 58.87 57.06 1ynf n SER 101 Cb 0.62 -0.32 -0.05 0.00 -1.01 0.00 0.00 64.21 63.45 1ynf n SER 101 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1ynf s SER 102 N -2.05 7.12 -0.11 6.43 0.15 -1.18 -4.59 113.70 119.47 1ynf s SER 102 Ca 0.18 2.10 0.10 0.00 0.70 0.00 0.00 55.95 59.03 1ynf s SER 102 Cb 0.16 -2.60 0.48 0.00 -1.71 0.00 0.00 66.02 62.34 1ynf s SER 102 CO 0.02 -0.23 1.28 0.00 1.20 0.00 0.00 173.24 175.50 1ynf n ALA 103 N 0.68 3.14 -0.00 5.45 0.00 -1.26 -4.54 120.51 123.98 1ynf n ALA 103 Ca 0.01 -1.08 0.23 0.00 0.00 0.00 0.00 53.44 52.61 1ynf n ALA 103 Cb 0.47 -1.05 0.68 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 2.48 0.00 0.00 0.00 4.64 -1.94 -3.42 113.55 115.31 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 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1ynf h SER 104 CO 0.23 0.00 0.93 -0.81 -0.87 0.00 0.00 176.83 176.32 1ynf n PRO 105 N -3.64 0.00 -1.29 4.77 -0.04 -1.26 -4.73 135.00 128.81 1ynf n PRO 105 Ca 0.12 -0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.13 1ynf n PRO 105 Cb 0.86 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 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 4.79 0.00 0.63 0.54 8.01 -1.26 -4.89 117.44 125.25 1ynf n TRP 107 Ca 0.00 0.00 0.06 0.00 -1.31 0.00 0.00 57.50 56.25 1ynf n TRP 107 Cb 0.00 0.00 0.32 0.00 -2.01 0.00 0.00 31.31 29.62 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 -0.15 0.50 0.27 -0.99 0.24 -1.10 -2.02 118.33 115.08 1ynf n VAL 108 Ca 0.00 0.12 0.14 0.00 -2.04 0.00 0.00 64.34 62.57 1ynf n VAL 108 Cb 0.00 -0.93 0.75 0.00 -1.47 0.00 0.00 33.84 32.20 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 2.63 1.18 -0.12 2.33 0.00 -1.51 -1.30 119.26 122.47 1ynf h ALA 109 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1ynf h ALA 109 Cb 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ynf h ALA 109 CO 0.00 0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.46 1ynf n ASN 110 N -3.47 3.04 -0.24 0.00 4.13 -0.85 -1.06 115.26 116.80 1ynf n ASN 110 Ca -0.01 -1.97 -0.07 0.00 1.68 0.00 0.00 54.58 54.20 1ynf n ASN 110 Cb 0.25 -0.06 0.04 0.00 -1.54 0.00 0.00 39.78 38.46 1ynf n ASN 110 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ynf h ALA 111 N 4.64 0.89 -2.52 5.41 0.00 -1.37 -3.40 119.26 122.91 1ynf h ALA 111 Ca 0.00 -0.21 0.18 0.00 0.00 0.00 0.00 54.91 54.88 1ynf h ALA 111 Cb 0.97 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1ynf h ALA 111 CO 0.00 0.56 0.62 0.00 0.00 0.00 0.00 179.25 180.43 1ynf s ALA 112 N -5.43 -1.67 -0.10 0.00 0.00 -1.26 -1.42 121.76 111.88 1ynf s ALA 112 Ca -0.12 -0.34 0.02 0.00 0.00 0.00 0.00 51.96 51.52 1ynf s ALA 112 Cb 0.14 0.79 -0.01 0.00 0.00 0.00 0.00 23.12 24.04 1ynf s ALA 112 CO 0.83 -1.07 -0.17 0.99 0.00 0.00 0.00 175.76 176.33 1ynf s THR 113 N -2.10 2.72 -0.07 0.00 2.01 -0.55 -0.40 115.64 117.24 1ynf s THR 113 Ca 0.23 -0.80 -0.03 0.00 0.31 0.00 0.00 61.69 61.41 1ynf s THR 113 Cb -0.03 -2.10 -0.04 0.00 0.01 0.00 0.00 72.50 70.35 1ynf s THR 113 CO 0.05 0.55 0.05 -0.63 -0.69 0.00 0.00 174.62 173.95 1ynf s ILE 114 N 0.15 4.69 -0.26 1.82 -1.09 -1.26 -1.96 121.20 123.28 1ynf s ILE 114 Ca -0.09 -0.19 -0.00 0.00 -2.23 0.00 0.00 60.65 58.14 1ynf s ILE 114 Cb -0.15 -3.03 0.08 0.00 -1.58 0.00 0.00 42.46 37.77 1ynf s ILE 114 CO 0.06 0.54 0.03 0.00 -1.23 0.00 0.00 174.94 174.34 1ynf s ALA 115 N -1.00 1.70 0.69 9.38 0.00 -0.12 -5.01 121.76 127.40 1ynf s ALA 115 Ca 0.16 -1.45 -0.17 0.00 0.00 0.00 0.00 51.96 50.50 1ynf s ALA 115 Cb -0.12 -1.50 0.02 0.00 0.00 0.00 0.00 23.12 21.52 1ynf s ALA 115 CO 0.06 -1.41 1.27 -2.14 0.00 0.00 0.00 175.76 173.54 1ynf s PRO 116 N 1.52 2.28 0.57 0.00 0.02 -1.26 -1.82 135.00 136.32 1ynf s PRO 116 Ca 0.03 1.99 0.38 0.00 0.02 0.00 0.00 61.00 63.42 1ynf s PRO 116 Cb -0.18 -1.82 2.09 0.00 0.02 0.00 0.00 34.50 34.61 1ynf s PRO 116 CO -0.14 -1.79 2.18 0.66 -0.33 0.00 0.00 177.00 177.58 1ynf h SER 117 N 0.14 0.00 0.83 2.53 4.64 -1.83 -0.38 113.55 119.48 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 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1ynf h SER 117 CO 0.51 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.47 1ynf n ALA 118 N -1.99 1.85 0.31 5.18 0.00 -1.26 -3.16 120.51 121.43 1ynf n ALA 118 Ca -0.03 0.01 0.03 0.00 0.00 0.00 0.00 53.44 53.46 1ynf n ALA 118 Cb 0.07 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.13 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 -1.97 0.73 -4.87 0.00 8.00 -0.16 -4.14 116.55 114.14 1ynf n ASP 119 Ca 0.04 -0.86 -0.32 0.00 0.71 0.00 0.00 54.79 54.35 1ynf n ASP 119 Cb 0.26 0.68 -0.05 0.00 -0.02 0.00 0.00 41.12 41.99 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 -1.31 4.91 0.20 -3.53 -4.23 -1.19 -2.59 115.64 107.89 1ynf s THR 120 Ca 0.04 0.51 0.20 0.00 -1.18 0.00 0.00 61.69 61.26 1ynf s THR 120 Cb 0.05 -3.62 0.16 0.00 1.34 0.00 0.00 72.50 70.43 1ynf s THR 120 CO 0.22 -0.09 1.78 -0.07 -0.54 0.00 0.00 174.62 175.91 1ynf h LEU 121 N 2.47 0.00 -2.98 4.79 3.38 -1.58 -3.01 115.31 118.39 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 0.34 0.00 -0.90 0.09 0.00 0.00 178.44 178.65 1ynf n ASP 122 N -3.56 3.68 -0.26 -0.43 5.75 -1.26 -4.97 116.55 115.49 1ynf n ASP 122 Ca -0.00 -2.26 -0.03 0.00 -0.01 0.00 0.00 54.79 52.48 1ynf n ASP 122 Cb 0.47 -0.40 -0.01 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 0.69 0.42 3.87 6.12 0.00 -1.14 -5.00 105.19 110.16 1ynf n GLY 123 Ca 0.19 -0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 1ynf n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ynf s LYS 124 N -1.95 2.75 -0.12 1.61 1.02 -1.26 -4.76 119.74 117.03 1ynf s LYS 124 Ca 0.00 -1.28 -0.23 0.00 0.02 0.00 0.00 55.97 54.48 1ynf s LYS 124 Cb 0.00 -2.50 -0.03 0.00 -0.52 0.00 0.00 37.83 34.77 1ynf s LYS 124 CO 0.00 0.07 0.69 0.08 -0.92 0.00 0.00 175.35 175.28 1ynf s VAL 125 N -2.30 5.02 -0.08 3.17 1.01 -0.38 -3.95 120.40 122.88 1ynf s VAL 125 Ca 0.42 1.39 0.01 0.00 0.00 0.00 0.00 61.98 63.79 1ynf s VAL 125 Cb -0.06 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 1ynf s VAL 125 CO 0.27 0.18 -0.09 -1.00 0.00 0.00 0.00 175.10 174.46 1ynf s HIS 126 N 1.29 2.87 -0.09 5.22 3.76 -0.75 -0.31 115.29 127.28 1ynf s HIS 126 Ca 0.35 -0.16 -0.01 0.00 -0.15 0.00 0.00 55.06 55.09 1ynf s HIS 126 Cb -0.17 -1.74 0.03 0.00 1.11 0.00 0.00 32.58 31.81 1ynf s HIS 126 CO 0.15 0.17 -0.03 -0.51 -0.85 0.00 0.00 174.74 173.67 1ynf s LEU 127 N -0.48 0.84 -0.24 0.89 1.02 -0.37 -0.95 118.68 119.39 1ynf s LEU 127 Ca 0.07 -0.17 -0.04 0.00 0.02 0.00 0.00 54.13 54.01 1ynf s LEU 127 Cb -0.12 -0.59 0.00 0.00 0.02 0.00 0.00 46.19 45.50 1ynf s LEU 127 CO 0.02 -0.16 -0.02 -0.89 0.02 0.00 0.00 176.35 175.33 1ynf s THR 128 N 1.82 3.43 0.32 5.49 2.01 -0.83 -0.11 115.64 127.77 1ynf s THR 128 Ca 0.04 -0.64 -0.29 0.00 0.31 0.00 0.00 61.69 61.11 1ynf s THR 128 Cb -0.12 -2.65 -0.11 0.00 0.01 0.00 0.00 72.50 69.63 1ynf s THR 128 CO -0.06 0.30 1.51 -0.69 -0.69 0.00 0.00 174.62 174.98 1ynf s VAL 129 N 1.45 2.20 0.02 3.82 1.01 -0.75 -1.48 120.40 126.67 1ynf s VAL 129 Ca 0.04 0.18 -0.24 0.00 0.00 0.00 0.00 61.98 61.96 1ynf s VAL 129 Cb -0.15 -3.12 -0.05 0.00 0.00 0.00 0.00 36.38 33.06 1ynf s VAL 129 CO -0.02 0.04 0.72 0.00 0.00 0.00 0.00 175.10 175.83 1ynf s ALA 130 N -0.54 3.39 0.27 5.51 0.00 -0.50 -3.64 121.76 126.25 1ynf s ALA 130 Ca 0.57 0.20 0.19 0.00 0.00 0.00 0.00 51.96 52.93 1ynf s ALA 130 Cb -0.46 -2.93 0.85 0.00 0.00 0.00 0.00 23.12 20.58 1ynf s ALA 130 CO 0.54 0.06 1.83 -2.95 0.00 0.00 0.00 175.76 175.23 1ynf h ASN 131 N 5.83 0.00 -6.52 0.00 7.08 -1.84 -3.41 115.58 116.73 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 37.33 1ynf h ASN 131 CO 0.71 0.32 -0.82 0.18 -2.08 0.00 0.00 177.43 175.74 1ynf n LEU 132 N -3.68 -2.16 0.19 6.14 4.77 -0.19 -4.34 117.00 117.72 1ynf n LEU 132 Ca -0.01 -0.92 0.06 0.00 -0.03 0.00 0.00 56.01 55.11 1ynf n LEU 132 Cb 0.43 -2.30 0.55 0.00 -2.33 0.00 0.00 43.42 39.77 1ynf n LEU 132 CO 0.36 0.38 1.03 -1.13 -1.33 0.00 0.00 177.39 176.71 1ynf h ASN 133 N -1.78 0.11 -0.79 -1.43 -0.73 -1.91 -3.04 115.58 106.02 1ynf h ASN 133 Ca -0.60 -0.01 0.09 0.00 1.87 0.00 0.00 56.30 57.65 1ynf h ASN 133 Cb 1.38 -0.03 -0.07 0.00 0.27 0.00 0.00 38.32 39.87 1ynf h ASN 133 CO 0.70 0.14 0.44 -1.13 -0.37 0.00 0.00 177.43 177.22 1ynf h ASN 134 N 0.12 0.64 -3.57 1.15 -0.73 -1.89 -3.40 115.58 107.91 1ynf h ASN 134 Ca 0.03 0.04 -0.65 0.00 1.87 0.00 0.00 56.30 57.60 1ynf h ASN 134 Cb 0.09 -0.08 -0.23 0.00 0.27 0.00 0.00 38.32 38.37 1ynf h ASN 134 CO 0.00 0.37 -0.64 -0.54 -0.37 0.00 0.00 177.43 176.25 1ynf s LYS 135 N -6.05 3.61 0.18 6.67 -0.14 -1.23 -5.01 119.74 117.78 1ynf s LYS 135 Ca -0.12 -0.50 -0.18 0.00 -1.36 0.00 0.00 55.97 53.80 1ynf s LYS 135 Cb 0.19 -3.24 0.13 0.00 -1.68 0.00 0.00 37.83 33.22 1ynf s LYS 135 CO 0.78 -0.15 1.62 0.35 -0.76 0.00 0.00 175.35 177.18 1ynf h PHE 136 N 8.09 -0.56 0.00 3.18 3.04 -1.85 0.87 116.94 129.70 1ynf h PHE 136 Ca -0.39 0.05 -0.00 0.00 3.98 0.00 0.00 57.97 61.61 1ynf h PHE 136 Cb 1.17 0.32 -0.00 0.00 2.56 0.00 0.00 35.95 40.00 1ynf h PHE 136 CO 0.64 -0.30 -0.02 1.12 -2.02 0.00 0.00 178.31 177.73 1ynf h HIS 137 N -0.12 0.00 0.00 0.41 2.07 -1.94 -2.11 115.15 113.46 1ynf h HIS 137 Ca 0.22 0.00 -0.16 0.00 -2.85 0.00 0.00 60.37 57.59 1ynf h HIS 137 Cb 0.46 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.42 1ynf h HIS 137 CO -0.49 0.02 -1.31 0.00 -3.07 0.00 0.00 177.93 173.08 1ynf h ARG 138 N 0.00 0.00 0.00 5.12 3.08 -1.52 -3.32 114.38 117.74 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 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1ynf h ARG 138 CO 0.00 0.30 0.00 0.66 -1.07 0.00 0.00 179.97 179.86 1ynf h SER 139 N 0.00 0.00 1.07 7.04 4.64 -0.17 -1.52 113.55 124.62 1ynf h SER 139 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1ynf h SER 139 Cb 1.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.63 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 -0.13 5.97 3.38 -1.64 -3.32 115.31 119.56 1ynf h LEU 140 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1ynf h LEU 140 Cb 0.