#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nft n SER 5 N 0.00 6.17 -4.32 4.39 3.41 -1.26 -4.84 113.62 117.17 1nft n SER 5 Ca 0.00 -2.90 -0.32 0.00 -0.26 0.00 0.00 58.87 55.39 1nft n SER 5 Cb 0.00 -1.09 -0.15 0.00 -0.26 0.00 0.00 64.21 62.71 1nft n SER 5 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1nft s VAL 6 N -1.66 2.51 -0.17 -3.33 1.01 -1.26 -1.25 120.40 116.24 1nft s VAL 6 Ca 0.25 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 1nft s VAL 6 Cb 0.19 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 1nft s VAL 6 CO -0.01 0.56 -0.01 -0.63 0.00 0.00 0.00 175.10 175.01 1nft s ILE 7 N -0.03 4.06 -0.47 2.22 -1.09 -0.11 -4.93 121.20 120.85 1nft s ILE 7 Ca -0.06 -0.29 -0.15 0.00 -2.23 0.00 0.00 60.65 57.92 1nft s ILE 7 Cb -0.15 -2.81 0.08 0.00 -1.58 0.00 0.00 42.46 38.00 1nft s ILE 7 CO 0.05 0.47 0.40 -0.13 -1.23 0.00 0.00 174.94 174.49 1nft s ARG 8 N 0.57 2.96 0.05 2.79 0.52 -1.26 -1.67 118.95 122.90 1nft s ARG 8 Ca -0.01 -1.38 -0.28 0.00 -0.52 0.00 0.00 55.73 53.53 1nft s ARG 8 Cb -0.14 -4.12 -0.05 0.00 0.52 0.00 0.00 34.95 31.16 1nft s ARG 8 CO 0.02 -1.05 0.89 -0.46 0.02 0.00 0.00 175.30 174.73 1nft s TRP 9 N 1.63 3.73 -0.15 -0.53 -0.11 0.58 -0.61 118.94 123.48 1nft s TRP 9 Ca 0.04 1.64 -0.18 0.00 1.22 0.00 0.00 56.10 58.82 1nft s TRP 9 Cb -0.25 -2.99 -0.04 0.00 -1.50 0.00 0.00 33.47 28.69 1nft s TRP 9 CO 0.06 0.15 0.47 0.00 -4.62 0.00 0.00 176.95 173.01 1nft s THR 11 N 0.99 2.86 -0.02 0.00 -4.23 0.65 -4.77 115.64 111.12 1nft s THR 11 Ca 0.24 -2.01 0.02 0.00 -1.18 0.00 0.00 61.69 58.76 1nft s THR 11 Cb -0.15 -2.46 0.04 0.00 1.34 0.00 0.00 72.50 71.27 1nft s THR 11 CO 0.09 -0.25 0.84 1.33 -0.54 0.00 0.00 174.62 176.09 1nft n VAL 12 N -0.30 0.63 -3.61 2.29 0.24 -1.26 -1.33 118.33 114.99 1nft n VAL 12 Ca -0.09 -0.68 -0.11 0.00 -2.04 0.00 0.00 64.34 61.42 1nft n VAL 12 Cb 0.58 0.58 -0.04 0.00 -1.47 0.00 0.00 33.84 33.49 1nft n VAL 12 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1nft s SER 13 N -0.88 -0.33 0.17 -1.34 1.04 -1.26 -4.81 113.70 106.29 1nft s SER 13 Ca 0.04 -0.28 -0.05 0.00 0.48 0.00 0.00 55.95 56.14 1nft s SER 13 Cb 0.04 0.53 0.06 0.00 0.10 0.00 0.00 66.02 66.75 1nft s SER 13 CO 0.00 -0.94 1.48 0.28 0.98 0.00 0.00 173.24 175.05 1nft h SER 14 N 2.23 0.70 -0.49 7.02 0.02 -1.97 0.35 113.55 121.42 1nft h SER 14 Ca -0.33 -0.38 0.04 0.00 -0.84 0.00 0.00 61.79 60.28 1nft h SER 14 Cb 1.27 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.58 1nft h SER 14 CO 0.42 1.11 0.32 -0.65 -1.14 0.00 0.00 176.83 176.90 1nft h PRO 15 N 0.48 0.51 -0.28 3.45 0.11 -1.98 -0.19 132.00 134.12 1nft h PRO 15 Ca 0.01 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.02 1nft h PRO 15 Cb 1.11 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1nft h PRO 15 CO 0.11 0.34 -0.09 1.49 -0.21 0.00 0.00 178.00 179.64 1nft h GLU 16 N 0.53 0.55 -0.96 1.05 4.81 -1.77 -1.93 114.58 116.86 1nft h GLU 16 Ca 0.20 -0.22 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1nft h GLU 16 Cb 0.13 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.43 1nft h GLU 16 CO -0.05 0.76 0.62 1.49 -0.73 0.00 0.00 179.01 181.11 1nft h GLU 17 N 0.29 1.16 -0.17 1.92 4.57 -0.25 -2.44 114.58 119.66 1nft h GLU 17 Ca 0.07 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1nft h GLU 17 Cb 0.58 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1nft h GLU 17 CO 0.03 0.77 0.11 -0.22 -1.18 0.00 0.00 179.01 178.52 1nft h LYS 18 N 1.19 0.22 -0.80 1.92 3.64 -0.90 -2.27 116.57 119.57 1nft h LYS 18 Ca 0.39 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.82 1nft h LYS 18 Cb 0.03 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.74 1nft h LYS 18 CO -0.13 0.16 0.47 -0.22 -2.27 0.00 0.00 179.45 177.46 1nft h LYS 19 N 0.22 0.81 0.09 1.90 3.64 -0.99 -1.45 116.57 120.78 1nft h LYS 19 Ca 0.06 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1nft h LYS 19 Cb -0.01 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 1nft h LYS 19 CO -0.01 0.54 -0.04 0.00 -2.27 0.00 0.00 179.45 177.66 1nft h ASN 21 N -0.26 0.00 -0.34 0.00 2.35 -0.93 0.61 115.58 117.00 1nft h ASN 21 Ca -0.01 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.59 1nft h ASN 21 Cb 0.22 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 1nft h ASN 21 CO 0.02 0.05 -0.34 0.78 -1.65 0.00 0.00 177.43 176.29 1nft h ASN 22 N 0.00 0.93 -0.13 5.81 -0.26 -0.77 -0.75 115.58 120.42 1nft h ASN 22 Ca -0.00 -0.40 -0.13 0.00 -0.56 0.00 0.00 56.30 55.21 1nft h ASN 22 Cb 0.10 -0.26 -0.01 0.00 -1.06 0.00 0.00 38.32 37.09 1nft h ASN 22 CO 0.01 1.18 -0.35 0.25 -1.06 0.00 0.00 177.43 177.46 1nft h LEU 23 N 0.73 0.66 0.27 1.61 5.85 -0.13 -0.85 115.31 123.45 1nft h LEU 23 Ca 0.07 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.52 1nft h LEU 23 Cb 0.92 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1nft h LEU 23 CO 0.08 0.95 -0.25 -0.09 -0.34 0.00 0.00 178.44 178.80 1nft h ARG 24 N 0.53 -0.52 -0.83 1.25 2.43 -0.88 0.11 114.38 116.47 1nft h ARG 24 Ca 0.06 0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.36 1nft h ARG 24 Cb 0.85 0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 30.44 1nft h ARG 24 CO 0.07 -0.35 0.47 -0.44 -1.51 0.00 0.00 179.97 178.22 1nft h ASP 25 N -0.54 0.66 1.08 -3.80 3.32 -0.95 0.12 116.42 116.32 1nft h ASP 25 Ca -0.01 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 1nft h ASP 25 Cb 0.49 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 1nft h ASP 25 CO -0.04 0.37 -0.09 -0.07 -1.72 0.00 0.00 179.24 177.69 1nft h LEU 26 N 0.78 0.00 -1.71 1.55 4.07 -0.75 -3.18 115.31 116.06 1nft h LEU 26 Ca 0.40 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.36 1nft h LEU 26 Cb 0.38 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.12 1nft h LEU 26 CO -0.26 0.09 0.00 0.35 -1.08 0.00 0.00 178.44 177.55 1nft n THR 27 N -3.21 0.26 -0.54 0.22 -2.24 0.33 -4.78 114.28 104.32 1nft n THR 27 Ca 0.01 -0.63 0.44 0.00 -2.27 0.00 0.00 64.05 61.60 1nft n THR 27 Cb 0.38 0.98 0.72 0.00 -2.10 0.00 0.00 70.33 70.31 1nft n THR 27 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1nft h GLN 28 N 1.40 0.01 -0.73 -0.78 1.08 -0.81 0.21 115.11 115.49 1nft h GLN 28 Ca 0.00 -0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 1nft h GLN 28 Cb 0.39 -0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.79 1nft h GLN 28 CO 0.00 0.01 0.06 1.04 -0.95 0.00 0.00 178.83 178.99 1nft n GLN 29 N -4.49 3.69 -3.89 1.46 1.13 -1.26 -4.86 117.38 109.15 1nft n GLN 29 Ca 0.41 -2.36 -0.22 0.00 -1.94 0.00 0.00 57.00 52.89 1nft n GLN 29 Cb 1.70 -2.06 -0.02 0.00 0.11 0.00 0.00 30.24 29.97 1nft n GLN 29 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1nft s GLU 30 N -2.35 3.45 0.33 -1.09 2.56 0.72 -5.03 118.70 117.29 1nft s GLU 30 Ca 0.41 -0.68 0.09 0.00 0.00 0.00 0.00 54.97 54.80 1nft s GLU 30 Cb 0.32 -2.87 0.57 0.00 2.00 0.00 0.00 34.13 34.15 1nft s GLU 30 CO 0.11 0.41 1.76 0.00 -0.56 0.00 0.00 175.26 176.99 1nft h ARG 31 N 1.28 0.15 -5.12 4.30 3.08 -1.89 -3.40 114.38 112.78 1nft h ARG 31 Ca -0.51 -0.06 -0.62 0.00 0.07 0.00 0.00 59.98 58.86 1nft h ARG 31 Cb 1.22 -0.01 -0.15 0.00 0.08 0.00 0.00 29.97 31.12 1nft h ARG 31 CO 0.62 0.51 -0.51 0.42 -1.07 0.00 0.00 179.97 179.94 1nft s ILE 32 N -4.19 5.29 0.34 2.04 1.01 -1.26 -4.89 121.20 119.53 1nft s ILE 32 Ca -0.04 0.15 0.08 0.00 0.00 0.00 0.00 60.65 60.85 1nft s ILE 32 Cb 0.14 -3.