#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 3.08 0.15 -2.53 0.00 -1.26 -4.07 121.76 117.12 1ynf s ALA 3 Ca 0.00 0.80 0.08 0.00 0.00 0.00 0.00 51.96 52.84 1ynf s ALA 3 Cb 0.00 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 1ynf s ALA 3 CO 0.00 -0.36 -0.18 -1.58 0.00 0.00 0.00 175.76 173.64 1ynf s TRP 4 N -1.59 1.76 -0.21 0.00 0.51 -0.26 -4.21 118.94 114.94 1ynf s TRP 4 Ca 0.59 -0.47 -0.20 0.00 -2.12 0.00 0.00 56.10 53.90 1ynf s TRP 4 Cb -0.25 -0.90 -0.03 0.00 -0.81 0.00 0.00 33.47 31.49 1ynf s TRP 4 CO 0.31 0.28 0.60 -2.00 -0.51 0.00 0.00 176.95 175.63 1ynf s GLU 5 N -2.62 4.17 -0.17 4.98 2.12 -1.26 -0.50 118.70 125.43 1ynf s GLU 5 Ca 0.13 0.54 -0.03 0.00 0.36 0.00 0.00 54.97 55.96 1ynf s GLU 5 Cb -0.06 -3.60 -0.02 0.00 0.26 0.00 0.00 34.13 30.71 1ynf s GLU 5 CO 0.06 -0.27 -0.05 0.08 -0.54 0.00 0.00 175.26 174.54 1ynf s VAL 6 N 2.01 3.70 -0.16 3.70 1.01 -0.15 -4.43 120.40 126.08 1ynf s VAL 6 Ca 0.27 -0.42 -0.21 0.00 0.00 0.00 0.00 61.98 61.61 1ynf s VAL 6 Cb -0.16 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 1ynf s VAL 6 CO 0.10 0.48 0.65 0.20 0.00 0.00 0.00 175.10 176.52 1ynf s ASN 7 N 0.60 6.77 -0.28 3.32 0.01 -0.59 -1.09 114.94 123.67 1ynf s ASN 7 Ca -0.03 0.93 -0.05 0.00 -0.71 0.00 0.00 52.86 53.00 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 -0.23 0.04 -0.36 -1.51 0.00 0.00 177.10 175.07 1ynf s PHE 8 N 1.58 3.13 0.12 2.20 0.40 -0.37 0.28 117.98 125.33 1ynf s PHE 8 Ca 0.31 -1.15 0.03 0.00 -0.60 0.00 0.00 56.93 55.51 1ynf s PHE 8 Cb -0.16 -2.20 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 1ynf s PHE 8 CO 0.12 -0.62 0.20 -0.51 0.70 0.00 0.00 175.22 175.11 1ynf s ASP 9 N 1.45 6.05 -0.21 1.36 1.11 -0.62 -0.07 116.67 125.73 1ynf s ASP 9 Ca 0.02 0.10 -0.20 0.00 0.18 0.00 0.00 52.55 52.65 1ynf s ASP 9 Cb -0.17 -1.76 -0.03 0.00 1.07 0.00 0.00 42.92 42.03 1ynf s ASP 9 CO 0.01 0.10 0.59 -0.83 1.18 0.00 0.00 175.17 176.22 1ynf s GLY 10 N -2.91 2.02 -0.37 0.21 0.00 -0.70 -0.04 107.32 105.52 1ynf s GLY 10 Ca 0.33 -0.34 -0.29 0.00 0.00 0.00 0.00 44.72 44.42 1ynf s GLY 10 CO 0.26 1.25 1.23 -2.27 0.00 0.00 0.00 173.10 173.58 1ynf s LEU 11 N 1.91 3.77 0.18 0.66 2.96 -0.02 -4.90 118.68 123.23 1ynf s LEU 11 Ca 0.27 0.90 -0.33 0.00 -0.22 0.00 0.00 54.13 54.75 1ynf s LEU 11 Cb -0.16 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 42.85 1ynf s LEU 11 CO 0.10 -1.16 1.41 0.52 -1.32 0.00 0.00 176.35 175.91 1ynf n VAL 12 N 6.48 0.46 -1.59 1.68 0.31 -1.26 -3.39 118.33 121.01 1ynf n VAL 12 Ca 0.14 -0.11 -0.30 0.00 -0.01 0.00 0.00 64.34 64.05 1ynf n VAL 12 Cb 0.48 -1.28 0.09 0.00 -0.91 0.00 0.00 33.84 32.21 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 0.48 1.62 0.51 2.92 0.00 -1.26 -4.73 107.32 106.86 1ynf s GLY 13 Ca 0.75 -0.23 0.22 0.00 0.00 0.00 0.00 44.72 45.46 1ynf s GLY 13 CO 0.46 0.19 2.09 -2.00 0.00 0.00 0.00 173.10 173.84 1ynf h LEU 14 N -1.04 0.00 -2.17 0.66 5.85 -1.93 -3.03 115.31 113.66 1ynf h LEU 14 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1ynf h LEU 14 Cb 1.27 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.30 1ynf h LEU 14 CO 0.60 0.11 0.00 0.35 -0.34 0.00 0.00 178.44 179.16 1ynf n THR 15 N -4.04 1.03 -1.70 1.05 -2.24 -1.26 -4.81 114.28 102.31 1ynf n THR 15 Ca -0.02 -0.78 -0.60 0.00 -2.27 0.00 0.00 64.05 60.37 1ynf n THR 15 Cb 0.19 0.17 -0.08 0.00 -2.10 0.00 0.00 70.33 68.52 1ynf n THR 15 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1ynf n HIS 16 N 0.89 1.84 -3.92 4.78 -0.00 -1.15 -4.50 115.22 113.16 1ynf n HIS 16 Ca 0.18 0.76 -0.08 0.00 -0.00 0.00 0.00 57.72 58.58 1ynf n HIS 16 Cb 0.57 -2.36 -0.03 0.00 -0.00 0.00 0.00 29.99 28.17 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 2.90 0.08 -0.20 1.57 -3.43 -1.26 -4.53 115.29 110.42 1ynf s HIS 17 Ca 0.99 -0.51 -0.06 0.00 -0.80 0.00 0.00 55.06 54.68 1ynf s HIS 17 Cb -1.20 0.50 -0.03 0.00 -1.43 0.00 0.00 32.58 30.42 1ynf s HIS 17 CO 0.68 -1.17 0.02 0.71 -2.00 0.00 0.00 174.74 172.98 1ynf s TYR 18 N -3.81 3.08 -0.08 0.38 4.12 -1.26 -4.92 117.35 114.85 1ynf s TYR 18 Ca 0.16 -0.34 0.20 0.00 0.02 0.00 0.00 57.07 57.11 1ynf s TYR 18 Cb -0.04 -2.09 0.41 0.00 -1.52 0.00 0.00 41.96 38.73 1ynf s TYR 18 CO 0.09 -0.16 1.18 0.00 0.02 0.00 0.00 175.55 176.68 1ynf n ALA 19 N 4.12 2.84 -0.94 3.71 0.00 -1.26 -4.65 120.51 124.33 1ynf n ALA 19 Ca -0.17 -2.68 0.00 0.00 0.00 0.00 0.00 53.44 50.59 1ynf n ALA 19 Cb 0.52 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 19.39 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 -0.16 0.00 0.49 0.00 -0.00 -1.26 -5.13 115.22 109.16 1ynf n HIS 31 Ca 0.11 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.95 1ynf n HIS 31 Cb 0.96 -0.32 0.22 0.00 -0.00 0.00 0.00 29.99 30.85 1ynf n HIS 31 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1ynf n ARG 32 N -1.26 2.41 -1.93 -1.40 1.74 -1.26 -5.01 116.66 109.95 1ynf n ARG 32 Ca 0.00 -2.12 -0.40 0.00 -0.77 0.00 0.00 57.85 54.56 1ynf n ARG 32 Cb 0.00 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 29.95 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 -1.59 2.64 -0.01 -1.55 0.40 -1.26 -4.93 117.98 111.68 1ynf s PHE 33 Ca 0.37 1.35 0.00 0.00 -0.60 0.00 0.00 56.93 58.05 1ynf s PHE 33 Cb 0.22 -3.78 -0.00 0.00 0.51 0.00 0.00 43.02 39.97 1ynf s PHE 33 CO 0.31 -2.49 0.01 0.94 0.70 0.00 0.00 175.22 174.69 1ynf n GLN 34 N -0.07 3.15 -3.67 0.44 7.27 -1.26 -4.86 117.38 118.37 1ynf n GLN 34 Ca 0.05 -0.00 -0.37 0.00 0.07 0.00 0.00 57.00 56.74 1ynf n GLN 34 Cb 0.43 -0.78 -0.11 0.00 2.41 0.00 0.00 30.24 32.18 1ynf n GLN 34 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 1ynf s VAL 35 N -1.57 4.94 0.32 1.69 1.01 -1.26 -4.48 120.40 121.05 1ynf s VAL 35 Ca -0.00 0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.09 1ynf s VAL 35 Cb 0.00 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 1ynf s VAL 35 CO 0.01 0.29 0.29 -0.94 0.00 0.00 0.00 175.10 174.75 1ynf s SER 36 N 1.63 5.37 -0.57 3.32 1.04 -0.04 -4.90 113.70 119.56 1ynf s SER 36 Ca 0.07 -0.43 0.04 0.00 0.48 0.00 0.00 55.95 56.10 1ynf s SER 36 Cb -0.15 -1.06 0.15 0.00 0.10 0.00 0.00 66.02 65.06 1ynf s SER 36 CO 0.08 -0.30 0.37 0.21 0.98 0.00 0.00 173.24 174.57 1ynf s ASN 37 N -3.98 3.99 0.19 7.02 3.84 -1.26 -1.33 114.94 123.41 1ynf s ASN 37 Ca 0.40 -3.30 -0.14 0.00 0.21 0.00 0.00 52.86 50.03 1ynf s ASN 37 Cb -0.06 -1.34 0.18 0.00 -0.55 0.00 0.00 41.25 39.48 1ynf s ASN 37 CO 0.27 -0.17 1.68 -0.65 -2.79 0.00 0.00 177.10 175.43 1ynf h PRO 38 N 5.96 0.09 -0.24 0.43 0.11 -1.79 -0.39 132.00 136.17 1ynf h PRO 38 Ca 0.08 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.23 1ynf h PRO 38 Cb 0.84 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.89 1ynf h PRO 38 CO 0.61 0.06 -0.02 -0.09 -0.21 0.00 0.00 178.00 178.35 1ynf h ARG 39 N 0.09 0.04 -0.40 1.05 2.43 -1.66 -1.30 114.38 114.63 1ynf h ARG 39 Ca 0.25 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.35 1ynf h ARG 39 Cb 0.38 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 1ynf h ARG 39 CO -0.44 0.03 -0.05 1.25 -1.51 0.00 0.00 179.97 179.25 1ynf h LEU 40 N 0.04 0.63 -0.59 3.80 5.85 -1.73 -1.45 115.31 121.86 1ynf h LEU 40 Ca 0.11 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1ynf h LEU 40 Cb 0.16 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1ynf h LEU 40 CO -0.21 0.74 0.34 0.00 -0.34 0.00 0.00 178.44 178.96 1ynf h ALA 41 N 1.33 0.76 -0.24 1.25 0.00 -0.41 -0.02 119.26 121.94 1ynf h ALA 41 Ca 0.12 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1ynf h ALA 41 Cb 0.46 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1ynf h ALA 41 CO 0.02 0.26 -0.12 0.00 0.00 0.00 0.00 179.25 179.41 1ynf h ALA 42 N 1.17 0.34 -0.65 0.00 0.00 -0.99 -2.72 119.26 116.39 1ynf h ALA 42 Ca 0.21 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1ynf h ALA 42 Cb 0.01 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1ynf h ALA 42 CO -0.04 0.20 0.42 0.87 0.00 0.00 0.00 179.25 180.70 1ynf h LYS 43 N 0.22 0.82 -0.96 0.00 1.79 -1.07 0.25 116.57 117.62 1ynf h LYS 43 Ca 0.05 -0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1ynf h LYS 43 Cb 0.62 -0.19 -0.05 0.00 -1.58 0.00 0.00 32.23 31.04 1ynf h LYS 43 CO 0.04 0.54 0.59 1.96 -1.08 0.00 0.00 179.45 181.50 1ynf h GLN 44 N 0.85 1.30 -0.38 3.15 4.20 -0.99 0.13 115.11 123.37 1ynf h GLN 44 Ca 0.25 -0.11 -0.16 0.00 0.06 0.00 0.00 58.65 58.69 1ynf h GLN 44 Cb -0.05 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.45 1ynf h GLN 44 CO -0.08 0.90 -0.37 0.78 -0.67 0.00 0.00 178.83 179.39 1ynf h GLY 45 N 1.32 1.01 1.21 3.46 0.00 -1.07 -2.75 103.07 106.26 1ynf h GLY 45 Ca 0.35 -1.03 -0.08 0.00 0.00 0.00 0.00 47.33 46.57 1ynf h GLY 45 CO -0.07 0.93 0.05 1.41 0.00 0.00 0.00 176.54 178.87 1ynf h LEU 46 N 0.75 0.92 -0.47 3.11 3.38 -0.59 -2.90 115.31 119.51 1ynf h LEU 46 Ca 0.06 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.82 1ynf h LEU 46 Cb 0.97 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 1ynf h LEU 46 CO 0.09 0.95 0.29 0.25 0.09 0.00 0.00 178.44 180.12 1ynf h LEU 47 N 0.90 0.49 -1.43 1.67 5.85 -0.89 0.43 115.31 122.33 1ynf h LEU 47 Ca 0.17 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1ynf h LEU 47 Cb 0.45 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1ynf h LEU 47 CO 0.02 0.35 0.00 1.17 -0.34 0.00 0.00 178.44 179.64 1ynf n LYS 48 N -4.79 0.11 0.00 1.25 4.81 -1.04 -1.20 118.16 117.29 1ynf n LYS 48 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 1ynf n LYS 48 Cb 0.05 -1.22 0.00 0.00 0.02 0.00 0.00 35.03 33.88 1ynf n LYS 48 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1ynf n LYS 50 N 0.66 0.00 -0.14 1.64 3.00 0.14 -2.03 118.16 121.43 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 0.02 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 0.55 -0.57 3.14 0.00 -1.40 0.24 119.26 121.21 1ynf h ALA 51 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1ynf h ALA 51 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1ynf h ALA 51 CO 0.00 -0.09 -0.07 -0.07 0.00 0.00 0.00 179.25 179.02 1ynf h LEU 52 N 0.49 1.05 0.02 0.00 3.38 -1.66 -1.06 115.31 117.53 1ynf h LEU 52 Ca 0.18 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.83 1ynf h LEU 52 Cb 0.05 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1ynf h LEU 52 CO -0.10 1.14 -0.06 0.00 0.09 0.00 0.00 178.44 179.50 1ynf h ALA 53 N 0.95 -0.08 -0.76 1.53 0.00 -1.50 -1.45 119.26 117.95 1ynf h ALA 53 Ca 0.15 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.14 1ynf h ALA 53 Cb 0.64 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 1ynf h ALA 53 CO 0.04 -0.56 0.50 -0.44 0.00 0.00 0.00 179.25 178.79 1ynf h ASP 54 N -0.12 0.68 0.16 0.00 3.32 -0.34 -0.49 116.42 119.64 1ynf h ASP 54 Ca 0.02 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ynf h ASP 54 Cb 0.14 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ynf h ASP 54 CO -0.05 0.43 0.00 0.00 -1.72 0.00 0.00 179.24 177.90 1ynf n ALA 55 N -2.44 2.33 0.00 3.45 0.00 -0.42 -4.87 120.51 118.56 1ynf n ALA 55 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1ynf n ALA 55 Cb 0.25 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.31 1ynf n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ynf n GLY 56 N 0.59 0.79 3.54 0.00 0.00 -0.19 -5.07 105.19 104.85 1ynf n GLY 56 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1ynf n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ynf s PHE 57 N -2.00 3.19 -0.15 1.61 0.40 -0.61 -5.01 117.98 115.42 1ynf s PHE 57 Ca 0.00 0.03 -0.41 0.00 -0.60 0.00 0.00 56.93 55.96 1ynf s PHE 57 Cb 0.00 -2.80 -0.18 0.00 0.51 0.00 0.00 43.02 40.55 1ynf s PHE 57 CO 0.00 -0.50 1.41 -2.30 0.70 0.00 0.00 175.22 174.52 1ynf n PRO 58 N 5.56 0.56 -4.16 0.24 -0.02 -1.26 -3.75 135.00 132.17 1ynf n PRO 58 Ca -0.07 0.20 -0.15 0.00 -2.02 0.00 0.00 63.50 61.46 1ynf n PRO 58 Cb 0.49 -1.78 -0.13 0.00 -0.02 0.00 0.00 33.50 32.05 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 1.56 0.53 0.32 -0.52 2.00 -1.26 -1.55 119.66 120.74 1ynf s GLN 59 Ca 0.94 -0.45 0.02 0.00 -2.00 0.00 0.00 55.36 53.86 1ynf s GLN 59 Cb -1.19 -0.44 -0.02 0.00 0.80 0.00 0.00 33.01 32.16 1ynf s GLN 59 CO 0.62 0.11 0.36 0.00 -0.50 0.00 0.00 175.29 175.87 1ynf s ALA 60 N -0.64 1.25 0.06 1.58 0.00 0.14 -4.85 121.76 119.31 1ynf s ALA 60 Ca -0.02 -1.76 0.02 0.00 0.00 0.00 0.00 51.96 50.20 1ynf s ALA 60 Cb -0.05 1.31 -0.03 0.00 0.00 0.00 0.00 23.12 24.35 1ynf s ALA 60 CO 0.00 -0.72 -0.08 0.54 0.00 0.00 0.00 175.76 175.50 1ynf s VAL 61 N -3.35 0.63 -0.09 0.00 0.11 -0.29 -1.59 120.40 115.82 1ynf s VAL 61 Ca 0.35 -1.41 0.02 0.00 -2.93 0.00 0.00 61.98 58.02 1ynf s VAL 61 Cb 0.01 -1.02 0.02 0.00 -1.53 0.00 0.00 36.38 33.86 1ynf s VAL 61 CO 0.22 -0.55 -0.12 -0.63 -3.33 0.00 0.00 175.10 170.68 1ynf s ILE 62 N -2.20 1.23 0.82 7.04 1.01 0.94 -4.83 121.20 125.21 1ynf s ILE 62 Ca -0.02 -0.50 -0.11 0.00 0.00 0.00 0.00 60.65 60.02 1ynf s ILE 62 Cb -0.04 -1.15 0.08 0.00 0.01 0.00 0.00 42.46 41.36 1ynf s ILE 62 CO -0.01 0.39 1.09 -2.16 0.00 0.00 0.00 174.94 174.24 1ynf s PRO 63 N 0.93 1.89 1.12 2.79 0.04 -1.26 -0.84 135.00 139.67 1ynf s PRO 63 Ca -0.09 0.99 -0.18 0.00 0.04 0.00 0.00 61.00 61.75 1ynf s PRO 63 Cb -0.15 -1.87 0.26 0.00 0.04 0.00 0.00 34.50 32.78 1ynf s PRO 63 CO 0.00 -1.85 1.19 -1.25 0.04 0.00 0.00 177.00 175.13 1ynf s PRO 64 N -4.94 -0.58 0.46 0.56 0.04 -1.22 -4.73 135.00 124.59 1ynf s PRO 64 Ca 0.62 -0.20 0.07 0.00 0.04 0.00 0.00 61.00 61.53 1ynf s PRO 64 Cb -0.17 -1.68 -0.01 0.00 0.04 0.00 0.00 34.50 32.68 1ynf s PRO 64 CO 0.56 -3.26 0.36 -1.01 0.04 0.00 0.00 177.00 173.69 1ynf s HIS 65 N -3.32 2.31 -0.33 0.56 3.76 -1.26 -5.04 115.29 111.97 1ynf s HIS 65 Ca 0.72 -0.63 -0.28 0.00 -0.15 0.00 0.00 55.06 54.72 1ynf s HIS 65 Cb -0.07 -2.05 -0.02 0.00 1.11 0.00 0.00 32.58 31.54 1ynf s HIS 65 CO 0.55 -0.20 1.83 -2.00 -0.85 0.00 0.00 174.74 174.07 1ynf s GLU 66 N -4.15 3.30 -0.05 1.40 2.12 -1.26 -4.93 118.70 115.14 1ynf s GLU 66 Ca 0.43 1.46 -0.02 0.00 0.36 0.00 0.00 54.97 57.19 1ynf s GLU 66 Cb -0.02 -4.21 0.03 0.00 0.26 0.00 0.00 34.13 30.19 1ynf s GLU 66 CO 0.25 -1.90 0.11 1.03 -0.54 0.00 0.00 175.26 174.21 1ynf s ARG 67 N 5.74 0.06 0.70 4.30 1.81 -1.26 -3.60 118.95 126.70 1ynf s ARG 67 Ca 0.81 