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1ynf h LEU 140 CO 0.00 0.00 -0.06 -0.33 0.09 0.00 0.00 178.44 178.14 1ynf h GLU 141 N 0.00 0.28 -0.62 1.13 5.08 -1.49 -3.39 114.58 115.57 1ynf h GLU 141 Ca 0.00 -0.12 0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1ynf h GLU 141 Cb 0.54 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.70 1ynf h GLU 141 CO 0.00 0.61 -0.34 0.00 -1.00 0.00 0.00 179.01 178.28 1ynf n ALA 142 N -2.36 -0.33 -0.11 3.43 0.00 -1.25 -0.81 120.51 119.08 1ynf n ALA 142 Ca -0.06 0.55 -0.05 0.00 0.00 0.00 0.00 53.44 53.87 1ynf n ALA 142 Cb 0.29 -0.13 0.02 0.00 0.00 0.00 0.00 19.45 19.63 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 0.12 -0.10 0.00 0.11 -1.87 0.12 132.00 130.38 1ynf h PRO 143 Ca 0.12 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 66.06 1ynf h PRO 143 Cb 0.28 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 1ynf h PRO 143 CO -0.59 0.08 -0.65 0.28 -0.21 0.00 0.00 178.00 176.90 1ynf h VAL 144 N 0.12 1.36 -0.51 3.15 2.07 -1.53 -2.69 116.25 118.22 1ynf h VAL 144 Ca 0.18 -2.01 -0.05 0.00 0.82 0.00 0.00 66.70 65.64 1ynf h VAL 144 Cb 0.24 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 1ynf h VAL 144 CO -0.28 0.61 0.10 0.74 0.02 0.00 0.00 177.57 178.76 1ynf h THR 145 N 0.30 1.22 -0.31 2.57 2.02 -0.46 -1.30 112.91 116.95 1ynf h THR 145 Ca -0.02 -0.83 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 1ynf h THR 145 Cb 1.20 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 1ynf h THR 145 CO 0.11 0.30 0.13 -0.08 0.37 0.00 0.00 175.52 176.36 1ynf h GLU 146 N 0.76 0.46 -0.44 6.66 4.81 -0.59 -1.23 114.58 125.02 1ynf h GLU 146 Ca 0.17 -0.08 0.04 0.00 -0.13 0.00 0.00 59.36 59.35 1ynf h GLU 146 Cb 0.31 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 1ynf h GLU 146 CO 0.00 0.46 0.22 0.77 -0.73 0.00 0.00 179.01 179.73 1ynf h SER 147 N 0.36 0.32 -0.33 1.04 0.02 -1.12 -1.33 113.55 112.51 1ynf h SER 147 Ca 0.10 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1ynf h SER 147 Cb 0.16 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 1ynf h SER 147 CO -0.01 0.23 0.18 -0.07 -1.14 0.00 0.00 176.83 176.02 1ynf h LEU 148 N 0.44 0.41 -1.02 5.07 3.38 -1.06 -1.57 115.31 120.97 1ynf h LEU 148 Ca 0.19 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1ynf h LEU 148 Cb 0.09 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1ynf h LEU 148 CO -0.13 0.39 0.33 -0.07 0.09 0.00 0.00 178.44 179.05 1ynf h LEU 149 N 0.41 0.93 -1.18 1.67 3.38 -0.92 -0.84 115.31 118.77 1ynf h LEU 149 Ca 0.12 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1ynf h LEU 149 Cb 0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1ynf h LEU 149 CO -0.02 0.80 -0.23 0.11 0.09 0.00 0.00 178.44 179.19 1ynf h LYS 150 N 1.02 0.00 0.00 1.13 1.57 -0.99 0.42 116.57 119.72 1ynf h LYS 150 Ca 0.25 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.00 1ynf h LYS 150 Cb 0.12 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1ynf h LYS 150 CO -0.03 0.23 -0.74 0.00 -0.57 0.00 0.00 179.45 178.34 1ynf h ALA 151 N 1.77 0.67 0.03 3.86 0.00 -0.52 -3.07 119.26 122.00 1ynf h ALA 151 Ca -0.00 -0.14 -0.31 0.00 0.00 0.00 0.00 54.91 54.45 1ynf h ALA 151 Cb 0.72 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 1ynf h ALA 151 CO 0.03 0.17 -1.74 -0.89 0.00 0.00 0.00 179.25 176.82 1ynf n ILE 152 N -2.86 1.60 -2.97 0.00 5.41 -0.39 -4.39 119.36 115.75 1ynf n ILE 152 Ca 0.00 -0.29 -0.38 0.00 1.00 0.00 0.00 62.75 63.08 1ynf n ILE 152 Cb 0.60 -1.89 -0.01 0.00 -0.71 0.00 0.00 39.64 37.62 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 -4.07 2.85 0.11 1.39 3.01 0.14 -1.58 117.46 119.31 1ynf n PHE 153 Ca -0.36 -3.02 -0.03 0.00 1.01 0.00 0.00 57.45 55.04 1ynf n PHE 153 Cb 0.83 -1.02 0.04 0.00 -0.01 0.00 0.00 39.48 39.32 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 4.58 0.00 -2.18 4.37 -0.73 -1.73 -3.43 115.58 116.46 1ynf h ASN 154 Ca 0.28 0.00 -0.52 0.00 1.87 0.00 0.00 56.30 57.93 1ynf h ASN 154 Cb 0.53 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.09 1ynf h ASN 154 CO 1.14 0.76 1.34 -0.62 -0.37 0.00 0.00 177.43 179.69 1ynf s ASP 155 N -6.71 5.42 0.20 1.15 -1.08 -1.26 -4.86 116.67 109.53 1ynf s ASP 155 Ca 0.00 0.65 0.20 0.00 -0.52 0.00 0.00 52.55 52.89 1ynf s ASP 155 Cb 0.11 -2.53 0.89 0.00 -1.46 0.00 0.00 42.92 39.93 1ynf s ASP 155 CO 0.78 -2.20 1.62 -0.62 0.52 0.00 0.00 175.17 175.27 1ynf n GLU 156 N 8.94 0.14 0.14 4.34 1.02 -1.26 -0.58 120.64 133.38 1ynf n GLU 156 Ca 0.22 0.42 0.12 0.00 -0.02 0.00 0.00 57.16 57.91 1ynf n GLU 156 Cb 0.51 -1.79 0.28 0.00 -0.02 0.00 0.00 31.44 30.41 1ynf n GLU 156 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1ynf h GLU 157 N 0.00 0.00 0.00 3.49 5.08 -1.99 -3.35 114.58 117.82 1ynf h GLU 157 Ca 0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 1ynf h GLU 157 Cb 0.27 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 1ynf h GLU 157 CO 0.00 0.00 -1.69 1.63 -1.00 0.00 0.00 179.01 177.95 1ynf n LYS 158 N -2.55 1.51 -4.62 2.33 4.76 -0.76 -4.91 118.16 113.93 1ynf n LYS 158 Ca 0.04 0.03 -0.25 0.00 -2.87 0.00 0.00 58.31 55.27 1ynf n LYS 158 Cb 0.47 -1.25 -0.14 0.00 -1.84 0.00 0.00 35.03 32.27 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 -2.24 1.71 -0.23 2.13 0.40 0.25 -1.25 117.98 118.75 1ynf s PHE 159 Ca -0.10 -0.37 -0.01 0.00 -0.60 0.00 0.00 56.93 55.86 1ynf s PHE 159 Cb 0.04 -1.03 0.07 0.00 0.51 0.00 0.00 43.02 42.60 1ynf s PHE 159 CO 0.35 0.07 0.01 -1.12 0.70 0.00 0.00 175.22 175.23 1ynf s SER 160 N -1.10 3.50 -0.23 1.36 0.01 0.58 -4.26 113.70 113.56 1ynf s SER 160 Ca 0.07 -1.12 -0.15 0.00 1.31 0.00 0.00 55.95 56.06 1ynf s SER 160 Cb -0.08 -0.90 -0.04 0.00 0.21 0.00 0.00 66.02 65.20 1ynf s SER 160 CO 0.01 -0.29 0.35 -0.69 0.41 0.00 0.00 173.24 173.03 1ynf s VAL 161 N 1.61 5.22 -0.05 3.43 1.01 -1.26 -1.23 120.40 129.12 1ynf s VAL 161 Ca -0.01 0.57 -0.02 0.00 0.00 0.00 0.00 61.98 62.52 1ynf s VAL 161 Cb -0.18 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 1ynf s VAL 161 CO -0.10 0.23 0.04 -1.00 0.00 0.00 0.00 175.10 174.28 1ynf s HIS 162 N 1.55 3.23 0.74 5.22 3.76 0.84 -4.98 115.29 125.66 1ynf s HIS 162 Ca 0.16 0.22 -0.13 0.00 -0.15 0.00 0.00 55.06 55.16 1ynf s HIS 162 Cb -0.15 -1.77 0.04 0.00 1.11 0.00 0.00 32.58 31.81 1ynf s HIS 162 CO 0.08 0.52 1.12 -1.12 -0.85 0.00 0.00 174.74 174.49 1ynf s SER 163 N -1.24 4.51 0.73 1.40 0.01 -1.26 -1.80 113.70 116.05 1ynf s SER 163 Ca 0.17 1.99 -0.15 0.00 1.31 0.00 0.00 55.95 59.28 1ynf s SER 163 Cb -0.12 -2.55 0.04 0.00 0.21 0.00 0.00 66.02 63.61 1ynf s SER 163 CO 0.07 -2.03 1.19 0.00 0.41 0.00 0.00 173.24 172.88 1ynf s ALA 164 N -2.56 2.12 0.85 1.44 0.00 -1.24 -4.51 121.76 117.87 1ynf s ALA 164 Ca 0.65 0.83 -0.11 0.00 0.00 0.00 0.00 51.96 53.34 1ynf s ALA 164 Cb -0.20 -3.45 0.11 0.00 0.00 0.00 0.00 23.12 19.57 1ynf s ALA 164 CO 0.49 -1.86 1.11 -0.51 0.00 0.00 0.00 175.76 174.99 1ynf s LEU 165 N -5.20 2.77 0.34 0.00 1.43 -1.26 -4.92 118.68 111.84 1ynf s LEU 165 Ca 0.73 1.89 -0.26 0.00 -1.03 0.00 0.00 54.13 55.46 1ynf s LEU 165 Cb -0.28 -4.41 -0.13 0.00 0.03 0.00 0.00 46.19 41.40 1ynf s LEU 165 CO 0.46 -2.57 0.85 -2.65 0.23 0.00 0.00 176.35 172.67 1ynf n PRO 166 N -3.87 1.04 -2.58 1.29 -0.02 -1.26 -4.69 135.00 124.91 1ynf n PRO 166 Ca 0.09 0.37 -0.43 0.00 -2.02 0.00 0.00 63.50 61.51 1ynf n PRO 166 Cb 0.53 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 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 3.22 -3.88 -0.52 1.13 -1.26 -4.72 117.38 111.92 1ynf n GLN 167 Ca 0.11 -3.34 -0.11 0.00 -1.94 0.00 0.00 57.00 51.72 1ynf n GLN 167 Cb 0.35 -3.38 -0.10 0.00 0.11 0.00 0.00 30.24 27.22 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 3.52 0.10 0.45 5.09 -7.23 -1.26 -5.04 120.40 116.02 1ynf s VAL 168 Ca 0.51 -0.80 0.18 0.00 -1.81 0.00 0.00 61.98 60.05 1ynf s VAL 168 Cb 0.04 -0.57 0.37 0.00 0.56 0.00 0.00 36.38 36.78 1ynf s VAL 168 CO 0.05 -0.44 1.93 0.00 -0.31 0.00 0.00 175.10 176.33 1ynf h ALA 169 N 4.08 2.20 0.00 1.32 0.00 -1.93 -0.84 119.26 124.08 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 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1ynf h ALA 169 CO 0.43 -0.40 -0.03 1.25 0.00 0.00 0.00 179.25 180.51 1ynf h LEU 170 N 0.34 0.00 -3.46 0.00 5.85 -1.96 -2.77 115.31 113.31 1ynf h LEU 170 Ca 0.36 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.75 1ynf h LEU 170 Cb 0.91 0.00 -0.24 0.00 0.37 0.00 0.00 40.66 41.69 1ynf h LEU 170 CO -0.10 0.03 -0.56 0.18 -0.34 0.00 0.00 178.44 177.65 1ynf n LEU 171 N -4.21 4.20 -4.68 2.25 4.77 -0.33 -4.41 117.00 114.59 1ynf n LEU 171 Ca -0.03 -4.34 -0.44 0.00 -0.03 0.00 0.00 56.01 51.16 1ynf n LEU 171 Cb 0.12 -0.46 -0.04 0.00 -2.33 0.00 0.00 43.42 40.71 1ynf n LEU 171 CO 0.32 1.76 1.45 0.61 -1.33 0.00 0.00 177.39 180.19 1ynf n GLY 172 N -0.90 1.55 2.91 -0.72 0.00 -1.05 -4.74 105.19 102.24 1ynf n GLY 172 Ca 0.35 0.76 -0.22 0.00 0.00 0.00 0.00 46.02 46.90 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 2.97 1.41 -0.06 1.61 2.15 -1.23 -1.97 116.67 121.55 1ynf s ASP 173 Ca 0.85 -0.19 0.11 0.00 0.43 0.00 0.00 52.55 53.75 1ynf s ASP 173 Cb -0.56 -0.60 0.31 0.00 -0.30 0.00 0.00 42.92 41.77 1ynf s ASP 173 CO 0.42 -0.06 1.25 -0.62 -0.17 0.00 0.00 175.17 175.98 1ynf n GLU 174 N 4.26 2.79 0.00 4.34 -0.58 -1.26 -1.03 120.64 129.16 1ynf n GLU 174 Ca -0.20 -2.20 0.00 0.00 -0.42 0.00 0.00 57.16 54.34 1ynf n GLU 174 Cb 0.51 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 29.99 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 -0.06 0.68 0.47 0.62 0.00 -1.26 -3.87 105.19 101.77 1ynf n GLY 175 Ca 0.12 -0.75 0.28 0.00 0.00 0.00 0.00 46.02 45.67 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 2.75 -0.09 4.61 0.00 -0.23 -1.31 119.26 124.33 1ynf h ALA 176 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ynf h ALA 176 Cb 0.00 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ynf h ALA 176 CO 0.00 -1.06 0.34 0.00 0.00 0.00 0.00 179.25 178.53 1ynf h ALA 177 N 1.53 1.50 -0.25 0.00 0.00 -1.20 0.62 119.26 121.46 1ynf h ALA 177 Ca 0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1ynf h ALA 177 Cb 1.77 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1ynf h ALA 177 CO -0.07 -0.39 0.00 0.09 0.00 0.00 0.00 179.25 178.88 1ynf n ASN 178 N -3.09 3.03 -4.81 0.00 3.02 -0.49 -1.55 115.26 111.37 1ynf n ASN 178 Ca -0.00 -2.36 -0.23 0.00 -0.03 0.00 0.00 54.58 51.96 1ynf n ASN 178 Cb 0.42 -0.30 -0.05 0.00 -0.61 0.00 0.00 39.78 39.24 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 -1.65 3.10 0.01 3.10 2.46 0.22 -1.13 115.29 121.39 1ynf s HIS 179 Ca 0.26 -0.09 -0.17 0.00 0.47 0.00 0.00 55.06 55.53 1ynf s HIS 179 Cb 0.18 -1.42 0.03 0.00 -0.13 0.00 0.00 32.58 31.24 1ynf s HIS 179 CO 0.11 0.52 0.37 -0.80 -2.47 0.00 0.00 174.74 172.48 1ynf s ASN 180 N -3.63 -0.25 -0.11 9.88 0.01 -0.61 -4.93 114.94 115.30 1ynf s ASN 180 Ca 0.32 0.08 -0.04 0.00 -0.71 0.00 0.00 52.86 52.52 1ynf s ASN 180 Cb -0.08 0.37 0.05 0.00 0.41 0.00 0.00 41.25 42.00 1ynf s ASN 180 CO 0.24 -0.55 0.14 -0.60 -1.51 0.00 0.00 177.10 174.82 1ynf s ARG 181 N -1.82 0.04 0.07 -0.60 3.52 -1.26 -1.21 118.95 117.68 1ynf s ARG 181 Ca -0.10 0.34 0.07 0.00 -0.13 0.00 0.00 55.73 55.92 1ynf s ARG 181 Cb -0.03 -0.78 -0.04 0.00 -1.56 0.00 0.00 34.95 32.55 1ynf s ARG 181 CO 0.02 -0.44 -0.16 -0.51 -0.81 0.00 0.00 175.30 173.40 1ynf s LEU 182 N 2.24 2.74 0.00 -0.88 1.43 -1.26 -4.09 118.68 118.86 1ynf s LEU 182 Ca 0.04 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 1ynf s LEU 182 Cb -0.13 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.49 1ynf s LEU 182 CO -0.07 0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.35 1ynf n GLY 183 N 1.24 -1.67 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 44.69 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 0.56 3.79 -0.02 0.00 -1.26 -2.44 105.19 105.61 1ynf n GLY 184 Ca 0.00 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1ynf n GLY 184 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ynf s HIS 185 N 0.00 3.36 0.27 1.61 3.76 -1.26 -4.62 115.29 118.40 1ynf s HIS 185 Ca 0.00 1.67 -0.01 0.00 -0.15 0.00 0.00 55.06 56.57 1ynf s HIS 185 Cb 0.00 -3.02 0.61 0.00 1.11 0.00 0.00 32.58 31.28 1ynf s HIS 185 CO 0.00 -0.34 1.67 1.88 -0.85 0.00 0.00 174.74 177.10 1ynf h TYR 186 N 2.47 0.36 0.00 1.40 0.99 -1.91 -0.54 116.97 119.74 1ynf h TYR 186 Ca -0.48 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.29 