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.11 1nft s ILE 32 CO 0.75 0.36 0.11 -0.94 0.00 0.00 0.00 174.94 175.22 1nft s SER 33 N 0.95 4.57 0.14 3.58 1.04 -0.38 -4.95 113.70 118.65 1nft s SER 33 Ca 0.07 -0.81 0.05 0.00 0.48 0.00 0.00 55.95 55.74 1nft s SER 33 Cb -0.13 -0.69 -0.04 0.00 0.10 0.00 0.00 66.02 65.25 1nft s SER 33 CO 0.03 -0.27 0.11 -0.22 0.98 0.00 0.00 173.24 173.87 1nft s LEU 34 N -3.81 3.76 -0.16 2.42 2.96 -1.26 -0.93 118.68 121.66 1nft s LEU 34 Ca 0.37 -0.12 -0.11 0.00 -0.22 0.00 0.00 54.13 54.05 1nft s LEU 34 Cb -0.02 -2.40 0.05 0.00 0.50 0.00 0.00 46.19 44.32 1nft s LEU 34 CO 0.22 0.10 0.40 0.28 -1.32 0.00 0.00 176.35 176.03 1nft s THR 35 N -1.64 -0.01 -0.21 3.68 -1.32 -0.67 -4.85 115.64 110.62 1nft s THR 35 Ca 0.30 0.05 -0.06 0.00 -1.21 0.00 0.00 61.69 60.76 1nft s THR 35 Cb -0.11 -0.58 -0.03 0.00 -1.51 0.00 0.00 72.50 70.28 1nft s THR 35 CO 0.23 0.02 0.04 0.00 -2.21 0.00 0.00 174.62 172.69 1nft s VAL 37 N 1.01 4.41 -0.17 0.00 1.01 -0.15 -4.94 120.40 121.58 1nft s VAL 37 Ca 0.03 -0.19 -0.03 0.00 0.00 0.00 0.00 61.98 61.79 1nft s VAL 37 Cb -0.14 -2.92 -0.02 0.00 0.00 0.00 0.00 36.38 33.30 1nft s VAL 37 CO 0.02 0.53 -0.06 -1.58 0.00 0.00 0.00 175.10 174.02 1nft s GLN 38 N -0.19 3.53 0.52 2.72 0.74 -1.26 -0.25 119.66 125.46 1nft s GLN 38 Ca 0.06 -0.59 0.01 0.00 0.05 0.00 0.00 55.36 54.89 1nft s GLN 38 Cb -0.12 -2.88 -0.01 0.00 1.10 0.00 0.00 33.01 31.10 1nft s GLN 38 CO 0.02 0.11 0.00 0.15 -0.55 0.00 0.00 175.29 175.02 1nft s LYS 39 N 0.68 2.21 0.01 1.67 -0.14 -0.45 -4.94 119.74 118.78 1nft s LYS 39 Ca -0.03 -2.42 -0.12 0.00 -1.36 0.00 0.00 55.97 52.04 1nft s LYS 39 Cb -0.15 -1.53 -0.33 0.00 -1.68 0.00 0.00 37.83 34.15 1nft s LYS 39 CO 0.02 -0.38 0.90 0.00 -0.76 0.00 0.00 175.35 175.13 1nft h ALA 40 N 1.33 0.01 -2.39 5.17 0.00 -1.90 -3.40 119.26 118.07 1nft h ALA 40 Ca -0.44 -0.98 -0.32 0.00 0.00 0.00 0.00 54.91 53.17 1nft h ALA 40 Cb 1.32 0.26 -0.15 0.00 0.00 0.00 0.00 17.79 19.22 1nft h ALA 40 CO 0.74 0.88 -0.62 0.95 0.00 0.00 0.00 179.25 181.20 1nft s THR 41 N -2.60 0.42 0.32 0.00 -4.23 -1.26 -4.91 115.64 103.38 1nft s THR 41 Ca -0.11 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.54 1nft s THR 41 Cb 0.05 -2.57 0.06 0.00 1.34 0.00 0.00 72.50 71.39 1nft s THR 41 CO 0.90 -0.04 1.75 0.10 -0.54 0.00 0.00 174.62 176.80 1nft h TYR 42 N 2.47 0.00 -0.66 3.99 -0.00 -1.94 -2.42 116.97 118.41 1nft h TYR 42 Ca -0.38 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.30 1nft h TYR 42 Cb 1.24 0.00 -0.03 0.00 -0.00 0.00 0.00 36.73 37.95 1nft h TYR 42 CO 0.43 0.45 0.20 1.25 -0.00 0.00 0.00 178.16 180.49 1nft h LEU 43 N 0.00 0.96 -1.11 0.10 5.85 -1.99 0.32 115.31 119.44 1nft h LEU 43 Ca -0.00 -0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.44 1nft h LEU 43 Cb 0.82 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 1nft h LEU 43 CO 0.06 0.92 -0.07 0.44 -0.34 0.00 0.00 178.44 179.45 1nft h ASP 44 N 0.96 0.53 -0.21 1.25 3.32 -1.86 -0.47 116.42 119.93 1nft h ASP 44 Ca 0.21 -0.12 -0.08 0.00 0.02 0.00 0.00 57.03 57.06 1nft h ASP 44 Cb 0.31 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1nft h ASP 44 CO -0.01 0.64 -0.10 0.00 -1.72 0.00 0.00 179.24 178.06 1nft h ILE 46 N 0.55 1.25 -0.42 0.00 2.04 0.62 -1.50 117.51 120.05 1nft h ILE 46 Ca 0.10 -0.93 -0.00 0.00 1.00 0.00 0.00 64.86 65.03 1nft h ILE 46 Cb 0.50 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 1nft h ILE 46 CO 0.03 0.32 0.26 0.11 0.00 0.00 0.00 178.15 178.86 1nft h LYS 47 N 0.53 0.57 -0.71 2.37 1.57 -1.17 -0.02 116.57 119.71 1nft h LYS 47 Ca 0.12 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1nft h LYS 47 Cb 0.41 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.57 1nft h LYS 47 CO 0.01 0.42 0.39 0.00 -0.57 0.00 0.00 179.45 179.70 1nft h ALA 48 N 1.12 1.35 -0.10 3.86 0.00 -0.90 0.18 119.26 124.76 1nft h ALA 48 Ca 0.15 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1nft h ALA 48 Cb -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1nft h ALA 48 CO -0.03 0.53 -0.31 0.82 0.00 0.00 0.00 179.25 180.27 1nft h ILE 49 N 0.99 1.39 -0.74 0.00 2.04 -0.91 0.14 117.51 120.43 1nft h ILE 49 Ca 0.25 -1.64 0.09 0.00 1.00 0.00 0.00 64.86 64.57 1nft h ILE 49 Cb 0.03 2.17 -0.07 0.00 -0.74 0.00 0.00 36.82 38.20 1nft h ILE 49 CO -0.04 0.48 0.38 0.00 0.00 0.00 0.00 178.15 178.97 1nft h ALA 50 N 0.49 1.03 -0.40 1.87 0.00 -0.77 -1.85 119.26 119.62 1nft h ALA 50 Ca -0.01 0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 1nft h ALA 50 Cb 0.93 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.56 1nft h ALA 50 CO 0.07 -0.02 0.21 0.09 0.00 0.00 0.00 179.25 179.60 1nft n ASN 51 N -4.84 3.29 -3.36 0.00 5.03 0.62 -4.86 115.26 111.14 1nft n ASN 51 Ca 0.12 -2.64 -0.24 0.00 0.87 0.00 0.00 54.58 52.69 1nft n ASN 51 Cb 0.28 -0.63 -0.00 0.00 -1.02 0.00 0.00 39.78 38.40 1nft n ASN 51 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1nft n ASN 52 N -0.10 -3.95 -0.01 6.41 5.15 -0.70 -4.84 115.26 117.24 1nft n ASN 52 Ca 0.23 -0.40 0.09 0.00 -0.60 0.00 0.00 54.58 53.90 1nft n ASN 52 Cb 0.93 -3.25 -0.13 0.00 -0.53 0.00 0.00 39.78 36.80 1nft n ASN 52 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1nft n GLU 53 N -3.79 0.57 -4.07 1.20 1.02 0.46 -4.99 120.64 111.04 1nft n GLU 53 Ca -0.02 -0.15 -0.12 0.00 -0.02 0.00 0.00 57.16 56.85 1nft n GLU 53 Cb 0.55 -1.41 -0.06 0.00 -0.02 0.00 0.00 31.44 30.50 1nft n GLU 53 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nft s ALA 54 N -3.18 0.40 0.00 0.62 0.00 -0.98 -4.95 121.76 113.68 1nft s ALA 54 Ca -0.06 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.63 1nft s ALA 54 Cb 0.11 1.16 0.00 0.00 0.00 0.00 0.00 23.12 24.40 1nft s ALA 54 CO 0.72 -0.78 0.00 -0.25 0.00 0.00 0.00 175.76 175.45 1nft n ASP 55 N -0.73 1.73 -3.53 0.00 8.00 0.22 -4.15 116.55 118.09 1nft n ASP 55 Ca 0.00 -0.22 -0.13 0.00 0.71 0.00 0.00 54.79 55.15 1nft n ASP 55 Cb 0.63 0.79 -0.05 0.00 -0.02 0.00 0.00 41.12 42.47 1nft n ASP 55 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nft s ALA 56 N -1.14 -1.83 -0.11 2.24 0.00 -1.18 -4.49 121.76 115.26 1nft s ALA 56 Ca 0.00 1.31 -0.30 0.00 0.00 0.00 0.00 51.96 52.97 1nft s ALA 