0.27 -0.16 0.00 -1.72 0.00 0.00 55.73 54.93 1ynf s ARG 67 Cb -0.23 -0.14 0.02 0.00 -0.45 0.00 0.00 34.95 34.15 1ynf s ARG 67 CO 0.33 -0.13 1.26 -2.14 -0.68 0.00 0.00 175.30 173.94 1ynf s PRO 68 N 0.87 2.27 -0.86 3.54 0.02 -1.26 -4.84 135.00 134.74 1ynf s PRO 68 Ca -0.07 1.93 -0.14 0.00 0.02 0.00 0.00 61.00 62.74 1ynf s PRO 68 Cb -0.09 -1.83 0.21 0.00 0.02 0.00 0.00 34.50 32.81 1ynf s PRO 68 CO -0.04 -1.78 0.83 0.12 -0.33 0.00 0.00 177.00 175.80 1ynf s PHE 69 N -1.68 3.72 0.25 6.54 5.36 0.44 -4.92 117.98 127.68 1ynf s PHE 69 Ca 0.79 -1.97 -0.05 0.00 -0.96 0.00 0.00 56.93 54.74 1ynf s PHE 69 Cb -0.34 -3.87 0.32 0.00 -0.34 0.00 0.00 43.02 38.79 1ynf s PHE 69 CO 0.43 -1.04 1.88 0.82 -1.46 0.00 0.00 175.22 175.85 1ynf h ILE 70 N 4.83 1.13 -1.02 3.12 1.08 -1.88 -3.10 117.51 121.67 1ynf h ILE 70 Ca 0.12 -0.39 0.25 0.00 -0.39 0.00 0.00 64.86 64.45 1ynf h ILE 70 Cb 1.03 -0.12 -0.11 0.00 -3.07 0.00 0.00 36.82 34.55 1ynf h ILE 70 CO 0.80 0.21 0.63 -0.65 -0.69 0.00 0.00 178.15 178.45 1ynf h PRO 71 N 1.14 0.49 0.00 2.37 0.11 -1.99 0.13 132.00 134.25 1ynf h PRO 71 Ca 0.38 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 66.35 1ynf h PRO 71 Cb 0.06 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.04 1ynf h PRO 71 CO -0.14 0.33 -0.53 -0.24 -0.21 0.00 0.00 178.00 177.20 1ynf h VAL 72 N 0.51 1.19 -0.21 3.15 3.04 -1.97 -2.14 116.25 119.82 1ynf h VAL 72 Ca 0.62 -1.96 -0.10 0.00 -1.01 0.00 0.00 66.70 64.24 1ynf h VAL 72 Cb 1.34 2.12 -0.01 0.00 -2.01 0.00 0.00 31.29 32.72 1ynf h VAL 72 CO -0.39 0.52 -0.31 -0.07 -1.01 0.00 0.00 177.57 176.32 1ynf h LEU 73 N 0.00 0.43 -0.63 3.16 3.38 -0.87 -1.49 115.31 119.29 1ynf h LEU 73 Ca -0.01 -0.16 -0.13 0.00 0.09 0.00 0.00 57.88 57.68 1ynf h LEU 73 Cb 1.08 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 1ynf h LEU 73 CO 0.07 0.72 -0.34 0.03 0.09 0.00 0.00 178.44 179.01 1ynf h ARG 74 N 0.36 0.70 0.00 1.13 3.08 -1.06 -2.10 114.38 116.50 1ynf h ARG 74 Ca 0.05 -0.33 -0.03 0.00 0.07 0.00 0.00 59.98 59.74 1ynf h ARG 74 Cb 0.73 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.77 1ynf h ARG 74 CO 0.06 0.94 -0.13 0.37 -1.07 0.00 0.00 179.97 180.14 1ynf h GLN 75 N 0.59 0.00 -0.03 0.04 4.15 -0.84 -1.19 115.11 117.83 1ynf h GLN 75 Ca 0.06 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.48 1ynf h GLN 75 Cb 0.86 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.55 1ynf h GLN 75 CO 0.07 0.13 0.00 1.28 -1.93 0.00 0.00 178.83 178.38 1ynf n LEU 76 N -4.12 0.73 0.00 -2.39 4.77 -0.61 -4.92 117.00 110.47 1ynf n LEU 76 Ca -0.02 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 1ynf n LEU 76 Cb 0.21 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1ynf n LEU 76 CO 0.33 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1ynf n GLY 77 N 1.03 0.64 3.62 -0.72 0.00 -0.45 -5.07 105.19 104.24 1ynf n GLY 77 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.98 -5.02 117.98 115.71 1ynf s PHE 78 Ca 0.00 0.46 0.07 0.00 -0.60 0.00 0.00 56.93 56.86 1ynf s PHE 78 Cb 0.00 -2.57 -0.01 0.00 0.51 0.00 0.00 43.02 40.95 1ynf s PHE 78 CO 0.00 -0.19 0.35 -1.54 0.70 0.00 0.00 175.22 174.54 1ynf s SER 79 N 1.52 4.85 0.00 1.36 1.04 -1.26 -3.89 113.70 117.31 1ynf s SER 79 Ca 0.16 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.68 1ynf s SER 79 Cb -0.16 -0.35 0.00 0.00 0.10 0.00 0.00 66.02 65.62 1ynf s SER 79 CO 0.09 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.19 1ynf n GLY 80 N -1.54 0.27 3.92 7.32 0.00 -1.26 -4.17 105.19 109.73 1ynf n GLY 80 Ca 0.02 -2.22 -0.27 0.00 0.00 0.00 0.00 46.02 43.56 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 5.24 0.29 1.61 1.04 -1.26 -4.76 113.70 111.86 1ynf s SER 81 Ca 0.00 0.64 0.03 0.00 0.48 0.00 0.00 55.95 57.10 1ynf s SER 81 Cb 0.00 -1.46 0.65 0.00 0.10 0.00 0.00 66.02 65.30 1ynf s SER 81 CO 0.00 -1.32 1.79 0.44 0.98 0.00 0.00 173.24 175.13 1ynf h ASP 82 N -0.40 0.77 0.21 7.02 3.32 -1.99 0.18 116.42 125.53 1ynf h ASP 82 Ca -0.45 0.08 -0.17 0.00 0.02 0.00 0.00 57.03 56.52 1ynf h ASP 82 Cb 1.28 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 1ynf h ASP 82 CO 0.61 0.32 -0.63 -0.33 -1.72 0.00 0.00 179.24 177.49 1ynf h GLU 83 N 0.80 0.41 -0.25 3.56 5.08 -1.99 -1.91 114.58 120.28 1ynf h GLU 83 Ca 0.53 -0.29 -0.10 0.00 -1.00 0.00 0.00 59.36 58.50 1ynf h GLU 83 Cb 0.74 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1ynf h GLU 83 CO -0.35 0.91 -0.23 1.96 -1.00 0.00 0.00 179.01 180.30 1ynf h GLN 84 N 0.30 0.61 -0.20 2.33 4.20 -1.50 -0.81 115.11 120.04 1ynf h GLN 84 Ca -0.01 -0.31 0.03 0.00 0.06 0.00 0.00 58.65 58.41 1ynf h GLN 84 Cb 1.18 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.94 1ynf h GLN 84 CO 0.11 0.91 0.02 0.28 -0.67 0.00 0.00 178.83 179.47 1ynf h VAL 85 N 0.32 0.89 -0.77 -0.54 2.07 -0.70 0.44 116.25 117.95 1ynf h VAL 85 Ca 0.04 -0.03 0.07 0.00 0.82 0.00 0.00 66.70 67.60 1ynf h VAL 85 Cb 0.79 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 1ynf h VAL 85 CO 0.06 0.02 0.45 -0.07 0.02 0.00 0.00 177.57 178.05 1ynf h LEU 86 N 0.09 0.69 -0.33 2.57 3.38 -1.22 0.01 115.31 120.50 1ynf h LEU 86 Ca 0.09 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.98 1ynf h LEU 86 Cb 0.10 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1ynf h LEU 86 CO -0.14 0.43 -0.20 -0.08 0.09 0.00 0.00 178.44 178.55 1ynf h GLU 87 N 0.82 0.71 -0.65 1.13 4.81 -0.31 -0.86 114.58 120.23 1ynf h GLU 87 Ca 0.35 -0.33 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1ynf h GLU 87 Cb 0.21 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 1ynf h GLU 87 CO -0.19 0.94 0.38 0.87 -0.73 0.00 0.00 179.01 180.27 1ynf h LYS 88 N 0.48 0.89 -0.38 1.92 1.57 0.39 -0.69 116.57 120.75 1ynf h LYS 88 Ca 0.07 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 1ynf h LYS 88 Cb 0.75 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1ynf h LYS 88 CO 0.06 0.66 -0.16 0.28 -0.57 0.00 0.00 179.45 179.71 1ynf h VAL 89 N 0.89 1.28 -0.66 0.50 2.07 -0.94 0.47 116.25 119.86 1ynf h VAL 89 Ca 0.23 -1.28 0.05 0.00 0.82 0.00 0.00 66.70 66.52 1ynf h VAL 89 Cb 0.01 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1ynf h VAL 89 CO -0.04 0.43 0.38 0.00 0.02 0.00 0.00 177.57 178.35 1ynf h ALA 90 N 0.81 0.88 0.02 1.67 0.00 -0.88 0.42 119.26 122.18 1ynf h ALA 90 Ca 0.09 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ynf h ALA 90 Cb 0.70 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1ynf h ALA 90 CO 0.05 0.08 -0.01 0.00 0.00 0.00 0.00 179.25 179.37 1ynf h ARG 91 N 0.71 -0.02 0.07 0.00 3.08 -0.94 -3.33 114.38 113.95 1ynf h ARG 91 Ca 0.29 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.23 1ynf h ARG 91 Cb 0.14 0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.20 1ynf h ARG 91 CO -0.16 0.71 -0.53 1.96 -1.07 0.00 0.00 179.97 180.88 1ynf h GLN 92 N -0.82 0.14 -1.49 0.04 4.20 -0.01 -3.43 115.11 113.74 1ynf h GLN 92 Ca -0.00 -0.24 -0.45 0.00 0.06 0.00 0.00 58.65 58.02 1ynf h GLN 92 Cb 0.75 0.09 -0.33 0.00 0.30 0.00 0.00 27.48 28.28 1ynf h GLN 92 CO 0.00 1.11 -0.97 0.00 -0.67 0.00 0.00 178.83 178.30 1ynf n ALA 93 N -2.72 1.39 0.28 3.87 0.00 0.42 -4.99 120.51 118.75 1ynf n ALA 93 Ca -0.14 -2.90 0.16 0.00 0.00 0.00 0.00 53.44 50.56 1ynf n ALA 93 Cb 0.66 -0.96 0.78 0.00 0.00 0.00 0.00 19.45 19.93 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 3.62 0.00 0.00 0.00 0.13 -0.42 -2.28 132.00 133.06 1ynf h PRO 94 Ca 0.03 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.14 1ynf h PRO 94 Cb 0.95 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.08 1ynf h PRO 94 CO 0.42 0.00 -0.09 1.12 -0.23 0.00 0.00 178.00 179.22 1ynf h HIS 95 N 0.00 0.00 0.00 1.56 2.07 -1.92 -2.09 115.15 114.76 1ynf h HIS 95 Ca 0.04 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.46 1ynf h HIS 95 Cb 0.80 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.77 1ynf h HIS 95 CO 0.00 0.09 -0.48 -1.49 -3.07 0.00 0.00 177.93 172.98 1ynf h TRP 96 N 0.00 0.00 -0.49 6.12 -0.00 -1.75 -3.18 115.95 116.65 1ynf h TRP 96 Ca -0.00 0.00 0.09 0.00 -0.00 0.00 0.00 58.89 58.97 1ynf h TRP 96 Cb 0.27 0.00 -0.07 0.00 -0.00 0.00 0.00 29.16 29.36 1ynf h TRP 96 CO 0.00 0.48 0.08 -0.07 -0.00 0.00 0.00 178.44 178.93 1ynf h LEU 97 N 0.00 -0.04 -0.53 -4.49 3.38 -1.57 -1.58 115.31 110.48 1ynf h LEU 97 Ca -0.00 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1ynf h LEU 97 Cb 0.90 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1ynf h LEU 97 CO 0.06 0.01 0.22 -1.28 0.09 0.00 0.00 178.44 177.54 1ynf h SER 98 N 0.21 0.72 0.18 -0.43 0.87 -1.69 -2.36 113.55 111.05 1ynf h SER 98 Ca 0.24 -0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 1ynf h SER 98 Cb 0.34 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1ynf h SER 98 CO -0.34 0.68 -0.05 0.28 -0.53 0.00 0.00 176.83 176.88 1ynf h SER 99 N 0.71 0.00 -0.39 6.23 0.02 -1.40 -2.23 113.55 116.49 1ynf h SER 99 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1ynf h SER 99 Cb 0.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1ynf h SER 99 CO -0.02 0.05 0.00 1.33 -1.14 0.00 0.00 176.83 177.05 1ynf n VAL 100 N -3.66 1.26 -1.46 2.27 0.24 -0.67 -4.40 118.33 111.92 1ynf n VAL 100 Ca -0.02 -1.16 0.06 0.00 -2.04 0.00 0.00 64.34 61.18 1ynf n VAL 100 Cb 0.15 0.35 0.08 0.00 -1.47 0.00 0.00 33.84 32.96 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 0.49 1.40 -4.77 -1.34 7.64 -0.85 -0.42 113.62 115.77 1ynf n SER 101 Ca 0.15 -2.66 -0.39 0.00 1.01 0.00 0.00 58.87 56.98 1ynf n SER 101 Cb 0.55 -0.34 -0.04 0.00 -1.01 0.00 0.00 64.21 63.36 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 -2.14 7.11 -0.13 6.43 0.15 -1.19 -4.58 113.70 119.35 1ynf s SER 102 Ca 0.20 2.12 0.10 0.00 0.70 0.00 0.00 55.95 59.07 1ynf s SER 102 Cb 0.17 -2.61 0.51 0.00 -1.71 0.00 0.00 66.02 62.39 1ynf s SER 102 CO 0.01 -0.25 1.32 0.00 1.20 0.00 0.00 173.24 175.52 1ynf n ALA 103 N 0.68 3.23 0.08 5.45 0.00 -1.26 -4.55 120.51 124.14 1ynf n ALA 103 Ca 0.01 -1.17 0.21 0.00 0.00 0.00 0.00 53.44 52.49 1ynf n ALA 103 Cb 0.47 -1.06 0.69 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 2.62 0.00 0.00 0.00 4.64 -1.94 -3.42 113.55 115.45 1ynf h SER 104 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1ynf h SER 104 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1ynf h SER 104 CO 0.26 0.00 1.00 -0.81 -0.87 0.00 0.00 176.83 176.41 1ynf n PRO 105 N -3.52 0.00 -1.34 4.77 -0.04 -1.26 -4.74 135.00 128.87 1ynf n PRO 105 Ca 0.09 -0.51 0.00 0.00 -0.04 0.00 0.00 63.50 63.04 1ynf n PRO 105 Cb 0.74 -2.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.20 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 5.08 0.00 0.67 0.54 8.01 -1.26 -4.88 117.44 125.60 1ynf n TRP 107 Ca 0.01 0.00 0.06 0.00 -1.31 0.00 0.00 57.50 56.27 1ynf n TRP 107 Cb 0.01 0.00 0.34 0.00 -2.01 0.00 0.00 31.31 29.65 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 -0.16 0.39 0.27 -0.99 0.24 -1.10 -1.89 118.33 115.09 1ynf n VAL 108 Ca 0.00 0.10 0.15 0.00 -2.04 0.00 0.00 64.34 62.54 1ynf n VAL 108 Cb 0.00 -0.90 0.70 0.00 -1.47 0.00 0.00 33.84 32.18 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 2.67 1.09 -0.05 2.33 0.00 -1.51 -1.79 119.26 122.00 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 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 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 -3.33 2.91 -0.21 0.00 4.13 -0.79 -1.05 115.26 116.93 1ynf n ASN 110 Ca -0.01 -1.96 -0.07 0.00 1.68 0.00 0.00 54.58 54.22 1ynf n ASN 110 Cb 0.29 -0.01 0.03 0.00 -1.54 0.00 0.00 39.78 38.55 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 4.67 0.77 -2.49 5.41 0.00 -1.46 -3.40 119.26 122.77 1ynf h ALA 111 Ca 0.00 -0.15 0.19 0.00 0.00 0.00 0.00 54.91 54.95 1ynf h ALA 111 Cb 0.96 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1ynf h ALA 111 CO 0.00 0.36 0.64 0.00 0.00 0.00 0.00 179.25 180.25 1ynf s ALA 112 N -5.62 -1.73 -0.10 0.00 0.00 -1.26 -1.61 121.76 111.45 1ynf s ALA 112 Ca -0.13 -0.30 0.02 0.00 0.00 0.00 0.00 51.96 51.55 1ynf s ALA 112 Cb 0.13 0.79 -0.01 0.00 0.00 0.00 0.00 23.12 24.03 1ynf s ALA 112 CO 0.79 -1.08 -0.18 0.99 0.00 0.00 0.00 175.76 176.28 1ynf s THR 113 N -2.10 2.65 -0.04 0.00 2.01 -0.52 -0.60 115.64 117.03 1ynf s THR 113 Ca 0.23 -0.82 -0.02 0.00 0.31 0.00 0.00 61.69 61.40 1ynf s THR 113 Cb -0.02 -2.06 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 1ynf s THR 113 CO 0.05 0.55 0.06 -0.63 -0.69 0.00 0.00 174.62 173.96 1ynf s ILE 114 N 0.16 4.70 -0.27 1.82 -1.09 -1.26 -1.93 121.20 123.33 1ynf s ILE 114 Ca -0.10 -0.29 -0.00 0.00 -2.23 0.00 0.00 60.65 58.02 1ynf s ILE 114 Cb -0.16 -3.09 0.08 0.00 -1.58 0.00 0.00 42.46 37.72 1ynf s ILE 114 CO 0.06 0.45 0.05 0.00 -1.23 0.00 0.00 174.94 174.27 1ynf s ALA 115 N -1.09 1.63 0.70 9.38 0.00 -0.20 -5.01 121.76 127.16 1ynf s ALA 115 Ca 0.19 -1.48 -0.16 0.00 0.00 0.00 0.00 51.96 50.51 1ynf s ALA 115 Cb -0.12 -1.52 0.02 0.00 0.00 0.00 0.00 23.12 21.50 1ynf s ALA 115 CO 0.09 -1.47 1.26 -2.14 0.00 0.00 0.00 175.76 173.50 1ynf s PRO 116 N 1.56 2.25 0.62 0.00 0.02 -1.26 -1.89 135.00 136.30 1ynf s PRO 116 Ca 0.04 1.95 0.38 0.00 0.02 0.00 0.00 61.00 63.40 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 -0.16 -1.80 2.17 0.66 -0.33 0.00 0.00 177.00 177.54 1ynf h SER 117 N 0.06 0.00 0.72 2.53 4.64 -1.82 -0.27 113.55 119.40 1ynf h SER 117 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1ynf h SER 117 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 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 1.91 0.27 5.18 0.00 -1.26 -3.17 120.51 121.45 1ynf n ALA 118 Ca -0.03 -0.06 0.03 0.00 0.00 0.00 0.00 53.44 53.39 1ynf n ALA 118 Cb 0.14 -1.33 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 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 -1.58 0.58 -4.87 0.00 10.43 -0.12 -4.15 116.55 116.84 1ynf n ASP 119 Ca 0.05 -0.79 -0.33 0.00 2.57 0.00 0.00 54.79 56.29 1ynf n ASP 119 Cb 0.24 0.76 -0.05 0.00 1.84 0.00 0.00 41.12 43.91 1ynf n ASP 119 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1ynf s THR 120 N -1.30 4.95 0.31 -3.53 -4.23 -1.19 -2.55 115.64 108.09 1ynf s THR 120 Ca 0.03 0.48 0.17 0.00 -1.18 0.00 0.00 61.69 61.20 1ynf s THR 120 Cb 0.05 -3.64 0.13 0.00 1.34 0.00 0.00 72.50 70.38 1ynf s THR 