1ynf h TYR 186 Cb 1.20 -0.03 0.00 0.00 1.00 0.00 0.00 36.73 38.91 1ynf h TYR 186 CO 0.59 -0.13 0.00 0.41 -0.00 0.00 0.00 178.16 179.03 1ynf n GLY 187 N -1.36 -1.09 3.89 3.88 0.00 -1.26 -4.77 105.19 104.48 1ynf n GLY 187 Ca 0.18 0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.14 3.66 0.16 1.61 2.02 -0.21 -4.71 118.70 118.09 1ynf s GLU 188 Ca 0.05 0.25 -0.34 0.00 0.02 0.00 0.00 54.97 54.96 1ynf s GLU 188 Cb 0.09 -2.46 -0.14 0.00 0.10 0.00 0.00 34.13 31.73 1ynf s GLU 188 CO 0.30 -0.02 1.60 -0.35 0.02 0.00 0.00 175.26 176.81 1ynf n PRO 189 N -1.51 2.19 0.00 0.39 -0.04 -1.26 -4.89 135.00 129.88 1ynf n PRO 189 Ca 0.01 0.79 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 1ynf n PRO 189 Cb 0.54 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 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 3.48 1.33 3.64 0.55 0.00 -1.26 -4.77 105.19 108.15 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 2.94 0.59 -0.25 1.61 -0.21 0.62 -4.80 119.66 120.16 1ynf s GLN 192 Ca 0.00 1.04 -0.00 0.00 0.02 0.00 0.00 55.36 56.42 1ynf s GLN 192 Cb 0.00 0.15 0.04 0.00 1.00 0.00 0.00 33.01 34.19 1ynf s GLN 192 CO 0.00 -0.13 -0.09 -1.17 -2.12 0.00 0.00 175.29 171.79 1ynf s LEU 193 N 1.60 3.20 -0.25 2.90 2.96 -0.35 -0.42 118.68 128.31 1ynf s LEU 193 Ca -0.09 -1.03 -0.11 0.00 -0.22 0.00 0.00 54.13 52.68 1ynf s LEU 193 Cb -0.05 -1.61 -0.05 0.00 0.50 0.00 0.00 46.19 44.98 1ynf s LEU 193 CO -0.18 -0.14 0.21 -0.36 -1.32 0.00 0.00 176.35 174.55 1ynf s PHE 194 N 1.25 3.29 -0.14 5.38 0.40 0.41 -1.57 117.98 127.00 1ynf s PHE 194 Ca -0.02 0.25 -0.04 0.00 -0.60 0.00 0.00 56.93 56.52 1ynf s PHE 194 Cb -0.17 -2.34 -0.03 0.00 0.51 0.00 0.00 43.02 40.98 1ynf s PHE 194 CO -0.05 -0.02 -0.00 0.08 0.70 0.00 0.00 175.22 175.92 1ynf s VAL 195 N 1.34 4.23 0.24 -0.44 1.01 -0.28 -0.85 120.40 125.65 1ynf s VAL 195 Ca 0.09 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 61.88 1ynf s VAL 195 Cb -0.14 -2.85 -0.05 0.00 0.00 0.00 0.00 36.38 33.33 1ynf s VAL 195 CO 0.07 0.51 -0.07 -0.72 0.00 0.00 0.00 175.10 174.89 1ynf s TYR 196 N 0.05 1.77 -0.06 5.22 -0.85 -0.77 -4.80 117.35 117.92 1ynf s TYR 196 Ca 0.02 -0.72 0.17 0.00 -0.52 0.00 0.00 57.07 56.03 1ynf s TYR 196 Cb -0.13 -0.97 -0.26 0.00 0.38 0.00 0.00 41.96 40.98 1ynf s TYR 196 CO 0.02 0.22 0.30 0.41 -1.52 0.00 0.00 175.55 174.99 1ynf n GLY 197 N -0.48 -0.82 3.33 5.49 0.00 -0.16 -0.11 105.19 112.45 1ynf n GLY 197 Ca -0.06 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.46 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 -3.02 1.09 -0.03 1.61 1.70 -0.96 -4.46 118.95 114.88 1ynf s ARG 198 Ca -0.07 -0.64 -0.15 0.00 -0.47 0.00 0.00 55.73 54.40 1ynf s ARG 198 Cb 0.10 0.48 0.03 0.00 -0.57 0.00 0.00 34.95 34.99 1ynf s ARG 198 CO 0.73 -0.43 0.33 -1.83 -1.08 0.00 0.00 175.30 173.02 1ynf s GLU 199 N -3.69 0.66 0.32 3.89 -1.05 -1.26 -0.46 118.70 117.10 1ynf s GLU 199 Ca 0.02 -0.11 -0.29 0.00 -0.15 0.00 0.00 54.97 54.44 1ynf s GLU 199 Cb 0.01 0.29 -0.11 0.00 -0.44 0.00 0.00 34.13 33.89 1ynf s GLU 199 CO -0.11 -0.17 1.43 -1.21 0.95 0.00 0.00 175.26 176.14 1ynf s GLU 200 N -1.17 4.23 0.00 -4.83 0.41 -1.26 -2.38 118.70 113.71 1ynf s GLU 200 Ca -0.12 2.38 0.00 0.00 -0.41 0.00 0.00 54.97 56.82 1ynf s GLU 200 Cb -0.05 -3.05 0.00 0.00 -1.78 0.00 0.00 34.13 29.25 1ynf s GLU 200 CO 0.04 -0.40 0.00 0.41 -0.49 0.00 0.00 175.26 174.82 1ynf n GLY 201 N 1.26 3.06 3.54 -1.39 0.00 -1.26 -4.98 105.19 105.42 1ynf n GLY 201 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1ynf n GLY 201 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ynf s ASN 202 N -0.64 6.40 0.18 1.61 2.47 -1.00 -4.91 114.94 119.05 1ynf s ASN 202 Ca 0.00 -0.11 0.19 0.00 0.42 0.00 0.00 52.86 53.35 1ynf s ASN 202 Cb 0.00 -2.36 0.83 0.00 -1.45 0.00 0.00 41.25 38.27 1ynf s ASN 202 CO 0.00 -0.84 1.58 -0.90 -3.72 0.00 0.00 177.10 173.22 1ynf n ASP 203 N 6.51 0.42 -4.56 -4.21 5.75 -1.26 -4.55 116.55 114.66 1ynf n ASP 203 Ca 0.01 0.62 -0.43 0.00 -0.01 0.00 0.00 54.79 54.98 1ynf n ASP 203 Cb 0.48 -0.71 -0.04 0.00 -1.03 0.00 0.00 41.12 39.83 1ynf n ASP 203 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1ynf s THR 204 N -3.24 4.38 0.02 2.12 2.01 -1.26 -4.97 115.64 114.70 1ynf s THR 204 Ca 0.04 0.66 -0.28 0.00 0.31 0.00 0.00 61.69 62.41 1ynf s THR 204 Cb 0.08 -4.51 0.10 0.00 0.01 0.00 0.00 72.50 68.18 1ynf s THR 204 CO 0.30 -0.98 0.83 0.00 -0.69 0.00 0.00 174.62 174.08 1ynf s ARG 205 N 3.98 0.90 0.50 4.92 1.70 -1.26 -4.75 118.95 124.94 1ynf s ARG 205 Ca 0.36 -0.30 -0.21 0.00 -0.47 0.00 0.00 55.73 55.12 1ynf s ARG 205 Cb -0.10 0.42 -0.09 0.00 -0.57 0.00 0.00 34.95 34.60 1ynf s ARG 205 CO 0.25 -0.39 0.80 -2.30 -1.08 0.00 0.00 175.30 172.58 1ynf n PRO 206 N -0.19 0.91 0.00 3.89 -0.02 -1.26 -4.94 135.00 133.38 1ynf n PRO 206 Ca -0.11 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1ynf n PRO 206 Cb 0.62 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 1ynf n PRO 206 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ynf n SER 207 N 0.32 1.25 0.00 2.55 3.41 -1.26 -4.77 113.62 115.11 1ynf n SER 207 Ca 0.11 -1.45 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 1ynf n SER 207 Cb 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 1ynf n SER 207 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1ynf n ARG 208 N -0.23 0.84 -3.87 4.33 0.63 -1.26 -4.98 116.66 112.13 1ynf n ARG 208 Ca 0.00 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.63 1ynf n ARG 208 Cb 0.19 -0.80 -0.15 0.00 0.45 0.00 0.00 32.46 32.15 1ynf n ARG 208 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1ynf s TYR 209 N -1.60 2.48 0.34 -0.14 4.12 -1.26 -5.07 117.35 116.22 1ynf s TYR 209 Ca 0.00 -2.12 -0.25 0.00 0.02 0.00 0.00 57.07 54.72 1ynf s TYR 209 Cb 0.00 -2.06 -0.14 0.00 -1.52 0.00 0.00 41.96 38.25 1ynf s TYR 209 CO 0.00 -0.87 0.67 -2.30 0.02 0.00 0.00 175.55 173.07 1ynf n PRO 210 N 4.63 0.69 -2.62 -1.71 -0.02 -1.26 -4.72 135.00 130.00 1ynf n PRO 210 Ca -0.02 0.25 -0.43 0.00 -2.02 0.00 0.00 63.50 61.28 1ynf n PRO 210 Cb 0.43 -1.51 -0.02 0.00 -0.02 0.00 0.00 33.50 32.37 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 -1.27 3.54 -0.23 3.55 0.00 -1.26 -4.92 121.76 121.18 1ynf s ALA 211 Ca 0.62 0.35 0.21 0.00 0.00 0.00 0.00 51.96 53.14 1ynf s ALA 211 Cb -0.69 -3.51 0.37 0.00 0.00 0.00 0.00 23.12 19.30 1ynf s ALA 211 CO 0.58 -0.84 1.60 0.00 0.00 0.00 0.00 175.76 177.10 1ynf h ARG 212 N 7.39 0.00 -5.23 0.00 3.08 -1.90 -3.44 114.38 114.27 1ynf h ARG 212 Ca -0.27 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.15 1ynf h ARG 212 Cb 1.11 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 30.95 1ynf h ARG 212 CO 0.91 0.22 -0.66 -1.14 -1.07 0.00 0.00 179.97 178.24 1ynf s GLN 213 N -3.20 3.67 0.12 0.04 2.00 -1.26 -3.57 119.66 117.47 1ynf s GLN 213 Ca 0.05 -0.51 0.06 0.00 -2.00 0.00 0.00 55.36 52.96 1ynf s GLN 213 Cb 0.07 -3.00 -0.04 0.00 0.80 0.00 0.00 33.01 30.84 1ynf s GLN 213 CO 0.69 0.16 -0.02 0.95 -0.50 0.00 0.00 175.29 176.56 1ynf s THR 214 N 0.60 3.76 0.29 -0.34 -4.23 -0.83 -0.99 115.64 113.89 1ynf s THR 214 Ca -0.02 -1.21 -0.01 0.00 -1.18 0.00 0.00 61.69 59.27 1ynf s THR 214 Cb -0.14 -2.82 0.17 0.00 1.34 0.00 0.00 72.50 71.05 1ynf s THR 214 CO 0.02 0.03 1.85 -0.09 -0.54 0.00 0.00 174.62 175.90 1ynf h ARG 215 N 3.20 0.86 -0.99 3.99 2.43 -1.11 -2.23 114.38 120.55 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 -0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 30.52 1ynf h ARG 215 CO 0.57 0.74 0.63 0.93 -1.51 0.00 0.00 179.97 181.33 1ynf h GLU 216 N 0.84 1.06 -0.11 0.20 3.07 -1.82 0.08 114.58 117.90 1ynf h GLU 216 Ca 0.19 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 58.96 1ynf h GLU 216 Cb 0.22 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1ynf h GLU 216 CO -0.01 0.70 -0.06 0.00 -1.40 0.00 0.00 179.01 178.24 1ynf h ALA 217 N 1.49 0.16 -0.67 3.43 0.00 -1.63 -2.54 119.26 119.50 1ynf h ALA 217 Ca 0.44 -0.26 0.06 0.00 0.00 0.00 0.00 54.91 55.15 1ynf h ALA 217 Cb 0.28 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 1ynf h ALA 217 CO -0.19 -0.06 0.37 0.77 0.00 0.00 0.00 179.25 180.14 1ynf h SER 218 N -0.13 0.55 -0.23 0.00 0.02 -0.82 -0.92 113.55 112.02 1ynf h SER 218 Ca 0.02 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 60.95 1ynf h SER 218 Cb 0.53 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 1ynf h SER 218 CO 0.02 0.36 -0.03 -0.33 -1.14 0.00 0.00 176.83 175.70 1ynf h GLU 219 N 0.69 0.55 -0.31 3.45 5.08 -1.00 -1.09 114.58 121.94 1ynf h GLU 219 Ca 0.30 -0.13 -0.17 0.00 -1.00 0.00 0.00 59.36 58.36 1ynf h GLU 219 Cb 0.19 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1ynf h GLU 219 CO -0.18 0.60 -0.49 0.00 -1.00 0.00 0.00 179.01 177.94 1ynf h ALA 220 N 1.45 0.55 -0.59 3.43 0.00 -0.86 -2.16 119.26 121.08 1ynf h ALA 220 Ca 0.11 -0.49 -0.07 0.00 0.00 0.00 0.00 54.91 54.46 1ynf h ALA 220 Cb 0.38 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1ynf h ALA 220 CO 0.02 0.68 0.09 0.28 0.00 0.00 0.00 179.25 180.32 1ynf h VAL 221 N 0.67 1.26 -0.87 0.00 2.07 -0.96 0.43 116.25 118.85 1ynf h VAL 221 Ca 0.03 -1.00 0.07 0.00 0.82 0.00 0.00 66.70 66.62 1ynf h VAL 221 Cb 1.08 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 31.54 1ynf h VAL 221 CO 0.11 0.37 0.54 0.00 0.02 0.00 0.00 177.57 178.60 1ynf h ALA 222 N 1.01 1.21 0.26 1.67 0.00 -1.03 0.12 119.26 122.51 1ynf h ALA 222 Ca 0.18 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1ynf h ALA 222 Cb 0.43 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ynf h ALA 222 CO 0.01 0.26 -0.12 0.00 0.00 0.00 0.00 179.25 179.40 1ynf h ARG 223 N 0.96 -0.33 -0.92 0.00 3.08 -0.88 -2.53 114.38 113.76 1ynf h ARG 223 Ca 0.39 0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.55 1ynf h ARG 223 Cb 0.22 0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.27 1ynf h ARG 223 CO -0.19 -0.06 0.59 -0.07 -1.07 0.00 0.00 179.97 179.18 1ynf h LEU 224 N -0.60 0.86 -0.27 3.04 3.38 -0.45 -1.01 115.31 120.27 1ynf h LEU 224 Ca -0.04 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1ynf h LEU 224 Cb 0.43 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1ynf h LEU 224 CO 0.06 0.52 0.00 0.59 0.09 0.00 0.00 178.44 179.69 1ynf n ASN 225 N -4.53 0.38 -4.09 -0.43 3.02 0.38 -4.89 115.26 105.10 1ynf n ASN 225 Ca 0.15 -2.00 -0.31 0.00 -0.03 0.00 0.00 54.58 52.40 1ynf n ASN 225 Cb 0.28 -0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.37 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 -0.30 -3.16 -2.66 3.52 6.02 -0.39 -4.74 117.38 115.67 1ynf n GLN 226 Ca 0.02 0.38 -0.42 0.00 -0.01 0.00 0.00 57.00 56.97 1ynf n GLN 226 Cb 0.06 -4.75 -0.03 0.00 1.02 0.00 0.00 30.24 26.54 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 -3.68 4.66 0.02 5.09 1.01 -0.96 -1.52 120.40 125.02 1ynf s VAL 227 Ca 0.34 1.95 -0.33 0.00 0.00 0.00 0.00 61.98 63.95 1ynf s VAL 227 Cb -0.19 -4.25 -0.11 0.00 0.00 0.00 0.00 36.38 31.83 1ynf s VAL 227 CO 0.91 0.18 1.84 -3.20 0.00 0.00 0.00 175.10 174.83 1ynf n ASN 228 N 3.71 3.65 -0.26 3.32 2.85 -1.07 -4.84 115.26 122.61 1ynf n ASN 228 Ca 0.06 0.98 0.28 0.00 -0.11 0.00 0.00 54.58 55.79 1ynf n ASN 228 Cb 0.50 -1.44 0.66 0.00 1.24 0.00 0.00 39.78 40.74 1ynf n ASN 228 