56 Cb 0.00 -0.15 0.10 0.00 0.00 0.00 0.00 23.12 23.07 1nft s ALA 56 CO 0.00 -0.43 0.86 -1.50 0.00 0.00 0.00 175.76 174.69 1nft s ILE 57 N -1.66 0.00 -0.14 0.00 2.07 -1.20 -1.66 121.20 118.60 1nft s ILE 57 Ca -0.04 0.00 -0.15 0.00 -1.41 0.00 0.00 60.65 59.05 1nft s ILE 57 Cb -0.00 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.54 1nft s ILE 57 CO 0.02 0.00 0.36 -0.44 -1.91 0.00 0.00 174.94 172.97 1nft s SER 58 N -1.21 6.53 0.09 4.50 0.01 -1.26 -1.11 113.70 121.26 1nft s SER 58 Ca -0.05 0.63 0.08 0.00 1.31 0.00 0.00 55.95 57.91 1nft s SER 58 Cb -0.00 -2.22 -0.03 0.00 0.21 0.00 0.00 66.02 63.97 1nft s SER 58 CO 0.05 0.07 -0.21 -0.76 0.41 0.00 0.00 173.24 172.80 1nft s LEU 59 N 0.46 2.28 0.00 2.44 1.02 -0.21 -4.94 118.68 119.73 1nft s LEU 59 Ca 0.20 -0.66 -0.10 0.00 0.02 0.00 0.00 54.13 53.58 1nft s LEU 59 Cb -0.14 -0.88 0.16 0.00 0.02 0.00 0.00 46.19 45.35 1nft s LEU 59 CO 0.06 0.06 0.94 -0.90 0.02 0.00 0.00 176.35 176.53 1nft n ASP 60 N 1.18 0.23 -0.35 2.29 5.68 -1.26 -1.84 116.55 122.48 1nft n ASP 60 Ca -0.19 -1.43 -0.03 0.00 -0.50 0.00 0.00 54.79 52.64 1nft n ASP 60 Cb 0.54 -0.70 0.11 0.00 -1.14 0.00 0.00 41.12 39.92 1nft n ASP 60 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1nft h GLY 61 N -1.14 1.37 1.81 6.12 0.00 -1.81 0.11 103.07 109.54 1nft h GLY 61 Ca -0.30 -0.56 -0.12 0.00 0.00 0.00 0.00 47.33 46.35 1nft h GLY 61 CO 0.23 0.54 -0.49 -1.33 0.00 0.00 0.00 176.54 175.49 1nft h GLY 62 N 1.31 0.22 1.53 4.60 0.00 -1.96 -1.52 103.07 107.24 1nft h GLY 62 Ca 0.34 -0.23 -0.24 0.00 0.00 0.00 0.00 47.33 47.20 1nft h GLY 62 CO -0.07 0.21 -1.01 1.46 0.00 0.00 0.00 176.54 177.14 1nft h GLN 63 N 0.16 0.41 -0.74 4.80 4.20 -1.78 -1.99 115.11 120.17 1nft h GLN 63 Ca 0.01 -0.48 -0.02 0.00 0.06 0.00 0.00 58.65 58.22 1nft h GLN 63 Cb 0.93 0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.82 1nft h GLN 63 CO 0.07 1.15 0.38 0.28 -0.67 0.00 0.00 178.83 180.04 1nft h VAL 64 N 0.22 1.23 0.16 -0.54 2.07 -0.54 0.11 116.25 118.95 1nft h VAL 64 Ca -0.10 -0.61 0.01 0.00 0.82 0.00 0.00 66.70 66.83 1nft h VAL 64 Cb 1.66 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1nft h VAL 64 CO 0.17 0.26 -0.22 0.15 0.02 0.00 0.00 177.57 177.96 1nft h PHE 65 N 1.04 -0.59 -0.28 1.57 3.57 -1.09 -2.32 116.94 118.85 1nft h PHE 65 Ca 0.26 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.82 1nft h PHE 65 Cb 0.07 0.24 -0.05 0.00 2.79 0.00 0.00 35.95 39.00 1nft h PHE 65 CO 0.01 -0.32 -0.02 0.93 -2.23 0.00 0.00 178.31 176.68 1nft h GLU 66 N -0.44 0.06 0.00 1.11 5.08 -0.95 -2.34 114.58 117.09 1nft h GLU 66 Ca 0.01 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1nft h GLU 66 Cb 0.44 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1nft h GLU 66 CO -0.09 0.04 0.00 0.00 -1.00 0.00 0.00 179.01 177.95 1nft h ALA 67 N 1.25 1.00 -0.01 3.43 0.00 -0.83 -2.47 119.26 121.64 1nft h ALA 67 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1nft h ALA 67 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1nft h ALA 67 CO -0.25 0.00 -0.46 0.41 0.00 0.00 0.00 179.25 178.95 1nft n GLY 68 N -0.74 -0.39 3.89 0.00 0.00 -0.89 -0.17 105.19 106.89 1nft n GLY 68 Ca -0.02 -0.54 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 1nft n GLY 68 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nft s LEU 69 N -2.58 3.14 0.39 0.99 1.43 -0.93 -4.08 118.68 117.04 1nft s LEU 69 Ca 0.19 1.12 -0.26 0.00 -1.03 0.00 0.00 54.13 54.14 1nft s LEU 69 Cb 0.18 -4.01 -0.09 0.00 0.03 0.00 0.00 46.19 42.30 1nft s LEU 69 CO 0.60 -1.06 1.23 0.00 0.23 0.00 0.00 176.35 177.35 1nft s ALA 70 N -3.17 3.23 -2.22 4.21 0.00 -1.26 -1.54 121.76 121.01 1nft s ALA 70 Ca 0.55 1.10 0.25 0.00 0.00 0.00 0.00 51.96 53.87 1nft s ALA 70 Cb -0.11 -3.43 0.49 0.00 0.00 0.00 0.00 23.12 20.07 1nft s ALA 70 CO 0.50 -0.65 1.41 -0.35 0.00 0.00 0.00 175.76 176.67 1nft n PRO 71 N 0.20 1.39 0.02 0.00 -0.04 -1.26 -4.90 135.00 130.41 1nft n PRO 71 Ca 0.03 -1.00 -0.12 0.00 -0.04 0.00 0.00 63.50 62.37 1nft n PRO 71 Cb 0.45 -1.48 -0.09 0.00 -0.04 0.00 0.00 33.50 32.34 1nft n PRO 71 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1nft h TYR 72 N 2.44 -0.11 -6.42 0.54 0.05 -1.70 -3.48 116.97 108.29 1nft h TYR 72 Ca 0.00 -0.00 -0.50 0.00 0.05 0.00 0.00 58.73 58.28 1nft h TYR 72 Cb 0.67 0.04 -0.08 0.00 1.01 0.00 0.00 36.73 38.36 1nft h TYR 72 CO 0.00 0.41 -0.78 1.63 -1.05 0.00 0.00 178.16 178.37 1nft n LYS 73 N -4.87 -4.93 -2.19 4.88 5.02 -0.59 -4.86 118.16 110.63 1nft n LYS 73 Ca -0.08 0.54 -0.33 0.00 -2.02 0.00 0.00 58.31 56.42 1nft n LYS 73 Cb 0.29 -5.40 -0.01 0.00 -0.02 0.00 0.00 35.03 29.89 1nft n LYS 73 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1nft s LEU 74 N -7.29 3.56 0.10 -0.35 1.43 0.76 -4.53 118.68 112.36 1nft s LEU 74 Ca 0.69 1.74 0.07 0.00 -1.03 0.00 0.00 54.13 55.60 1nft s LEU 74 Cb -0.36 -4.53 -0.03 0.00 0.03 0.00 0.00 46.19 41.30 1nft s LEU 74 CO 0.86 -0.95 -0.17 -1.59 0.23 0.00 0.00 176.35 174.72 1nft s LYS 75 N -4.03 1.04 0.22 1.70 -2.85 -0.65 -3.84 119.74 111.33 1nft s LYS 75 Ca 0.62 -1.15 -0.30 0.00 -1.00 0.00 0.00 55.97 54.15 1nft s LYS 75 Cb -0.14 -1.13 -0.09 0.00 -2.06 0.00 0.00 37.83 34.41 1nft s LYS 75 CO 0.34 0.25 1.20 -1.25 0.10 0.00 0.00 175.35 175.99 1nft s PRO 76 N -2.11 4.49 0.00 1.78 0.04 -1.26 -1.88 135.00 136.07 1nft s PRO 76 Ca 0.06 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.02 1nft s PRO 76 Cb -0.09 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.25 1nft s PRO 76 CO 0.04 -0.06 0.00 0.44 0.04 0.00 0.00 177.00 177.45 1nft n ILE 77 N 2.11 0.00 -3.47 0.56 -5.35 -0.17 -4.79 119.36 108.25 1nft n ILE 77 Ca 0.03 -0.33 -0.15 0.00 -0.27 0.00 0.00 62.75 62.03 1nft n ILE 77 Cb 0.44 0.85 -0.04 0.00 -1.74 0.00 0.00 39.64 39.15 1nft n ILE 77 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1nft s ALA 78 N -1.21 -1.68 -0.01 -1.28 0.00 -1.24 -1.81 121.76 114.53 1nft s ALA 78 Ca 0.00 0.90 -0.05 0.00 0.00 0.00 0.00 51.96 52.81 1nft s ALA 78 Cb 0.00 0.44 0.00 0.00 0.00 0.00 0.00 23.12 23.56 1nft s ALA 78 CO 0.00 -0.57 0.11 0.00 0.00 0.00 0.00 175.76 175.30 1nft s ALA 79 N -2.47 -0.25 0.54 0.00 0.00 0.61 -1.32 121.76 118.86 1nft s ALA 79 Ca -0.05 -0.08 -0.19 0.00 0.00 0.00 0.00 51.96 51.64 1nft s ALA 79 Cb -0.00 0.03 -0.06 0.00 0.00 0.00 0.00 23.12 23.09 1nft s ALA 79 CO -0.01 -0.16 1.10 -1.21 0.00 0.00 0.00 175.76 175.47 1nft s GLU 80 N -1.03 3.44 -0.01 0.00 2.02 -0.08 -1.11 118.70 121.94 1nft s GLU 80 Ca -0.11 1.50 0.06 0.00 0.02 0.00 0.00 54.97 56.44 1nft s GLU 80 Cb -0.06 -2.03 -0.03 0.00 0.10 0.00 0.00 34.13 32.11 1nft s GLU 80 CO 0.01 -0.76 -0.20 0.08 0.02 0.00 0.00 175.26 174.41 1nft s VAL 81 N -1.91 2.59 0.25 2.63 1.01 -0.69 -4.63 120.40 119.64 1nft s VAL 81 Ca 0.70 -1.03 0.08 0.00 0.00 0.00 0.00 61.98 61.73 1nft s VAL 81 Cb -0.21 -2.00 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 1nft s VAL 81 CO 0.27 0.50 -0.11 -0.31 0.00 0.00 0.00 175.10 175.44 1nft s TYR 82 N -0.75 1.88 0.26 5.22 2.02 -1.26 -0.78 117.35 123.94 1nft s TYR 82 Ca 0.12 -0.61 -0.00 0.00 -0.37 0.00 0.00 57.07 56.21 1nft s TYR 82 Cb -0.10 -0.96 0.35 0.00 -0.40 0.00 0.00 41.96 40.85 1nft s TYR 82 CO 0.01 0.36 1.72 0.93 -1.57 0.00 0.00 175.55 177.00 1nft h GLU 83 N 2.40 0.64 0.00 -0.62 5.08 -1.96 -3.22 114.58 116.90 1nft h GLU 83 Ca -0.39 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 57.75 1nft h GLU 83 Cb 1.23 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1nft h GLU 83 CO 0.64 0.77 0.00 -2.39 -1.00 0.00 0.00 179.01 177.03 1nft n HIS 84 N -4.16 0.00 -0.14 4.33 1.44 -1.26 -3.39 115.22 112.04 1nft n HIS 84 Ca 0.01 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.72 1nft n HIS 84 Cb 0.37 -0.31 0.00 0.00 0.12 0.00 0.00 29.99 30.17 1nft n HIS 84 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1nft n THR 85 N -1.31 0.72 -3.44 0.61 -2.24 -1.22 -5.07 114.28 102.33 1nft n THR 85 Ca 0.13 -0.79 -0.16 0.00 -2.27 0.00 0.00 64.05 60.96 1nft n THR 85 Cb 0.25 0.66 0.01 0.00 -2.10 0.00 0.00 70.33 69.15 1nft n THR 85 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nft n GLU 86 N -0.36 -1.40 -0.21 -0.78 1.02 -1.22 -2.84 120.64 114.85 1nft n GLU 86 Ca 0.00 1.00 0.00 0.00 -0.02 0.00 0.00 57.16 58.14 1nft n GLU 86 Cb 0.25 -4.28 0.00 0.00 -0.02 0.00 0.00 31.44 27.39 1nft n GLU 86 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nft n GLY 87 N -1.69 2.35 3.92 0.62 0.00 -1.26 -5.00 105.19 104.13 1nft n GLY 87 Ca -0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.61 1nft n GLY 87 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1nft s SER 88 N -3.65 6.40 -0.97 1.61 0.15 -1.13 -5.00 113.70 111.12 1nft s SER 88 Ca 0.00 0.43 -0.07 0.00 0.70 0.00 0.00 55.95 57.01 1nft s SER 88 Cb 0.00 -2.02 -0.04 0.00 -1.71 0.00 0.00 66.02 62.24 1nft s SER 88 CO 0.00 -0.02 2.92 0.35 1.20 0.00 0.00 173.24 177.69 1nft n THR 89 N -0.50 4.11 -4.76 6.45 -2.24 -1.26 -4.53 114.28 111.54 1nft n THR 89 Ca -0.04 -2.91 -0.25 0.00 -2.27 0.00 0.00 64.05 58.58 1nft n THR 89 Cb 0.53 -2.14 -0.16 0.00 -2.10 0.00 0.00 70.33 66.46 1nft n THR 89 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1nft s THR 90 N 0.16 1.32 -0.13 4.28 2.01 -1.26 -1.14 115.64 120.88 1nft s THR 90 Ca 0.63 -0.66 -0.11 0.00 0.31 0.00 0.00 61.69 61.86 1nft s THR 90 Cb 0.25 -1.14 -0.09 0.00 0.01 0.00 0.00 72.50 71.53 1nft s THR 90 CO -0.09 0.38 0.14 0.28 -0.69 0.00 0.00 174.62 174.65 1nft h SER 91 N 6.27 0.00 -5.17 3.53 0.02 -0.77 -3.41 113.55 114.02 1nft h SER 91 Ca -0.33 -0.28 0.05 0.00 -0.84 0.00 0.00 61.79 60.40 1nft h SER 91 Cb 1.17 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 1nft h SER 91 CO 0.48 0.80 0.40 -0.72 -1.14 0.00 0.00 176.83 176.65 1nft s TYR 92 N -1.97 0.11 -0.06 3.45 -0.85 -1.05 -4.93 117.35 112.05 1nft s TYR 92 Ca -0.12 -0.68 0.06 0.00 -0.52 0.00 0.00 57.07 55.81 1nft s TYR 92 Cb 0.01 0.79 -0.01 0.00 0.38 0.00 0.00 41.96 43.12 1nft s TYR 92 CO 0.28 -1.32 -0.24 0.71 -1.52 0.00 0.00 175.55 173.46 1nft s TYR 93 N -2.20 2.46 -0.02 -3.49 1.51 -1.26 -0.24 117.35 114.11 1nft s TYR 93 Ca 0.18 -0.66 -0.30 0.00 -1.01 0.00 0.00 57.07 55.28 1nft s TYR 93 Cb -0.04 -1.60 -0.03 0.00 -0.11 0.00 0.00 41.96 40.18 1nft s TYR 93 CO 0.09 -0.18 1.02 0.00 -1.11 0.00 0.00 175.55 175.37 1nft s ALA 94 N -0.22 3.25 0.24 3.71 0.00 -0.13 -0.75 121.76 127.87 1nft s ALA 94 Ca -0.02 0.54 0.04 0.00 0.00 0.00 0.00 51.96 52.52 1nft s ALA 94 Cb -0.13 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.55 1nft s ALA 94 CO 0.03 -0.36 -0.01 0.14 0.00 0.00 0.00 175.76 175.57 1nft s VAL 95 N 1.29 1.15 -0.28 0.00 -7.23 -0.88 -0.56 120.40 113.89 1nft s VAL 95 Ca 0.52 -2.05 0.03 0.00 -1.81 0.00 0.00 61.98 58.67 1nft s VAL 95 Cb -0.21 -2.39 0.07 0.00 0.56 0.00 0.00 36.38 34.41 1nft s VAL 95 CO 0.26 -0.30 -0.07 0.00 -0.31 0.00 0.00 175.10 174.67 1nft s ALA 96 N -3.34 2.58 -0.10 1.32 0.00 -1.26 -2.34 121.76 118.62 1nft s ALA 96 Ca 0.29 -1.90 -0.18 0.00 0.00 0.00 0.00 51.96 50.17 1nft s ALA 96 Cb 0.05 -1.66 -0.04 0.00 0.00 0.00 0.00 23.12 21.47 1nft s ALA 96 CO 0.10 -1.31 0.48 0.08 0.00 0.00 0.00 175.76 175.11 1nft s VAL 97 N 1.09 5.14 0.25 0.00 1.01 -0.86 -0.37 120.40 126.66 1nft s VAL 97 Ca -0.04 0.98 0.05 0.00 0.00 0.00 0.00 61.98 62.97 1nft s VAL 97 Cb -0.20 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 1nft s VAL 97 CO -0.06 0.36 -0.04 0.68 0.00 0.00 0.00 175.10 176.04 1nft s VAL 98 N 0.39 1.39 0.31 2.92 -7.23 -0.04 -1.35 120.40 116.78 1nft s VAL 98 Ca 0.26 -2.09 -0.28 0.00 -1.81 0.00 0.00 61.98 58.07 1nft s VAL 98 Cb -0.16 -2.37 -0.09 0.00 0.56 0.00 0.00 36.38 34.33 1nft s VAL 98 CO 0.11 -0.34 1.02 -0.54 -0.31 0.00 0.00 175.10 175.04 1nft s LYS 99 N -3.78 4.57 0.43 4.82 1.02 -1.26 -0.93 119.74 124.60 1nft s LYS 99 Ca 0.28 1.56 -0.25 0.00 0.02 0.00 0.00 55.97 57.58 1nft s LYS 99 Cb 0.04 -2.97 -0.08 0.00 -0.52 0.00 0.00 37.83 34.30 1nft s LYS 99 CO 0.10 0.22 1.26 0.21 -0.92 0.00 0.00 175.35 176.22 1nft s LYS 100 N -1.76 3.86 0.00 1.68 2.20 -0.06 -3.13 119.74 122.54 1nft s LYS 100 Ca 0.48 2.04 0.00 0.00 -0.36 0.00 0.00 55.97 58.13 1nft s LYS 100 Cb -0.25 -2.63 0.00 0.00 -1.51 0.00 0.00 37.83 33.44 1nft s LYS 100 CO 0.32 -0.55 0.00 0.41 -0.36 0.00 0.00 175.35 175.17 1nft n GLY 101 N 0.63 3.16 3.76 5.54 0.00 -1.26 -4.96 105.19 112.06 1nft n GLY 101 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1nft n GLY 101 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nft s THR 102 N -2.68 3.16 -0.13 2.61 -4.23 -1.18 -4.98 115.64 108.20 1nft s THR 102 Ca 0.00 0.38 0.05 0.00 -1.18 0.00 0.00 61.69 60.93 1nft s THR 102 Cb 0.00 -2.88 -0.06 0.00 1.34 0.00 0.00 72.50 70.90 1nft s THR 102 CO 0.00 -0.49 0.16 -0.62 -0.54 0.00 0.00 174.62 173.13 1nft n GLU 103 N -3.61 3.30 -1.53 3.99 4.71 -1.26 -5.03 120.64 121.21 1nft n GLU 103 Ca 0.08 -0.02 -0.37 0.00 -0.01 0.00 0.00 57.16 56.85 1nft n GLU 103 Cb 0.54 -0.88 0.07 0.00 -1.01 0.00 0.00 31.44 30.15 1nft n GLU 103 CO 0.00 0.00 0.00 1.97 0.09 0.00 0.00 177.13 179.19 1nft n PHE 104 N -1.34 0.76 -3.84 -0.32 -1.74 -1.26 -5.03 117.46 104.69 1nft n PHE 104 Ca 0.00 0.42 -0.09 0.00 -0.56 0.00 0.00 57.45 57.22 1nft n PHE 104 Cb 0.09 -2.12 -0.01 0.00 1.52 0.00 0.00 39.48 38.97 1nft n PHE 104 CO 0.00 0.00 0.00 0.25 -0.56 0.00 0.00 176.76 176.45 1nft n THR 105 N -2.05 0.00 0.27 1.97 -2.24 -1.26 -4.98 114.28 105.99 1nft n THR 105 Ca 0.14 -0.69 0.14 0.00 -2.27 0.00 0.00 64.05 61.36 1nft n THR 105 Cb 0.48 -0.17 0.72 0.00 -2.10 0.00 0.00 70.33 69.26 1nft n THR 105 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1nft h VAL 106 N 0.74 0.44 0.00 2.28 3.04 -1.85 -1.70 116.25 119.21 