120 CO 0.20 0.01 1.82 -0.07 -0.54 0.00 0.00 174.62 176.04 1ynf h LEU 121 N 2.80 0.00 -3.03 4.79 3.38 -1.60 -2.99 115.31 118.66 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 0.35 0.00 -0.90 0.09 0.00 0.00 178.44 178.67 1ynf n ASP 122 N -3.81 3.83 -0.34 -0.43 5.75 -1.26 -4.97 116.55 115.32 1ynf n ASP 122 Ca -0.01 -2.34 -0.04 0.00 -0.01 0.00 0.00 54.79 52.38 1ynf n ASP 122 Cb 0.43 -0.43 -0.02 0.00 -1.03 0.00 0.00 41.12 40.06 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 0.64 0.53 3.82 6.12 0.00 -1.13 -5.00 105.19 110.17 1ynf n GLY 123 Ca 0.20 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 1ynf n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ynf s LYS 124 N -2.04 2.58 -0.12 1.61 1.02 -1.26 -4.76 119.74 116.77 1ynf s LYS 124 Ca 0.00 -1.42 -0.24 0.00 0.02 0.00 0.00 55.97 54.34 1ynf s LYS 124 Cb 0.00 -2.36 -0.03 0.00 -0.52 0.00 0.00 37.83 34.92 1ynf s LYS 124 CO 0.00 0.05 0.73 0.08 -0.92 0.00 0.00 175.35 175.29 1ynf s VAL 125 N -2.37 4.99 -0.08 3.17 1.01 -0.34 -3.95 120.40 122.82 1ynf s VAL 125 Ca 0.41 1.46 0.01 0.00 0.00 0.00 0.00 61.98 63.86 1ynf s VAL 125 Cb -0.04 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 1ynf s VAL 125 CO 0.25 0.15 -0.08 -1.00 0.00 0.00 0.00 175.10 174.43 1ynf s HIS 126 N 1.43 2.91 -0.10 5.22 3.76 -0.79 -0.22 115.29 127.50 1ynf s HIS 126 Ca 0.36 -0.10 -0.01 0.00 -0.15 0.00 0.00 55.06 55.16 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 0.22 -0.02 -0.51 -0.85 0.00 0.00 174.74 173.74 1ynf s LEU 127 N -0.55 0.84 -0.24 0.89 1.02 -0.39 -1.04 118.68 119.20 1ynf s LEU 127 Ca 0.08 -0.24 -0.05 0.00 0.02 0.00 0.00 54.13 53.94 1ynf s LEU 127 Cb -0.12 -0.57 -0.01 0.00 0.02 0.00 0.00 46.19 45.51 1ynf s LEU 127 CO 0.02 -0.19 0.02 -0.89 0.02 0.00 0.00 176.35 175.33 1ynf s THR 128 N 1.88 3.75 0.33 5.49 2.01 -0.81 -0.41 115.64 127.89 1ynf s THR 128 Ca 0.04 -0.46 -0.29 0.00 0.31 0.00 0.00 61.69 61.30 1ynf s THR 128 Cb -0.13 -2.78 -0.11 0.00 0.01 0.00 0.00 72.50 69.49 1ynf s THR 128 CO -0.06 0.32 1.52 -0.69 -0.69 0.00 0.00 174.62 175.02 1ynf s VAL 129 N 1.52 2.12 0.01 3.82 1.01 -0.76 -1.44 120.40 126.68 1ynf s VAL 129 Ca 0.05 0.11 -0.21 0.00 0.00 0.00 0.00 61.98 61.93 1ynf s VAL 129 Cb -0.15 -3.07 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 1ynf s VAL 129 CO -0.00 0.02 0.63 0.00 0.00 0.00 0.00 175.10 175.75 1ynf s ALA 130 N -0.57 3.47 0.35 5.51 0.00 -0.63 -3.67 121.76 126.22 1ynf s ALA 130 Ca 0.58 0.08 0.14 0.00 0.00 0.00 0.00 51.96 52.75 1ynf s ALA 130 Cb -0.47 -2.79 0.74 0.00 0.00 0.00 0.00 23.12 20.60 1ynf s ALA 130 CO 0.55 0.15 1.82 -2.95 0.00 0.00 0.00 175.76 175.33 1ynf h ASN 131 N 5.61 0.00 -6.43 0.00 7.08 -1.84 -3.41 115.58 116.59 1ynf h ASN 131 Ca -0.45 0.00 -0.49 0.00 -3.08 0.00 0.00 56.30 52.28 1ynf h ASN 131 Cb 1.20 0.00 -0.07 0.00 -2.08 0.00 0.00 38.32 37.37 1ynf h ASN 131 CO 0.70 0.37 -0.82 0.18 -2.08 0.00 0.00 177.43 175.78 1ynf n LEU 132 N -4.01 -2.34 0.22 6.14 4.77 -0.21 -4.33 117.00 117.24 1ynf n LEU 132 Ca -0.02 -0.91 0.06 0.00 -0.03 0.00 0.00 56.01 55.11 1ynf n LEU 132 Cb 0.42 -2.37 0.52 0.00 -2.33 0.00 0.00 43.42 39.66 1ynf n LEU 132 CO 0.38 0.40 0.92 -1.13 -1.33 0.00 0.00 177.39 176.64 1ynf h ASN 133 N -1.84 0.01 -0.87 -1.43 -0.73 -1.91 -2.99 115.58 105.82 1ynf h ASN 133 Ca -0.60 -0.00 0.07 0.00 1.87 0.00 0.00 56.30 57.64 1ynf h ASN 133 Cb 1.37 -0.00 -0.07 0.00 0.27 0.00 0.00 38.32 39.90 1ynf h ASN 133 CO 0.67 0.17 0.54 -1.13 -0.37 0.00 0.00 177.43 177.30 1ynf h ASN 134 N 0.01 0.83 -3.57 1.15 -0.73 -1.89 -3.40 115.58 107.98 1ynf h ASN 134 Ca 0.00 0.02 -0.65 0.00 1.87 0.00 0.00 56.30 57.54 1ynf h ASN 134 Cb 0.28 -0.15 -0.24 0.00 0.27 0.00 0.00 38.32 38.49 1ynf h ASN 134 CO 0.02 0.51 -0.65 -0.54 -0.37 0.00 0.00 177.43 176.40 1ynf s LYS 135 N -6.05 3.59 0.19 6.67 -0.14 -1.23 -5.01 119.74 117.75 1ynf s LYS 135 Ca -0.12 -0.51 -0.16 0.00 -1.36 0.00 0.00 55.97 53.81 1ynf s LYS 135 Cb 0.19 -3.23 0.16 0.00 -1.68 0.00 0.00 37.83 33.27 1ynf s LYS 135 CO 0.79 -0.18 1.64 0.35 -0.76 0.00 0.00 175.35 177.20 1ynf h PHE 136 N 8.16 -0.33 0.00 3.18 3.04 -1.85 0.70 116.94 129.83 1ynf h PHE 136 Ca -0.39 0.05 -0.01 0.00 3.98 0.00 0.00 57.97 61.60 1ynf h PHE 136 Cb 1.17 0.22 -0.00 0.00 2.56 0.00 0.00 35.95 39.90 1ynf h PHE 136 CO 0.64 -0.24 -0.06 1.12 -2.02 0.00 0.00 178.31 177.76 1ynf h HIS 137 N -0.02 0.00 0.00 0.41 2.07 -1.94 -2.14 115.15 113.52 1ynf h HIS 137 Ca 0.25 0.00 -0.16 0.00 -2.85 0.00 0.00 60.37 57.60 1ynf h HIS 137 Cb 0.40 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.35 1ynf h HIS 137 CO -0.45 0.06 -1.31 0.00 -3.07 0.00 0.00 177.93 173.17 1ynf h ARG 138 N 0.00 0.00 0.00 5.12 3.08 -1.47 -3.32 114.38 117.79 1ynf h ARG 138 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1ynf h ARG 138 Cb 0.12 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 1ynf h ARG 138 CO 0.01 0.33 -0.03 0.66 -1.07 0.00 0.00 179.97 179.87 1ynf h SER 139 N 0.00 0.00 1.06 7.04 4.64 -0.23 -1.37 113.55 124.68 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 1.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.67 1ynf h SER 139 CO 0.05 0.03 0.00 -0.07 -0.87 0.00 0.00 176.83 175.97 1ynf h LEU 140 N 0.00 0.00 -0.16 5.97 3.38 -1.63 -3.32 115.31 119.55 1ynf h LEU 140 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1ynf h LEU 140 Cb 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1ynf h LEU 140 CO 0.00 0.00 -0.01 -0.33 0.09 0.00 0.00 178.44 178.19 1ynf h GLU 141 N 0.00 0.30 -0.59 1.13 5.08 -1.46 -3.39 114.58 115.65 1ynf h GLU 141 Ca 0.00 -0.10 0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1ynf h GLU 141 Cb 0.53 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.68 1ynf h GLU 141 CO 0.00 0.54 -0.35 0.00 -1.00 0.00 0.00 179.01 178.20 1ynf n ALA 142 N -2.33 -0.38 -0.17 3.43 0.00 -1.25 -0.77 120.51 119.05 1ynf n ALA 142 Ca -0.05 0.50 -0.02 0.00 0.00 0.00 0.00 53.44 53.87 1ynf n ALA 142 Cb 0.24 -0.06 0.07 0.00 0.00 0.00 0.00 19.45 19.70 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 0.22 -0.07 0.00 0.11 -1.87 0.14 132.00 130.53 1ynf h PRO 143 Ca 0.09 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.99 1ynf h PRO 143 Cb 0.24 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.30 1ynf h PRO 143 CO -0.56 0.15 -0.78 0.28 -0.21 0.00 0.00 178.00 176.88 1ynf h VAL 144 N 0.23 1.37 -0.75 3.15 2.07 -1.53 -2.72 116.25 118.07 1ynf h VAL 144 Ca 0.26 -2.19 -0.01 0.00 0.82 0.00 0.00 66.70 65.58 1ynf h VAL 144 Cb 0.36 2.16 -0.04 0.00 -1.52 0.00 0.00 31.29 32.26 1ynf h VAL 144 CO -0.35 0.66 0.42 0.74 0.02 0.00 0.00 177.57 179.06 1ynf h THR 145 N 0.29 1.22 -0.44 2.57 2.02 -0.38 -1.00 112.91 117.20 1ynf h THR 145 Ca -0.04 -0.53 -0.05 0.00 0.77 0.00 0.00 66.41 66.56 1ynf h THR 145 Cb 1.37 0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 1ynf h THR 145 CO 0.14 0.24 0.07 -0.08 0.37 0.00 0.00 175.52 176.26 1ynf h GLU 146 N 1.04 0.73 -0.58 6.66 4.81 -0.60 -1.37 114.58 125.27 1ynf h GLU 146 Ca 0.27 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1ynf h GLU 146 Cb 0.01 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 1ynf h GLU 146 CO -0.05 0.75 0.37 0.77 -0.73 0.00 0.00 179.01 180.13 1ynf h SER 147 N 0.58 0.68 -0.39 1.04 0.02 -1.11 -1.46 113.55 112.91 1ynf h SER 147 Ca 0.13 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1ynf h SER 147 Cb 0.38 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 1ynf h SER 147 CO 0.01 0.51 0.19 -0.07 -1.14 0.00 0.00 176.83 176.33 1ynf h LEU 148 N 0.78 0.50 -0.96 5.07 3.38 -1.02 -1.65 115.31 121.42 1ynf h LEU 148 Ca 0.21 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 1ynf h LEU 148 Cb -0.07 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1ynf h LEU 148 CO -0.04 0.48 0.22 -0.07 0.09 0.00 0.00 178.44 179.12 1ynf h LEU 149 N 0.49 0.90 -1.33 1.67 3.38 -1.00 -0.97 115.31 118.46 1ynf h LEU 149 Ca 0.13 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1ynf h LEU 149 Cb 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1ynf h LEU 149 CO -0.02 0.83 -0.31 0.11 0.09 0.00 0.00 178.44 179.14 1ynf h LYS 150 N 0.95 0.00 0.00 1.13 6.56 -1.04 0.41 116.57 124.58 1ynf h LYS 150 Ca 0.22 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.77 1ynf h LYS 150 Cb 0.24 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.89 1ynf h LYS 150 CO -0.01 0.31 -0.63 0.00 -2.06 0.00 0.00 179.45 177.06 1ynf h ALA 151 N 1.69 0.72 0.03 3.86 0.00 -0.63 -3.02 119.26 121.91 1ynf h ALA 151 Ca -0.00 -0.17 -0.29 0.00 0.00 0.00 0.00 54.91 54.44 1ynf h ALA 151 Cb 0.65 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1ynf h ALA 151 CO 0.04 0.21 -1.58 -0.89 0.00 0.00 0.00 179.25 177.02 1ynf n ILE 152 N -2.93 1.59 -2.89 0.00 5.41 -0.43 -4.36 119.36 115.75 1ynf n ILE 152 Ca 0.00 -0.22 -0.38 0.00 1.00 0.00 0.00 62.75 63.16 1ynf n ILE 152 Cb 0.61 -1.94 -0.00 0.00 -0.71 0.00 0.00 39.64 37.59 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 -4.18 2.87 0.11 1.39 3.01 0.14 -1.53 117.46 119.28 1ynf n PHE 153 Ca -0.35 -2.94 -0.03 0.00 1.01 0.00 0.00 57.45 55.14 1ynf n PHE 153 Cb 0.79 -1.05 0.07 0.00 -0.01 0.00 0.00 39.48 39.28 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 4.43 0.00 -2.28 4.37 -0.73 -1.73 -3.43 115.58 116.22 1ynf h ASN 154 Ca 0.33 0.00 -0.53 0.00 1.87 0.00 0.00 56.30 57.98 1ynf h ASN 154 Cb 0.48 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.04 1ynf h ASN 154 CO 1.14 0.75 1.31 -0.62 -0.37 0.00 0.00 177.43 179.64 1ynf s ASP 155 N -6.76 5.53 0.14 1.15 -1.08 -1.26 -4.86 116.67 109.53 1ynf s ASP 155 Ca -0.00 0.66 0.18 0.00 -0.52 0.00 0.00 52.55 52.86 1ynf s ASP 155 Cb 0.11 -2.53 0.76 0.00 -1.46 0.00 0.00 42.92 39.81 1ynf s ASP 155 CO 0.78 -2.11 1.54 -0.62 0.52 0.00 0.00 175.17 175.28 1ynf n GLU 156 N 8.88 0.09 0.03 4.34 1.02 -1.26 -0.66 120.64 133.08 1ynf n GLU 156 Ca 0.21 0.39 0.13 0.00 -0.02 0.00 0.00 57.16 57.86 1ynf n GLU 156 Cb 0.50 -1.70 0.38 0.00 -0.02 0.00 0.00 31.44 30.61 1ynf n GLU 156 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1ynf n GLU 157 N -1.88 0.11 -0.02 3.49 1.02 -1.26 -3.99 120.64 118.11 1ynf n GLU 157 Ca 0.02 0.06 -0.01 0.00 -0.02 0.00 0.00 57.16 57.21 1ynf n GLU 157 Cb 0.16 -1.60 -0.04 0.00 -0.02 0.00 0.00 31.44 29.94 1ynf n GLU 157 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ynf n LYS 158 N -1.78 2.52 -4.82 3.49 5.02 -0.75 -4.91 118.16 116.93 1ynf n LYS 158 Ca 0.06 -0.01 -0.25 0.00 -2.02 0.00 0.00 58.31 56.08 1ynf n LYS 158 Cb 0.38 -1.13 -0.15 0.00 -0.02 0.00 0.00 35.03 34.11 1ynf n LYS 158 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1ynf s PHE 159 N -2.18 1.67 -0.25 2.13 0.40 0.16 -1.20 117.98 118.71 1ynf s PHE 159 Ca -0.02 -0.33 -0.00 0.00 -0.60 0.00 0.00 56.93 55.98 1ynf s PHE 159 Cb 0.02 -1.05 0.07 0.00 0.51 0.00 0.00 43.02 42.57 1ynf s PHE 159 CO 0.21 -0.00 0.01 -1.12 0.70 0.00 0.00 175.22 175.02 1ynf s SER 160 N -0.61 3.77 -0.24 1.36 0.01 0.69 -4.27 113.70 114.41 1ynf s SER 160 Ca 0.07 -1.29 -0.14 0.00 1.31 0.00 0.00 55.95 55.90 1ynf s SER 160 Cb -0.07 -1.02 -0.04 0.00 0.21 0.00 0.00 66.02 65.09 1ynf s SER 160 CO -0.00 -0.30 0.34 -0.69 0.41 0.00 0.00 173.24 172.99 1ynf s VAL 161 N 1.50 5.22 -0.05 3.43 1.01 -1.26 -1.26 120.40 129.00 1ynf s VAL 161 Ca 0.00 0.54 -0.01 0.00 0.00 0.00 0.00 61.98 62.51 1ynf s VAL 161 Cb -0.18 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1ynf s VAL 161 CO -0.11 0.24 0.02 -1.00 0.00 0.00 0.00 175.10 174.25 1ynf s HIS 162 N 1.55 3.19 0.72 5.22 3.76 0.46 -4.98 115.29 125.21 1ynf s HIS 162 Ca 0.15 0.19 -0.14 0.00 -0.15 0.00 0.00 55.06 55.11 1ynf s HIS 162 Cb -0.15 -1.76 0.03 0.00 1.11 0.00 0.00 32.58 31.82 1ynf s HIS 162 CO 0.08 0.50 1.13 -1.12 -0.85 0.00 0.00 174.74 174.48 1ynf s SER 163 N -1.23 4.58 0.72 1.40 0.01 -1.26 -1.83 113.70 116.09 1ynf s SER 163 Ca 0.17 2.06 -0.15 0.00 1.31 0.00 0.00 55.95 59.34 1ynf s SER 163 Cb -0.12 -2.56 0.03 0.00 0.21 0.00 0.00 66.02 63.59 1ynf s SER 163 CO 0.07 -1.99 1.21 0.00 0.41 0.00 0.00 173.24 172.94 1ynf s ALA 164 N -2.40 2.15 0.86 1.44 0.00 -1.24 -4.54 121.76 118.03 1ynf s ALA 164 Ca 0.67 0.90 -0.11 0.00 0.00 0.00 0.00 51.96 53.43 1ynf s ALA 164 Cb -0.22 -3.47 0.11 0.00 0.00 0.00 0.00 23.12 19.53 1ynf s ALA 164 CO 0.47 -1.84 1.10 -0.51 0.00 0.00 0.00 175.76 174.99 1ynf s LEU 165 N -5.06 2.72 0.40 0.00 1.43 -1.26 -4.92 118.68 111.98 1ynf s LEU 165 Ca 0.75 1.85 -0.24 0.00 -1.03 0.00 0.00 54.13 55.46 1ynf s LEU 165 Cb -0.30 -4.36 -0.12 0.00 0.03 0.00 0.00 46.19 41.44 1ynf s LEU 165 CO 0.44 -2.57 0.80 -2.65 0.23 0.00 0.00 176.35 172.61 1ynf n PRO 166 N -3.87 0.96 -2.64 1.29 -0.02 -1.26 -4.69 135.00 124.77 1ynf n PRO 166 Ca 0.09 0.34 -0.43 0.00 -2.02 0.00 0.00 63.50 61.48 1ynf n PRO 166 Cb 0.53 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 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 0.40 3.24 -3.87 -0.52 1.13 -1.26 -4.73 117.38 111.77 1ynf n GLN 167 Ca 0.11 -3.42 -0.11 0.00 -1.94 0.00 0.00 57.00 51.64 1ynf n GLN 167 Cb 0.38 -3.34 -0.10 0.00 0.11 0.00 0.00 30.24 27.30 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 3.27 0.09 0.53 5.09 -7.23 -1.26 -5.04 120.40 115.85 1ynf s VAL 168 Ca 0.50 -0.70 0.23 0.00 -1.81 0.00 0.00 61.98 60.19 1ynf s VAL 168 Cb 0.03 -0.44 0.35 0.00 0.56 0.00 0.00 36.38 36.89 1ynf s VAL 168 CO 0.05 -0.39 2.05 0.00 -0.31 0.00 0.00 175.10 176.50 1ynf h ALA 169 N 4.26 2.28 0.00 1.32 0.00 -1.93 -0.66 119.26 124.54 1ynf h ALA 169 Ca -0.31 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 1ynf h ALA 169 Cb 1.19 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ynf h ALA 169 CO 0.41 -0.42 -0.10 1.25 0.00 0.00 0.00 179.25 180.38 1ynf h LEU 170 N 0.00 0.00 -3.42 0.00 5.85 -1.96 -2.80 115.31 112.98 1ynf h LEU 170 Ca 0.16 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.57 1ynf h LEU 170 Cb 0.65 0.00 -0.24 0.00 0.37 0.00 0.00 40.66 41.45 1ynf h LEU 170 CO -0.00 0.10 -0.65 0.18 -0.34 0.00 0.00 178.44 177.74 1ynf n LEU 171 N -3.85 4.00 -4.68 2.25 4.77 -0.26 -4.39 117.00 114.83 1ynf n LEU 171 Ca -0.02 -4.36 -0.44 0.00 -0.03 0.00 0.00 56.01 51.15 1ynf n LEU 171 Cb 0.20 -0.44 -0.04 0.00 -2.33 0.00 0.00 43.42 40.82 1ynf n LEU 171 CO 0.31 1.78 1.44 0.61 -1.33 0.00 0.00 177.39 180.21 1ynf n GLY 172 N -0.90 1.56 2.91 -0.72 0.00 -1.06 -4.73 105.19 102.25 1ynf n GLY 172 Ca 0.33 0.74 -0.23 0.00 0.00 0.00 0.00 46.02 46.87 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 2.83 1.53 -0.06 1.61 2.15 -1.24 -2.03 116.67 121.47 1ynf s ASP 173 Ca 0.84 -0.21 0.12 0.00 0.43 0.00 0.00 52.55 53.73 1ynf s ASP 173 Cb -0.55 -0.64 0.34 0.00 -0.30 0.00 0.00 42.92 41.77 1ynf s ASP 173 CO 0.41 -0.06 1.27 -0.62 -0.17 0.00 0.00 175.17 175.99 1ynf n GLU 174 N 4.33 2.84 0.00 4.34 -0.58 -1.26 -1.05 120.64 129.26 1ynf n GLU 174 Ca -0.19 -2.24 0.00 0.00 -0.42 0.00 0.00 57.16 54.31 1ynf n GLU 174 Cb 0.51 -1.41 0.00 0.00 -0.57 0.00 0.00 31.44 29.97 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 0.04 0.78 0.48 0.62 0.00 -1.26 -3.84 105.19 102.01 1ynf n GLY 175 Ca 0.13 -0.73 0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.70 2.89 -0.03 4.61 0.00 -0.41 -1.05 119.26 124.57 1ynf h ALA 176 Ca 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ynf h ALA 176 Cb 0.00 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1ynf h ALA 176 CO 0.00 -1.18 0.30 0.00 0.00 0.00 0.00 179.25 178.37 1ynf h ALA 177 N 1.51 1.36 -0.18 0.00 0.00 -1.19 0.45 119.26 121.20 1ynf h ALA 177 Ca 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1ynf h ALA 177 Cb 1.