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ynf h PRO 229 N 8.78 0.13 -0.00 1.20 0.11 -1.94 0.26 132.00 140.54 1ynf h PRO 229 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 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 -0.16 0.00 -0.21 0.00 0.00 178.00 178.65 1ynf n GLN 230 N -4.35 0.54 -0.84 1.05 10.64 -1.26 -3.65 117.38 119.51 1ynf n GLN 230 Ca 0.22 -0.20 -0.06 0.00 -1.83 0.00 0.00 57.00 55.13 1ynf n GLN 230 Cb 1.01 -1.50 0.20 0.00 -0.86 0.00 0.00 30.24 29.09 1ynf n GLN 230 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 1ynf n GLN 231 N -1.06 1.97 -3.99 2.61 6.02 0.92 -4.97 117.38 118.88 1ynf n GLN 231 Ca 0.12 -3.15 -0.13 0.00 -0.01 0.00 0.00 57.00 53.83 1ynf n GLN 231 Cb 0.30 -1.86 -0.14 0.00 1.02 0.00 0.00 30.24 29.56 1ynf n GLN 231 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1ynf s VAL 232 N -3.23 0.18 -0.02 5.09 0.11 -1.23 -0.28 120.40 121.02 1ynf s VAL 232 Ca 0.46 -0.22 0.01 0.00 -2.93 0.00 0.00 61.98 59.30 1ynf s VAL 232 Cb 0.41 -0.18 0.02 0.00 -1.53 0.00 0.00 36.38 35.10 1ynf s VAL 232 CO 0.02 -0.03 -0.01 -0.63 -3.33 0.00 0.00 175.10 171.11 1ynf s ILE 233 N -0.25 0.22 -0.20 7.04 1.01 0.44 -4.94 121.20 124.52 1ynf s ILE 233 Ca -0.01 -0.00 -0.06 0.00 0.00 0.00 0.00 60.65 60.58 1ynf s ILE 233 Cb -0.02 -0.27 -0.03 0.00 0.01 0.00 0.00 42.46 42.15 1ynf s ILE 233 CO -0.00 0.13 0.02 -0.36 0.00 0.00 0.00 174.94 174.72 1ynf s PHE 234 N 0.65 3.08 -0.00 3.97 0.40 -1.26 -0.44 117.98 124.37 1ynf s PHE 234 Ca -0.07 -0.35 0.05 0.00 -0.60 0.00 0.00 56.93 55.96 1ynf s PHE 234 Cb -0.10 -2.10 -0.01 0.00 0.51 0.00 0.00 43.02 41.32 1ynf s PHE 234 CO -0.01 -0.18 -0.16 0.00 0.70 0.00 0.00 175.22 175.57 1ynf s ALA 235 N 0.95 1.34 -0.00 5.36 0.00 -0.03 -4.97 121.76 124.41 1ynf s ALA 235 Ca 0.02 -0.73 -0.20 0.00 0.00 0.00 0.00 51.96 51.05 1ynf s ALA 235 Cb -0.14 -0.32 -0.05 0.00 0.00 0.00 0.00 23.12 22.60 1ynf s ALA 235 CO 0.02 0.32 0.56 -1.14 0.00 0.00 0.00 175.76 175.52 1ynf s GLN 236 N -0.52 4.27 0.58 0.00 0.74 -1.26 -1.84 119.66 121.62 1ynf s GLN 236 Ca 0.06 0.68 -0.18 0.00 0.05 0.00 0.00 55.36 55.97 1ynf s GLN 236 Cb -0.07 -3.33 -0.04 0.00 1.10 0.00 0.00 33.01 30.68 1ynf s GLN 236 CO -0.00 0.42 1.12 -1.14 -0.55 0.00 0.00 175.29 175.14 1ynf s GLN 237 N -0.32 3.16 -0.07 1.67 2.00 0.85 -1.83 119.66 125.11 1ynf s GLN 237 Ca 0.30 1.53 -0.30 0.00 -2.00 0.00 0.00 55.36 54.89 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 -0.99 1.61 1.21 -0.50 0.00 0.00 175.29 176.79 1ynf s ASN 238 N -2.06 6.68 0.53 6.67 2.47 -0.50 -4.27 114.94 124.47 1ynf s ASN 238 Ca 0.71 2.15 0.19 0.00 0.42 0.00 0.00 52.86 56.33 1ynf s ASN 238 Cb -0.23 -2.53 1.35 0.00 -1.45 0.00 0.00 41.25 38.39 1ynf s ASN 238 CO 0.32 -0.92 2.14 1.55 -3.72 0.00 0.00 177.10 176.47 1ynf h PRO 239 N 9.46 0.00 0.00 0.43 0.13 -1.91 -2.16 132.00 137.95 1ynf h PRO 239 Ca -0.38 0.00 -0.12 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 -0.56 -0.44 -0.23 0.00 0.00 178.00 177.73 1ynf h ASP 240 N 0.00 0.00 0.69 1.44 3.32 -1.93 -2.63 116.42 117.31 1ynf h ASP 240 Ca 0.03 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.88 1ynf h ASP 240 Cb 0.13 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1ynf h ASP 240 CO -0.00 0.56 -0.92 1.62 -1.72 0.00 0.00 179.24 178.78 1ynf h VAL 241 N 0.00 1.54 -0.46 -1.35 3.04 -1.66 -3.17 116.25 114.20 1ynf h VAL 241 Ca -0.01 -2.81 -0.05 0.00 -1.01 0.00 0.00 66.70 62.83 1ynf h VAL 241 Cb 1.06 2.57 -0.02 0.00 -2.01 0.00 0.00 31.29 32.90 1ynf h VAL 241 CO 0.07 0.81 0.10 0.40 -1.01 0.00 0.00 177.57 177.94 1ynf h ILE 242 N 0.07 1.24 0.00 3.17 2.04 -1.36 -1.61 117.51 121.06 1ynf h ILE 242 Ca -0.04 -0.85 0.00 0.00 1.00 0.00 0.00 64.86 64.97 1ynf h ILE 242 Cb 1.58 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1ynf h ILE 242 CO 0.13 0.30 0.00 0.47 0.00 0.00 0.00 178.15 179.06 1ynf n ASP 243 N -4.49 0.00 -0.79 1.72 8.00 -1.01 -1.83 116.55 118.16 1ynf n ASP 243 Ca 0.01 0.35 0.11 0.00 0.71 0.00 0.00 54.79 55.96 1ynf n ASP 243 Cb 0.23 -0.41 0.07 0.00 -0.02 0.00 0.00 41.12 40.99 1ynf n ASP 243 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ynf n GLN 244 N -1.41 1.91 0.00 -1.24 6.02 -0.64 -4.80 117.38 117.22 1ynf n GLN 244 Ca 0.03 -1.63 0.00 0.00 -0.01 0.00 0.00 57.00 55.40 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 1.27 0.83 3.47 1.08 0.00 -0.76 -4.91 105.19 106.16 1ynf n GLY 245 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.63 4.81 -1.25 1.61 1.01 -0.98 -4.80 120.40 119.16 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 -4.87 0.34 0.00 0.00 0.00 0.00 36.38 31.85 1ynf s VAL 246 CO 0.00 -1.60 1.89 2.22 0.00 0.00 0.00 175.10 177.62 1ynf n PHE 247 N 6.32 0.00 -3.84 5.22 1.16 -1.26 -4.18 117.46 120.88 1ynf n PHE 247 Ca 0.31 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.78 1ynf n PHE 247 Cb 0.46 -0.35 -0.09 0.00 -1.61 0.00 0.00 39.48 37.90 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 -2.77 0.02 0.49 2.97 3.76 -1.26 -4.69 115.29 113.81 1ynf s HIS 248 Ca 0.21 -0.17 0.14 0.00 -0.15 0.00 0.00 55.06 55.08 1ynf s HIS 248 Cb 0.19 -0.02 1.17 0.00 1.11 0.00 0.00 32.58 35.03 1ynf s HIS 248 CO 0.52 -0.39 2.12 -0.97 -0.85 0.00 0.00 174.74 175.18 1ynf h ASN 249 N 3.72 0.12 0.00 1.40 -1.24 -1.87 -2.60 115.58 115.12 1ynf h ASN 249 Ca -0.31 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.69 1ynf h ASN 249 Cb 1.19 -0.03 0.00 0.00 0.73 0.00 0.00 38.32 40.21 1ynf h ASN 249 CO 0.45 0.09 0.00 -0.90 -1.29 0.00 0.00 177.43 175.78 1ynf n ASP 250 N -4.52 0.61 -0.04 1.15 5.75 -0.59 -1.15 116.55 117.75 1ynf n ASP 250 Ca -0.01 -1.38 0.02 0.00 -0.01 0.00 0.00 54.79 53.40 1ynf n ASP 250 Cb 0.09 -0.31 -0.01 0.00 -1.03 0.00 0.00 41.12 39.87 1ynf n ASP 250 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1ynf n VAL 251 N 0.08 0.00 -0.24 2.12 0.31 -0.98 -3.06 118.33 116.55 1ynf n VAL 251 Ca 0.00 -0.45 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 1ynf n VAL 251 Cb 0.15 1.02 0.00 0.00 -0.91 0.00 0.00 33.84 34.10 1ynf n VAL 251 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ynf n ILE 252 N -0.68 0.00 -3.55 2.52 0.13 -0.59 -4.39 119.36 112.80 1ynf n ILE 252 Ca 0.01 -0.13 -0.13 0.00 -1.10 0.00 0.00 62.75 61.40 1ynf n ILE 252 Cb 0.06 1.24 -0.05 0.00 -0.84 0.00 0.00 39.64 40.05 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 -0.17 -1.86 -0.10 1.51 0.00 -0.30 -2.07 121.76 118.77 1ynf s ALA 253 Ca 0.00 1.43 -0.12 0.00 0.00 0.00 0.00 51.96 53.27 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 -0.36 0.33 0.54 0.00 0.00 0.00 175.76 176.27 1ynf s VAL 254 N -1.28 0.01 0.31 0.00 0.11 0.13 -3.99 120.40 115.69 1ynf s VAL 254 Ca -0.05 -0.09 0.11 0.00 -2.93 0.00 0.00 61.98 59.01 1ynf s VAL 254 Cb -0.00 -0.50 -0.06 0.00 -1.53 0.00 0.00 36.38 34.29 1ynf s VAL 254 CO 0.04 -0.05 -0.13 -0.94 -3.33 0.00 0.00 175.10 170.69 1ynf s SER 255 N -0.11 3.75 -0.30 3.54 1.04 -1.26 -0.51 113.70 119.85 1ynf s SER 255 Ca -0.03 -1.07 -0.15 0.00 0.48 0.00 0.00 55.95 55.19 1ynf s SER 255 Cb -0.03 -0.37 0.17 0.00 0.10 0.00 0.00 66.02 65.89 1ynf s SER 255 CO 0.01 -0.08 1.05 0.21 0.98 0.00 0.00 173.24 175.41 1ynf s ASN 256 N -3.58 -0.48 1.81 7.02 2.47 -0.27 -4.78 114.94 117.14 1ynf s ASN 256 Ca 0.31 0.53 0.00 0.00 0.42 0.00 0.00 52.86 54.12 1ynf s ASN 256 Cb -0.02 1.49 0.00 0.00 -1.45 0.00 0.00 41.25 41.28 1ynf s ASN 256 CO 0.16 -0.09 0.00 0.54 -3.72 0.00 0.00 177.10 173.99 1ynf n ARG 257 N 5.07 0.00 -0.02 0.43 1.74 -1.26 -1.31 116.66 121.31 1ynf n ARG 257 Ca -0.08 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.13 1ynf n ARG 257 Cb 0.53 0.00 0.23 0.00 -1.02 0.00 0.00 32.46 32.21 1ynf n ARG 257 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ynf n GLN 258 N 8.50 2.15 -4.09 5.56 0.00 -1.02 0.26 117.38 128.73 1ynf n GLN 258 Ca 0.00 -1.68 -0.36 0.00 0.00 0.00 0.00 57.00 54.96 1ynf n GLN 258 Cb 0.00 -1.47 -0.07 0.00 0.00 0.00 0.00 30.24 28.70 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 -1.94 5.00 -0.30 -0.39 1.01 -0.43 -4.31 120.40 119.04 1ynf s VAL 259 Ca 0.32 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.32 1ynf s VAL 259 Cb 0.20 -3.15 0.09 0.00 0.00 0.00 0.00 36.38 33.53 1ynf s VAL 259 CO 0.31 0.61 0.06 -0.22 0.00 0.00 0.00 175.10 175.86 1ynf s LEU 260 N -0.97 2.87 -0.45 3.92 2.96 -1.26 -1.11 118.68 124.64 1ynf s LEU 260 Ca 0.14 -1.66 -0.22 0.00 -0.22 0.00 0.00 54.13 52.17 1ynf s LEU 260 Cb -0.12 -1.09 0.03 0.00 0.50 0.00 0.00 46.19 45.51 1ynf s LEU 260 CO 0.03 -0.37 0.72 0.12 -1.32 0.00 0.00 176.35 175.53 1ynf s PHE 261 N 1.42 3.02 0.11 5.38 5.36 0.33 -1.54 117.98 132.07 1ynf s PHE 261 Ca 0.07 0.04 -0.04 0.00 -0.96 0.00 0.00 56.93 56.05 1ynf s PHE 261 Cb -0.18 -3.53 -0.03 0.00 -0.34 0.00 0.00 43.02 38.95 1ynf s PHE 261 CO -0.17 -0.94 0.11 0.00 -1.46 0.00 0.00 175.22 172.75 1ynf s HIS 263 N -3.97 3.44 0.41 0.00 2.46 -0.88 -0.85 115.29 115.89 1ynf s HIS 263 Ca 0.16 1.27 0.24 0.00 0.47 0.00 0.00 55.06 57.20 1ynf s HIS 263 Cb 0.06 -2.62 1.33 0.00 -0.13 0.00 0.00 32.58 31.22 1ynf s HIS 263 CO -0.03 -0.18 2.04 -0.56 -2.47 0.00 0.00 174.74 173.54 1ynf h GLN 264 N 1.31 0.00 -0.74 2.88 3.07 -1.63 -2.41 115.11 117.59 1ynf h GLN 264 Ca -0.47 0.00 -0.16 0.00 0.09 0.00 0.00 58.65 58.11 1ynf h GLN 264 Cb 1.18 0.00 -0.09 0.00 0.08 0.00 0.00 27.48 28.65 1ynf h GLN 264 CO 0.63 0.14 0.20 1.04 0.09 0.00 0.00 178.83 180.93 1ynf n GLN 265 N -3.77 3.80 0.02 0.06 6.02 -1.26 -4.60 117.38 117.66 1ynf n GLN 265 Ca -0.02 -2.86 -0.13 0.00 -0.01 0.00 0.00 57.00 53.99 1ynf n GLN 265 Cb 0.25 -2.17 -0.09 0.00 1.02 0.00 0.00 30.24 29.25 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 2.95 -0.10 -3.56 -1.58 0.00 -1.75 -3.42 119.26 111.79 1ynf h ALA 266 Ca 0.19 -0.25 -0.67 0.00 0.00 0.00 0.00 54.91 54.19 1ynf h ALA 266 Cb 2.15 0.04 -0.16 0.00 0.00 0.00 0.00 17.79 19.82 1ynf h ALA 266 CO 0.64 -0.28 -0.73 -0.06 0.00 0.00 0.00 179.25 178.82 1ynf s PHE 267 N -3.96 2.79 0.12 0.00 0.40 -1.26 -1.42 117.98 114.65 1ynf s PHE 267 Ca -0.15 -0.13 -0.31 0.00 -0.60 0.00 0.00 56.93 55.74 1ynf s PHE 267 Cb 0.01 -1.47 -0.10 0.00 0.51 0.00 0.00 43.02 41.97 1ynf s PHE 267 CO 0.61 0.42 1.58 0.00 0.70 0.00 0.00 175.22 178.53 1ynf h ALA 268 N 3.77 -0.74 -1.86 5.36 0.00 -1.54 -2.99 119.26 121.25 1ynf h ALA 268 Ca -0.49 -0.06 -0.65 0.00 0.00 0.00 0.00 54.91 53.71 1ynf h ALA 268 Cb 1.17 0.75 -0.38 0.00 0.00 0.00 0.00 17.79 19.33 1ynf h ALA 268 CO 0.53 -0.99 -0.21 0.54 0.00 0.00 0.00 179.25 179.12 1ynf n ARG 269 N -5.46 3.70 -0.17 0.00 1.74 -1.26 -4.91 116.66 110.29 1ynf n ARG 269 Ca -0.07 -4.68 -0.07 0.00 -0.77 0.00 0.00 57.85 52.26 1ynf n ARG 269 Cb 0.38 -2.29 -0.02 0.00 -1.02 0.00 0.00 32.46 29.51 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 3.16 -0.22 -0.58 5.56 4.15 -1.90 -1.07 115.11 124.21 1ynf h GLN 270 Ca 0.27 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.82 1ynf h GLN 270 Cb 0.51 0.05 -0.11 0.00 0.21 0.00 0.00 27.48 28.13 1ynf h GLN 270 CO 0.94 -0.15 -0.23 1.03 -1.93 0.00 0.00 178.83 178.49 1ynf h SER 271 N -0.23 -0.80 -0.61 -0.69 0.87 -1.91 0.28 113.55 110.46 1ynf h SER 271 Ca 0.19 0.20 -0.04 0.00 -1.23 0.00 0.00 61.79 60.91 1ynf h SER 271 Cb 0.56 0.45 -0.03 0.00 -0.44 0.00 0.00 62.40 62.95 1ynf h SER 271 CO -0.64 -0.25 0.21 1.56 -0.53 0.00 0.00 176.83 177.18 