1nft h VAL 106 Ca -0.11 -0.58 0.00 0.00 -1.01 0.00 0.00 66.70 64.99 1nft h VAL 106 Cb 0.39 1.41 0.00 0.00 -2.01 0.00 0.00 31.29 31.07 1nft h VAL 106 CO 0.18 0.11 0.00 -1.13 -1.01 0.00 0.00 177.57 175.72 1nft h ASN 107 N 0.00 0.00 -0.61 3.17 -1.24 -1.93 -3.23 115.58 111.75 1nft h ASN 107 Ca -0.00 0.00 -0.41 0.00 0.71 0.00 0.00 56.30 56.60 1nft h ASN 107 Cb 0.40 0.00 -0.26 0.00 0.73 0.00 0.00 38.32 39.19 1nft h ASN 107 CO 0.01 0.00 -0.21 0.47 -1.29 0.00 0.00 177.43 176.42 1nft n ASP 108 N -3.01 4.30 0.10 1.15 8.00 -0.64 -4.77 116.55 121.69 1nft n ASP 108 Ca 0.00 -3.79 0.02 0.00 0.71 0.00 0.00 54.79 51.74 1nft n ASP 108 Cb 0.27 -0.58 -0.02 0.00 -0.02 0.00 0.00 41.12 40.77 1nft n ASP 108 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1nft h LEU 109 N 1.63 0.00 -9.53 0.64 5.85 -1.66 -3.44 115.31 108.80 1nft h LEU 109 Ca 0.34 0.00 -0.53 0.00 0.84 0.00 0.00 57.88 58.53 1nft h LEU 109 Cb 1.44 0.00 0.04 0.00 0.37 0.00 0.00 40.66 42.51 1nft h LEU 109 CO 0.73 0.52 1.09 1.67 -0.34 0.00 0.00 178.44 182.11 1nft n GLN 110 N -3.09 2.78 -0.45 1.25 7.27 -1.26 -1.44 117.38 122.44 1nft n GLN 110 Ca -0.02 1.01 0.00 0.00 0.07 0.00 0.00 57.00 58.06 1nft n GLN 110 Cb 0.77 -2.90 0.00 0.00 2.41 0.00 0.00 30.24 30.52 1nft n GLN 110 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1nft n GLY 111 N 4.18 0.84 3.92 1.69 0.00 0.39 -5.01 105.19 111.20 1nft n GLY 111 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 1nft n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nft s LYS 112 N -0.49 2.16 0.13 1.61 -0.14 -0.52 -4.00 119.74 118.48 1nft s LYS 112 Ca 0.00 -0.14 0.03 0.00 -1.36 0.00 0.00 55.97 54.49 1nft s LYS 112 Cb 0.00 -2.11 -0.04 0.00 -1.68 0.00 0.00 37.83 34.00 1nft s LYS 112 CO 0.00 -1.32 0.21 0.95 -0.76 0.00 0.00 175.35 174.43 1nft s THR 113 N -3.33 5.07 0.04 2.17 -4.23 -1.26 -1.05 115.64 113.05 1nft s THR 113 Ca 0.60 -0.72 -0.01 0.00 -1.18 0.00 0.00 61.69 60.39 1nft s THR 113 Cb -0.11 -3.56 -0.03 0.00 1.34 0.00 0.00 72.50 70.14 1nft s THR 113 CO 0.46 -0.02 -0.03 -0.94 -0.54 0.00 0.00 174.62 173.55 1nft s SER 114 N -2.95 0.42 -0.14 3.99 1.04 -1.07 -0.40 113.70 114.58 1nft s SER 114 Ca 0.33 -0.84 0.01 0.00 0.48 0.00 0.00 55.95 55.94 1nft s SER 114 Cb -0.11 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.17 1nft s SER 114 CO 0.27 -0.50 -0.18 0.00 0.98 0.00 0.00 173.24 173.80 1nft s HIS 116 N 0.72 1.55 0.22 0.00 3.76 -0.69 -1.29 115.29 119.56 1nft s HIS 116 Ca -0.08 -0.52 -0.02 0.00 -0.15 0.00 0.00 55.06 54.29 1nft s HIS 116 Cb -0.16 -0.80 0.20 0.00 1.11 0.00 0.00 32.58 32.93 1nft s HIS 116 CO 0.01 0.20 1.59 1.79 -0.85 0.00 0.00 174.74 177.48 1nft h THR 117 N 3.47 1.29 0.00 1.30 1.35 -1.74 -3.41 112.91 115.17 1nft h THR 117 Ca -0.41 -1.54 0.00 0.00 -0.55 0.00 0.00 66.41 63.91 1nft h THR 117 Cb 1.20 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 1nft h THR 117 CO 0.50 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.87 1nft n GLY 118 N -0.04 1.76 3.72 5.82 0.00 -1.26 -1.17 105.19 114.02 1nft n GLY 118 Ca -0.02 -0.83 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 1nft n GLY 118 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1nft s LEU 119 N 0.00 4.38 0.00 0.99 0.20 0.29 -3.32 118.68 121.21 1nft s LEU 119 Ca 0.00 2.29 0.00 0.00 0.69 0.00 0.00 54.13 57.11 1nft s LEU 119 Cb 0.00 -3.59 0.00 0.00 -0.43 0.00 0.00 46.19 42.17 1nft s LEU 119 CO 0.00 -0.60 0.00 0.61 -0.29 0.00 0.00 176.35 176.07 1nft n GLY 120 N 3.25 1.01 3.84 7.98 0.00 -1.26 -4.98 105.19 115.03 1nft n GLY 120 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1nft n GLY 120 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nft s ARG 121 N -0.49 4.07 0.00 1.61 0.52 -1.21 -4.78 118.95 118.67 1nft s ARG 121 Ca 0.00 0.73 0.00 0.00 -0.52 0.00 0.00 55.73 55.94 1nft s ARG 121 Cb 0.00 -2.54 0.00 0.00 0.52 0.00 0.00 34.95 32.93 1nft s ARG 121 CO 0.00 0.21 0.77 0.43 0.02 0.00 0.00 175.30 176.73 1nft n SER 122 N -0.10 0.00 0.02 0.23 7.64 -1.26 -1.08 113.62 119.07 1nft n SER 122 Ca 0.02 0.77 -0.03 0.00 1.01 0.00 0.00 58.87 60.64 1nft n SER 122 Cb 0.53 -0.27 0.22 0.00 -1.01 0.00 0.00 64.21 63.67 1nft n SER 122 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nft h ALA 123 N -1.85 1.14 0.00 -0.43 0.00 -1.91 -1.26 119.26 114.94 1nft h ALA 123 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1nft h ALA 123 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1nft h ALA 123 CO 0.00 0.54 -0.51 0.78 0.00 0.00 0.00 179.25 180.06 1nft h GLY 124 N 1.00 0.00 0.00 0.00 0.00 -1.66 -3.39 103.07 99.01 1nft h GLY 124 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1nft h GLY 124 CO 0.04 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.45 1nft n TRP 125 N -2.61 -0.54 -0.12 5.60 -0.00 -0.58 -4.25 117.44 114.95 1nft n TRP 125 Ca 0.03 0.08 -0.12 0.00 -0.00 0.00 0.00 57.50 57.49 1nft n TRP 125 Cb 0.50 0.55 -0.03 0.00 -0.00 0.00 0.00 31.31 32.33 1nft n TRP 125 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 1nft h ASN 126 N 0.00 0.72 0.16 5.87 2.35 -0.79 -2.72 115.58 121.17 1nft h ASN 126 Ca 0.00 -0.38 -0.01 0.00 -0.55 0.00 0.00 56.30 55.36 1nft h ASN 126 Cb 0.00 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.17 1nft h ASN 126 CO 0.00 0.94 -0.08 0.40 -1.65 0.00 0.00 177.43 177.04 1nft h ILE 127 N 0.50 0.80 -0.26 2.81 2.04 -1.48 -2.05 117.51 119.86 1nft h ILE 127 Ca 0.09 -1.14 0.03 0.00 1.00 0.00 0.00 64.86 64.84 1nft h ILE 127 Cb 0.64 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 38.04 1nft h ILE 127 CO 0.04 0.21 0.08 1.55 0.00 0.00 0.00 178.15 180.04 1nft h PRO 128 N -0.89 0.19 -0.14 2.37 0.13 -1.78 -1.94 132.00 129.94 1nft h PRO 128 Ca -0.02 -0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 64.97 1nft h PRO 128 Cb 0.51 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.60 1nft h PRO 128 CO 0.04 0.13 -0.41 0.82 -0.23 0.00 0.00 178.00 178.34 1nft h ILE 129 N 0.20 1.36 0.00 -3.56 1.08 -1.64 -2.00 117.51 112.94 1nft h ILE 129 Ca 0.11 -1.70 -0.04 0.00 -0.39 0.00 0.00 64.86 62.84 1nft h ILE 129 Cb 0.09 2.06 -0.01 0.00 -3.07 0.00 0.00 36.82 35.89 1nft h ILE 129 CO -0.12 0.51 -0.20 1.23 -0.69 0.00 0.00 178.15 178.88 1nft h GLY 130 N 0.14 0.00 0.80 5.37 0.00 -1.35 -1.10 103.07 106.94 1nft h GLY 130 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 1nft h GLY 130 CO 0.09 0.00 -0.01 -0.84 0.00 0.00 0.00 176.54 175.78 1nft h THR 131 N 0.00 1.26 -0.17 4.70 2.02 -1.23 0.04 112.91 119.53 1nft h THR 131 Ca -0.00 -0.88 -0.10 0.00 0.77 0.00 0.00 66.41 66.21 1nft h THR 131 Cb 0.38 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 1nft h THR 131 CO 0.03 0.26 -0.32 -0.07 0.37 0.00 0.00 175.52 175.79 1nft h LEU 132 N 0.06 0.34 0.02 2.58 3.38 -1.04 -0.56 115.31 120.09 1nft h LEU 132 Ca 0.05 