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.66 1ynf h ALA 177 CO -0.03 -0.32 0.00 0.09 0.00 0.00 0.00 179.25 179.00 1ynf n ASN 178 N -2.98 2.78 -4.83 0.00 3.02 -0.40 -1.49 115.26 111.36 1ynf n ASN 178 Ca -0.01 -2.36 -0.22 0.00 -0.03 0.00 0.00 54.58 51.96 1ynf n ASN 178 Cb 0.36 -0.26 -0.04 0.00 -0.61 0.00 0.00 39.78 39.23 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 -1.63 3.12 -0.03 3.10 2.46 0.16 -1.16 115.29 121.30 1ynf s HIS 179 Ca 0.22 -0.11 -0.20 0.00 0.47 0.00 0.00 55.06 55.43 1ynf s HIS 179 Cb 0.15 -1.42 0.04 0.00 -0.13 0.00 0.00 32.58 31.22 1ynf s HIS 179 CO 0.08 0.51 0.43 -0.80 -2.47 0.00 0.00 174.74 172.49 1ynf s ASN 180 N -3.85 -0.35 -0.12 9.88 0.01 -0.61 -4.93 114.94 114.97 1ynf s ASN 180 Ca 0.33 0.31 -0.04 0.00 -0.71 0.00 0.00 52.86 52.75 1ynf s ASN 180 Cb -0.08 0.39 0.05 0.00 0.41 0.00 0.00 41.25 42.03 1ynf s ASN 180 CO 0.25 -0.50 0.11 -0.60 -1.51 0.00 0.00 177.10 174.86 1ynf s ARG 181 N -1.27 0.03 0.04 -0.60 3.52 -1.26 -1.16 118.95 118.25 1ynf s ARG 181 Ca -0.13 0.22 0.06 0.00 -0.13 0.00 0.00 55.73 55.76 1ynf s ARG 181 Cb -0.03 -1.04 -0.03 0.00 -1.56 0.00 0.00 34.95 32.28 1ynf s ARG 181 CO 0.06 -0.49 -0.15 -0.51 -0.81 0.00 0.00 175.30 173.39 1ynf s LEU 182 N 2.21 2.75 0.00 -0.88 1.43 -1.26 -4.12 118.68 118.81 1ynf s LEU 182 Ca 0.04 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.77 1ynf s LEU 182 Cb -0.14 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.48 1ynf s LEU 182 CO -0.07 0.26 0.00 0.61 0.23 0.00 0.00 176.35 177.38 1ynf n GLY 183 N 1.50 -1.59 0.00 -3.19 0.00 0.98 -4.59 105.19 98.31 1ynf n GLY 183 Ca -0.16 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.16 0.56 3.78 -0.02 0.00 -1.26 -2.43 105.19 105.66 1ynf n GLY 184 Ca 0.00 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1ynf n GLY 184 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ynf s HIS 185 N 0.00 3.31 0.27 1.61 3.76 -1.26 -4.63 115.29 118.35 1ynf s HIS 185 Ca 0.00 1.65 -0.01 0.00 -0.15 0.00 0.00 55.06 56.55 1ynf s HIS 185 Cb 0.00 -3.10 0.60 0.00 1.11 0.00 0.00 32.58 31.18 1ynf s HIS 185 CO 0.00 -0.54 1.66 1.88 -0.85 0.00 0.00 174.74 176.90 1ynf h TYR 186 N 2.56 0.30 0.00 1.40 0.99 -1.91 -0.03 116.97 120.28 1ynf h TYR 186 Ca -0.48 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.30 1ynf h TYR 186 Cb 1.21 -0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.94 1ynf h TYR 186 CO 0.58 -0.16 0.00 0.41 -0.00 0.00 0.00 178.16 178.99 1ynf n GLY 187 N -1.37 -1.07 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 45.92 1ynf n GLY 187 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ynf s GLU 188 N -3.12 3.68 0.14 1.61 2.02 -0.03 -4.72 118.70 118.27 1ynf s GLU 188 Ca 0.05 0.31 -0.34 0.00 0.02 0.00 0.00 54.97 55.02 1ynf s GLU 188 Cb 0.09 -2.42 -0.14 0.00 0.10 0.00 0.00 34.13 31.76 1ynf s GLU 188 CO 0.30 -0.06 1.61 -2.30 0.02 0.00 0.00 175.26 174.83 1ynf n PRO 189 N -1.58 2.17 0.00 0.39 -0.02 -1.26 -4.88 135.00 129.81 1ynf n PRO 189 Ca 0.01 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1ynf n PRO 189 Cb 0.54 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 1ynf n PRO 189 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ynf n GLY 190 N 3.53 1.30 3.64 -1.23 0.00 -1.26 -4.76 105.19 106.41 1ynf n GLY 190 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.14 1ynf n GLY 190 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ynf s GLN 192 N 3.03 0.60 -0.25 1.61 -0.21 0.66 -4.80 119.66 120.31 1ynf s GLN 192 Ca 0.00 1.02 -0.00 0.00 0.02 0.00 0.00 55.36 56.40 1ynf s GLN 192 Cb 0.00 0.13 0.04 0.00 1.00 0.00 0.00 33.01 34.17 1ynf s GLN 192 CO 0.00 -0.12 -0.09 -1.17 -2.12 0.00 0.00 175.29 171.79 1ynf s LEU 193 N 1.49 3.15 -0.25 2.90 2.96 -0.31 -0.54 118.68 128.07 1ynf s LEU 193 Ca -0.09 -1.01 -0.11 0.00 -0.22 0.00 0.00 54.13 52.69 1ynf s LEU 193 Cb -0.05 -1.61 -0.05 0.00 0.50 0.00 0.00 46.19 44.99 1ynf s LEU 193 CO -0.18 -0.14 0.19 -0.36 -1.32 0.00 0.00 176.35 174.55 1ynf s PHE 194 N 1.25 3.28 -0.16 5.38 0.40 0.48 -1.57 117.98 127.04 1ynf s PHE 194 Ca -0.02 0.22 -0.06 0.00 -0.60 0.00 0.00 56.93 56.47 1ynf s PHE 194 Cb -0.17 -2.34 -0.04 0.00 0.51 0.00 0.00 43.02 40.99 1ynf s PHE 194 CO -0.06 -0.03 0.03 0.08 0.70 0.00 0.00 175.22 175.94 1ynf s VAL 195 N 1.37 4.53 0.25 -0.44 1.01 -0.31 -0.76 120.40 126.03 1ynf s VAL 195 Ca 0.08 -0.13 0.05 0.00 0.00 0.00 0.00 61.98 61.98 1ynf s VAL 195 Cb -0.15 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 1ynf s VAL 195 CO 0.07 0.49 -0.05 -0.72 0.00 0.00 0.00 175.10 174.89 1ynf s TYR 196 N 0.18 1.74 -0.09 5.22 -0.85 -0.80 -4.80 117.35 117.95 1ynf s TYR 196 Ca 0.03 -0.77 0.16 0.00 -0.52 0.00 0.00 57.07 55.96 1ynf s TYR 196 Cb -0.13 -0.98 -0.24 0.00 0.38 0.00 0.00 41.96 41.00 1ynf s TYR 196 CO 0.01 0.16 0.23 0.41 -1.52 0.00 0.00 175.55 174.84 1ynf n GLY 197 N -0.48 -0.79 3.29 5.49 0.00 0.05 -0.12 105.19 112.62 1ynf n GLY 197 Ca -0.06 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.52 1ynf n GLY 197 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ynf s ARG 198 N -2.82 1.01 -0.05 1.61 1.70 -0.96 -4.47 118.95 114.97 1ynf s ARG 198 Ca -0.07 -0.80 -0.13 0.00 -0.47 0.00 0.00 55.73 54.25 1ynf s ARG 198 Cb 0.08 0.43 0.02 0.00 -0.57 0.00 0.00 34.95 34.92 1ynf s ARG 198 CO 0.69 -0.38 0.31 -2.00 -1.08 0.00 0.00 175.30 172.84 1ynf s GLU 199 N -3.83 0.57 0.32 3.89 2.12 -1.26 -0.50 118.70 120.00 1ynf s GLU 199 Ca 0.04 0.00 -0.29 0.00 0.36 0.00 0.00 54.97 55.08 1ynf s GLU 199 Cb 0.03 0.26 -0.10 0.00 0.26 0.00 0.00 34.13 34.57 1ynf s GLU 199 CO -0.11 -0.14 1.33 -1.21 -0.54 0.00 0.00 175.26 174.60 1ynf s GLU 200 N -0.85 4.34 0.00 4.30 0.41 -1.26 -2.43 118.70 123.20 1ynf s GLU 200 Ca -0.09 2.23 0.00 0.00 -0.41 0.00 0.00 54.97 56.70 1ynf s GLU 200 Cb -0.04 -3.08 0.00 0.00 -1.78 0.00 0.00 34.13 29.23 1ynf s GLU 200 CO 0.03 -0.24 0.00 0.41 -0.49 0.00 0.00 175.26 174.97 1ynf n GLY 201 N 1.06 3.09 3.54 -1.39 0.00 -1.26 -4.98 105.19 105.24 1ynf n GLY 201 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.68 6.41 0.00 1.61 3.84 -1.02 -4.90 114.94 120.20 1ynf s ASN 202 Ca 0.00 -0.12 0.16 0.00 0.21 0.00 0.00 52.86 53.11 1ynf s ASN 202 Cb 0.00 -2.41 0.68 0.00 -0.55 0.00 0.00 41.25 38.97 1ynf s ASN 202 CO 0.00 -1.01 1.51 -0.90 -2.79 0.00 0.00 177.10 173.91 1ynf n ASP 203 N 6.96 0.00 -4.55 -4.21 5.68 -1.26 -4.54 116.55 114.63 1ynf n ASP 203 Ca 0.03 0.50 -0.43 0.00 -0.50 0.00 0.00 54.79 54.39 1ynf n ASP 203 Cb 0.48 -0.50 -0.04 0.00 -1.14 0.00 0.00 41.12 39.92 1ynf n ASP 203 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1ynf s THR 204 N -3.00 4.41 0.05 2.12 2.01 -1.26 -4.97 115.64 115.00 1ynf s THR 204 Ca 0.08 0.59 -0.27 0.00 0.31 0.00 0.00 61.69 62.40 1ynf s THR 204 Cb 0.10 -4.49 0.09 0.00 0.01 0.00 0.00 72.50 68.21 1ynf s THR 204 CO 0.29 -0.97 0.80 0.00 -0.69 0.00 0.00 174.62 174.05 1ynf s ARG 205 N 3.91 0.97 0.51 4.92 3.03 -1.26 -4.76 118.95 126.28 1ynf s ARG 205 Ca 0.35 -0.37 -0.21 0.00 2.03 0.00 0.00 55.73 57.54 1ynf s ARG 205 Cb -0.11 0.44 -0.09 0.00 -1.03 0.00 0.00 34.95 34.17 1ynf s ARG 205 CO 0.24 -0.43 0.79 -2.30 -1.13 0.00 0.00 175.30 172.47 1ynf n PRO 206 N -0.29 0.87 0.00 3.89 -0.02 -1.26 -4.94 135.00 133.24 1ynf n PRO 206 Ca -0.11 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1ynf n PRO 206 Cb 0.63 -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 0.25 1.02 0.00 2.55 3.41 -1.26 -4.77 113.62 114.83 1ynf n SER 207 Ca 0.11 -1.15 0.00 0.00 -0.26 0.00 0.00 58.87 57.57 1ynf n SER 207 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 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 -0.08 1.97 -3.84 4.33 0.63 -1.26 -4.98 116.66 113.44 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 0.07 -0.81 -0.15 0.00 0.45 0.00 0.00 32.46 32.03 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 -1.61 2.44 0.31 -0.14 4.12 -1.26 -5.07 117.35 116.13 1ynf s TYR 209 Ca 0.00 -2.16 -0.26 0.00 0.02 0.00 0.00 57.07 54.67 1ynf s TYR 209 Cb 0.00 -2.11 -0.15 0.00 -1.52 0.00 0.00 41.96 38.18 1ynf s TYR 209 CO 0.00 -0.89 0.63 -2.30 0.02 0.00 0.00 175.55 173.01 1ynf n PRO 210 N 4.64 0.57 -2.61 -1.71 -0.02 -1.26 -4.71 135.00 129.89 1ynf n PRO 210 Ca -0.01 0.20 -0.43 0.00 -2.02 0.00 0.00 63.50 61.25 1ynf n PRO 210 Cb 0.42 -1.40 -0.02 0.00 -0.02 0.00 0.00 33.50 32.47 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 -1.22 3.57 -0.00 3.55 0.00 -1.26 -4.93 121.76 121.46 1ynf s ALA 211 Ca 0.62 0.34 0.16 0.00 0.00 0.00 0.00 51.96 53.08 1ynf s ALA 211 Cb -0.73 -3.52 0.29 0.00 0.00 0.00 0.00 23.12 19.15 1ynf s ALA 211 CO 0.58 -0.88 1.54 0.00 0.00 0.00 0.00 175.76 177.00 1ynf h ARG 212 N 7.44 0.00 -5.22 0.00 3.08 -1.90 -3.44 114.38 114.34 1ynf h ARG 212 Ca -0.26 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.16 1ynf h ARG 212 Cb 1.11 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.95 1ynf h ARG 212 CO 0.92 0.50 -0.64 -1.14 -1.07 0.00 0.00 179.97 178.54 1ynf s GLN 213 N -3.19 3.73 0.12 0.04 2.00 -1.26 -3.64 119.66 117.46 1ynf s GLN 213 Ca 0.02 -0.48 0.06 0.00 -2.00 0.00 0.00 55.36 52.97 1ynf s GLN 213 Cb 0.09 -3.06 -0.04 0.00 0.80 0.00 0.00 33.01 30.80 1ynf s GLN 213 CO 0.73 0.16 -0.03 0.95 -0.50 0.00 0.00 175.29 176.59 1ynf s THR 214 N 0.62 3.73 0.32 -0.34 -4.23 -0.86 -0.77 115.64 114.11 1ynf s THR 214 Ca -0.00 -1.21 0.02 0.00 -1.18 0.00 0.00 61.69 59.32 1ynf s THR 214 Cb -0.14 -2.80 0.16 0.00 1.34 0.00 0.00 72.50 71.06 1ynf s THR 214 CO 0.02 0.04 1.86 -0.09 -0.54 0.00 0.00 174.62 175.92 1ynf h ARG 215 N 3.25 0.65 -0.76 3.99 2.43 -1.13 -2.24 114.38 120.57 1ynf h ARG 215 Ca -0.48 -0.13 0.10 0.00 -0.81 0.00 0.00 59.98 58.66 1ynf h ARG 215 Cb 1.18 -0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 30.55 1ynf h ARG 215 CO 0.57 0.63 0.40 0.93 -1.51 0.00 0.00 179.97 180.98 1ynf h GLU 216 N 0.63 0.64 -0.13 0.20 3.07 -1.82 0.27 114.58 117.44 1ynf h GLU 216 Ca 0.14 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 58.93 1ynf h GLU 216 Cb 0.30 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1ynf h GLU 216 CO 0.00 0.42 -0.03 0.00 -1.40 0.00 0.00 179.01 178.01 1ynf h ALA 217 N 1.45 0.17 -0.59 3.43 0.00 -1.63 -2.40 119.26 119.70 1ynf h ALA 217 Ca 0.38 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1ynf h ALA 217 Cb 0.40 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1ynf h ALA 217 CO -0.27 -0.08 0.29 0.77 0.00 0.00 0.00 179.25 179.96 1ynf h SER 218 N -0.07 0.41 0.07 0.00 0.02 -0.84 -0.58 113.55 112.56 1ynf h SER 218 Ca 0.03 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 1ynf h SER 218 Cb 0.45 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 1ynf h SER 218 CO 0.01 0.27 -0.21 -0.33 -1.14 0.00 0.00 176.83 175.43 1ynf h GLU 219 N 0.55 0.26 -0.30 3.45 5.08 -0.96 -1.06 114.58 121.60 1ynf h GLU 219 Ca 0.27 -0.08 -0.17 0.00 -1.00 0.00 0.00 59.36 58.38 1ynf h GLU 219 Cb 0.21 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1ynf h GLU 219 CO -0.20 0.47 -0.50 0.00 -1.00 0.00 0.00 179.01 177.78 1ynf h ALA 220 N 1.55 0.53 -0.56 3.43 0.00 -0.75 -2.16 119.26 121.31 1ynf h ALA 220 Ca 0.04 -0.50 -0.11 0.00 0.00 0.00 0.00 54.91 54.35 1ynf h ALA 220 Cb 0.51 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ynf h ALA 220 CO 0.03 0.68 -0.07 0.28 0.00 0.00 0.00 179.25 180.18 1ynf h VAL 221 N 0.67 1.27 -0.88 0.00 2.07 -0.85 0.45 116.25 118.97 1ynf h VAL 221 Ca 0.03 -1.21 0.04 0.00 0.82 0.00 0.00 66.70 66.38 1ynf h VAL 221 Cb 1.09 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.72 1ynf h VAL 221 CO 0.11 0.43 0.56 0.00 0.02 0.00 0.00 177.57 178.69 1ynf h ALA 222 N 1.00 1.17 -0.00 1.67 0.00 -1.05 0.85 119.26 122.89 1ynf h ALA 222 Ca 0.15 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ynf h ALA 222 Cb 0.62 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1ynf h ALA 222 CO 0.04 0.38 -0.00 0.00 0.00 0.00 0.00 179.25 179.67 1ynf h ARG 223 N 1.07 0.00 -0.97 0.00 3.08 -0.90 -2.48 114.38 114.18 1ynf h ARG 223 Ca 0.36 -0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.50 1ynf h ARG 223 Cb 0.06 -0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.03 1ynf h ARG 223 CO -0.13 0.35 0.62 -0.07 -1.07 0.00 0.00 179.97 179.66 1ynf h LEU 224 N -0.34 0.92 -0.40 3.04 3.38 -0.44 -1.21 115.31 120.25 1ynf h LEU 224 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1ynf h LEU 224 Cb 0.35 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1ynf h LEU 224 CO 0.00 0.54 0.00 0.59 0.09 0.00 0.00 178.44 179.66 1ynf n ASN 225 N -4.55 0.55 -4.08 -0.43 3.02 0.25 -4.90 115.26 105.12 1ynf n ASN 225 Ca 0.17 -2.01 -0.30 0.00 -0.03 0.00 0.00 54.58 52.40 1ynf n ASN 225 Cb 0.29 -0.10 -0.02 0.00 -0.61 0.00 0.00 39.78 39.33 1ynf n ASN 225 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ynf n GLN 226 N -0.23 -3.25 -2.81 3.52 6.02 -0.46 -4.75 117.38 115.42 1ynf n GLN 226 Ca 0.03 0.39 -0.41 0.00 -0.01 0.00 0.00 57.00 57.00 1ynf n GLN 226 Cb 0.10 -4.76 -0.04 0.00 1.02 0.00 0.00 30.24 26.55 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 