1ynf h GLN 272 N -0.08 0.94 0.18 2.24 4.20 -1.77 -2.15 115.11 118.66 1ynf h GLN 272 Ca 0.27 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 1ynf h GLN 272 Cb 0.50 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1ynf h GLN 272 CO -0.64 0.82 -0.08 1.25 -0.67 0.00 0.00 178.83 179.50 1ynf h LEU 273 N 0.86 -0.20 -0.54 1.46 5.85 0.04 -1.57 115.31 121.22 1ynf h LEU 273 Ca 0.20 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1ynf h LEU 273 Cb 0.26 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1ynf h LEU 273 CO -0.01 -0.11 0.33 -0.07 -0.34 0.00 0.00 178.44 178.24 1ynf h LEU 274 N -0.27 0.54 -0.74 2.25 3.38 -0.97 -0.61 115.31 118.90 1ynf h LEU 274 Ca -0.02 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.99 1ynf h LEU 274 Cb 0.21 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1ynf h LEU 274 CO 0.04 0.38 0.46 0.00 0.09 0.00 0.00 178.44 179.41 1ynf h ALA 275 N 1.23 0.98 -0.52 1.53 0.00 -1.29 0.46 119.26 121.65 1ynf h ALA 275 Ca 0.21 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1ynf h ALA 275 Cb 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ynf h ALA 275 CO -0.09 0.22 0.28 -0.97 0.00 0.00 0.00 179.25 178.69 1ynf h ASN 276 N 0.88 0.66 -0.73 0.00 -0.00 -0.60 -1.65 115.58 114.13 1ynf h ASN 276 Ca 0.31 -0.10 -0.06 0.00 -0.00 0.00 0.00 56.30 56.44 1ynf h ASN 276 Cb 0.07 -0.17 -0.03 0.00 -0.00 0.00 0.00 38.32 38.19 1ynf h ASN 276 CO -0.13 0.57 0.22 -0.07 -0.00 0.00 0.00 177.43 178.02 1ynf h LEU 277 N 0.69 1.07 -0.92 0.34 4.07 -0.46 -1.22 115.31 118.88 1ynf h LEU 277 Ca 0.18 -0.21 0.06 0.00 0.08 0.00 0.00 57.88 58.00 1ynf h LEU 277 Cb 0.07 -0.28 -0.06 0.00 1.08 0.00 0.00 40.66 41.46 1ynf h LEU 277 CO -0.03 1.00 0.59 0.03 -1.08 0.00 0.00 178.44 178.95 1ynf h ARG 278 N 1.09 1.04 0.00 1.13 3.08 -0.48 0.72 114.38 120.96 1ynf h ARG 278 Ca 0.24 -0.06 -0.13 0.00 0.07 0.00 0.00 59.98 60.09 1ynf h ARG 278 Cb 0.32 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1ynf h ARG 278 CO -0.01 0.69 -0.62 0.00 -1.07 0.00 0.00 179.97 178.97 1ynf h ALA 279 N 1.42 0.84 0.00 0.04 0.00 -0.80 -3.34 119.26 117.43 1ynf h ALA 279 Ca 0.40 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1ynf h ALA 279 Cb 0.16 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ynf h ALA 279 CO -0.17 0.77 -1.94 0.54 0.00 0.00 0.00 179.25 178.45 1ynf n ARG 280 N -3.61 0.64 -3.86 0.00 1.74 -0.51 -4.89 116.66 106.17 1ynf n ARG 280 Ca -0.00 -0.16 -0.36 0.00 -0.77 0.00 0.00 57.85 56.55 1ynf n ARG 280 Cb 0.66 -1.47 -0.13 0.00 -1.02 0.00 0.00 32.46 30.49 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 3.36 0.14 1.55 1.01 0.24 -5.07 120.40 118.34 1ynf s VAL 281 Ca -0.07 -1.05 -0.32 0.00 0.00 0.00 0.00 61.98 60.54 1ynf s VAL 281 Cb 0.12 -2.81 -0.11 0.00 0.00 0.00 0.00 36.38 33.58 1ynf s VAL 281 CO 0.82 0.02 1.78 0.59 0.00 0.00 0.00 175.10 178.31 1ynf n ASN 282 N 4.74 3.90 0.00 3.32 5.03 -1.26 -1.41 115.26 129.58 1ynf n ASN 282 Ca -0.14 1.02 0.00 0.00 0.87 0.00 0.00 54.58 56.32 1ynf n ASN 282 Cb 0.46 -1.53 0.00 0.00 -1.02 0.00 0.00 39.78 37.69 1ynf n ASN 282 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ynf n GLY 283 N 4.08 0.41 3.03 7.41 0.00 -1.26 -4.74 105.19 114.13 1ynf n GLY 283 Ca 0.18 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.43 -2.57 -3.62 1.61 -0.00 -0.50 -4.88 117.46 105.08 1ynf n PHE 284 Ca 0.00 -0.12 -0.03 0.00 -0.00 0.00 0.00 57.45 57.30 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 -2.08 -2.09 -0.52 3.13 0.00 -1.26 -4.91 121.76 114.03 1ynf s ALA 286 Ca 0.39 2.33 -0.07 0.00 0.00 0.00 0.00 51.96 54.61 1ynf s ALA 286 Cb -0.07 -1.69 0.13 0.00 0.00 0.00 0.00 23.12 21.50 1ynf s ALA 286 CO 0.35 -0.69 0.37 0.42 0.00 0.00 0.00 175.76 176.21 1ynf s ILE 287 N 2.27 4.01 -0.13 0.00 1.01 -0.59 -4.98 121.20 122.79 1ynf s ILE 287 Ca -0.07 -2.14 -0.18 0.00 0.00 0.00 0.00 60.65 58.25 1ynf s ILE 287 Cb -0.08 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 1ynf s ILE 287 CO -0.19 -0.80 0.50 -1.61 0.00 0.00 0.00 174.94 172.84 1ynf s GLU 288 N 0.92 4.32 -0.39 2.79 2.02 -1.25 -1.66 118.70 125.44 1ynf s GLU 288 Ca 0.10 0.46 -0.18 0.00 0.02 0.00 0.00 54.97 55.37 1ynf s GLU 288 Cb -0.23 -3.46 0.01 0.00 0.10 0.00 0.00 34.13 30.55 1ynf s GLU 288 CO -0.03 0.10 0.48 0.08 0.02 0.00 0.00 175.26 175.91 1ynf s VAL 289 N 0.82 5.03 0.45 2.63 1.01 -0.03 -4.85 120.40 125.46 1ynf s VAL 289 Ca 0.26 -0.02 -0.24 0.00 0.00 0.00 0.00 61.98 61.98 1ynf s VAL 289 Cb -0.15 -4.01 -0.07 0.00 0.00 0.00 0.00 36.38 32.14 1ynf s VAL 289 CO 0.10 -0.35 1.26 -2.16 0.00 0.00 0.00 175.10 173.96 1ynf s PRO 290 N 2.31 3.73 0.49 2.72 0.04 -1.26 -1.62 135.00 141.40 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 -2.54 1.18 0.00 0.04 0.00 0.00 34.50 33.02 1ynf s PRO 290 CO 0.14 -0.65 2.06 0.00 0.04 0.00 0.00 177.00 178.59 1ynf h ALA 291 N 2.22 2.09 -0.45 8.56 0.00 -1.97 -1.73 119.26 127.97 1ynf h ALA 291 Ca -0.50 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.49 1ynf h ALA 291 Cb 1.26 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.94 1ynf h ALA 291 CO 0.61 -0.16 0.02 1.15 0.00 0.00 0.00 179.25 180.87 1ynf h THR 292 N 0.18 0.67 0.02 0.00 2.02 -2.00 -2.91 112.91 110.90 1ynf h THR 292 Ca 0.15 -0.05 -0.14 0.00 0.77 0.00 0.00 66.41 67.14 1ynf h THR 292 Cb 0.38 0.52 0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1ynf h THR 292 CO -0.02 0.02 -0.57 1.56 0.37 0.00 0.00 175.52 176.88 1ynf h GLN 293 N 0.14 0.34 -3.48 6.66 4.20 -1.72 -3.44 115.11 117.80 1ynf h GLN 293 Ca 0.23 -0.40 -0.41 0.00 0.06 0.00 0.00 58.65 58.13 1ynf h GLN 293 Cb 0.33 0.12 -0.39 0.00 0.30 0.00 0.00 27.48 27.84 1ynf h GLN 293 CO -0.36 1.10 -0.75 0.08 -0.67 0.00 0.00 178.83 178.22 1ynf s VAL 294 N -3.03 0.13 0.84 -0.54 1.01 -0.82 -4.85 120.40 113.15 1ynf s VAL 294 Ca -0.14 0.23 -0.12 0.00 0.00 0.00 0.00 61.98 61.95 1ynf s VAL 294 Cb 0.02 -0.37 0.10 0.00 0.00 0.00 0.00 36.38 36.13 1ynf s VAL 294 CO 0.81 0.18 1.13 -0.94 0.00 0.00 0.00 175.10 176.28 1ynf s SER 295 N 2.07 4.12 0.18 3.32 1.04 -1.19 -4.05 113.70 119.19 1ynf s SER 295 Ca 0.05 1.03 -0.10 0.00 0.48 0.00 0.00 55.95 57.40 1ynf s SER 295 Cb -0.12 -1.64 0.08 0.00 0.10 0.00 0.00 66.02 64.43 1ynf s SER 295 CO -0.04 -2.17 1.69 0.58 0.98 0.00 0.00 173.24 174.28 1ynf h VAL 296 N -1.23 1.25 -0.33 5.02 2.07 -1.98 -1.11 116.25 119.94 1ynf h VAL 296 Ca -0.48 -0.93 0.05 0.00 0.82 0.00 0.00 66.70 66.16 1ynf h VAL 296 Cb 1.31 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 1ynf h VAL 296 CO 0.62 0.35 0.06 -1.28 0.02 0.00 0.00 177.57 177.34 1ynf h SER 297 N 0.93 -0.01 -0.87 0.57 0.87 -1.92 0.77 113.55 113.87 1ynf h SER 297 Ca 0.20 0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.80 1ynf h SER 297 Cb 0.36 0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.36 1ynf h SER 297 CO 0.00 0.03 0.47 0.44 -0.53 0.00 0.00 176.83 177.25 1ynf h ASP 298 N 0.17 1.10 -0.25 6.23 3.45 -1.86 -1.39 116.42 123.87 1ynf h ASP 298 Ca 0.16 -0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.52 1ynf h ASP 298 Cb 0.18 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.66 1ynf h ASP 298 CO -0.22 0.88 0.16 0.74 -1.57 0.00 0.00 179.24 179.24 1ynf h THR 299 N 1.23 1.07 -0.30 0.35 2.02 -0.08 -1.05 112.91 116.15 1ynf h THR 299 Ca 0.31 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 67.24 1ynf h THR 299 Cb 0.04 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1ynf h THR 299 CO -0.05 0.07 -0.27 0.58 0.37 0.00 0.00 175.52 176.22 1ynf h VAL 300 N 0.34 1.27 0.03 3.16 2.07 -0.53 0.44 116.25 123.03 1ynf h VAL 300 Ca 0.09 -1.35 -0.21 0.00 0.82 0.00 0.00 66.70 66.05 1ynf h VAL 300 Cb -0.03 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1ynf h VAL 300 CO -0.02 0.44 -0.96 0.77 0.02 0.00 0.00 177.57 177.82 1ynf h SER 301 N 0.53 0.21 0.39 0.57 4.64 -1.11 -3.34 113.55 115.44 1ynf h SER 301 Ca 0.07 -0.19 -0.17 0.00 -0.47 0.00 0.00 61.79 61.03 1ynf h SER 301 Cb 0.74 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.73 1ynf h SER 301 CO 0.06 1.05 -1.76 0.35 -0.87 0.00 0.00 176.83 175.66 1ynf n THR 302 N -3.56 0.94 -3.01 2.95 -2.24 -0.41 -4.97 114.28 103.98 1ynf n THR 302 Ca -0.03 -0.68 -0.15 0.00 -2.27 0.00 0.00 64.05 60.91 1ynf n THR 302 Cb 0.87 -0.48 0.04 0.00 -2.10 0.00 0.00 70.33 68.66 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 -2.70 -1.61 -0.32 4.78 4.02 0.14 -4.12 117.16 117.35 1ynf n TYR 303 Ca -0.14 0.52 0.07 0.00 -0.01 0.00 0.00 57.90 58.34 1ynf n TYR 303 Cb 0.84 -3.46 0.23 0.00 -0.02 0.00 0.00 39.34 36.93 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 -1.38 0.70 -0.82 7.72 5.85 -1.85 -1.74 115.31 123.78 1ynf h LEU 304 Ca -0.36 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1ynf h LEU 304 Cb 1.24 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1ynf h LEU 304 CO 0.36 0.33 -0.03 0.49 -0.34 0.00 0.00 178.44 179.25 1ynf n PHE 305 N -4.76 0.00 -0.96 1.25 3.01 -1.26 -3.71 117.46 111.02 1ynf n PHE 305 Ca 0.18 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.41 1ynf n PHE 305 Cb 0.40 -0.02 0.12 0.00 -0.01 0.00 0.00 39.48 39.97 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 -0.04 4.81 -4.96 4.37 2.85 -0.65 -4.34 115.26 117.29 1ynf n ASN 306 Ca 0.18 -3.41 -0.22 0.00 -0.11 0.00 0.00 54.58 51.02 1ynf n ASN 306 Cb 0.34 -0.85 -0.01 0.00 1.24 0.00 0.00 39.78 40.49 1ynf n ASN 306 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1ynf s SER 307 N -1.00 6.15 -0.20 1.20 1.04 -1.24 -1.37 113.70 118.28 1ynf s SER 307 Ca 0.50 0.19 -0.12 0.00 0.48 0.00 0.00 55.95 56.99 1ynf s SER 307 Cb 0.41 -1.74 -0.05 0.00 0.10 0.00 0.00 66.02 64.74 1ynf s SER 307 CO 0.06 -0.33 0.23 -1.10 0.98 0.00 0.00 173.24 173.08 1ynf s GLN 308 N -4.24 4.17 -0.48 4.02 -0.21 -0.66 -4.66 119.66 117.60 1ynf s GLN 308 Ca 0.41 -0.08 -0.12 0.00 0.02 0.00 0.00 55.36 55.59 1ynf s GLN 308 Cb -0.09 -3.48 0.11 0.00 1.00 0.00 0.00 33.01 30.54 1ynf s GLN 308 CO 0.33 0.14 0.37 -1.17 -2.12 0.00 0.00 175.29 172.85 1ynf s LEU 309 N 0.80 5.69 0.22 2.90 2.96 -1.26 -0.63 118.68 129.36 1ynf s LEU 309 Ca 0.12 -1.72 0.01 0.00 -0.22 0.00 0.00 54.13 52.32 1ynf s LEU 309 Cb -0.13 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 1ynf s LEU 309 CO 0.03 -0.69 0.39 -0.76 -1.32 0.00 0.00 176.35 174.00 1ynf s LEU 310 N 1.47 4.24 -0.04 -0.68 1.43 -1.26 -4.75 118.68 119.09 1ynf s LEU 310 Ca 0.04 0.29 0.05 0.00 -1.03 0.00 0.00 54.13 53.48 1ynf s LEU 310 Cb -0.26 -3.07 -0.02 0.00 0.03 0.00 0.00 46.19 42.86 1ynf s LEU 310 CO 0.02 -0.07 -0.18 -0.44 0.23 0.00 0.00 176.35 175.90 1ynf s SER 311 N -3.50 3.70 0.49 2.29 0.01 -1.26 -4.83 113.70 110.60 1ynf s SER 311 Ca 0.37 -0.29 0.08 0.00 1.31 0.00 0.00 55.95 57.42 1ynf s SER 311 Cb -0.10 -0.69 0.04 0.00 0.21 0.00 0.00 66.02 65.48 1ynf s SER 311 CO 0.30 0.34 0.67 -0.13 0.41 0.00 0.00 173.24 174.83 1ynf s ARG 312 N -0.68 2.60 0.36 12.44 0.52 0.24 -5.01 118.95 129.43 1ynf s ARG 312 Ca 0.11 -1.33 0.08 0.00 -0.52 0.00 0.00 55.73 54.07 1ynf s ARG 312 Cb -0.10 -2.69 0.69 0.00 0.52 0.00 0.00 34.95 33.36 1ynf s ARG 312 CO 0.00 -0.53 1.87 -0.44 0.02 0.00 0.00 175.30 176.22 1ynf h ASP 313 N 0.41 0.29 0.00 0.23 3.45 -1.99 -2.50 116.42 116.31 1ynf h ASP 313 Ca -0.37 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.02 1ynf h ASP 313 Cb 1.28 