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1nft h LEU 132 Cb 0.40 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1nft h LEU 132 CO 0.01 0.65 -0.01 0.40 0.09 0.00 0.00 178.44 179.57 1nft h ILE 133 N 0.29 1.31 -0.77 1.22 2.04 -1.16 0.23 117.51 120.67 1nft h ILE 133 Ca 0.04 -1.06 0.10 0.00 1.00 0.00 0.00 64.86 64.93 1nft h ILE 133 Cb 0.70 2.02 -0.07 0.00 -0.74 0.00 0.00 36.82 38.73 1nft h ILE 133 CO 0.05 0.27 0.41 -0.74 0.00 0.00 0.00 178.15 178.15 1nft h HIS 134 N -0.49 0.75 0.00 1.37 2.76 -0.61 0.26 115.15 119.17 1nft h HIS 134 Ca -0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1nft h HIS 134 Cb 0.47 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 29.21 1nft h HIS 134 CO 0.08 0.29 0.00 0.54 -1.30 0.00 0.00 177.93 177.54 1nft n ARG 135 N -4.80 0.84 -0.86 5.26 1.74 -0.25 -4.91 116.66 113.67 1nft n ARG 135 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 1nft n ARG 135 Cb 0.28 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 1nft n ARG 135 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nft n GLY 136 N 0.86 0.65 0.15 -0.13 0.00 0.08 -4.92 105.19 101.88 1nft n GLY 136 Ca 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.15 1nft n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nft h ALA 137 N 0.00 0.67 -3.34 4.61 0.00 -0.78 -3.43 119.26 116.99 1nft h ALA 137 Ca 0.00 -0.63 -0.66 0.00 0.00 0.00 0.00 54.91 53.62 1nft h ALA 137 Cb 0.00 -0.08 -0.28 0.00 0.00 0.00 0.00 17.79 17.44 1nft h ALA 137 CO 0.00 0.81 -0.78 0.42 0.00 0.00 0.00 179.25 179.70 1nft s ILE 138 N -3.50 2.89 -0.24 0.00 1.01 -0.74 -4.97 121.20 115.64 1nft s ILE 138 Ca -0.04 -0.72 -0.11 0.00 0.00 0.00 0.00 60.65 59.78 1nft s ILE 138 Cb 0.11 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.33 1nft s ILE 138 CO 0.82 0.53 0.19 -1.61 0.00 0.00 0.00 174.94 174.87 1nft s GLU 139 N 0.33 4.07 -0.20 2.79 8.01 -1.26 -4.21 118.70 128.23 1nft s GLU 139 Ca -0.12 -0.22 -0.08 0.00 0.01 0.00 0.00 54.97 54.56 1nft s GLU 139 Cb -0.16 -3.55 0.08 0.00 -4.31 0.00 0.00 34.13 26.20 1nft s GLU 139 CO 0.06 0.04 0.43 -0.46 0.01 0.00 0.00 175.26 175.34 1nft s TRP 140 N 1.13 -0.78 -0.09 1.61 -0.00 -1.26 -4.79 118.94 114.76 1nft s TRP 140 Ca 0.09 1.51 0.21 0.00 -0.00 0.00 0.00 56.10 57.91 1nft s TRP 140 Cb -0.14 0.32 -0.27 0.00 -0.00 0.00 0.00 33.47 33.38 1nft s TRP 140 CO 0.05 -0.46 0.49 -1.91 -0.00 0.00 0.00 176.95 175.12 1nft n GLU 141 N 5.08 0.66 0.00 5.86 2.13 -1.26 -5.08 120.64 128.03 1nft n GLU 141 Ca -0.13 -0.10 0.00 0.00 0.66 0.00 0.00 57.16 57.59 1nft n GLU 141 Cb 0.51 -1.57 0.00 0.00 0.27 0.00 0.00 31.44 30.65 1nft n GLU 141 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1nft n GLY 142 N 1.35 0.75 0.37 8.31 0.00 -1.26 -5.02 105.19 109.70 1nft n GLY 142 Ca -0.09 -1.06 0.17 0.00 0.00 0.00 0.00 46.02 45.03 1nft n GLY 142 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1nft h ILE 143 N 1.38 0.78 -2.83 -0.61 6.09 -1.93 -3.05 117.51 117.35 1nft h ILE 143 Ca 0.00 -0.07 -0.71 0.00 -1.37 0.00 0.00 64.86 62.72 1nft h ILE 143 Cb 0.00 0.57 -0.19 0.00 0.47 0.00 0.00 36.82 37.67 1nft h ILE 143 CO 0.00 0.04 0.48 -0.70 -3.07 0.00 0.00 178.15 174.90 1nft s GLU 144 N -5.20 3.41 0.00 2.19 -6.30 -1.26 0.69 118.70 112.23 1nft s GLU 144 Ca -0.06 -1.68 0.00 0.00 -2.50 0.00 0.00 54.97 50.73 1nft s GLU 144 Cb 0.20 -4.58 0.00 0.00 0.00 0.00 0.00 34.13 29.75 1nft s GLU 144 CO 0.74 -1.63 0.00 0.43 0.02 0.00 0.00 175.26 174.82 1nft n SER 145 N 6.14 -0.01 0.00 -1.70 7.64 -1.15 -4.94 113.62 119.60 1nft n SER 145 Ca 0.10 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.43 1nft n SER 145 Cb 0.47 0.45 0.00 0.00 -1.01 0.00 0.00 64.21 64.11 1nft n SER 145 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nft n GLY 146 N -1.00 0.90 3.74 0.23 0.00 0.22 -5.10 105.19 104.18 1nft n GLY 146 Ca 0.00 -1.95 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 1nft n GLY 146 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1nft s SER 147 N -4.00 4.85 0.59 1.61 0.15 -1.26 -4.30 113.70 111.34 1nft s SER 147 Ca 0.00 2.61 0.36 0.00 0.70 0.00 0.00 55.95 59.61 1nft s SER 147 Cb 0.00 -2.62 1.87 0.00 -1.71 0.00 0.00 66.02 63.56 1nft s SER 147 CO 0.00 -1.84 2.20 0.58 1.20 0.00 0.00 173.24 175.38 1nft h VAL 148 N 0.80 0.24 -0.76 4.45 2.07 -1.95 -2.31 116.25 118.78 1nft h VAL 148 Ca -0.51 -0.25 0.09 0.00 0.82 0.00 0.00 66.70 66.85 1nft h VAL 148 Cb 1.32 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 32.24 1nft h VAL 148 CO 0.54 0.04 0.50 -0.33 0.02 0.00 0.00 177.57 178.34 1nft h GLU 149 N 0.00 0.66 -0.38 1.57 5.08 -1.99 -0.90 114.58 118.63 1nft h GLU 149 Ca -0.00 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.17 1nft h GLU 149 Cb 0.19 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1nft h GLU 149 CO 0.00 0.44 -0.34 1.96 -1.00 0.00 0.00 179.01 180.07 1nft h GLN 150 N 0.68 0.89 -0.42 2.33 4.20 -1.78 -1.83 115.11 119.19 1nft h GLN 150 Ca 0.35 -0.46 -0.04 0.00 0.06 0.00 0.00 58.65 58.56 1nft h GLN 150 Cb 0.45 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 1nft h GLN 150 CO -0.13 1.11 0.12 0.00 -0.67 0.00 0.00 178.83 179.26 1nft h ALA 151 N 0.77 0.54 0.00 3.87 0.00 -1.51 -2.53 119.26 120.40 1nft h ALA 151 Ca 0.06 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1nft h ALA 151 Cb 0.93 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1nft h ALA 151 CO 0.09 0.20 -0.20 0.28 0.00 0.00 0.00 179.25 179.62 1nft h VAL 152 N 0.53 0.98 0.00 0.00 2.07 -1.07 -1.99 116.25 116.76 1nft h VAL 152 Ca 0.13 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1nft h VAL 152 Cb 0.28 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1nft h VAL 152 CO -0.00 0.19 0.00 0.00 0.02 0.00 0.00 177.57 177.78 1nft n ALA 153 N -2.43 2.15 1.40 1.67 0.00 -0.70 -1.93 120.51 120.68 1nft n ALA 153 Ca -0.02 -0.03 0.14 0.00 0.00 0.00 0.00 53.44 53.52 1nft n ALA 153 Cb 0.27 -1.44 0.45 0.00 0.00 0.00 0.00 19.45 18.73 1nft n ALA 153 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nft n LYS 154 N -1.99 1.66 -0.04 0.00 5.02 -0.75 -4.51 118.16 117.55 1nft n LYS 154 Ca 0.05 -1.04 -0.09 0.00 -2.02 0.00 0.00 58.31 55.22 1nft n LYS 154 Cb 0.36 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.86 1nft n LYS 154 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1nft n PHE 155 N 0.24 0.00 -3.44 2.13 7.35 -0.88 -4.93 117.46 117.92 1nft n PHE 155 Ca 0.18 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.55 1nft n PHE 155 Cb 0.39 -0.35 -0.05 0.00 0.35 0.00 0.00 39.48 39.82 1nft n PHE 155 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1nft s PHE 156 N -2.40 3.44 0.10 -5.13 0.08 -0.81 -0.46 117.98 112.80 1nft s PHE 156 Ca -0.17 0.78 0.01 0.00 0.12 0.00 0.00 56.93 57.67 1nft s PHE 156 Cb 0.04 -2.19 -0.22 0.00 -0.57 0.00 0.00 43.02 40.08 1nft s PHE 156 CO 0.23 0.28 1.23 