4.68 -0.00 5.09 1.01 -0.94 -1.60 120.40 124.95 1ynf s VAL 227 Ca 0.33 1.91 -0.33 0.00 0.00 0.00 0.00 61.98 63.90 1ynf s VAL 227 Cb -0.18 -4.25 -0.11 0.00 0.00 0.00 0.00 36.38 31.84 1ynf s VAL 227 CO 0.91 0.29 1.86 -3.20 0.00 0.00 0.00 175.10 174.95 1ynf n ASN 228 N 3.12 3.64 -0.30 3.32 2.85 -1.06 -4.84 115.26 121.99 1ynf n ASN 228 Ca 0.02 0.97 0.30 0.00 -0.11 0.00 0.00 54.58 55.76 1ynf n ASN 228 Cb 0.50 -1.44 0.67 0.00 1.24 0.00 0.00 39.78 40.76 1ynf n ASN 228 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ynf h PRO 229 N 9.02 0.12 -0.00 1.20 0.11 -1.94 0.28 132.00 140.80 1ynf h PRO 229 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ynf h PRO 229 Cb 1.26 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1ynf h PRO 229 CO 0.94 0.08 -0.15 1.04 -0.21 0.00 0.00 178.00 179.70 1ynf n GLN 230 N -4.34 0.22 -0.84 1.05 6.02 -1.26 -3.62 117.38 114.60 1ynf n GLN 230 Ca 0.24 -0.06 -0.06 0.00 -0.01 0.00 0.00 57.00 57.11 1ynf n GLN 230 Cb 1.09 -1.50 0.21 0.00 1.02 0.00 0.00 30.24 31.06 1ynf n GLN 230 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1ynf n GLN 231 N -1.34 2.20 -4.08 -1.09 6.02 0.98 -4.97 117.38 115.09 1ynf n GLN 231 Ca 0.09 -3.10 -0.14 0.00 -0.01 0.00 0.00 57.00 53.84 1ynf n GLN 231 Cb 0.31 -1.91 -0.14 0.00 1.02 0.00 0.00 30.24 29.52 1ynf n GLN 231 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1ynf s VAL 232 N -3.18 0.34 -0.02 5.09 1.01 -1.23 -0.24 120.40 122.17 1ynf s VAL 232 Ca 0.47 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1ynf s VAL 232 Cb 0.41 -0.32 0.02 0.00 0.00 0.00 0.00 36.38 36.50 1ynf s VAL 232 CO 0.04 -0.00 0.01 -0.63 0.00 0.00 0.00 175.10 174.52 1ynf s ILE 233 N -0.33 0.03 -0.20 2.22 1.01 0.30 -4.94 121.20 119.28 1ynf s ILE 233 Ca -0.01 0.12 -0.05 0.00 0.00 0.00 0.00 60.65 60.72 1ynf s ILE 233 Cb -0.03 -0.12 -0.02 0.00 0.01 0.00 0.00 42.46 42.29 1ynf s ILE 233 CO -0.00 0.08 -0.01 -0.36 0.00 0.00 0.00 174.94 174.65 1ynf s PHE 234 N 0.79 3.03 0.00 3.97 0.40 -1.26 -0.39 117.98 124.52 1ynf s PHE 234 Ca -0.07 -0.49 0.05 0.00 -0.60 0.00 0.00 56.93 55.83 1ynf s PHE 234 Cb -0.10 -2.07 -0.02 0.00 0.51 0.00 0.00 43.02 41.35 1ynf s PHE 234 CO -0.02 -0.25 -0.16 0.00 0.70 0.00 0.00 175.22 175.49 1ynf s ALA 235 N 0.97 1.34 0.03 5.36 0.00 0.06 -4.97 121.76 124.54 1ynf s ALA 235 Ca 0.01 -0.75 -0.18 0.00 0.00 0.00 0.00 51.96 51.04 1ynf s ALA 235 Cb -0.14 -0.31 -0.06 0.00 0.00 0.00 0.00 23.12 22.61 1ynf s ALA 235 CO 0.02 0.31 0.50 -1.14 0.00 0.00 0.00 175.76 175.45 1ynf s GLN 236 N -0.61 4.11 0.54 0.00 0.74 -1.26 -1.91 119.66 121.27 1ynf s GLN 236 Ca 0.05 0.59 -0.19 0.00 0.05 0.00 0.00 55.36 55.86 1ynf s GLN 236 Cb -0.07 -3.25 -0.06 0.00 1.10 0.00 0.00 33.01 30.73 1ynf s GLN 236 CO 0.00 0.61 1.11 -1.14 -0.55 0.00 0.00 175.29 175.32 1ynf s GLN 237 N -0.90 3.41 -0.07 1.67 2.00 0.83 -1.84 119.66 124.75 1ynf s GLN 237 Ca 0.27 1.56 -0.30 0.00 -2.00 0.00 0.00 55.36 54.89 1ynf s GLN 237 Cb -0.18 -2.02 -0.05 0.00 0.80 0.00 0.00 33.01 31.56 1ynf s GLN 237 CO 0.16 -0.79 1.67 1.21 -0.50 0.00 0.00 175.29 177.03 1ynf s ASN 238 N -1.86 6.62 0.53 6.67 2.47 -0.54 -4.29 114.94 124.55 1ynf s ASN 238 Ca 0.71 2.19 0.19 0.00 0.42 0.00 0.00 52.86 56.37 1ynf s ASN 238 Cb -0.22 -2.53 1.37 0.00 -1.45 0.00 0.00 41.25 38.41 1ynf s ASN 238 CO 0.26 -0.97 2.16 1.55 -3.72 0.00 0.00 177.10 176.39 1ynf h PRO 239 N 9.73 0.00 -0.03 0.43 0.13 -1.91 -2.23 132.00 138.13 1ynf h PRO 239 Ca -0.39 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.62 1ynf h PRO 239 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1ynf h PRO 239 CO 0.96 0.00 -0.53 -0.44 -0.23 0.00 0.00 178.00 177.76 1ynf h ASP 240 N 0.00 0.09 0.74 1.44 5.19 -1.93 -2.56 116.42 119.39 1ynf h ASP 240 Ca 0.01 -0.04 -0.20 0.00 -0.62 0.00 0.00 57.03 56.17 1ynf h ASP 240 Cb 0.03 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.50 1ynf h ASP 240 CO -0.00 0.60 -0.93 1.62 -3.12 0.00 0.00 179.24 177.42 1ynf h VAL 241 N 0.06 1.57 -0.46 -1.35 3.04 -1.67 -3.14 116.25 114.30 1ynf h VAL 241 Ca -0.00 -2.89 -0.04 0.00 -1.01 0.00 0.00 66.70 62.75 1ynf h VAL 241 Cb 0.96 2.61 -0.02 0.00 -2.01 0.00 0.00 31.29 32.83 1ynf h VAL 241 CO 0.07 0.83 0.13 0.40 -1.01 0.00 0.00 177.57 177.99 1ynf h ILE 242 N 0.05 1.23 0.00 3.17 2.04 -1.35 -1.53 117.51 121.13 1ynf h ILE 242 Ca -0.04 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.04 1ynf h ILE 242 Cb 1.60 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 1ynf h ILE 242 CO 0.13 0.28 0.00 0.47 0.00 0.00 0.00 178.15 179.03 1ynf n ASP 243 N -4.52 0.04 -0.91 1.72 8.00 -0.98 -1.71 116.55 118.19 1ynf n ASP 243 Ca 0.01 0.51 0.12 0.00 0.71 0.00 0.00 54.79 56.14 1ynf n ASP 243 Cb 0.20 -0.52 0.09 0.00 -0.02 0.00 0.00 41.12 40.87 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 -1.55 2.17 0.00 -1.24 6.02 -0.61 -4.81 117.38 117.36 1ynf n GLN 244 Ca 0.02 -1.85 0.00 0.00 -0.01 0.00 0.00 57.00 55.16 1ynf n GLN 244 Cb 0.09 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 29.90 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 1.30 0.91 3.49 1.08 0.00 -0.69 -4.91 105.19 106.37 1ynf n GLY 245 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.61 4.65 -1.27 1.61 1.01 -0.99 -4.80 120.40 118.99 1ynf s VAL 246 Ca 0.00 -2.00 0.29 0.00 0.00 0.00 0.00 61.98 60.27 1ynf s VAL 246 Cb 0.00 -4.95 0.37 0.00 0.00 0.00 0.00 36.38 31.80 1ynf s VAL 246 CO 0.00 -1.71 1.93 2.22 0.00 0.00 0.00 175.10 177.54 1ynf n PHE 247 N 6.80 0.00 -3.84 5.22 1.16 -1.26 -4.19 117.46 121.34 1ynf n PHE 247 Ca 0.35 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.82 1ynf n PHE 247 Cb 0.46 -0.34 -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 -2.74 0.04 0.44 2.97 3.76 -1.26 -4.69 115.29 113.80 1ynf s HIS 248 Ca 0.22 -0.22 0.11 0.00 -0.15 0.00 0.00 55.06 55.02 1ynf s HIS 248 Cb 0.20 -0.03 1.00 0.00 1.11 0.00 0.00 32.58 34.86 1ynf s HIS 248 CO 0.51 -0.40 2.07 -0.97 -0.85 0.00 0.00 174.74 175.10 1ynf h ASN 249 N 3.63 0.33 0.00 1.40 -1.24 -1.87 -2.60 115.58 115.23 1ynf h ASN 249 Ca -0.32 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.69 1ynf h ASN 249 Cb 1.19 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 40.16 1ynf h ASN 249 CO 0.46 0.23 0.00 -0.90 -1.29 0.00 0.00 177.43 175.94 1ynf n ASP 250 N -4.49 0.36 -0.07 1.15 5.75 -0.56 -1.21 116.55 117.48 1ynf n ASP 250 Ca 0.02 -1.15 0.02 0.00 -0.01 0.00 0.00 54.79 53.67 1ynf n ASP 250 Cb 0.11 -0.18 -0.00 0.00 -1.03 0.00 0.00 41.12 40.02 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 -0.06 0.00 -0.13 2.12 0.31 -0.98 -3.04 118.33 116.55 1ynf n VAL 251 Ca 0.00 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 1ynf n VAL 251 Cb 0.09 1.04 0.00 0.00 -0.91 0.00 0.00 33.84 34.06 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 -0.40 0.00 -3.55 2.52 0.13 -0.57 -4.39 119.36 113.12 1ynf n ILE 252 Ca 0.01 -0.16 -0.13 0.00 -1.10 0.00 0.00 62.75 61.37 1ynf n ILE 252 Cb 0.07 1.13 -0.05 0.00 -0.84 0.00 0.00 39.64 39.95 1ynf n ILE 252 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1ynf s ALA 253 N -0.26 -1.86 -0.09 1.51 0.00 -0.35 -2.06 121.76 118.64 1ynf s ALA 253 Ca 0.00 1.41 -0.12 0.00 0.00 0.00 0.00 51.96 53.25 1ynf s ALA 253 Cb 0.00 -0.32 0.03 0.00 0.00 0.00 0.00 23.12 22.83 1ynf s ALA 253 CO 0.00 -0.39 0.32 0.54 0.00 0.00 0.00 175.76 176.23 1ynf s VAL 254 N -1.45 0.02 0.32 0.00 0.11 0.03 -3.99 120.40 115.44 1ynf s VAL 254 Ca -0.04 -0.13 0.10 0.00 -2.93 0.00 0.00 61.98 58.98 1ynf s VAL 254 Cb -0.00 -0.50 -0.06 0.00 -1.53 0.00 0.00 36.38 34.29 1ynf s VAL 254 CO 0.02 -0.07 -0.11 -0.94 -3.33 0.00 0.00 175.10 170.67 1ynf s SER 255 N -0.23 3.80 -0.30 3.54 1.04 -1.26 -0.64 113.70 119.65 1ynf s SER 255 Ca -0.04 -1.08 -0.17 0.00 0.48 0.00 0.00 55.95 55.15 1ynf s SER 255 Cb -0.03 -0.39 0.18 0.00 0.10 0.00 0.00 66.02 65.88 1ynf s SER 255 CO 0.01 -0.12 1.11 0.21 0.98 0.00 0.00 173.24 175.44 1ynf s ASN 256 N -3.60 -0.37 1.90 7.02 2.47 -0.27 -4.78 114.94 117.31 1ynf s ASN 256 Ca 0.32 0.49 0.00 0.00 0.42 0.00 0.00 52.86 54.09 1ynf s ASN 256 Cb -0.01 1.41 0.00 0.00 -1.45 0.00 0.00 41.25 41.21 1ynf s ASN 256 CO 0.17 -0.07 0.00 0.54 -3.72 0.00 0.00 177.10 174.02 1ynf n ARG 257 N 4.85 0.00 -0.03 0.43 5.12 -1.26 -1.29 116.66 124.49 1ynf n ARG 257 Ca -0.08 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 55.97 1ynf n ARG 257 Cb 0.54 0.00 0.30 0.00 -1.16 0.00 0.00 32.46 32.13 1ynf n ARG 257 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ynf n GLN 258 N 12.92 2.04 -4.14 5.56 0.00 -1.02 -0.01 117.38 132.74 1ynf n GLN 258 Ca 0.00 -1.53 -0.36 0.00 0.00 0.00 0.00 57.00 55.11 1ynf n GLN 258 Cb 0.00 -1.47 -0.08 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 -1.92 4.89 -0.29 -0.39 1.01 -0.41 -4.30 120.40 118.99 1ynf s VAL 259 Ca 0.33 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.29 1ynf s VAL 259 Cb 0.20 -3.10 0.09 0.00 0.00 0.00 0.00 36.38 33.58 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 -0.95 2.72 -0.46 3.92 2.96 -1.26 -1.12 118.68 124.49 1ynf s LEU 260 Ca 0.14 -1.60 -0.22 0.00 -0.22 0.00 0.00 54.13 52.23 1ynf s LEU 260 Cb -0.12 -1.05 0.03 0.00 0.50 0.00 0.00 46.19 45.56 1ynf s LEU 260 CO 0.03 -0.37 0.75 0.12 -1.32 0.00 0.00 176.35 175.56 1ynf s PHE 261 N 1.46 3.00 0.13 5.38 5.36 0.18 -1.55 117.98 131.94 1ynf s PHE 261 Ca 0.07 0.02 -0.05 0.00 -0.96 0.00 0.00 56.93 56.01 1ynf s PHE 261 Cb -0.18 -3.60 -0.02 0.00 -0.34 0.00 0.00 43.02 38.88 1ynf s PHE 261 CO -0.17 -0.99 0.14 0.00 -1.46 0.00 0.00 175.22 172.74 1ynf s HIS 263 N -3.99 3.41 0.48 0.00 2.46 -0.87 -0.76 115.29 116.02 1ynf s HIS 263 Ca 0.18 1.20 0.19 0.00 0.47 0.00 0.00 55.06 57.10 1ynf s HIS 263 Cb 0.06 -2.54 1.27 0.00 -0.13 0.00 0.00 32.58 31.23 1ynf s HIS 263 CO -0.01 -0.04 2.08 -0.56 -2.47 0.00 0.00 174.74 173.74 1ynf h GLN 264 N 1.72 0.00 -0.69 2.88 3.07 -1.63 -2.02 115.11 118.44 1ynf h GLN 264 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.26 1ynf h GLN 264 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.74 1ynf h GLN 264 CO 0.64 0.10 0.00 1.04 0.09 0.00 0.00 178.83 180.70 1ynf n GLN 265 N -4.19 3.92 -0.02 0.06 6.02 -1.26 -4.59 117.38 117.32 1ynf n GLN 265 Ca -0.03 -2.35 -0.13 0.00 -0.01 0.00 0.00 57.00 54.48 1ynf n GLN 265 Cb 0.18 -2.08 -0.10 0.00 1.02 0.00 0.00 30.24 29.26 1ynf n GLN 265 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ynf h ALA 266 N 3.50 0.01 -3.61 -1.58 0.00 -1.68 -3.42 119.26 112.47 1ynf h ALA 266 Ca 0.00 -0.28 -0.67 0.00 0.00 0.00 0.00 54.91 53.96 1ynf h ALA 266 Cb 1.61 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 19.23 1ynf h ALA 266 CO 0.37 -0.21 -0.74 -0.06 0.00 0.00 0.00 179.25 178.61 1ynf s PHE 267 N -3.99 2.75 0.13 0.00 0.40 -1.26 -1.46 117.98 114.54 1ynf s PHE 267 Ca -0.16 -0.15 -0.27 0.00 -0.60 0.00 0.00 56.93 55.75 1ynf s PHE 267 Cb 0.01 -1.47 -0.05 0.00 0.51 0.00 0.00 43.02 42.03 1ynf s PHE 267 CO 0.68 0.40 1.61 0.00 0.70 0.00 0.00 175.22 178.61 1ynf h ALA 268 N 3.87 -0.46 -1.89 5.36 0.00 -1.55 -2.97 119.26 121.62 1ynf h ALA 268 Ca -0.49 -0.01 -0.63 0.00 0.00 0.00 0.00 54.91 53.79 1ynf h ALA 268 Cb 1.17 0.61 -0.39 0.00 0.00 0.00 0.00 17.79 19.17 1ynf h ALA 268 CO 0.52 -0.84 -0.37 0.54 0.00 0.00 0.00 179.25 179.10 1ynf n ARG 269 N -5.42 3.53 -0.19 0.00 1.74 -1.26 -4.91 116.66 110.14 1ynf n ARG 269 Ca -0.04 -4.67 -0.07 0.00 -0.77 0.00 0.00 57.85 52.30 1ynf n ARG 269 Cb 0.33 -2.27 -0.01 0.00 -1.02 0.00 0.00 32.46 29.49 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 3.02 -0.20 -0.59 5.56 4.15 -1.90 -1.03 115.11 124.12 1ynf h GLN 270 Ca 0.25 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.79 1ynf h GLN 270 Cb 0.56 0.04 -0.12 0.00 0.21 0.00 0.00 27.48 28.18 1ynf h GLN 270 CO 0.91 -0.13 -0.27 0.77 -1.93 0.00 0.00 178.83 178.17 1ynf h SER 271 N -0.20 -0.96 -0.56 -0.69 0.02 -1.91 0.16 113.55 109.42 1ynf h SER 271 Ca 0.20 0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.36 1ynf h SER 271 Cb 0.56 0.51 -0.03 0.00 0.14 0.00 0.00 62.40 63.58 1ynf h SER 271 CO -0.67 -0.28 0.32 1.56 -1.14 0.00 0.00 176.83 176.62 1ynf h GLN 272 N -0.12 0.77 0.06 3.45 4.20 -1.77 -2.09 115.11 119.61 1ynf h GLN 272 Ca 0.26 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 1ynf h GLN 272 Cb 0.53 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1ynf h GLN 272 CO -0.66 0.58 -0.03 1.25 -0.67 0.00 0.00 178.83 179.30 1ynf h LEU 273 N 0.75 -0.06 -0.58 1.46 5.85 0.03 -1.67 115.31 121.09 1ynf h LEU 273 Ca 0.20 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1ynf h LEU 273 Cb 0.02 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1ynf h LEU 273 CO -0.03 0.02 0.38 -0.07 -0.34 0.00 0.00 178.44 178.39 1ynf h LEU 274 N -0.14 0.67 -0.61 2.25 3.38 -0.95 -0.54 115.31 119.37 1ynf h LEU 274 Ca -0.01 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.97 1ynf h LEU 274 Cb 0.12 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1ynf h LEU 274 CO 0.01 0.50 0.36 0.00 0.09 0.00 0.00 178.44 179.40 1ynf h ALA 275 N 1.20 0.80 -0.46 1.53 0.00 -1.29 0.13 119.26 121.17 1ynf h ALA 275 Ca 0.21 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1ynf h ALA 275 Cb -0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1ynf h ALA 275 CO -0.04 0.07 0.30 -0.97 0.00 0.00 0.00 179.25 178.61 1ynf h ASN 276 N 0.69 0.52 -0.72 0.00 -0.00 -0.70 -1.61 115.58 113.77 1ynf h ASN 276 Ca 0.26 -0.01 -0.04 0.00 -0.00 0.00 0.00 56.30 56.51 1ynf h ASN 276 Cb 0.08 -0.13 -0.03 0.00 -0.00 0.00 0.00 38.32 38.24 1ynf h ASN 276 CO -0.13 0.38 0.30 -0.07 -0.00 0.00 0.00 177.43 177.90 1ynf h LEU 277 N 0.62 0.98 -0.94 0.34 4.07 -0.48 -1.37 115.31 118.52 1ynf h LEU 277 Ca 0.17 -0.16 0.05 0.00 0.08 0.00 0.00 57.88 58.02 1ynf h LEU 277 Cb -0.06 -0.25 -0.06 0.00 1.08 0.00 0.00 40.66 41.37 1ynf h LEU 277 CO -0.04 0.87 0.60 0.03 -1.08 0.00 0.00 178.44 178.82 1ynf h ARG 278 N 1.02 1.09 -0.01 1.13 3.08 -0.53 0.70 114.38 120.87 1ynf h ARG 278 Ca 0.24 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 60.09 1ynf h ARG 278 Cb 0.19 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1ynf h ARG 278 CO -0.02 0.72 -0.64 0.00 -1.07 0.00 0.00 179.97 178.95 1ynf h ALA 279 N 1.41 0.91 0.00 0.04 0.00 -0.86 -3.34 119.26 117.42 1ynf h ALA 279 Ca 0.39 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1ynf