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.98 1ynf h ASP 313 CO 0.44 0.47 0.00 -0.90 -1.57 0.00 0.00 179.24 177.68 1ynf n ASP 314 N -4.23 0.00 0.00 6.45 3.85 -1.26 -4.87 116.55 116.49 1ynf n ASP 314 Ca -0.00 -1.02 0.00 0.00 -0.71 0.00 0.00 54.79 53.05 1ynf n ASP 314 Cb 0.30 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.07 1ynf n ASP 314 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ynf n GLY 315 N 0.85 0.74 0.47 6.12 0.00 -0.94 -5.24 105.19 107.19 1ynf n GLY 315 Ca 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.19 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 -3.66 1.61 3.41 -1.26 -4.76 113.62 108.29 1ynf n SER 316 Ca 0.00 -0.78 -0.14 0.00 -0.26 0.00 0.00 58.87 57.69 1ynf n SER 316 Cb 0.00 -0.13 -0.13 0.00 -0.26 0.00 0.00 64.21 63.69 1ynf n SER 316 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ynf s LEU 319 N 0.00 -0.28 -0.32 1.04 1.43 -0.29 -0.59 118.68 119.68 1ynf s LEU 319 Ca 0.09 0.55 -0.15 0.00 -1.03 0.00 0.00 54.13 53.59 1ynf s LEU 319 Cb -0.01 0.65 -0.02 0.00 0.03 0.00 0.00 46.19 46.85 1ynf s LEU 319 CO 0.07 -0.24 0.37 -0.69 0.23 0.00 0.00 176.35 176.08 1ynf s VAL 320 N 2.41 5.17 0.24 -1.59 1.01 0.20 -0.41 120.40 127.42 1ynf s VAL 320 Ca 0.02 0.21 0.10 0.00 0.00 0.00 0.00 61.98 62.30 1ynf s VAL 320 Cb -0.12 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1ynf s VAL 320 CO -0.08 -0.02 -0.17 -0.76 0.00 0.00 0.00 175.10 174.07 1ynf s LEU 321 N 2.04 2.57 0.50 3.92 1.02 0.14 -1.66 118.68 127.21 1ynf s LEU 321 Ca 0.13 -1.02 -0.14 0.00 0.02 0.00 0.00 54.13 53.11 1ynf s LEU 321 Cb -0.16 -0.87 -0.07 0.00 0.02 0.00 0.00 46.19 45.11 1ynf s LEU 321 CO 0.11 -0.07 0.93 -2.16 0.02 0.00 0.00 176.35 175.18 1ynf s PRO 322 N -3.57 3.86 0.51 1.29 0.04 -1.26 -1.28 135.00 134.59 1ynf s PRO 322 Ca 0.26 0.80 0.30 0.00 0.04 0.00 0.00 61.00 62.40 1ynf s PRO 322 Cb -0.03 -2.20 1.42 0.00 0.04 0.00 0.00 34.50 33.74 1ynf s PRO 322 CO 0.10 -0.24 1.84 1.96 0.04 0.00 0.00 177.00 180.70 1ynf h GLN 323 N 0.86 0.09 -0.42 4.56 4.20 -1.64 -1.39 115.11 121.37 1ynf h GLN 323 Ca -0.47 -0.01 0.12 0.00 0.06 0.00 0.00 58.65 58.36 1ynf h GLN 323 Cb 1.19 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.93 1ynf h GLN 323 CO 0.62 0.06 0.32 0.93 -0.67 0.00 0.00 178.83 180.09 1ynf h GLU 324 N 0.09 0.00 0.00 1.46 3.07 -1.88 -0.91 114.58 116.41 1ynf h GLU 324 Ca 0.50 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 59.22 1ynf h GLU 324 Cb 1.82 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.71 1ynf h GLU 324 CO -0.06 0.00 -0.65 0.00 -1.40 0.00 0.00 179.01 176.89 1ynf h ARG 326 N 0.00 0.06 0.00 0.00 2.43 -1.34 -3.01 114.38 112.51 1ynf h ARG 326 Ca -0.01 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1ynf h ARG 326 Cb 1.17 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1ynf h ARG 326 CO 0.08 0.96 0.00 0.39 -1.51 0.00 0.00 179.97 179.89 1ynf n GLU 327 N -3.33 0.12 -3.49 0.20 1.02 -0.78 -4.53 120.64 109.84 1ynf n GLU 327 Ca -0.05 0.23 -0.42 0.00 -0.02 0.00 0.00 57.16 56.89 1ynf n GLU 327 Cb 0.98 -1.67 -0.09 0.00 -0.02 0.00 0.00 31.44 30.64 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 -3.11 3.29 0.24 -0.32 2.46 -1.03 -4.96 115.29 111.85 1ynf s HIS 328 Ca 0.09 -1.25 -0.09 0.00 0.47 0.00 0.00 55.06 54.29 1ynf s HIS 328 Cb 0.12 -3.09 0.38 0.00 -0.13 0.00 0.00 32.58 29.87 1ynf s HIS 328 CO 0.44 -0.83 1.64 0.00 -2.47 0.00 0.00 174.74 173.52 1ynf h ALA 329 N 8.58 0.69 -0.34 1.58 0.00 -1.86 0.17 119.26 128.09 1ynf h ALA 329 Ca -0.26 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ynf h ALA 329 Cb 1.10 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 1ynf h ALA 329 CO 0.82 -0.42 0.22 0.78 0.00 0.00 0.00 179.25 180.65 1ynf h GLY 330 N 0.08 0.48 0.69 0.00 0.00 -1.93 0.68 103.07 103.08 1ynf h GLY 330 Ca 0.38 -0.19 -0.06 0.00 0.00 0.00 0.00 47.33 47.47 1ynf h GLY 330 CO -0.65 0.18 -0.17 -2.08 0.00 0.00 0.00 176.54 173.81 1ynf h VAL 331 N 0.45 1.38 -0.84 4.60 2.07 -1.63 -2.42 116.25 119.86 1ynf h VAL 331 Ca 0.12 -1.42 0.02 0.00 0.82 0.00 0.00 66.70 66.24 1ynf h VAL 331 Cb -0.03 2.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 1ynf h VAL 331 CO -0.03 0.41 0.56 -0.25 0.02 0.00 0.00 177.57 178.28 1ynf h TRP 332 N -0.12 1.04 -0.32 1.57 2.91 -0.56 -0.04 115.95 120.45 1ynf h TRP 332 Ca 0.01 0.02 -0.00 0.00 1.13 0.00 0.00 58.89 60.05 1ynf h TRP 332 Cb 0.74 -0.35 -0.02 0.00 -0.51 0.00 0.00 29.16 29.02 1ynf h TRP 332 CO 0.10 0.65 0.19 0.78 -1.03 0.00 0.00 178.44 179.13 1ynf h GLY 333 N 1.12 0.46 1.00 2.65 0.00 -0.80 -1.58 103.07 105.92 1ynf h GLY 333 Ca 0.31 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1ynf h GLY 333 CO -0.07 0.18 0.35 -1.82 0.00 0.00 0.00 176.54 175.18 1ynf h TYR 334 N 0.41 0.71 -0.69 5.60 3.20 -0.82 -2.42 116.97 122.97 1ynf h TYR 334 Ca 0.11 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.01 1ynf h TYR 334 Cb 0.00 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.00 1ynf h TYR 334 CO -0.04 0.46 0.45 -0.07 -1.64 0.00 0.00 178.16 177.32 1ynf h LEU 335 N 0.74 0.76 -1.43 2.82 -0.00 -0.70 0.85 115.31 118.36 1ynf h LEU 335 Ca 0.20 -0.01 -0.06 0.00 -0.00 0.00 0.00 57.88 58.01 1ynf h LEU 335 Cb -0.06 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 40.41 1ynf h LEU 335 CO -0.04 0.55 -0.28 0.78 -0.00 0.00 0.00 178.44 179.44 1ynf h ASN 336 N 0.90 0.00 -0.19 -0.43 2.35 -1.04 0.91 115.58 118.09 1ynf h ASN 336 Ca 0.26 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.86 1ynf h ASN 336 Cb -0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.30 1ynf h ASN 336 CO -0.07 0.28 -0.46 -0.08 -1.65 0.00 0.00 177.43 175.45 1ynf h GLU 337 N 0.00 0.65 -0.49 0.81 4.81 -0.87 -2.84 114.58 116.65 1ynf h GLU 337 Ca -0.00 -0.44 -0.05 0.00 -0.13 0.00 0.00 59.36 58.74 1ynf h GLU 337 Cb 0.56 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 1ynf h GLU 337 CO 0.04 1.06 0.11 1.25 -0.73 0.00 0.00 179.01 180.74 1ynf h LEU 338 N 0.34 0.69 -1.20 1.64 5.85 -0.18 -1.14 115.31 121.31 1ynf h LEU 338 Ca -0.00 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 1ynf h LEU 338 Cb 1.07 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.90 1ynf h LEU 338 CO 0.10 0.69 0.16 0.25 -0.34 0.00 0.00 178.44 179.30 1ynf h LEU 339 N 0.72 0.65 0.00 2.25 5.85 -0.72 -2.72 115.31 121.34 1ynf h LEU 339 Ca 0.16 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1ynf h LEU 339 Cb 0.29 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.15 1ynf h LEU 339 CO -0.00 0.62 -0.77 0.00 -0.34 0.00 0.00 178.44 177.95 1ynf h ALA 340 N 1.47 0.52 -2.33 1.25 0.00 -1.21 -3.44 119.26 115.52 1ynf h ALA 340 Ca 0.16 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.63 1ynf h ALA 340 Cb 0.20 0.00 0.17 0.00 0.00 0.00 0.00 17.79 18.16 1ynf h ALA 340 CO -0.01 0.00 0.17 0.00 0.00 0.00 0.00 179.25 179.41 1ynf s ALA 341 N -3.22 0.73 -1.18 0.00 0.00 -0.47 -4.92 121.76 112.70 1ynf s ALA 341 Ca 0.04 -0.39 -0.20 0.00 0.00 0.00 0.00 51.96 51.41 1ynf s ALA 341 Cb 0.13 -3.12 0.05 0.00 0.00 0.00 0.00 23.12 20.18 1ynf s ALA 341 CO 0.75 -3.02 1.66 0.34 0.00 0.00 0.00 175.76 175.50 1ynf s ASP 342 N -3.38 6.54 0.23 0.00 -1.08 -1.26 -4.89 116.67 112.83 1ynf s ASP 342 Ca 0.66 -1.99 -0.22 0.00 -0.52 0.00 0.00 52.55 50.48 1ynf s ASP 342 Cb -0.19 -2.58 0.04 0.00 -1.46 0.00 0.00 42.92 38.73 1ynf s ASP 342 CO 0.58 -1.48 0.79 0.54 0.52 0.00 0.00 175.17 176.13 1ynf s ASN 343 N 4.79 -0.25 0.54 -0.34 2.20 -1.26 -5.06 114.94 115.56 1ynf s ASN 343 Ca 0.53 -0.52 0.27 0.00 -0.94 0.00 0.00 52.86 52.20 1ynf s ASN 343 Cb 0.02 0.65 1.57 0.00 -2.00 0.00 0.00 41.25 41.48 1ynf s ASN 343 CO 0.02 -1.19 2.14 -0.65 -2.94 0.00 0.00 177.10 174.48 1ynf h PRO 344 N 2.00 0.00 -6.07 3.55 0.11 -1.91 -3.43 132.00 126.24 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 0.24 0.07 1.39 0.42 -0.21 0.00 0.00 178.00 179.92 1ynf s ILE 345 N -4.43 3.27 -0.81 4.15 1.01 -1.26 -4.60 121.20 118.53 1ynf s ILE 345 Ca -0.04 0.26 0.07 0.00 0.00 0.00 0.00 60.65 60.93 1ynf s ILE 345 Cb 0.14 -3.42 0.04 0.00 0.01 0.00 0.00 42.46 39.23 1ynf s ILE 345 CO 0.58 -0.31 0.67 -1.54 0.00 0.00 0.00 174.94 174.35 1ynf n SER 346 N 11.68 1.45 -3.68 3.58 3.41 -1.26 -4.59 113.62 124.21 1ynf n SER 346 Ca 0.26 -1.23 -0.15 0.00 -0.26 0.00 0.00 58.87 57.50 1ynf n SER 346 Cb 0.48 0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 64.44 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 -0.67 0.75 -0.09 4.33 2.12 -1.26 -5.09 118.70 118.79 1ynf s GLU 347 Ca 0.07 0.14 0.04 0.00 0.36 0.00 0.00 54.97 55.58 1ynf s GLU 347 Cb 0.06 0.35 -0.00 0.00 0.26 0.00 0.00 34.13 34.79 1ynf s GLU 347 CO 0.10 -0.20 -0.23 -0.51 -0.54 0.00 0.00 175.26 173.88 1ynf s LEU 348 N -0.92 2.14 -0.08 2.70 1.02 -1.26 -1.13 118.68 121.15 1ynf s LEU 348 Ca -0.10 -0.52 0.01 0.00 0.02 0.00 0.00 54.13 53.55 1ynf s LEU 348 Cb -0.03 -1.42 0.02 0.00 0.02 0.00 0.00 46.19 44.78 1ynf s LEU 348 CO 0.05 0.19 -0.11 -0.75 0.02 0.00 0.00 176.35 175.75 1ynf s LYS 349 N 0.17 1.67 -0.06 1.70 2.20 0.46 -4.95 119.74 120.94 1ynf s LYS 349 Ca -0.13 -0.37 0.01 0.00 -0.36 0.00 0.00 55.97 55.11 1ynf s LYS 349 Cb -0.16 -1.48 -0.03 0.00 -1.51 0.00 0.00 37.83 34.64 1ynf s LYS 349 CO 0.07 -0.06 -0.06 0.08 -0.36 0.00 0.00 175.35 175.01 1ynf s VAL 350 N 0.98 3.76 0.05 4.02 1.01 -1.26 0.24 120.40 129.20 1ynf s VAL 350 Ca -0.08 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.45 1ynf s VAL 350 Cb -0.15 -2.55 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 1ynf s VAL 350 CO -0.00 0.57 -0.15 -0.36 0.00 0.00 0.00 175.10 175.16 1ynf s PHE 351 N -0.85 1.31 -0.49 5.22 0.40 -0.41 -4.95 117.98 118.21 1ynf s PHE 351 Ca 0.13 -0.39 -0.24 0.00 -0.60 0.00 0.00 56.93 55.83 1ynf s PHE 351 Cb -0.11 -0.76 0.03 0.00 0.51 0.00 0.00 43.02 42.69 1ynf s PHE 351 CO 0.02 0.06 0.89 0.34 0.70 0.00 0.00 175.22 177.23 1ynf s ASP 352 N -1.35 6.41 -0.31 1.36 2.15 -1.26 -1.52 116.67 122.15 1ynf s ASP 352 Ca 0.01 -0.15 0.13 0.00 0.43 0.00 0.00 52.55 52.98 1ynf s ASP 352 Cb -0.09 -2.42 0.47 0.00 -0.30 0.00 0.00 42.92 40.58 1ynf s ASP 352 CO 0.02 -1.08 1.12 0.18 -0.17 0.00 0.00 175.17 175.24 1ynf n LEU 353 N 7.13 3.39 -0.18 -1.34 4.32 -1.26 -4.86 117.00 124.20 1ynf n LEU 353 Ca 0.03 -4.14 -0.01 0.00 -0.02 0.00 0.00 56.01 51.87 1ynf n LEU 353 Cb 0.48 -0.00 0.08 0.00 -1.62 0.00 0.00 43.42 42.36 1ynf n LEU 353 CO 0.62 1.72 0.83 -0.09 -1.22 0.00 0.00 177.39 179.24 1ynf h ARG 354 N 2.48 0.10 0.02 3.23 2.43 -1.95 -2.82 114.38 117.87 1ynf h ARG 354 Ca 0.14 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 1ynf h ARG 354 Cb 1.31 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.82 1ynf h ARG 354 CO 0.56 0.06 -0.11 0.93 -1.51 0.00 0.00 179.97 179.90 1ynf h GLU 355 N 0.10 -0.19 -1.72 0.20 4.39 -1.94 0.14 114.58 115.56 1ynf h GLU 355 Ca 0.29 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.00 1ynf h GLU 355 Cb 0.45 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1ynf h GLU 355 CO -0.49 -0.13 0.00 0.45 -1.16 0.00 0.00 179.01 177.68 1ynf n SER 356 N -5.24 1.19 0.00 1.42 2.88 -1.06 -3.55 113.62 109.26 1ynf n SER 356 Ca -0.06 -0.84 0.00 0.00 -1.33 0.00 0.00 58.87 56.64 1ynf n SER 356 Cb 0.16 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 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 1.01 0.00 -0.14 -1.46 0.00 0.03 -1.24 