0.66 -0.10 0.00 0.00 175.22 177.52 1nft h SER 157 N 2.44 0.24 -5.01 1.36 4.64 -1.22 -3.44 113.55 112.56 1nft h SER 157 Ca -0.47 -0.24 -0.05 0.00 -0.47 0.00 0.00 61.79 60.56 1nft h SER 157 Cb 1.17 -0.08 -0.16 0.00 -0.31 0.00 0.00 62.40 63.03 1nft h SER 157 CO 0.69 1.17 0.14 0.00 -0.87 0.00 0.00 176.83 177.96 1nft s ALA 158 N -2.75 -1.55 0.25 5.18 0.00 -1.26 -5.00 121.76 116.64 1nft s ALA 158 Ca -0.02 0.81 -0.05 0.00 0.00 0.00 0.00 51.96 52.70 1nft s ALA 158 Cb 0.09 0.40 -0.02 0.00 0.00 0.00 0.00 23.12 23.58 1nft s ALA 158 CO 0.85 -0.53 0.32 -1.12 0.00 0.00 0.00 175.76 175.28 1nft s SER 159 N -1.93 0.29 -0.24 0.00 0.01 -0.65 -2.59 113.70 108.60 1nft s SER 159 Ca -0.05 -1.26 0.02 0.00 1.31 0.00 0.00 55.95 55.96 1nft s SER 159 Cb -0.01 0.51 0.06 0.00 0.21 0.00 0.00 66.02 66.80 1nft s SER 159 CO -0.01 -1.04 -0.09 0.00 0.41 0.00 0.00 173.24 172.51 1nft s VAL 161 N 1.26 2.04 -0.39 0.00 1.01 -0.03 -1.70 120.40 122.58 1nft s VAL 161 Ca -0.06 -3.10 -0.44 0.00 0.00 0.00 0.00 61.98 58.38 1nft s VAL 161 Cb -0.19 -2.41 -0.18 0.00 0.00 0.00 0.00 36.38 33.60 1nft s VAL 161 CO -0.06 -0.88 1.65 -2.65 0.00 0.00 0.00 175.10 173.16 1nft n PRO 162 N 3.13 0.50 0.00 2.72 -0.02 -1.26 -1.97 135.00 138.10 1nft n PRO 162 Ca 0.09 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1nft n PRO 162 Cb 0.34 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1nft n PRO 162 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nft n GLY 163 N 4.04 0.44 3.76 -1.23 0.00 0.00 -0.55 105.19 111.66 1nft n GLY 163 Ca 0.29 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.94 1nft n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nft s ALA 164 N -2.00 2.90 0.00 4.61 0.00 -0.83 -4.83 121.76 121.60 1nft s ALA 164 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 51.96 52.99 1nft s ALA 164 Cb 0.00 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1nft s ALA 164 CO 0.00 -0.86 0.00 0.25 0.00 0.00 0.00 175.76 175.15 1nft n THR 165 N -0.72 0.00 -0.07 0.00 -2.24 -1.26 -4.91 114.28 105.07 1nft n THR 165 Ca 0.09 -0.07 -0.22 0.00 -2.27 0.00 0.00 64.05 61.57 1nft n THR 165 Cb 0.48 0.54 -0.12 0.00 -2.10 0.00 0.00 70.33 69.13 1nft n THR 165 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1nft n ILE 166 N -0.39 1.62 -3.99 2.28 2.08 -1.26 -4.91 119.36 114.78 1nft n ILE 166 Ca 0.00 -0.31 -0.34 0.00 0.56 0.00 0.00 62.75 62.65 1nft n ILE 166 Cb 0.00 -1.88 -0.15 0.00 -0.75 0.00 0.00 39.64 36.86 1nft n ILE 166 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1nft s GLU 167 N -2.46 3.21 0.33 0.38 0.41 -1.26 -5.01 118.70 114.31 1nft s GLU 167 Ca -0.28 -0.72 0.01 0.00 -0.41 0.00 0.00 54.97 53.57 1nft s GLU 167 Cb 0.07 -2.84 0.58 0.00 -1.78 0.00 0.00 34.13 30.17 1nft s GLU 167 CO 0.64 -0.21 1.99 0.37 -0.49 0.00 0.00 175.26 177.56 1nft h GLN 168 N 8.04 0.88 -0.13 1.61 4.15 -1.97 -2.07 115.11 125.61 1nft h GLN 168 Ca -0.43 -0.06 0.04 0.00 0.77 0.00 0.00 58.65 58.96 1nft h GLN 168 Cb 1.15 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.64 1nft h GLN 168 CO 0.62 0.60 0.11 0.87 -1.93 0.00 0.00 178.83 179.10 1nft h LYS 169 N 0.90 0.00 0.00 1.69 1.57 -1.94 -1.76 116.57 117.02 1nft h LYS 169 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1nft h LYS 169 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1nft h LYS 169 CO -0.05 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.11 1nft n LEU 170 N -4.20 0.54 -0.17 2.94 4.77 -0.78 -1.63 117.00 118.47 1nft n LEU 170 Ca 0.00 0.63 0.05 0.00 -0.03 0.00 0.00 56.01 56.67 1nft n LEU 170 Cb 0.23 -0.56 -0.02 0.00 -2.33 0.00 0.00 43.42 40.74 1nft n LEU 170 CO 0.32 -0.49 0.14 0.00 -1.33 0.00 0.00 177.39 176.02 1nft h ARG 172 N 0.85 0.56 -0.05 0.00 2.43 -1.27 -2.37 114.38 114.52 1nft h ARG 172 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1nft h ARG 172 Cb 0.34 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1nft h ARG 172 CO 0.00 0.37 0.00 1.04 -1.51 0.00 0.00 179.97 179.87 1nft n GLN 173 N -4.47 1.42 -2.61 0.20 1.13 -0.27 -4.94 117.38 107.84 1nft n GLN 173 Ca 0.06 -0.62 -0.36 0.00 -1.94 0.00 0.00 57.00 54.14 1nft n GLN 173 Cb 0.15 -1.43 -0.05 0.00 0.11 0.00 0.00 30.24 29.02 1nft n GLN 173 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1nft s LYS 175 N -2.51 3.97 0.00 0.00 2.20 -1.26 -4.97 119.74 117.17 1nft s LYS 175 Ca 0.57 0.57 0.00 0.00 -0.36 0.00 0.00 55.97 56.75 1nft s LYS 175 Cb -0.20 -2.58 0.00 0.00 -1.51 0.00 0.00 37.83 33.54 1nft s LYS 175 CO 0.25 0.25 0.00 0.41 -0.36 0.00 0.00 175.35 175.91 1nft n GLY 176 N -0.08 2.17 3.80 5.54 0.00 -1.26 -4.40 105.19 110.97 1nft n GLY 176 Ca 0.01 -2.03 -0.30 0.00 0.00 0.00 0.00 46.02 43.70 1nft n GLY 176 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1nft s ASP 177 N 0.00 4.44 0.44 1.61 1.47 -1.26 -4.61 116.67 118.76 1nft s ASP 177 Ca 0.00 1.28 0.13 0.00 1.18 0.00 0.00 52.55 55.14 1nft s ASP 177 Cb 0.00 -2.01 1.02 0.00 -0.34 0.00 0.00 42.92 41.59 1nft s ASP 177 CO 0.00 -2.00 2.02 -0.65 0.68 0.00 0.00 175.17 175.22 1nft h PRO 178 N -1.11 0.39 -0.60 2.11 0.11 -2.00 -0.82 132.00 130.08 1nft h PRO 178 Ca -0.47 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 1nft h PRO 178 Cb 1.27 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1nft h PRO 178 CO 0.59 0.26 0.02 0.87 -0.21 0.00 0.00 178.00 179.53 1nft h LYS 179 N 0.40 1.03 -0.00 1.05 6.56 -2.03 -3.37 116.57 120.22 1nft h LYS 179 Ca 0.22 -0.31 0.00 0.00 -1.06 0.00 0.00 60.65 59.50 1nft h LYS 179 Cb 0.36 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 31.91 1nft h LYS 179 CO -0.06 0.99 -0.00 0.25 -2.06 0.00 0.00 179.45 178.58 1nft n THR 180 N -4.19 0.00 0.18 -0.16 -2.24 -0.71 -4.79 114.28 102.38 1nft n THR 180 Ca 0.03 -0.50 0.16 0.00 -2.27 0.00 0.00 64.05 61.48 1nft n THR 180 Cb 0.33 1.01 0.78 0.00 -2.10 0.00 0.00 70.33 70.35 1nft n THR 180 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1nft h LYS 181 N 0.14 0.00 -0.17 -0.78 2.10 -1.34 -2.71 116.57 113.80 1nft h LYS 181 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 1nft h LYS 181 Cb 0.03 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.35 1nft h LYS 181 CO 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 179.45 177.43 1nft s ALA 183 N -2.90 2.75 0.04 0.00 0.00 -1.02 -0.82 121.76 119.80 1nft s ALA 183 Ca 0.39 -0.03 0.32 0.00 0.00 0.00 0.00 51.96 52.63 1nft s ALA 183 Cb 0.33 -3.13 1.49 0.00 0.00 0.00 0.00 23.12 21.81 1nft s ALA 183 CO 0.05 -1.15 1.95 0.00 0.00 0.00 0.00 175.76 176.62 1nft h ARG 184 N -0.66 0.00 -0.20 0.00 -0.00 -1.90 0.26 114.38 111.88 1nft h ARG 184 Ca -0.44 0.00 -0.02 0.00 -0.50 0.00 0.00 59.98 59.01 1nft h ARG 184 Cb 1.22 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 31.17 1nft h ARG 184 CO 0.59 0.00 -0.02 0.27 0.00 0.00 0.00 179.97 180.81 1nft n ASN 185 N -2.73 3.23 -4.40 