h ALA 279 Cb 0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1ynf h ALA 279 CO -0.15 0.79 -1.95 0.54 0.00 0.00 0.00 179.25 178.48 1ynf n ARG 280 N -3.79 0.64 -3.88 0.00 1.74 -0.56 -4.89 116.66 105.92 1ynf n ARG 280 Ca -0.01 -0.17 -0.36 0.00 -0.77 0.00 0.00 57.85 56.54 1ynf n ARG 280 Cb 0.64 -1.48 -0.14 0.00 -1.02 0.00 0.00 32.46 30.47 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 -3.31 3.27 0.15 1.55 1.01 0.24 -5.07 120.40 118.24 1ynf s VAL 281 Ca -0.08 -1.03 -0.31 0.00 0.00 0.00 0.00 61.98 60.56 1ynf s VAL 281 Cb 0.12 -2.74 -0.11 0.00 0.00 0.00 0.00 36.38 33.65 1ynf s VAL 281 CO 0.83 0.06 1.80 0.21 0.00 0.00 0.00 175.10 178.00 1ynf s ASN 282 N 1.36 6.41 0.00 3.32 2.47 -1.26 -1.45 114.94 125.79 1ynf s ASN 282 Ca -0.01 2.79 0.00 0.00 0.42 0.00 0.00 52.86 56.07 1ynf s ASN 282 Cb -0.18 -2.58 0.00 0.00 -1.45 0.00 0.00 41.25 37.05 1ynf s ASN 282 CO -0.01 -0.99 0.00 0.61 -3.72 0.00 0.00 177.10 172.98 1ynf n GLY 283 N 4.16 0.44 3.07 1.21 0.00 -1.26 -4.74 105.19 108.07 1ynf n GLY 283 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.42 -2.78 -3.63 1.61 -0.00 -0.53 -4.88 117.46 104.83 1ynf n PHE 284 Ca 0.00 -0.24 -0.03 0.00 -0.00 0.00 0.00 57.45 57.18 1ynf n PHE 284 Cb 0.11 -1.37 -0.05 0.00 -0.00 0.00 0.00 39.48 38.17 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 -2.05 -0.51 3.13 0.00 -1.26 -4.91 121.76 114.07 1ynf s ALA 286 Ca 0.44 2.35 -0.09 0.00 0.00 0.00 0.00 51.96 54.66 1ynf s ALA 286 Cb -0.08 -1.69 0.13 0.00 0.00 0.00 0.00 23.12 21.48 1ynf s ALA 286 CO 0.38 -0.74 0.39 0.42 0.00 0.00 0.00 175.76 176.21 1ynf s ILE 287 N 2.43 4.25 -0.13 0.00 1.01 -0.59 -4.98 121.20 123.19 1ynf s ILE 287 Ca -0.07 -1.97 -0.16 0.00 0.00 0.00 0.00 60.65 58.45 1ynf s ILE 287 Cb -0.09 -3.78 -0.04 0.00 0.01 0.00 0.00 42.46 38.55 1ynf s ILE 287 CO -0.19 -0.81 0.38 -1.61 0.00 0.00 0.00 174.94 172.71 1ynf s GLU 288 N 1.11 4.26 -0.41 2.79 2.02 -1.25 -1.65 118.70 125.58 1ynf s GLU 288 Ca 0.08 0.27 -0.18 0.00 0.02 0.00 0.00 54.97 55.16 1ynf s GLU 288 Cb -0.24 -3.41 0.01 0.00 0.10 0.00 0.00 34.13 30.59 1ynf s GLU 288 CO -0.02 0.24 0.50 0.08 0.02 0.00 0.00 175.26 176.08 1ynf s VAL 289 N 0.42 5.01 0.44 2.63 1.01 0.06 -4.85 120.40 125.12 1ynf s VAL 289 Ca 0.21 -0.07 -0.25 0.00 0.00 0.00 0.00 61.98 61.87 1ynf s VAL 289 Cb -0.14 -4.05 -0.08 0.00 0.00 0.00 0.00 36.38 32.11 1ynf s VAL 289 CO 0.07 -0.40 1.29 -2.16 0.00 0.00 0.00 175.10 173.90 1ynf s PRO 290 N 2.35 3.78 0.47 2.72 0.04 -1.26 -1.62 135.00 141.49 1ynf s PRO 290 Ca 0.16 2.10 0.15 0.00 0.04 0.00 0.00 61.00 63.45 1ynf s PRO 290 Cb -0.16 -2.60 1.13 0.00 0.04 0.00 0.00 34.50 32.91 1ynf s PRO 290 CO 0.15 -0.63 2.06 0.00 0.04 0.00 0.00 177.00 178.62 1ynf h ALA 291 N 2.33 2.01 -0.81 8.56 0.00 -1.97 -1.69 119.26 127.70 1ynf h ALA 291 Ca -0.50 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.45 1ynf h ALA 291 Cb 1.26 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 1ynf h ALA 291 CO 0.61 -0.07 0.50 1.79 0.00 0.00 0.00 179.25 182.08 1ynf h THR 292 N 0.24 1.07 0.10 0.00 1.35 -2.00 -2.98 112.91 110.68 1ynf h THR 292 Ca 0.15 -0.32 -0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1ynf h THR 292 Cb 0.28 0.04 0.00 0.00 -1.73 0.00 0.00 68.15 66.74 1ynf h THR 292 CO -0.03 0.17 -0.05 1.56 -0.25 0.00 0.00 175.52 176.93 1ynf h GLN 293 N 0.94 -0.13 -3.54 4.72 1.08 -1.70 -3.44 115.11 113.04 1ynf h GLN 293 Ca 0.34 0.01 -0.40 0.00 -1.45 0.00 0.00 58.65 57.15 1ynf h GLN 293 Cb 0.10 0.03 -0.38 0.00 -0.05 0.00 0.00 27.48 27.18 1ynf h GLN 293 CO -0.15 0.38 -0.75 0.08 -0.95 0.00 0.00 178.83 177.44 1ynf s VAL 294 N -3.58 0.15 0.84 -0.54 1.01 -0.87 -4.86 120.40 112.55 1ynf s VAL 294 Ca -0.14 0.25 -0.12 0.00 0.00 0.00 0.00 61.98 61.97 1ynf s VAL 294 Cb 0.00 -0.35 0.09 0.00 0.00 0.00 0.00 36.38 36.13 1ynf s VAL 294 CO 0.56 0.22 1.12 -0.94 0.00 0.00 0.00 175.10 176.06 1ynf s SER 295 N 1.99 4.16 0.21 3.32 1.04 -1.19 -4.10 113.70 119.13 1ynf s SER 295 Ca 0.04 1.08 -0.07 0.00 0.48 0.00 0.00 55.95 57.48 1ynf s SER 295 Cb -0.12 -1.73 0.16 0.00 0.10 0.00 0.00 66.02 64.43 1ynf s SER 295 CO -0.04 -2.15 1.71 0.58 0.98 0.00 0.00 173.24 174.32 1ynf h VAL 296 N -1.22 1.26 -0.35 5.02 2.07 -1.98 -1.03 116.25 120.02 1ynf h VAL 296 Ca -0.48 -1.02 0.03 0.00 0.82 0.00 0.00 66.70 66.05 1ynf h VAL 296 Cb 1.30 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1ynf h VAL 296 CO 0.62 0.38 0.15 -1.28 0.02 0.00 0.00 177.57 177.45 1ynf h SER 297 N 0.98 0.19 -0.74 0.57 0.87 -1.92 0.54 113.55 114.04 1ynf h SER 297 Ca 0.20 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.76 1ynf h SER 297 Cb 0.43 -0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.35 1ynf h SER 297 CO 0.01 0.15 0.36 0.44 -0.53 0.00 0.00 176.83 177.26 1ynf h ASP 298 N 0.31 0.98 -0.31 6.23 3.45 -1.85 -1.54 116.42 123.70 1ynf h ASP 298 Ca 0.15 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.50 1ynf h ASP 298 Cb 0.10 -0.25 -0.02 0.00 -0.56 0.00 0.00 39.33 38.60 1ynf h ASP 298 CO -0.13 0.83 0.20 0.74 -1.57 0.00 0.00 179.24 179.31 1ynf h THR 299 N 1.07 1.08 -0.24 0.35 2.02 -0.14 -1.02 112.91 116.02 1ynf h THR 299 Ca 0.26 -0.14 -0.13 0.00 0.77 0.00 0.00 66.41 67.17 1ynf h THR 299 Cb 0.11 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 1ynf h THR 299 CO -0.03 0.08 -0.38 0.58 0.37 0.00 0.00 175.52 176.14 1ynf h VAL 300 N 0.42 1.29 0.02 3.16 2.07 -0.59 0.24 116.25 122.87 1ynf h VAL 300 Ca 0.11 -1.52 -0.21 0.00 0.82 0.00 0.00 66.70 65.90 1ynf h VAL 300 Cb -0.05 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1ynf h VAL 300 CO -0.03 0.48 -0.96 0.77 0.02 0.00 0.00 177.57 177.85 1ynf h SER 301 N 0.46 0.18 0.38 0.57 4.64 -1.12 -3.33 113.55 115.33 1ynf h SER 301 Ca 0.04 -0.17 -0.04 0.00 -0.47 0.00 0.00 61.79 61.16 1ynf h SER 301 Cb 0.87 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 1ynf h SER 301 CO 0.07 1.04 -1.65 0.35 -0.87 0.00 0.00 176.83 175.77 1ynf n THR 302 N -3.54 0.39 -2.93 2.95 -2.24 -0.40 -4.97 114.28 103.54 1ynf n THR 302 Ca -0.03 -0.56 -0.16 0.00 -2.27 0.00 0.00 64.05 61.04 1ynf n THR 302 Cb 0.88 -0.20 0.03 0.00 -2.10 0.00 0.00 70.33 68.94 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 -2.48 -1.56 -0.36 4.78 4.02 0.07 -4.13 117.16 117.51 1ynf n TYR 303 Ca -0.05 0.46 0.10 0.00 -0.01 0.00 0.00 57.90 58.40 1ynf n TYR 303 Cb 0.62 -3.55 0.28 0.00 -0.02 0.00 0.00 39.34 36.67 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 -1.24 0.86 -0.92 7.72 5.85 -1.85 -1.72 115.31 124.01 1ynf h LEU 304 Ca -0.38 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1ynf h LEU 304 Cb 1.26 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1ynf h LEU 304 CO 0.39 0.39 -0.06 0.49 -0.34 0.00 0.00 178.44 179.31 1ynf n PHE 305 N -4.69 0.00 -0.77 1.25 3.01 -1.26 -3.70 117.46 111.30 1ynf n PHE 305 Ca 0.21 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.47 1ynf n PHE 305 Cb 0.46 -0.03 0.12 0.00 -0.01 0.00 0.00 39.48 40.03 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 0.06 4.15 -4.95 4.37 4.05 -0.65 -4.36 115.26 117.94 1ynf n ASN 306 Ca 0.17 -3.26 -0.23 0.00 0.45 0.00 0.00 54.58 51.71 1ynf n ASN 306 Cb 0.37 -0.80 -0.01 0.00 1.23 0.00 0.00 39.78 40.57 1ynf n ASN 306 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1ynf s SER 307 N -0.78 6.16 -0.19 1.20 1.04 -1.24 -1.34 113.70 118.56 1ynf s SER 307 Ca 0.44 0.33 -0.11 0.00 0.48 0.00 0.00 55.95 57.10 1ynf s SER 307 Cb 0.37 -1.84 -0.05 0.00 0.10 0.00 0.00 66.02 64.60 1ynf s SER 307 CO 0.07 -0.38 0.17 -1.10 0.98 0.00 0.00 173.24 172.98 1ynf s GLN 308 N -4.34 4.20 -0.45 4.02 -0.21 -0.72 -4.65 119.66 117.52 1ynf s GLN 308 Ca 0.42 -0.14 -0.10 0.00 0.02 0.00 0.00 55.36 55.56 1ynf s GLN 308 Cb -0.10 -3.42 0.10 0.00 1.00 0.00 0.00 33.01 30.59 1ynf s GLN 308 CO 0.36 0.29 0.32 -1.17 -2.12 0.00 0.00 175.29 172.96 1ynf s LEU 309 N 0.38 5.49 0.23 2.90 2.96 -1.26 -0.67 118.68 128.71 1ynf s LEU 309 Ca 0.10 -1.70 0.02 0.00 -0.22 0.00 0.00 54.13 52.33 1ynf s LEU 309 Cb -0.11 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 1ynf s LEU 309 CO -0.01 -0.63 0.38 -0.76 -1.32 0.00 0.00 176.35 174.01 1ynf s LEU 310 N 1.42 4.25 -0.06 -0.68 1.43 -1.26 -4.75 118.68 119.02 1ynf s LEU 310 Ca 0.04 0.24 0.04 0.00 -1.03 0.00 0.00 54.13 53.42 1ynf s LEU 310 Cb -0.25 -3.02 -0.02 0.00 0.03 0.00 0.00 46.19 42.92 1ynf s LEU 310 CO 0.01 -0.08 -0.16 -0.44 0.23 0.00 0.00 176.35 175.91 1ynf s SER 311 N -3.64 3.86 0.50 2.29 0.01 -1.26 -4.83 113.70 110.63 1ynf s SER 311 Ca 0.36 -0.26 0.05 0.00 1.31 0.00 0.00 55.95 57.41 1ynf s SER 311 Cb -0.10 -0.89 0.03 0.00 0.21 0.00 0.00 66.02 65.27 1ynf s SER 311 CO 0.30 0.31 0.69 -0.13 0.41 0.00 0.00 173.24 174.83 1ynf s ARG 312 N -0.55 2.63 0.38 12.44 1.81 0.30 -5.01 118.95 130.96 1ynf s ARG 312 Ca 0.08 -1.05 0.15 0.00 -1.72 0.00 0.00 55.73 53.18 1ynf s ARG 312 Cb -0.11 -2.61 0.78 0.00 -0.45 0.00 0.00 34.95 32.55 1ynf s ARG 312 CO 0.01 -0.55 1.84 -0.44 -0.68 0.00 0.00 175.30 175.48 1ynf h ASP 313 N 0.31 0.00 -0.00 0.23 3.45 -1.99 -2.52 116.42 115.91 1ynf h ASP 313 Ca -0.40 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.06 1ynf h ASP 313 Cb 1.29 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.06 1ynf h ASP 313 CO 0.48 0.35 0.00 -0.90 -1.57 0.00 0.00 179.24 177.60 1ynf n ASP 314 N -4.00 0.01 0.00 6.45 3.85 -1.26 -4.87 116.55 116.74 1ynf n ASP 314 Ca -0.02 -1.08 0.00 0.00 -0.71 0.00 0.00 54.79 52.99 1ynf n ASP 314 Cb 0.40 -0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.17 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 0.96 0.70 0.67 6.12 0.00 -0.95 -5.24 105.19 107.46 1ynf n GLY 315 Ca 0.22 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.19 1ynf n GLY 315 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ynf n SER 316 N 0.00 -0.89 -3.67 1.61 2.88 -1.26 -4.75 113.62 107.54 1ynf n SER 316 Ca 0.00 -0.74 -0.15 0.00 -1.33 0.00 0.00 58.87 56.65 1ynf n SER 316 Cb 0.00 -0.19 -0.14 0.00 -0.75 0.00 0.00 64.21 63.13 1ynf n SER 316 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1ynf s LEU 319 N 0.00 -0.17 -0.31 2.46 1.43 -0.27 -0.54 118.68 121.28 1ynf s LEU 319 Ca 0.13 0.48 -0.13 0.00 -1.03 0.00 0.00 54.13 53.58 1ynf s LEU 319 Cb -0.01 0.52 -0.03 0.00 0.03 0.00 0.00 46.19 46.70 1ynf s LEU 319 CO 0.10 -0.24 0.29 -0.69 0.23 0.00 0.00 176.35 176.04 1ynf s VAL 320 N 2.31 5.24 0.24 -1.59 1.01 0.15 -0.47 120.40 127.29 1ynf s VAL 320 Ca 0.01 0.11 0.11 0.00 0.00 0.00 0.00 61.98 62.21 1ynf s VAL 320 Cb -0.12 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 1ynf s VAL 320 CO -0.07 0.07 -0.19 -0.76 0.00 0.00 0.00 175.10 174.15 1ynf s LEU 321 N 1.88 2.55 0.51 3.92 1.43 0.16 -1.75 118.68 127.38 1ynf s LEU 321 Ca 0.10 -0.99 -0.14 0.00 -1.03 0.00 0.00 54.13 52.07 1ynf s LEU 321 Cb -0.16 -0.97 -0.07 0.00 0.03 0.00 0.00 46.19 45.01 1ynf s LEU 321 CO 0.11 -0.01 0.93 -2.16 0.23 0.00 0.00 176.35 175.45 1ynf s PRO 322 N -3.37 3.83 0.56 1.29 0.04 -1.26 -1.18 135.00 134.90 1ynf s PRO 322 Ca 0.26 0.77 0.28 0.00 0.04 0.00 0.00 61.00 62.34 1ynf s PRO 322 Cb -0.04 -2.20 1.48 0.00 0.04 0.00 0.00 34.50 33.79 1ynf s PRO 322 CO 0.11 -0.27 1.98 0.37 0.04 0.00 0.00 177.00 179.24 1ynf h GLN 323 N 0.73 0.00 -0.09 4.56 4.15 -1.63 -1.54 115.11 121.29 1ynf h GLN 323 Ca -0.46 0.00 0.03 0.00 0.77 0.00 0.00 58.65 58.98 1ynf h GLN 323 Cb 1.19 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.87 1ynf h GLN 323 CO 0.62 0.00 0.09 0.93 -1.93 0.00 0.00 178.83 178.54 1ynf h GLU 324 N 0.00 0.00 0.00 1.69 3.07 -1.88 -0.87 114.58 116.58 1ynf h GLU 324 Ca 0.21 0.00 -0.13 0.00 -0.50 0.00 0.00 59.36 58.95 1ynf h GLU 324 Cb 1.00 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.89 1ynf h GLU 324 CO -0.00 0.00 -0.60 0.00 -1.40 0.00 0.00 179.01 177.01 1ynf h ARG 326 N 0.00 0.12 0.00 0.00 9.65 -1.34 -3.04 114.38 119.77 1ynf h ARG 326 Ca -0.01 -0.20 0.00 0.00 -1.10 0.00 0.00 59.98 58.68 1ynf h ARG 326 Cb 1.17 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.82 1ynf h ARG 326 CO 0.08 1.04 0.00 0.39 2.80 0.00 0.00 179.97 184.28 1ynf n GLU 327 N -3.39 0.03 -3.47 0.20 -0.58 -0.79 -4.54 120.64 108.09 1ynf n GLU 327 Ca -0.06 0.07 -0.43 0.00 -0.42 0.00 0.00 57.16 56.32 1ynf n GLU 327 Cb 0.99 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 30.28 1ynf n GLU 327 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1ynf s HIS 328 N -2.97 3.30 0.24 -0.32 2.46 -1.02 -4.96 115.29 112.02 1ynf s HIS 328 Ca 0.13 -1.32 -0.06 0.00 0.47 0.00 0.00 55.06 54.28 1ynf s HIS 328 Cb 0.16 -3.24 0.43 0.00 -0.13 0.00 0.00 32.58 29.80 1ynf s HIS 328 CO 0.45 -0.88 1.67 0.00 -2.47 0.00 0.00 174.74 173.51 1ynf h ALA 329 N 8.62 0.85 -0.41 1.58 0.00 -1.86 0.15 119.26 128.19 1ynf h ALA 329 Ca -0.26 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ynf h ALA 329 Cb 1.09 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1ynf h ALA 329 CO 0.86 -0.37 0.26 0.78 0.00 0.00 0.00 179.25 180.78 1ynf h GLY 330 N 0.20 0.59 0.71 0.00 0.00 -1.93 0.79 103.07 103.44 1ynf h GLY 330 Ca 0.40 -0.24 -0.07 0.00 0.00 0.00 0.00 47.33 47.42 1ynf h GLY 330 CO -0.54 0.23 -0.20 -2.08 0.00 0.00 0.00 176.54 173.95 1ynf h VAL 331 N 0.55 1.38 -0.89 4.60 2.07 -1.64 -2.44 116.25 119.89 1ynf h VAL 331 Ca 0.15 -1.46 0.01 0.00 0.82 0.00 0.00 66.70 66.22 1ynf h VAL 331 Cb -0.03 2.