120.51 118.71 1ynf n ALA 358 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 1ynf n ALA 358 Cb 0.17 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.89 1ynf n ALA 358 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ynf n ASN 359 N 0.00 3.63 0.00 0.00 3.02 -1.23 -4.82 115.26 115.86 1ynf n ASN 359 Ca 0.00 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.57 1ynf n ASN 359 Cb 0.00 -0.38 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 1ynf n ASN 359 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ynf n GLY 360 N 1.42 1.15 3.05 7.41 0.00 -0.97 -5.09 105.19 112.16 1ynf n GLY 360 Ca 0.21 -0.34 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 1ynf n GLY 360 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ynf s GLY 361 N -2.34 1.05 0.02 -0.02 0.00 -0.38 -5.05 107.32 100.61 1ynf s GLY 361 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 43.97 1ynf s GLY 361 CO 0.00 0.26 0.03 0.61 0.00 0.00 0.00 173.10 174.00 1ynf n GLY 362 N 4.26 2.19 0.34 0.20 0.00 -1.26 -4.63 105.19 106.28 1ynf n GLY 362 Ca -0.19 -2.14 0.07 0.00 0.00 0.00 0.00 46.02 43.76 1ynf n GLY 362 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ynf h PRO 363 N 0.00 0.83 -0.07 1.61 0.13 -1.89 -2.37 132.00 130.24 1ynf h PRO 363 Ca -0.01 -0.05 -0.18 0.00 -0.87 0.00 0.00 66.00 64.89 1ynf h PRO 363 Cb 0.05 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 30.99 1ynf h PRO 363 CO 0.02 0.55 -0.73 0.00 -0.23 0.00 0.00 178.00 177.61 1ynf h ALA 364 N 1.55 0.62 -0.30 -0.56 0.00 -1.49 -3.13 119.26 115.95 1ynf h ALA 364 Ca 0.49 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1ynf h ALA 364 Cb 0.57 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1ynf h ALA 364 CO -0.30 0.77 0.15 0.00 0.00 0.00 0.00 179.25 179.87 1ynf n LEU 366 N -4.45 0.40 -4.09 0.00 4.77 -1.10 -2.22 117.00 110.31 1ynf n LEU 366 Ca 0.01 -0.15 -0.15 0.00 -0.03 0.00 0.00 56.01 55.70 1ynf n LEU 366 Cb 0.10 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.06 1ynf n LEU 366 CO 0.36 0.07 -0.42 0.00 -1.33 0.00 0.00 177.39 176.07 1ynf s ARG 367 N -1.98 0.62 -0.17 3.23 1.04 -0.70 -1.68 118.95 119.32 1ynf s ARG 367 Ca 0.38 -0.76 0.01 0.00 -1.04 0.00 0.00 55.73 54.32 1ynf s ARG 367 Cb 0.18 -0.48 0.02 0.00 -2.04 0.00 0.00 34.95 32.64 1ynf s ARG 367 CO 0.30 0.10 -0.17 -1.17 -0.04 0.00 0.00 175.30 174.32 1ynf s LEU 368 N -1.47 2.03 -0.19 -1.89 2.96 0.97 -3.62 118.68 117.48 1ynf s LEU 368 Ca -0.06 -0.63 -0.26 0.00 -0.22 0.00 0.00 54.13 52.95 1ynf s LEU 368 Cb -0.09 -1.37 -0.01 0.00 0.50 0.00 0.00 46.19 45.22 1ynf s LEU 368 CO 0.01 -0.03 0.89 -0.13 -1.32 0.00 0.00 176.35 175.76 1ynf s ARG 369 N 1.36 4.28 -0.26 1.98 0.52 -1.26 -1.32 118.95 124.24 1ynf s ARG 369 Ca 0.04 1.10 0.00 0.00 -0.52 0.00 0.00 55.73 56.36 1ynf s ARG 369 Cb -0.13 -3.60 0.08 0.00 0.52 0.00 0.00 34.95 31.82 1ynf s ARG 369 CO -0.12 -0.42 0.02 0.08 0.02 0.00 0.00 175.30 174.89 1ynf s VAL 370 N 2.47 1.24 -0.14 3.52 1.01 -0.31 -4.83 120.40 123.36 1ynf s VAL 370 Ca 0.40 -1.30 -0.29 0.00 0.00 0.00 0.00 61.98 60.78 1ynf s VAL 370 Cb -0.16 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 1ynf s VAL 370 CO 0.11 -0.36 1.27 -0.69 0.00 0.00 0.00 175.10 175.42 1ynf s VAL 371 N 1.49 4.24 -0.00 2.92 1.01 -1.26 -0.90 120.40 127.89 1ynf s VAL 371 Ca 0.02 1.52 0.04 0.00 0.00 0.00 0.00 61.98 63.55 1ynf s VAL 371 Cb -0.18 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 1ynf s VAL 371 CO -0.13 -0.11 -0.13 -0.76 0.00 0.00 0.00 175.10 173.98 1ynf s LEU 372 N 3.25 2.05 0.91 3.92 1.43 0.38 -4.64 118.68 125.96 1ynf s LEU 372 Ca 0.56 -0.26 -0.12 0.00 -1.03 0.00 0.00 54.13 53.28 1ynf s LEU 372 Cb -0.23 -0.63 0.13 0.00 0.03 0.00 0.00 46.19 45.49 1ynf s LEU 372 CO 0.17 0.13 1.13 0.42 0.23 0.00 0.00 176.35 178.44 1ynf s THR 373 N -0.37 2.07 0.25 5.49 -4.23 -1.26 -1.05 115.64 116.53 1ynf s THR 373 Ca 0.04 0.02 -0.05 0.00 -1.18 0.00 0.00 61.69 60.52 1ynf s THR 373 Cb -0.05 -2.76 0.24 0.00 1.34 0.00 0.00 72.50 71.26 1ynf s THR 373 CO -0.00 -0.03 1.89 -0.08 -0.54 0.00 0.00 174.62 175.86 1ynf h GLU 374 N -1.48 1.15 -0.17 3.99 4.81 -1.94 0.17 114.58 121.11 1ynf h GLU 374 Ca -0.50 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 58.50 1ynf h GLU 374 Cb 1.33 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 1ynf h GLU 374 CO 0.62 0.76 -0.53 0.93 -0.73 0.00 0.00 179.01 180.06 1ynf h GLU 375 N 1.18 0.50 -0.29 1.92 5.08 -1.92 -2.51 114.58 118.55 1ynf h GLU 375 Ca 0.38 -0.31 -0.15 0.00 -1.00 0.00 0.00 59.36 58.28 1ynf h GLU 375 Cb 0.01 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1ynf h GLU 375 CO -0.12 0.91 -0.44 0.93 -1.00 0.00 0.00 179.01 179.28 1ynf h GLU 376 N 0.39 0.73 -0.96 2.33 5.08 -1.76 -2.25 114.58 118.14 1ynf h GLU 376 Ca 0.01 -0.40 0.02 0.00 -1.00 0.00 0.00 59.36 57.99 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 1.02 0.63 0.00 -1.00 0.00 0.00 179.01 179.76 1ynf h ARG 377 N 0.59 1.23 -0.01 2.33 3.08 -0.56 -1.42 114.38 119.62 1ynf h ARG 377 Ca 0.04 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 1ynf h ARG 377 Cb 1.00 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.76 1ynf h ARG 377 CO 0.09 0.81 -0.40 0.00 -1.07 0.00 0.00 179.97 179.41 1ynf h ARG 378 N 1.27 0.02 0.00 0.04 3.08 -1.19 -3.01 114.38 114.59 1ynf h ARG 378 Ca 0.37 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.41 1ynf h ARG 378 Cb -0.09 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.96 1ynf h ARG 378 CO -0.10 0.42 0.00 0.00 -1.07 0.00 0.00 179.97 179.22 1ynf h ALA 379 N 1.58 1.00 -2.75 0.04 0.00 -0.67 -3.46 119.26 115.00 1ynf h ALA 379 Ca -0.00 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.40 1ynf h ALA 379 Cb 0.71 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.56 1ynf h ALA 379 CO 0.05 0.00 0.52 0.08 0.00 0.00 0.00 179.25 179.90 1ynf s VAL 380 N -3.35 3.11 -0.33 0.00 1.01 -0.99 -4.49 120.40 115.36 1ynf s VAL 380 Ca 0.05 0.96 -0.35 0.00 0.00 0.00 0.00 61.98 62.64 1ynf s VAL 380 Cb 0.07 -3.55 -0.11 0.00 0.00 0.00 0.00 36.38 32.79 1ynf s VAL 380 CO 0.61 0.11 2.16 -3.20 0.00 0.00 0.00 175.10 174.77 1ynf n ASN 381 N 0.17 2.23 0.12 3.32 2.85 -0.62 -4.79 115.26 118.55 1ynf n ASN 381 Ca 0.04 0.46 0.17 0.00 -0.11 0.00 0.00 54.58 55.14 1ynf n ASN 381 Cb 0.46 -1.27 0.74 0.00 1.24 0.00 0.00 39.78 40.95 1ynf n ASN 381 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ynf h PRO 382 N 12.08 0.00 0.00 1.20 0.11 -1.90 -2.61 132.00 140.89 1ynf h PRO 382 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1ynf h PRO 382 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1ynf h PRO 382 CO 1.01 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.80 1ynf n ALA 383 N -2.49 1.34 -3.45 -0.75 0.00 -1.26 -5.10 120.51 108.80 1ynf n ALA 383 Ca 0.05 0.04 -0.37 0.00 0.00 0.00 0.00 53.44 53.16 1ynf n ALA 383 Cb 0.43 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.62 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 -1.81 3.55 0.00 0.00 0.24 -0.99 -4.68 118.33 114.64 1ynf n VAL 384 Ca 0.01 -5.32 0.00 0.00 -2.04 0.00 0.00 64.34 56.99 1ynf n VAL 384 Cb 0.11 -2.31 0.00 0.00 -1.47 0.00 0.00 33.84 30.17 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 1.94 0.00 -0.29 -1.34 0.23 -1.26 -1.12 115.26 113.42 1ynf n ASN 387 Ca 0.24 0.00 0.05 0.00 -0.53 0.00 0.00 54.58 54.34 1ynf n ASN 387 Cb 0.37 0.00 0.20 0.00 -2.08 0.00 0.00 39.78 38.27 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 0.61 -0.12 0.53 3.32 -2.00 -0.48 116.42 118.27 1ynf h ASP 388 Ca 0.00 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1ynf h ASP 388 Cb 0.00 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1ynf h ASP 388 CO 0.00 0.31 0.04 0.74 -1.72 0.00 0.00 179.24 178.61 1ynf h THR 389 N 0.71 1.16 -0.47 0.35 2.02 -2.05 -0.98 112.91 113.65 1ynf h THR 389 Ca 0.43 -0.49 -0.08 0.00 0.77 0.00 0.00 66.41 67.04 1ynf h THR 389 Cb 0.50 1.26 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 1ynf h THR 389 CO -0.30 0.15 -0.02 0.25 0.37 0.00 0.00 175.52 175.96 1ynf h LEU 390 N 0.03 0.84 -0.26 2.58 5.85 -1.90 -1.25 115.31 121.20 1ynf h LEU 390 Ca 0.04 -0.32 0.05 0.00 0.84 0.00 0.00 57.88 58.49 1ynf h LEU 390 Cb 0.19 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 1ynf h LEU 390 CO -0.00 0.96 -0.05 0.15 -0.34 0.00 0.00 178.44 179.15 1ynf h PHE 391 N 0.70 -0.12 -0.52 1.25 3.57 -0.99 0.14 116.94 120.97 1ynf h PHE 391 Ca 0.13 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.57 1ynf h PHE 391 Cb 0.54 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 1ynf h PHE 391 CO 0.04 -0.10 -0.03 -0.91 -2.23 0.00 0.00 178.31 175.08 1ynf h ASN 392 N 0.01 0.88 -0.29 0.41 2.35 -1.08 -1.42 115.58 116.44 1ynf h ASN 392 Ca 0.12 -0.24 -0.03 0.00 -0.55 0.00 0.00 56.30 55.60 1ynf h ASN 392 Cb 0.19 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 1ynf h ASN 392 CO -0.26 0.95 0.05 0.00 -1.65 0.00 0.00 177.43 176.52 1ynf h ALA 393 N 1.14 0.39 -0.49 -0.83 0.00 -0.68 -1.91 119.26 116.87 1ynf h ALA 393 Ca 0.15 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1ynf h ALA 393 Cb 0.53 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ynf h ALA 393 CO 0.03 0.07 0.08 -0.07 0.00 0.00 0.00 179.25 179.36 1ynf h LEU 394 N 0.30 0.79 -0.95 0.00 3.38 -0.64 -0.98 115.31 117.20 1ynf h LEU 394 Ca 0.09 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.82 1ynf h LEU 394 Cb 0.34 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 1ynf h LEU 394 CO 0.01 0.85 0.62 0.78 0.09 0.00 0.00 178.44 180.79 1ynf h ASN 395 N 0.69 1.06 -0.37 -0.43 2.35 -1.19 0.60 115.58 118.30 1ynf h ASN 395 Ca 0.15 -0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.81 1ynf h ASN 395 Cb 0.40 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 1ynf h ASN 395 CO 0.01 0.75 -0.05 0.44 -1.65 0.00 0.00 177.43 176.94 1ynf h ASP 396 N 1.25 0.68 -0.49 5.81 3.32 -1.10 -1.32 116.42 124.57 1ynf h ASP 396 Ca 0.36 -0.34 0.04 0.00 0.02 0.00 0.00 57.03 57.11 1ynf h ASP 396 Cb -0.09 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.24 1ynf h ASP 396 CO -0.09 0.86 0.26 -0.25 -1.72 0.00 0.00 179.24 178.29 1ynf h TRP 397 N 0.48 0.47 -0.35 4.55 7.01 -0.60 -1.52 115.95 125.99 1ynf h TRP 397 Ca 0.10 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.11 1ynf h TRP 397 Cb 0.54 -0.14 -0.02 0.00 -2.10 0.00 0.00 29.16 27.44 1ynf h TRP 397 CO 0.04 0.24 0.18 0.28 -2.79 0.00 0.00 178.44 176.40 1ynf h VAL 398 N 0.50 1.15 0.00 2.65 2.07 -0.71 -1.98 116.25 119.93 1ynf h VAL 398 Ca 0.21 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1ynf h VAL 398 Cb 0.10 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1ynf h VAL 398 CO -0.14 0.16 -0.07 0.44 0.02 0.00 0.00 177.57 177.98 1ynf h ASP 399 N 0.44 0.00 0.10 0.57 3.32 -0.86 0.25 116.42 120.24 1ynf h ASP 399 Ca 0.12 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.98 1ynf h ASP 399 Cb 0.09 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.66 1ynf h ASP 399 CO -0.02 0.07 -0.81 -0.09 -1.72 0.00 0.00 179.24 176.67 1ynf h ARG 400 N 0.00 0.37 0.00 3.56 2.43 -0.87 -3.41 114.38 116.46 1ynf h ARG 400 Ca -0.00 -0.53 -0.08 0.00 -0.81 0.00 0.00 59.98 58.55 1ynf h ARG 400 Cb 0.14 0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 1ynf h ARG 400 CO 0.01 1.22 -1.90 0.66 -1.51 0.00 0.00 179.97 178.45 1ynf n TYR 401 N -4.11 0.00 -2.95 2.20 4.02 -0.78 -5.01 117.16 110.52 1ynf n TYR 401 Ca -0.13 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.36 1ynf n TYR 401 Cb 0.80 -0.52 -0.06 0.00 -0.02 0.00 0.00 39.34 39.54 1ynf n TYR 401 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1ynf s TYR 402 N -3.00 3.88 0.36 -0.72 1.51 0.06 -4.96 117.35 114.48 1ynf s TYR 402 Ca -0.07 1.63 -0.09 0.00 -1.01 0.00 0.00 57.07 57.53 1ynf s TYR 402 Cb 0.10 -2.81 -0.06 0.00 -0.11 0.00 0.00 41.96 39.08 1ynf s TYR 402 CO 0.72 0.45 0.70 1.03 -1.11 0.00 0.00 175.55 177.35 1ynf s ARG 403 N -0.88 3.75 0.13 -0.62 0.52 -1.26 -4.71 118.95 115.89 1ynf s ARG 403 Ca 0.37 0.35 0.24 0.00 -0.52 0.00 0.00 55.73 56.17 1ynf s ARG 403 Cb -0.23 -2.47 0.27 0.00 0.52 0.00 0.00 34.95 33.04 1ynf s ARG 403 CO 0.26 0.05 1.26 -0.44 0.02 0.00 0.00 175.30 176.45 1ynf h ASP 404 N 1.48 0.00 -3.70 0.23 3.45 -1.94 -2.10 116.42 113.84 1ynf h ASP 404 Ca -0.47 -0.20 -0.25 0.00 0.43 0.00 0.00 57.03 56.53 1ynf h ASP 404 Cb 1.19 0.00 -0.29 0.00 -0.56 0.00 0.00 39.33 39.66 1ynf h ASP 404 CO 0.65 0.10 -0.72 -0.60 -1.57 0.00 0.00 179.24 177.09 1ynf s ARG 405 N -3.20 0.03 -0.13 3.56 3.52 -1.26 -4.25 118.95 117.23 1ynf s ARG 405 Ca 0.05 0.02 -0.25 0.00 -0.13 0.00 0.00 55.73 55.42 1ynf s ARG 405 Cb 0.13 -0.08 0.06 0.00 -1.56 0.00 0.00 34.95 33.49 1ynf s ARG 405 CO 0.74 -0.03 0.62 -1.17 -0.81 0.00 0.00 175.30 174.65 1ynf s LEU 406 N 0.21 -0.38 0.10 -0.88 2.96 -0.46 -4.93 118.68 115.30 1ynf s LEU 406 Ca -0.02 0.90 -0.01 0.00 -0.22 0.00 0.00 54.13 54.79 1ynf s LEU 406 Cb -0.03 2.23 -0.04 0.00 0.50 0.00 0.00 46.19 48.85 1ynf s LEU 406 CO -0.01 -0.41 0.01 0.42 -1.32 0.00 0.00 176.35 175.04 1ynf s THR 407 N -0.52 0.25 0.48 3.68 -4.23 -1.26 -0.85 115.64 113.18 1ynf s THR 407 Ca -0.06 -1.88 0.20 0.00 -1.18 0.00 0.00 61.69 58.76 1ynf s THR 407 Cb -0.03 -1.83 0.37 0.00 1.34 0.00 0.00 72.50 72.35 1ynf s THR 407 CO 0.05 -0.69 1.96 0.00 -0.54 0.00 0.00 174.62 175.40 1ynf h ALA 408 N 2.96 2.27 0.00 3.99 0.00 -1.83 -0.61 119.26 126.05 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 1.18 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1ynf h ALA 408 CO 0.62 -0.44 -0.13 0.00 0.00 0.00 0.00 179.25 179.31 1ynf h ALA 409 N 1.70 1.43 0.00 0.00 0.00 -1.96 -2.29 119.26 118.13 1ynf h ALA 409 Ca 0.30 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1ynf h ALA 409 Cb 0.87 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1ynf h ALA 409 CO -0.06 0.16 0.00 -0.25 0.00 0.00 0.00 179.25 179.10 1ynf n ASP 410 N -3.86 0.04 0.23 0.00 8.00 -0.24 -3.51 116.55 117.21 1ynf n ASP 410 Ca -0.02 0.50 0.16 0.00 0.71 0.00 0.00 54.79 56.14 1ynf n ASP 410 Cb 0.22 -0.51 0.73 0.00 -0.02 0.00 0.00 41.12 41.54 1ynf n ASP 410 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1ynf h LEU 411 N 0.00 0.00 0.00 0.64 3.38 -1.51 -2.04 115.31 115.78 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 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1ynf h LEU 411 CO 0.00 0.00 -0.38 0.00 0.09 0.00 0.00 178.44 178.15 1ynf n ALA 412 N -1.94 3.24 -2.17 1.53 0.00 -1.23 -4.86 120.51 115.07 1ynf n ALA 412 Ca -0.00 -0.29 -0.43 0.00 0.00 0.00 0.00 53.44 52.72 1ynf n ALA 412 Cb 0.18 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.40 1ynf n ALA 412 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ynf s ASP 413 N -3.04 6.48 0.58 0.00 3.68 -0.77 -4.80 116.67 118.80 1ynf s ASP 413 Ca 0.12 1.61 0.27 0.00 2.13 0.00 0.00 52.55 56.68 1ynf s ASP 413 Cb 0.18 -2.53 1.69 0.00 -1.45 0.00 0.00 42.92 40.81 1ynf s ASP 413 CO 0.66 -1.17 2.20 1.55 0.13 0.00 0.00 175.17 178.54 1ynf h PRO 414 N 10.25 0.00 -0.19 4.34 0.13 -1.89 -1.49 132.00 143.15 1ynf h PRO 414 Ca -0.32 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.66 1ynf h PRO 414 Cb 1.14 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1ynf h PRO 414 CO 1.00 0.00 -0.48 0.37 -0.23 0.00 0.00 178.00 178.66 1ynf h GLN 415 N 0.00 0.49 -0.56 0.86 4.15 -1.95 -1.52 115.11 116.57 1ynf h GLN 415 Ca 0.02 -0.28 -0.04 0.00 0.77 0.00 0.00 58.65 59.12 1ynf h GLN 415 Cb 0.12 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.80 1ynf h GLN 415 CO -0.00 0.87 0.19 1.25 -1.93 0.00 0.00 178.83 179.21 1ynf h LEU 416 N 0.39 0.80 0.03 -2.39 5.85 -1.59 -0.36 115.31 118.04 1ynf h LEU 416 Ca 0.02 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.57 1ynf h LEU 416 Cb 0.99 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.79 1ynf h LEU 416 CO 0.09 0.78 -0.15 0.25 -0.34 0.00 0.00 178.44 179.07 1ynf h LEU 417 N 0.78 -0.42 -0.85 2.25 5.85 -1.27 -0.90 115.31 120.74 1ynf h LEU 417 Ca 0.18 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 1ynf h LEU 417 Cb 0.25 0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 1ynf h LEU 417 CO -0.01 -0.21 0.51 0.03 -0.34 0.00 0.00 178.44 178.42 1ynf h ARG 418 N -0.26 1.16 -0.24 1.25 2.47 -1.06 -1.65 114.38 116.05 1ynf h ARG 418 Ca 0.04 -0.11 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1ynf h ARG 418 Cb 0.31 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.38 1ynf h ARG 418 CO -0.13 0.82 0.15 0.93 0.56 0.00 0.00 179.97 182.30 1ynf h GLU 419 N 1.17 0.32 -0.47 0.04 5.08 -0.77 -2.12 114.58 117.83 1ynf h GLU 419 Ca 0.31 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.60 1ynf h GLU 419 Cb -0.04 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1ynf h GLU 419 CO -0.06 0.22 0.12 0.78 -1.00 0.00 0.00 179.01 179.07 1ynf h GLY 420 N 0.31 0.75 0.70 -3.84 0.00 -0.83 -0.64 103.07 99.52 1ynf h GLY 420 Ca 0.09 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1ynf h GLY 420 CO -0.02 0.38 -0.02 3.21 0.00 0.00 0.00 176.54 180.09 1ynf h ARG 421 N 0.68 0.16 -0.25 4.80 2.47 -1.07 -1.42 114.38 119.75 1ynf h ARG 421 Ca 0.15 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.80 1ynf h ARG 421 Cb 0.24 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.54 1ynf h ARG 421 CO -0.00 0.48 0.12 1.49 0.56 0.00 0.00 179.97 182.62 1ynf h GLU 422 N -0.17 0.35 -0.32 0.04 4.81 -1.26 -1.08 114.58 116.96 1ynf h GLU 422 Ca 0.02 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.27 1ynf h GLU 422 Cb 0.42 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.67 1ynf h GLU 422 CO 0.01 0.35 -0.15 0.00 -0.73 0.00 0.00 179.01 178.49 1ynf h ALA 423 N 0.99 0.11 -0.17 2.92 0.00 -1.08 0.19 119.26 122.23 1ynf h ALA 423 Ca 0.09 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 1ynf h ALA 423 Cb 0.11 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1ynf h ALA 423 CO -0.01 -0.53 -0.20 -0.07 0.00 0.00 0.00 179.25 178.44 1ynf h LEU 424 N -0.10 0.28 -0.43 0.00 3.38 -1.07 0.33 115.31 117.69 1ynf h LEU 424 Ca 0.16 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1ynf h LEU 424 Cb 0.35 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1ynf h LEU 424 CO -0.38 0.49 -0.15 -0.78 0.09 0.00 0.00 178.44 177.70 1ynf h ASP 425 N 0.26 0.88 -0.43 -0.43 3.58 -0.25 -0.68 116.42 119.36 1ynf h ASP 425 Ca 0.05 -0.38 -0.12 0.00 0.42 0.00 0.00 57.03 57.00 1ynf h ASP 425 Cb 0.51 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.30 1ynf h ASP 425 CO 0.03 1.06 -0.19 0.58 -2.88 0.00 0.00 179.24 177.85 1ynf h VAL 426 N 0.69 1.28 -0.68 2.25 2.07 -0.64 -2.99 116.25 118.22 1ynf h VAL 426 Ca 0.10 -1.33 -0.04 0.00 0.82 0.00 0.00 66.70 66.25 1ynf h VAL 426 Cb 0.71 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1ynf h VAL 426 CO 0.05 0.45 0.25 0.25 0.02 0.00 0.00 177.57 178.60 1ynf h LEU 427 N 0.71 0.93 -1.97 2.57 5.85 -0.80 -1.27 115.31 121.33 1ynf h LEU 427 Ca 0.10 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1ynf h LEU 427 Cb 0.75 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.54 1ynf h LEU 427 CO 0.06 0.84 -0.10 0.77 -0.34 0.00 0.00 178.44 179.67 1ynf h SER 428 N 0.98 0.00 0.05 1.25 4.64 -1.00 0.13 113.55 119.61 1ynf h SER 428 Ca 0.23 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.45 1ynf h SER 428 Cb 0.21 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1ynf h SER 428 CO -0.02 0.10 -0.41 1.56 -0.87 0.00 0.00 176.83 177.19 1ynf h GLN 429 N 0.00 0.19 -0.79 4.77 4.20 -1.22 0.81 115.11 123.07 1ynf h GLN 429 Ca -0.00 -0.27 0.03 0.00 0.06 0.00 0.00 58.65 58.47 1ynf h GLN 429 Cb 0.21 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.03 1ynf h GLN 429 CO 0.01 1.07 0.50 1.25 -0.67 0.00 0.00 178.83 181.00 1ynf h LEU 430 N -0.56 0.83 -0.99 1.46 5.85 -0.52 -1.77 115.31 119.61 1ynf h LEU 430 Ca -0.07 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1ynf h LEU 430 Cb 1.26 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1ynf h LEU 430 CO 0.08 0.57 0.00 0.18 -0.34 0.00 0.00 178.44 178.93 1ynf n LEU 431 N -4.60 1.48 -3.71 2.25 4.77 0.40 -4.94 117.00 112.65 1ynf n LEU 431 Ca 0.09 -0.63 -0.24 0.00 -0.03 0.00 0.00 56.01 55.21 1ynf n LEU 431 Cb 0.09 -0.10 0.03 0.00 -2.33 0.00 0.00 43.42 41.10 1ynf n LEU 431 CO 0.34 0.31 -0.09 -3.20 -1.33 0.00 0.00 177.39 173.42 1ynf n ASN 432 N 0.21 -2.31 -0.00 -1.43 5.15 -0.67 -4.61 115.26 111.60 1ynf n ASN 432 Ca 0.15 -0.89 0.06 0.00 -0.60 0.00 0.00 54.58 53.31 1ynf n ASN 432 Cb 0.29 -3.81 -0.08 0.00 -0.53 0.00 0.00 39.78 35.66 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 -4.20 0.50 0.00 1.20 4.77 0.25 -5.01 117.00 114.51 1ynf n LEU 433 Ca -0.24 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.33 1ynf n LEU 433 Cb 0.66 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1ynf n LEU 433 CO 0.69 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 1ynf n GLY 434 N 1.39 -0.76 3.35 -0.72 0.00 -1.20 -4.13 105.19 103.11 1ynf n GLY 434 Ca 0.02 -1.15 -0.41 0.00 0.00 0.00 0.00 46.02 44.48 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 -1.05 4.31 0.10 1.61 7.64 -1.26 -4.68 113.62 120.29 1ynf n SER 435 Ca 0.00 -2.86 0.12 0.00 1.01 0.00 0.00 58.87 57.14 1ynf n SER 435 Cb 0.00 -1.69 0.03 0.00 -1.01 0.00 0.00 64.21 61.54 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 5.20 0.00 -2.97 0.44 3.04 -1.94 -3.45 116.25 116.56 1ynf h VAL 436 Ca 0.45 -0.88 -0.58 0.00 -1.01 0.00 0.00 66.70 64.67 1ynf h VAL 436 Cb 0.81 1.40 -0.03 0.00 -2.01 0.00 0.00 31.29 31.46 1ynf h VAL 436 CO 1.56 0.00 -0.39 -0.31 -1.01 0.00 0.00 177.57 177.42 1ynf s TYR 437 N -3.32 3.49 0.23 3.17 1.51 -1.26 -4.80 117.35 116.38 1ynf s TYR 437 Ca 0.01 0.38 -0.06 0.00 -1.01 0.00 0.00 57.07 56.39 1ynf s TYR 437 Cb 0.10 -1.87 0.39 0.00 -0.11 0.00 0.00 41.96 40.48 1ynf s TYR 437 CO 0.78 0.48 1.73 -1.35 -1.11 0.00 0.00 175.55 176.08 1ynf h PRO 438 N 2.70 0.40 0.00 -1.71 0.11 -2.00 -0.67 132.00 130.82 1ynf h PRO 438 Ca -0.46 -0.02 -0.00 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 -0.02 0.27 -0.21 0.00 0.00 178.00 179.03 1ynf h PHE 439 N 0.41 0.00 -0.00 0.65 -5.15 -1.99 -0.39 116.94 110.46 1ynf h PHE 439 Ca 0.38 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.15 1ynf h PHE 439 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.72 1ynf h PHE 439 CO -0.18 0.02 -0.18 1.04 -2.00 0.00 0.00 178.31 177.01 1ynf n GLN 440 N -3.36 0.62 0.00 6.09 6.02 -0.27 -5.19 117.38 121.29 1ynf n GLN 440 Ca -0.02 -0.27 0.09 0.00 -0.01 0.00 0.00 57.00 56.79 1ynf n GLN 440 Cb 0.13 -1.49 0.08 0.00 1.02 0.00 0.00 30.24 29.97 1ynf n GLN 440 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59