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 1ynf h VAL 331 CO -0.03 0.42 0.59 -0.25 0.02 0.00 0.00 177.57 178.32 1ynf h TRP 332 N -0.09 1.11 -0.29 1.57 2.91 -0.61 -0.28 115.95 120.27 1ynf h TRP 332 Ca 0.01 0.03 -0.00 0.00 1.13 0.00 0.00 58.89 60.05 1ynf h TRP 332 Cb 0.78 -0.38 -0.01 0.00 -0.51 0.00 0.00 29.16 29.04 1ynf h TRP 332 CO 0.10 0.70 0.18 0.78 -1.03 0.00 0.00 178.44 179.17 1ynf h GLY 333 N 1.19 0.43 1.00 2.65 0.00 -0.79 -1.55 103.07 106.00 1ynf h GLY 333 Ca 0.33 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.48 1ynf h GLY 333 CO -0.07 0.17 0.38 -1.82 0.00 0.00 0.00 176.54 175.19 1ynf h TYR 334 N 0.38 0.77 -0.90 5.60 3.20 -0.84 -2.42 116.97 122.77 1ynf h TYR 334 Ca 0.11 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 1ynf h TYR 334 Cb 0.00 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 37.97 1ynf h TYR 334 CO -0.05 0.51 0.56 -0.07 -1.64 0.00 0.00 178.16 177.47 1ynf h LEU 335 N 0.81 1.07 -1.20 2.82 3.38 -0.74 0.11 115.31 121.55 1ynf h LEU 335 Ca 0.22 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 1ynf h LEU 335 Cb -0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 1ynf h LEU 335 CO -0.04 0.81 -0.16 0.78 0.09 0.00 0.00 178.44 179.91 1ynf h ASN 336 N 1.23 0.34 -0.28 -0.43 2.35 -1.02 0.60 115.58 118.38 1ynf h ASN 336 Ca 0.32 -0.09 -0.11 0.00 -0.55 0.00 0.00 56.30 55.88 1ynf h ASN 336 Cb -0.08 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.20 1ynf h ASN 336 CO -0.06 0.53 -0.25 -0.33 -1.65 0.00 0.00 177.43 175.66 1ynf h GLU 337 N 0.33 0.67 -0.83 0.81 5.08 -0.85 -2.81 114.58 116.98 1ynf h GLU 337 Ca 0.06 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1ynf h GLU 337 Cb 0.48 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 1ynf h GLU 337 CO 0.03 0.95 0.50 1.25 -1.00 0.00 0.00 179.01 180.74 1ynf h LEU 338 N 0.41 0.99 -1.13 1.33 5.85 -0.30 -0.81 115.31 121.65 1ynf h LEU 338 Ca 0.05 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1ynf h LEU 338 Cb 0.81 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 1ynf h LEU 338 CO 0.06 0.76 0.59 0.25 -0.34 0.00 0.00 178.44 179.76 1ynf h LEU 339 N 1.14 1.02 0.00 2.25 5.85 -0.73 -2.63 115.31 122.20 1ynf h LEU 339 Ca 0.30 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.99 1ynf h LEU 339 Cb -0.05 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.73 1ynf h LEU 339 CO -0.06 0.74 -0.72 0.00 -0.34 0.00 0.00 178.44 178.06 1ynf h ALA 340 N 1.45 0.52 -2.35 1.25 0.00 -1.18 -3.44 119.26 115.51 1ynf h ALA 340 Ca 0.33 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.79 1ynf h ALA 340 Cb -0.13 0.00 0.16 0.00 0.00 0.00 0.00 17.79 17.82 1ynf h ALA 340 CO -0.07 0.00 0.18 0.00 0.00 0.00 0.00 179.25 179.36 1ynf s ALA 341 N -3.18 0.84 -1.06 0.00 0.00 -0.36 -4.92 121.76 113.08 1ynf s ALA 341 Ca 0.05 -0.40 -0.22 0.00 0.00 0.00 0.00 51.96 51.40 1ynf s ALA 341 Cb 0.13 -3.11 0.06 0.00 0.00 0.00 0.00 23.12 20.21 1ynf s ALA 341 CO 0.74 -2.94 1.47 0.34 0.00 0.00 0.00 175.76 175.37 1ynf s ASP 342 N -3.44 6.58 0.22 0.00 2.15 -1.26 -4.89 116.67 116.03 1ynf s ASP 342 Ca 0.66 -1.71 -0.23 0.00 0.43 0.00 0.00 52.55 51.70 1ynf s ASP 342 Cb -0.19 -2.55 0.04 0.00 -0.30 0.00 0.00 42.92 39.92 1ynf s ASP 342 CO 0.58 -1.40 0.79 0.54 -0.17 0.00 0.00 175.17 175.51 1ynf s ASN 343 N 4.69 -0.26 0.56 -0.34 2.20 -1.26 -5.06 114.94 115.46 1ynf s ASN 343 Ca 0.46 -0.48 0.30 0.00 -0.94 0.00 0.00 52.86 52.20 1ynf s ASN 343 Cb 0.00 0.63 1.67 0.00 -2.00 0.00 0.00 41.25 41.56 1ynf s ASN 343 CO -0.07 -1.16 2.16 -0.65 -2.94 0.00 0.00 177.10 174.45 1ynf h PRO 344 N 2.00 0.00 -6.12 3.55 0.11 -1.91 -3.43 132.00 126.19 1ynf h PRO 344 Ca -0.22 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.33 1ynf h PRO 344 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 1ynf h PRO 344 CO 0.25 0.06 1.36 0.42 -0.21 0.00 0.00 178.00 179.88 1ynf s ILE 345 N -4.33 3.33 -0.46 4.15 1.01 -1.26 -4.61 121.20 119.04 1ynf s ILE 345 Ca -0.04 0.32 0.04 0.00 0.00 0.00 0.00 60.65 60.97 1ynf s ILE 345 Cb 0.14 -3.51 0.05 0.00 0.01 0.00 0.00 42.46 39.14 1ynf s ILE 345 CO 0.55 -0.37 0.72 -1.20 0.00 0.00 0.00 174.94 174.64 1ynf n SER 346 N 11.35 1.52 -3.72 3.58 7.64 -1.26 -4.59 113.62 128.15 1ynf n SER 346 Ca 0.25 -1.33 -0.14 0.00 1.01 0.00 0.00 58.87 58.67 1ynf n SER 346 Cb 0.48 -0.02 -0.09 0.00 -1.01 0.00 0.00 64.21 63.57 1ynf n SER 346 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1ynf s GLU 347 N -0.46 0.59 -0.11 1.43 2.12 -1.26 -5.09 118.70 115.92 1ynf s GLU 347 Ca 0.05 0.42 0.03 0.00 0.36 0.00 0.00 54.97 55.83 1ynf s GLU 347 Cb 0.03 0.28 -0.00 0.00 0.26 0.00 0.00 34.13 34.70 1ynf s GLU 347 CO 0.05 -0.11 -0.21 -0.51 -0.54 0.00 0.00 175.26 173.94 1ynf s LEU 348 N -0.20 2.24 -0.10 2.70 1.43 -1.26 -1.12 118.68 122.36 1ynf s LEU 348 Ca -0.04 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.57 1ynf s LEU 348 Cb -0.03 -1.46 0.02 0.00 0.03 0.00 0.00 46.19 44.74 1ynf s LEU 348 CO 0.02 0.16 -0.13 -0.75 0.23 0.00 0.00 176.35 175.88 1ynf s LYS 349 N 0.36 1.95 -0.04 1.70 2.47 0.38 -4.95 119.74 121.61 1ynf s LYS 349 Ca -0.17 -0.45 0.02 0.00 -1.56 0.00 0.00 55.97 53.81 1ynf s LYS 349 Cb -0.17 -1.73 -0.03 0.00 -1.46 0.00 0.00 37.83 34.43 1ynf s LYS 349 CO 0.08 -0.11 -0.07 0.08 0.16 0.00 0.00 175.35 175.49 1ynf s VAL 350 N 1.15 3.70 0.04 4.02 1.01 -1.26 0.37 120.40 129.43 1ynf s VAL 350 Ca -0.04 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.41 1ynf s VAL 350 Cb -0.14 -2.55 -0.02 0.00 0.00 0.00 0.00 36.38 33.67 1ynf s VAL 350 CO -0.03 0.52 -0.16 -0.36 0.00 0.00 0.00 175.10 175.07 1ynf s PHE 351 N -0.88 1.37 -0.46 5.22 0.40 -0.33 -4.95 117.98 118.35 1ynf s PHE 351 Ca 0.14 -0.36 -0.23 0.00 -0.60 0.00 0.00 56.93 55.88 1ynf s PHE 351 Cb -0.11 -0.81 0.03 0.00 0.51 0.00 0.00 43.02 42.64 1ynf s PHE 351 CO 0.04 0.05 0.78 0.34 0.70 0.00 0.00 175.22 177.13 1ynf s ASP 352 N -1.18 6.40 -0.32 1.36 -1.08 -1.26 -1.50 116.67 119.08 1ynf s ASP 352 Ca 0.03 -0.15 0.13 0.00 -0.52 0.00 0.00 52.55 52.03 1ynf s ASP 352 Cb -0.08 -2.38 0.46 0.00 -1.46 0.00 0.00 42.92 39.46 1ynf s ASP 352 CO 0.01 -0.92 1.10 0.18 0.52 0.00 0.00 175.17 176.06 1ynf n LEU 353 N 6.72 3.31 -0.30 -1.34 4.77 -1.26 -4.86 117.00 124.04 1ynf n LEU 353 Ca 0.02 -4.20 0.03 0.00 -0.03 0.00 0.00 56.01 51.82 1ynf n LEU 353 Cb 0.48 -0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.74 1ynf n LEU 353 CO 0.59 1.75 1.15 0.03 -1.33 0.00 0.00 177.39 179.58 1ynf h ARG 354 N 2.55 0.80 -0.11 3.23 2.47 -1.95 -2.85 114.38 118.51 1ynf h ARG 354 Ca 0.13 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 1ynf h ARG 354 Cb 1.25 -0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 29.39 1ynf h ARG 354 CO 0.58 0.53 0.07 0.93 0.56 0.00 0.00 179.97 182.64 1ynf h GLU 355 N 0.82 0.15 -1.67 0.04 4.39 -1.94 0.16 114.58 116.53 1ynf h GLU 355 Ca 0.40 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.09 1ynf h GLU 355 Cb 0.36 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1ynf h GLU 355 CO -0.24 0.12 0.00 0.45 -1.16 0.00 0.00 179.01 178.18 1ynf n SER 356 N -5.00 1.20 0.00 1.42 2.88 -1.08 -3.55 113.62 109.49 1ynf n SER 356 Ca -0.05 -0.82 0.00 0.00 -1.33 0.00 0.00 58.87 56.67 1ynf n SER 356 Cb 0.04 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.29 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 0.93 0.00 -0.35 -1.46 0.00 0.04 -1.24 120.51 118.43 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 0.18 0.00 0.29 0.00 0.00 0.00 0.00 19.45 19.93 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 3.80 0.00 0.00 3.02 -1.23 -4.92 115.26 115.93 1ynf n ASN 359 Ca 0.00 -2.02 0.00 0.00 -0.03 0.00 0.00 54.58 52.53 1ynf n ASN 359 Cb 0.00 -0.45 0.00 0.00 -0.61 0.00 0.00 39.78 38.72 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 1.41 1.09 3.06 7.41 0.00 -0.99 -5.09 105.19 112.08 1ynf n GLY 360 Ca 0.22 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.35 1.06 0.00 -0.02 0.00 -0.37 -5.05 107.32 100.60 1ynf s GLY 361 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 43.96 1ynf s GLY 361 CO 0.00 0.23 0.00 0.61 0.00 0.00 0.00 173.10 173.94 1ynf n GLY 362 N 4.23 2.25 0.26 0.20 0.00 -1.26 -4.63 105.19 106.23 1ynf n GLY 362 Ca -0.19 -2.12 0.03 0.00 0.00 0.00 0.00 46.02 43.74 1ynf n GLY 362 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ynf h PRO 363 N 0.00 0.42 -0.22 1.61 0.11 -1.89 -2.42 132.00 129.61 1ynf h PRO 363 Ca 0.00 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 65.92 1ynf h PRO 363 Cb 0.00 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.01 1ynf h PRO 363 CO 0.00 0.28 -0.54 0.00 -0.21 0.00 0.00 178.00 177.52 1ynf h ALA 364 N 1.49 0.64 -0.59 -0.75 0.00 -1.47 -3.11 119.26 115.46 1ynf h ALA 364 Ca 0.37 -0.51 0.06 0.00 0.00 0.00 0.00 54.91 54.82 1ynf h ALA 364 Cb 0.51 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1ynf h ALA 364 CO -0.36 0.69 0.39 0.00 0.00 0.00 0.00 179.25 179.97 1ynf n LEU 366 N -4.47 0.34 -4.06 0.00 4.77 -1.09 -2.28 117.00 110.20 1ynf n LEU 366 Ca 0.08 -0.13 -0.14 0.00 -0.03 0.00 0.00 56.01 55.80 1ynf n LEU 366 Cb 0.23 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.20 1ynf n LEU 366 CO 0.34 0.06 -0.41 0.00 -1.33 0.00 0.00 177.39 176.06 1ynf s ARG 367 N -1.98 0.54 -0.19 3.23 1.04 -0.56 -1.73 118.95 119.32 1ynf s ARG 367 Ca 0.37 -0.74 0.01 0.00 -1.04 0.00 0.00 55.73 54.33 1ynf s ARG 367 Cb 0.18 -0.34 0.03 0.00 -2.04 0.00 0.00 34.95 32.77 1ynf s ARG 367 CO 0.29 0.06 -0.18 -1.17 -0.04 0.00 0.00 175.30 174.27 1ynf s LEU 368 N -1.50 2.24 -0.19 -1.89 2.96 0.90 -3.60 118.68 117.60 1ynf s LEU 368 Ca -0.09 -0.73 -0.26 0.00 -0.22 0.00 0.00 54.13 52.84 1ynf s LEU 368 Cb -0.10 -1.44 -0.01 0.00 0.50 0.00 0.00 46.19 45.14 1ynf s LEU 368 CO 0.00 -0.04 0.86 -0.13 -1.32 0.00 0.00 176.35 175.73 1ynf s ARG 369 N 1.30 4.28 -0.25 1.98 0.52 -1.26 -1.23 118.95 124.27 1ynf s ARG 369 Ca 0.03 1.06 0.00 0.00 -0.52 0.00 0.00 55.73 56.30 1ynf s ARG 369 Cb -0.14 -3.59 0.07 0.00 0.52 0.00 0.00 34.95 31.81 1ynf s ARG 369 CO -0.12 -0.40 0.01 0.08 0.02 0.00 0.00 175.30 174.89 1ynf s VAL 370 N 2.40 1.28 -0.13 3.52 1.01 -0.25 -4.83 120.40 123.40 1ynf s VAL 370 Ca 0.39 -1.26 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 1ynf s VAL 370 Cb -0.16 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 1ynf s VAL 370 CO 0.11 -0.30 1.23 -0.69 0.00 0.00 0.00 175.10 175.45 1ynf s VAL 371 N 1.48 4.30 -0.01 2.92 1.01 -1.26 -0.97 120.40 127.86 1ynf s VAL 371 Ca 0.00 1.59 0.04 0.00 0.00 0.00 0.00 61.98 63.61 1ynf s VAL 371 Cb -0.18 -4.03 -0.01 0.00 0.00 0.00 0.00 36.38 32.16 1ynf s VAL 371 CO -0.11 -0.10 -0.12 -0.76 0.00 0.00 0.00 175.10 174.02 1ynf s LEU 372 N 3.07 2.02 0.91 3.92 1.43 0.34 -4.64 118.68 125.73 1ynf s LEU 372 Ca 0.54 -0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 53.30 1ynf s LEU 372 Cb -0.22 -0.63 0.14 0.00 0.03 0.00 0.00 46.19 45.51 1ynf s LEU 372 CO 0.16 0.15 1.14 0.42 0.23 0.00 0.00 176.35 178.45 1ynf s THR 373 N -0.27 2.00 0.31 5.49 -4.23 -1.26 -1.11 115.64 116.58 1ynf s THR 373 Ca 0.04 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.55 1ynf s THR 373 Cb -0.05 -2.74 0.24 0.00 1.34 0.00 0.00 72.50 71.29 1ynf s THR 373 CO -0.00 0.00 1.95 -0.08 -0.54 0.00 0.00 174.62 175.95 1ynf h GLU 374 N -1.52 0.96 -0.38 3.99 4.81 -1.96 0.18 114.58 120.66 1ynf h GLU 374 Ca -0.51 -0.08 -0.15 0.00 -0.13 0.00 0.00 59.36 58.49 1ynf h GLU 374 Cb 1.33 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 1ynf h GLU 374 CO 0.62 0.68 -0.35 0.93 -0.73 0.00 0.00 179.01 180.16 1ynf h GLU 375 N 0.98 0.87 -0.20 1.92 4.39 -1.95 -2.49 114.58 118.10 1ynf h GLU 375 Ca 0.26 -0.43 -0.15 0.00 0.34 0.00 0.00 59.36 59.37 1ynf h GLU 375 Cb -0.04 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 1ynf h GLU 375 CO -0.05 1.08 -0.52 0.93 -1.16 0.00 0.00 179.01 179.29 1ynf h GLU 376 N 0.72 0.56 -0.89 2.33 5.08 -1.76 -2.25 114.58 118.36 1ynf h GLU 376 Ca 0.07 -0.33 0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1ynf h GLU 376 Cb 0.92 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.16 1ynf h GLU 376 CO 0.08 0.94 0.58 -0.09 -1.00 0.00 0.00 179.01 179.52 1ynf h ARG 377 N 0.44 1.19 -0.03 2.33 2.43 -0.55 -1.31 114.38 118.87 1ynf h ARG 377 Ca 0.02 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 59.01 1ynf h ARG 377 Cb 1.05 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 30.32 1ynf h ARG 377 CO 0.10 0.80 -0.42 0.00 -1.51 0.00 0.00 179.97 178.93 1ynf h ARG 378 N 1.22 0.07 0.00 0.20 2.47 -1.18 -3.02 114.38 114.14 1ynf h ARG 378 Ca 0.33 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 59.01 1ynf h ARG 378 Cb -0.12 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.20 1ynf h ARG 378 CO -0.07 0.48 0.00 0.00 0.56 0.00 0.00 179.97 180.95 1ynf h ALA 379 N 1.51 1.00 -2.70 0.04 0.00 -0.65 -3.46 119.26 115.00 1ynf h ALA 379 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.41 1ynf h ALA 379 Cb 0.77 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.61 1ynf h ALA 379 CO 0.06 0.00 0.49 0.08 0.00 0.00 0.00 179.25 179.88 1ynf s VAL 380 N -3.36 3.27 -0.35 0.00 1.01 -1.00 -4.50 120.40 115.47 1ynf s VAL 380 Ca 0.05 1.06 -0.36 0.00 0.00 0.00 0.00 61.98 62.74 1ynf s VAL 380 Cb 0.07 -3.60 -0.12 0.00 0.00 0.00 0.00 36.38 32.74 1ynf s VAL 380 CO 0.60 0.10 2.18 -3.20 0.00 0.00 0.00 175.10 174.77 1ynf n ASN 381 N 0.14 2.09 0.20 3.32 2.85 -0.58 -4.79 115.26 118.49 1ynf n ASN 381 Ca 0.04 0.44 0.17 0.00 -0.11 0.00 0.00 54.58 55.12 1ynf n ASN 381 Cb 0.47 -1.25 0.83 0.00 1.24 0.00 0.00 39.78 41.07 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 12.14 0.00 0.00 1.20 0.11 -1.89 -2.65 132.00 140.91 1ynf h PRO 382 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 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 1.02 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.81 1ynf n ALA 383 N -2.34 1.50 -3.40 -0.75 0.00 -1.26 -5.10 120.51 109.16 1ynf n ALA 383 Ca 0.02 0.01 -0.38 0.00 0.00 0.00 0.00 53.44 53.09 1ynf n ALA 383 Cb 0.33 -1.24 -0.04 0.00 0.00 0.00 0.00 19.45 18.50 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 -1.75 3.78 0.00 0.00 0.24 -1.00 -4.67 118.33 114.93 1ynf n VAL 384 Ca 0.02 -5.38 0.00 0.00 -2.04 0.00 0.00 64.34 56.94 1ynf n VAL 384 Cb 0.14 -2.31 0.00 0.00 -1.47 0.00 0.00 33.84 30.20 1ynf n VAL 384 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1ynf n ASN 387 N 1.94 0.00 -0.28 -1.34 0.23 -1.26 -1.14 115.26 113.41 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 0.19 0.00 -2.08 0.00 0.00 39.78 38.26 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 0.53 -0.05 0.53 5.19 -2.00 -0.54 116.42 120.08 1ynf h ASP 388 Ca 0.00 0.08 -0.00 0.00 -0.62 0.00 0.00 57.03 56.48 1ynf h ASP 388 Cb 0.00 -0.01 -0.00 0.00 0.18 0.00 0.00 39.33 39.50 1ynf h ASP 388 CO 0.00 0.26 0.02 0.74 -3.12 0.00 0.00 179.24 177.14 1ynf h THR 389 N 0.65 1.14 -0.44 0.35 2.02 -2.05 -1.11 112.91 113.46 1ynf h THR 389 Ca 0.42 -0.41 -0.05 0.00 0.77 0.00 0.00 66.41 67.13 1ynf h THR 389 Cb 0.52 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 1ynf h THR 389 CO -0.32 0.12 0.06 0.25 0.37 0.00 0.00 175.52 176.00 1ynf h LEU 390 N -0.08 0.71 -0.34 2.58 5.85 -1.90 -1.28 115.31 120.85 1ynf h LEU 390 Ca 0.02 -0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.52 1ynf h LEU 390 Cb 0.17 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1ynf h LEU 390 CO -0.00 0.80 0.06 0.15 -0.34 0.00 0.00 178.44 179.11 1ynf h PHE 391 N 0.60 0.10 -0.22 1.25 3.57 -1.02 0.14 116.94 121.35 1ynf h PHE 391 Ca 0.13 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.53 1ynf h PHE 391 Cb 0.40 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 1ynf h PHE 391 CO 0.03 0.01 -0.38 -0.91 -2.23 0.00 0.00 178.31 174.83 1ynf h ASN 392 N 0.18 0.52 -0.29 0.41 2.35 -1.10 -1.64 115.58 116.01 1ynf h ASN 392 Ca 0.16 -0.22 -0.05 0.00 -0.55 0.00 0.00 56.30 55.64 1ynf h ASN 392 Cb 0.18 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1ynf h ASN 392 CO -0.22 0.85 -0.01 0.00 -1.65 0.00 0.00 177.43 176.40 1ynf h ALA 393 N 1.18 0.39 -0.57 -0.83 0.00 -0.65 -1.96 119.26 116.81 1ynf h ALA 393 Ca 0.04 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1ynf h ALA 393 Cb 0.85 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1ynf h ALA 393 CO 0.07 0.14 0.01 -0.07 0.00 0.00 0.00 179.25 179.41 1ynf h LEU 394 N 0.30 0.97 -1.11 0.00 3.38 -0.69 -0.96 115.31 117.20 1ynf h LEU 394 Ca 0.08 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1ynf h LEU 394 Cb 0.45 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1ynf h LEU 394 CO 0.02 1.03 0.15 0.78 0.09 0.00 0.00 178.44 180.52 1ynf h ASN 395 N 0.88 0.73 -0.34 -0.43 2.35 -1.23 0.00 115.58 117.54 1ynf h ASN 395 Ca 0.16 -0.11 -0.09 0.00 -0.55 0.00 0.00 56.30 55.71 1ynf h ASN 395 Cb 0.53 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1ynf h ASN 395 CO 0.03 0.70 -0.12 0.44 -1.65 0.00 0.00 177.43 176.82 1ynf h ASP 396 N 0.77 0.69 -0.42 5.81 3.32 -1.09 -1.42 116.42 124.08 1ynf h ASP 396 Ca 0.17 -0.39 0.04 0.00 0.02 0.00 0.00 57.03 56.88 1ynf h ASP 396 Cb 0.24 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.56 1ynf h ASP 396 CO -0.01 0.92 0.18 -0.25 -1.72 0.00 0.00 179.24 178.36 1ynf h TRP 397 N 0.46 0.32 -0.30 4.55 7.01 -0.73 -1.48 115.95 125.78 1ynf h TRP 397 Ca 0.08 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 1ynf h TRP 397 Cb 0.64 -0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 27.61 1ynf h TRP 397 CO 0.05 0.14 0.14 0.28 -2.79 0.00 0.00 178.44 176.26 1ynf h VAL 398 N 0.36 1.16 0.00 2.65 2.07 -0.85 -1.88 116.25 119.76 1ynf h VAL 398 Ca 0.19 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1ynf h VAL 398 Cb 0.15 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1ynf h VAL 398 CO -0.17 0.17 -0.08 0.44 0.02 0.00 0.00 177.57 177.94 1ynf h ASP 399 N 0.35 0.00 0.03 0.57 3.32 -0.91 0.73 116.42 120.51 1ynf h ASP 399 Ca 0.10 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.03 1ynf h ASP 399 Cb 0.13 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.70 1ynf h ASP 399 CO -0.01 0.08 -0.49 0.03 -1.72 0.00 0.00 179.24 177.13 1ynf h ARG 400 N 0.00 0.28 0.00 3.56 3.08 -0.81 -3.41 114.38 117.08 1ynf h ARG 400 Ca -0.00 -0.34 -0.05 0.00 0.07 0.00 0.00 59.98 59.66 1ynf h ARG 400 Cb 0.16 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1ynf h ARG 400 CO 0.01 1.06 -1.92 0.66 -1.07 0.00 0.00 179.97 178.72 1ynf n TYR 401 N -4.32 0.00 -2.97 3.04 4.02 -0.75 -5.00 117.16 111.18 1ynf n TYR 401 Ca -0.11 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.39 1ynf n TYR 401 Cb 0.63 -0.50 -0.06 0.00 -0.02 0.00 0.00 39.34 39.40 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 -3.16 3.87 0.36 -0.72 1.51 0.24 -4.96 117.35 114.48 1ynf s TYR 402 Ca -0.07 1.61 -0.09 0.00 -1.01 0.00 0.00 57.07 57.51 1ynf s TYR 402 Cb 0.11 -2.80 -0.06 0.00 -0.11 0.00 0.00 41.96 39.10 1ynf s TYR 402 CO 0.77 0.45 0.69 1.03 -1.11 0.00 0.00 175.55 177.38 1ynf s ARG 403 N -0.84 3.73 0.13 -0.62 0.52 -1.26 -4.72 118.95 115.88 1ynf s ARG 403 Ca 0.37 0.31 0.24 0.00 -0.52 0.00 0.00 55.73 56.12 1ynf s ARG 403 Cb -0.23 -2.49 0.22 0.00 0.52 0.00 0.00 34.95 32.98 1ynf s ARG 403 CO 0.26 0.06 1.21 -0.44 0.02 0.00 0.00 175.30 176.41 1ynf h ASP 404 N 1.44 0.00 -3.79 0.23 5.19 -1.94 -2.11 116.42 115.44 1ynf h ASP 404 Ca -0.47 -0.20 -0.27 0.00 -0.62 0.00 0.00 57.03 55.47 1ynf h ASP 404 Cb 1.19 0.00 -0.28 0.00 0.18 0.00 0.00 39.33 40.41 1ynf h ASP 404 CO 0.65 0.10 -0.74 -0.13 -3.12 0.00 0.00 179.24 176.00 1ynf s ARG 405 N -3.21 0.18 -0.15 3.56 0.52 -1.26 -4.25 118.95 114.35 1ynf s ARG 405 Ca 0.04 -0.07 -0.24 0.00 -0.52 0.00 0.00 55.73 54.94 1ynf s ARG 405 Cb 0.13 -0.19 0.06 0.00 0.52 0.00 0.00 34.95 35.47 1ynf s ARG 405 CO 0.75 0.04 0.61 -1.17 0.02 0.00 0.00 175.30 175.55 1ynf s LEU 406 N -0.00 -0.35 0.12 2.53 2.96 -0.44 -4.93 118.68 118.56 1ynf s LEU 406 Ca 0.00 0.96 -0.00 0.00 -0.22 0.00 0.00 54.13 54.87 1ynf s LEU 406 Cb -0.01 2.19 -0.04 0.00 0.50 0.00 0.00 46.19 48.82 1ynf s LEU 406 CO -0.00 -0.37 0.02 0.42 -1.32 0.00 0.00 176.35 175.09 1ynf s THR 407 N -0.35 0.30 0.50 3.68 -4.23 -1.26 -0.86 115.64 113.41 1ynf s THR 407 Ca -0.05 -1.91 0.21 0.00 -1.18 0.00 0.00 61.69 58.76 1ynf s THR 407 Cb -0.03 -1.92 0.36 0.00 1.34 0.00 0.00 72.50 72.25 1ynf s THR 407 CO 0.04 -0.61 2.01 0.00 -0.54 0.00 0.00 174.62 175.52 1ynf h ALA 408 N 2.90 2.30 0.00 3.99 0.00 -1.82 -0.61 119.26 126.01 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 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1ynf h ALA 408 CO 0.62 -0.43 -0.13 0.00 0.00 0.00 0.00 179.25 179.31 1ynf h ALA 409 N 1.76 1.49 0.00 0.00 0.00 -1.96 -2.18 119.26 118.36 1ynf h ALA 409 Ca 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ynf h ALA 409 Cb 0.76 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1ynf h ALA 409 CO -0.03 0.16 0.00 -0.25 0.00 0.00 0.00 179.25 179.13 1ynf n ASP 410 N -3.95 0.45 0.22 0.00 8.00 -0.24 -3.46 116.55 117.59 1ynf n ASP 410 Ca -0.02 0.56 0.16 0.00 0.71 0.00 0.00 54.79 56.20 1ynf n ASP 410 Cb 0.22 -0.68 0.74 0.00 -0.02 0.00 0.00 41.12 41.38 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 -1.49 -1.89 115.31 115.96 1ynf h LEU 411 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ynf h LEU 411 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1ynf h LEU 411 CO 0.00 0.00 -0.40 0.00 0.09 0.00 0.00 178.44 178.13 1ynf n ALA 412 N -1.92 3.17 -2.13 1.53 0.00 -1.22 -4.87 120.51 115.07 1ynf n ALA 412 Ca -0.00 -0.28 -0.43 0.00 0.00 0.00 0.00 53.44 52.73 1ynf n ALA 412 Cb 0.15 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 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 -3.22 6.47 0.57 0.00 -1.08 -0.71 -4.80 116.67 113.92 1ynf s ASP 413 Ca 0.11 1.71 0.27 0.00 -0.52 0.00 0.00 52.55 54.12 1ynf s ASP 413 Cb 0.17 -2.53 1.71 0.00 -1.46 0.00 0.00 42.92 40.81 1ynf s ASP 413 CO 0.67 -1.16 2.23 1.55 0.52 0.00 0.00 175.17 178.97 1ynf h PRO 414 N 10.31 0.00 -0.41 4.34 0.13 -1.89 -1.60 132.00 142.89 1ynf h PRO 414 Ca -0.34 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.66 1ynf h PRO 414 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1ynf h PRO 414 CO 0.99 0.01 -0.26 0.37 -0.23 0.00 0.00 178.00 178.88 1ynf h GLN 415 N 0.00 0.85 -0.64 0.86 4.15 -1.95 -1.37 115.11 117.01 1ynf h GLN 415 Ca -0.00 -0.37 -0.05 0.00 0.77 0.00 0.00 58.65 59.00 1ynf h GLN 415 Cb 0.02 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.66 1ynf h GLN 415 CO 0.00 1.01 0.19 1.25 -1.93 0.00 0.00 178.83 179.35 1ynf h LEU 416 N 0.73 0.94 -0.11 -2.39 5.85 -1.61 -0.53 115.31 118.18 1ynf h LEU 416 Ca 0.09 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.61 1ynf h LEU 416 Cb 0.80 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 1ynf h LEU 416 CO 0.07 0.90 0.00 0.25 -0.34 0.00 0.00 178.44 179.32 1ynf h LEU 417 N 0.92 -0.04 -0.85 2.25 5.85 -1.26 -1.01 115.31 121.18 1ynf h LEU 417 Ca 0.21 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 1ynf h LEU 417 Cb 0.30 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1ynf h LEU 417 CO -0.01 -0.00 0.39 0.03 -0.34 0.00 0.00 178.44 178.52 1ynf h ARG 418 N 0.04 1.23 -0.43 1.25 3.08 -1.01 -1.78 114.38 116.76 1ynf h ARG 418 Ca 0.05 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 1ynf h ARG 418 Cb 0.05 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1ynf h ARG 418 CO -0.08 0.95 0.21 0.93 -1.07 0.00 0.00 179.97 180.91 1ynf h GLU 419 N 1.21 0.61 -0.39 0.04 5.08 -0.80 -2.18 114.58 118.15 1ynf h GLU 419 Ca 0.29 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.51 1ynf h GLU 419 Cb 0.14 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1ynf h GLU 419 CO -0.03 0.52 0.01 0.78 -1.00 0.00 0.00 179.01 179.29 1ynf h GLY 420 N 0.55 0.66 0.75 -3.84 0.00 -0.90 -0.68 103.07 99.61 1ynf h GLY 420 Ca 0.15 -0.40 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 1ynf h GLY 420 CO -0.02 0.38 -0.06 3.21 0.00 0.00 0.00 176.54 180.04 1ynf h ARG 421 N 0.59 0.31 -0.25 4.80 2.47 -1.10 -1.41 114.38 119.80 1ynf h ARG 421 Ca 0.12 -0.13 -0.01 0.00 -1.26 0.00 0.00 59.98 58.70 1ynf h ARG 421 Cb 0.35 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.65 1ynf h ARG 421 CO 0.01 0.62 0.11 1.49 0.56 0.00 0.00 179.97 182.76 1ynf h GLU 422 N -0.01 0.36 -0.31 0.04 4.81 -1.29 -0.88 114.58 117.30 1ynf h GLU 422 Ca 0.04 -0.06 0.07 0.00 -0.13 0.00 0.00 59.36 59.27 1ynf h GLU 422 Cb 0.52 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.78 1ynf h GLU 422 CO 0.02 0.39 -0.10 0.00 -0.73 0.00 0.00 179.01 178.59 1ynf h ALA 423 N 0.95 0.17 -0.29 2.92 0.00 -1.08 0.07 119.26 122.01 1ynf h ALA 423 Ca 0.08 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1ynf h ALA 423 Cb 0.16 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1ynf h ALA 423 CO -0.01 -0.49 -0.12 -0.07 0.00 0.00 0.00 179.25 178.56 1ynf h LEU 424 N -0.04 0.47 -0.49 0.00 3.38 -1.07 0.27 115.31 117.83 1ynf h LEU 424 Ca 0.15 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 1ynf h LEU 424 Cb 0.27 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1ynf h LEU 424 CO -0.34 0.63 -0.09 -0.78 0.09 0.00 0.00 178.44 177.95 1ynf h ASP 425 N 0.45 0.93 -0.44 -0.43 -0.00 -0.35 -0.78 116.42 115.81 1ynf h ASP 425 Ca 0.08 -0.35 -0.09 0.00 -0.00 0.00 0.00 57.03 56.67 1ynf h ASP 425 Cb 0.49 -0.25 -0.01 0.00 -0.00 0.00 0.00 39.33 39.55 1ynf h ASP 425 CO 0.03 1.06 -0.09 0.58 -0.00 0.00 0.00 179.24 180.82 1ynf h VAL 426 N 0.79 1.27 -0.63 2.25 2.07 -0.67 -2.96 116.25 118.37 1ynf h VAL 426 Ca 0.13 -1.19 -0.04 0.00 0.82 0.00 0.00 66.70 66.41 1ynf h VAL 426 Cb 0.64 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 1ynf h VAL 426 CO 0.04 0.41 0.23 0.25 0.02 0.00 0.00 177.57 178.52 1ynf h LEU 427 N 0.67 0.86 -1.92 2.57 5.85 -0.80 -1.10 115.31 121.44 1ynf h LEU 427 Ca 0.11 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1ynf h LEU 427 Cb 0.62 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 1ynf h LEU 427 CO 0.04 0.78 -0.11 0.77 -0.34 0.00 0.00 178.44 179.58 1ynf h SER 428 N 0.91 0.00 0.04 1.25 4.64 -1.00 1.00 113.55 120.39 1ynf h SER 428 Ca 0.21 0.00 -0.08 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 0.11 -0.34 1.56 -0.87 0.00 0.00 176.83 177.28 1ynf h GLN 429 N 0.00 0.15 -0.82 4.77 4.20 -1.17 0.65 115.11 122.90 1ynf h GLN 429 Ca -0.00 -0.22 0.02 0.00 0.06 0.00 0.00 58.65 58.51 1ynf h GLN 429 Cb 0.24 0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.05 1ynf h GLN 429 CO 0.01 1.05 0.53 1.25 -0.67 0.00 0.00 178.83 181.01 1ynf h LEU 430 N -0.64 0.90 -1.27 1.46 6.46 -0.58 -1.75 115.31 119.89 1ynf h LEU 430 Ca -0.05 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.69 1ynf h LEU 430 Cb 1.20 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.92 1ynf h LEU 430 CO 0.06 0.63 0.00 0.18 -0.62 0.00 0.00 178.44 178.69 1ynf n LEU 431 N -4.55 1.87 -3.75 2.25 4.77 0.29 -4.94 117.00 112.93 1ynf n LEU 431 Ca 0.09 -0.87 -0.26 0.00 -0.03 0.00 0.00 56.01 54.94 1ynf n LEU 431 Cb 0.06 -0.18 0.02 0.00 -2.33 0.00 0.00 43.42 40.99 1ynf n LEU 431 CO 0.35 0.43 -0.12 -3.20 -1.33 0.00 0.00 177.39 173.53 1ynf n ASN 432 N 0.49 -2.78 -0.00 -1.43 5.15 -0.66 -4.60 115.26 111.43 1ynf n ASN 432 Ca 0.14 -0.95 0.06 0.00 -0.60 0.00 0.00 54.58 53.23 1ynf n ASN 432 Cb 0.33 -3.54 -0.08 0.00 -0.53 0.00 0.00 39.78 35.96 1ynf n ASN 432 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1ynf n LEU 433 N -4.23 0.49 0.00 1.20 4.77 0.19 -5.01 117.00 114.41 1ynf n LEU 433 Ca -0.21 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 1ynf n LEU 433 Cb 0.64 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 1ynf n LEU 433 CO 0.69 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.49 1ynf n GLY 434 N 1.38 -0.76 3.39 -0.72 0.00 -1.20 -4.13 105.19 103.14 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 4.40 0.10 1.61 7.64 -1.26 -4.67 113.62 120.38 1ynf n SER 435 Ca 0.00 -2.87 0.08 0.00 1.01 0.00 0.00 58.87 57.09 1ynf n SER 435 Cb 0.00 -1.70 -0.01 0.00 -1.01 0.00 0.00 64.21 61.49 1ynf n SER 435 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 1ynf h VAL 436 N 5.28 0.17 -3.11 0.44 3.04 -1.94 -3.46 116.25 116.67 1ynf h VAL 436 Ca 0.45 -1.31 -0.58 0.00 -1.01 0.00 0.00 66.70 64.25 1ynf h VAL 436 Cb 0.82 1.71 -0.03 0.00 -2.01 0.00 0.00 31.29 31.78 1ynf h VAL 436 CO 1.54 0.09 -0.33 -0.31 -1.01 0.00 0.00 177.57 177.55 1ynf s TYR 437 N -3.22 3.48 0.23 3.17 1.51 -1.26 -4.80 117.35 116.46 1ynf s TYR 437 Ca -0.00 0.50 -0.06 0.00 -1.01 0.00 0.00 57.07 56.49 1ynf s TYR 437 Cb 0.09 -1.96 0.39 0.00 -0.11 0.00 0.00 41.96 40.37 1ynf s TYR 437 CO 0.78 0.44 1.72 -1.35 -1.11 0.00 0.00 175.55 176.04 1ynf h PRO 438 N 2.76 0.37 0.00 -1.71 0.11 -2.00 -0.45 132.00 131.08 1ynf h PRO 438 Ca -0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1ynf h PRO 438 Cb 1.17 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1ynf h PRO 438 CO 0.73 0.25 -0.03 0.27 -0.21 0.00 0.00 178.00 179.00 1ynf h PHE 439 N 0.38 0.00 -0.00 0.65 -5.15 -1.99 -0.59 116.94 110.24 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 0.56 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.73 1ynf h PHE 439 CO -0.19 0.03 -0.16 1.04 -2.00 0.00 0.00 178.31 177.03 1ynf n GLN 440 N -3.37 0.67 0.00 6.09 6.02 -0.19 -5.19 117.38 121.42 1ynf n GLN 440 Ca -0.02 -0.28 0.09 0.00 -0.01 0.00 0.00 57.00 56.78 1ynf n GLN 440 Cb 0.14 -1.49 0.07 0.00 1.02 0.00 0.00 30.24 29.98 1ynf n GLN 440 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59