7.04 0.23 -1.26 -4.75 115.26 112.61 1nft n ASN 185 Ca -0.00 -3.16 -0.34 0.00 -0.53 0.00 0.00 54.58 50.55 1nft n ASN 185 Cb 0.18 -0.53 0.11 0.00 -2.08 0.00 0.00 39.78 37.47 1nft n ASN 185 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1nft n ALA 186 N -0.86 -2.58 -0.29 -2.53 0.00 0.08 -4.80 120.51 109.52 1nft n ALA 186 Ca 0.21 -0.56 0.28 0.00 0.00 0.00 0.00 53.44 53.37 1nft n ALA 186 Cb 0.84 -1.78 0.51 0.00 0.00 0.00 0.00 19.45 19.03 1nft n ALA 186 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1nft n PRO 187 N -1.36 -0.06 -0.84 0.00 -0.02 -1.26 -1.40 135.00 130.06 1nft n PRO 187 Ca 0.07 1.26 0.08 0.00 -2.02 0.00 0.00 63.50 62.88 1nft n PRO 187 Cb 0.53 -2.24 0.40 0.00 -0.02 0.00 0.00 33.50 32.17 1nft n PRO 187 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1nft n TYR 188 N -5.07 1.97 -2.34 6.00 4.01 -1.26 -4.60 117.16 115.87 1nft n TYR 188 Ca 0.33 -0.70 -0.26 0.00 -0.16 0.00 0.00 57.90 57.12 1nft n TYR 188 Cb 1.13 -0.45 0.05 0.00 -0.31 0.00 0.00 39.34 39.76 1nft n TYR 188 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1nft s SER 189 N -0.81 5.22 0.09 7.72 1.04 -0.49 -2.88 113.70 123.59 1nft s SER 189 Ca 0.54 0.53 0.00 0.00 0.48 0.00 0.00 55.95 57.50 1nft s SER 189 Cb 0.40 -1.36 0.00 0.00 0.10 0.00 0.00 66.02 65.16 1nft s SER 189 CO 0.18 -1.31 0.00 0.61 0.98 0.00 0.00 173.24 173.71 1nft n GLY 190 N -2.71 -1.44 0.07 7.32 0.00 -0.31 -2.38 105.19 105.74 1nft n GLY 190 Ca 0.06 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.52 1nft n GLY 190 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1nft h TYR 191 N -0.36 -0.06 -0.51 1.61 0.05 -1.93 -1.92 116.97 113.85 1nft h TYR 191 Ca 0.01 -0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.75 1nft h TYR 191 Cb 0.35 0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 1nft h TYR 191 CO -0.92 0.26 0.17 0.66 -1.05 0.00 0.00 178.16 177.28 1nft h SER 192 N -0.39 0.69 -0.34 3.88 4.64 -1.94 -1.71 113.55 118.39 1nft h SER 192 Ca -0.01 -0.10 -0.02 0.00 -0.47 0.00 0.00 61.79 61.19 1nft h SER 192 Cb 0.35 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 1nft h SER 192 CO 0.01 0.66 0.12 1.23 -0.87 0.00 0.00 176.83 177.98 1nft h GLY 193 N 0.91 0.55 2.00 -0.77 0.00 -1.30 -1.04 103.07 103.42 1nft h GLY 193 Ca 0.17 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 47.10 1nft h GLY 193 CO -0.01 0.30 -0.40 0.00 0.00 0.00 0.00 176.54 176.43 1nft h ALA 194 N 0.96 1.25 -0.31 3.60 0.00 -1.11 -0.20 119.26 123.45 1nft h ALA 194 Ca 0.11 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 1nft h ALA 194 Cb 0.22 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1nft h ALA 194 CO -0.01 0.50 -0.42 0.35 0.00 0.00 0.00 179.25 179.68 1nft h PHE 195 N 0.00 1.01 -0.03 0.00 3.57 -1.07 -2.80 116.94 117.62 1nft h PHE 195 Ca -0.00 -0.33 -0.12 0.00 3.53 0.00 0.00 57.97 61.05 1nft h PHE 195 Cb 0.74 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 1nft h PHE 195 CO 0.00 1.13 -0.52 0.45 -2.23 0.00 0.00 178.31 177.14 1nft h HIS 196 N 0.60 0.11 -0.71 0.41 3.86 -0.58 -0.64 115.15 118.22 1nft h HIS 196 Ca 0.04 -0.04 0.09 0.00 -1.16 0.00 0.00 60.37 59.29 1nft h HIS 196 Cb 1.01 -0.02 -0.07 0.00 1.06 0.00 0.00 27.41 29.39 1nft h HIS 196 CO 0.07 0.60 0.36 0.00 0.86 0.00 0.00 177.93 179.83 1nft h LEU 198 N 0.63 0.05 -0.65 0.00 5.85 -1.04 -1.38 115.31 118.77 1nft h LEU 198 Ca 0.34 -0.45 0.12 0.00 0.84 0.00 0.00 57.88 58.74 1nft h LEU 198 Cb 0.33 -0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.26 1nft h LEU 198 CO -0.25 0.49 0.18 0.50 -0.34 0.00 0.00 178.44 179.02 1nft h LYS 199 N -0.38 0.31 0.00 1.25 3.64 -0.84 -1.14 116.57 119.41 1nft h LYS 199 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1nft h LYS 199 Cb 0.47 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1nft h LYS 199 CO 0.00 0.21 0.00 -0.25 -2.27 0.00 0.00 179.45 177.14 1nft n ASP 200 N -5.09 0.00 -0.19 4.20 8.00 0.29 -4.88 116.55 118.89 1nft n ASP 200 Ca 0.11 -1.66 -0.02 0.00 0.71 0.00 0.00 54.79 53.92 1nft n ASP 200 Cb 0.35 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.44 1nft n ASP 200 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nft n GLY 201 N 0.64 0.55 0.05 0.44 0.00 -0.43 -4.88 105.19 101.56 1nft n GLY 201 Ca 0.07 -0.30 0.13 0.00 0.00 0.00 0.00 46.02 45.92 1nft n GLY 201 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nft n LYS 202 N -2.20 0.11 -3.74 1.61 4.76 -0.53 -4.81 118.16 113.36 1nft n LYS 202 Ca -0.02 0.15 -0.11 0.00 -2.87 0.00 0.00 58.31 55.45 1nft n LYS 202 Cb 0.17 -1.64 -0.06 0.00 -1.84 0.00 0.00 35.03 31.65 1nft n LYS 202 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1nft s GLY 203 N -3.25 -0.13 0.09 0.72 0.00 -1.21 -4.67 107.32 98.88 1nft s GLY 203 Ca 0.11 -0.11 0.14 0.00 0.00 0.00 0.00 44.72 44.85 1nft s GLY 203 CO 0.51 -0.34 1.00 -0.55 0.00 0.00 0.00 173.10 173.71 1nft h ASP 204 N 2.88 0.00 -4.10 1.64 3.32 -1.04 -3.42 116.42 115.69 1nft h ASP 204 Ca -0.33 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.25 1nft h ASP 204 Cb 1.21 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.47 1nft h ASP 204 CO 0.48 0.73 -0.81 -0.69 -1.72 0.00 0.00 179.24 177.23 1nft s VAL 205 N -2.82 1.04 -0.16 -1.35 1.01 -1.20 -4.40 120.40 112.53 1nft s VAL 205 Ca -0.01 -0.55 -0.00 0.00 0.00 0.00 0.00 61.98 61.42 1nft s VAL 205 Cb 0.08 -0.88 -0.00 0.00 0.00 0.00 0.00 36.38 35.58 1nft s VAL 205 CO 0.80 0.30 -0.14 0.00 0.00 0.00 0.00 175.10 176.06 1nft s ALA 206 N -0.21 2.54 -0.60 5.51 0.00 -0.45 -0.86 121.76 127.69 1nft s ALA 206 Ca 0.03 -1.04 -0.21 0.00 0.00 0.00 0.00 51.96 50.74 1nft s ALA 206 Cb -0.06 -1.27 0.08 0.00 0.00 0.00 0.00 23.12 21.87 1nft s ALA 206 CO -0.00 -0.04 0.82 -0.06 0.00 0.00 0.00 175.76 176.48 1nft s PHE 207 N 0.82 2.85 0.00 0.00 0.08 -0.42 -2.03 117.98 119.29 1nft s PHE 207 Ca -0.05 -0.65 0.00 0.00 0.12 0.00 0.00 56.93 56.35 1nft s PHE 207 Cb -0.15 -4.07 0.00 0.00 -0.57 0.00 0.00 43.02 38.23 1nft s PHE 207 CO 0.00 -1.41 0.00 1.33 -0.10 0.00 0.00 175.22 175.04 1nft n VAL 208 N 5.77 0.00 -4.31 -0.44 0.24 -0.99 -3.74 118.33 114.86 1nft n VAL 208 Ca -0.06 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.00 1nft n VAL 208 Cb 0.44 0.00 -0.08 0.00 -1.47 0.00 0.00 33.84 32.73 1nft n VAL 208 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1nft s LYS 209 N 1.40 2.12 0.55 7.34 -2.85 -1.26 -2.08 119.74 124.96 1nft s LYS 209 Ca 0.00 -1.75 0.29 0.00 -1.00 0.00 0.00 55.97 53.51 1nft s LYS 209 Cb 0.00 -1.95 1.56 0.00 -2.06 0.00 0.00 37.83 35.38 1nft s LYS 209 CO 0.00 0.11 1.86 1.12 0.10 0.00 0.00 175.35 178.54 1nft h HIS 210 N 1.75 0.00 0.00 1.78 2.07 -1.29 -1.58 115.15 117.89 1nft h HIS 210 Ca -0.43 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.09 1nft h HIS 210 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1nft h HIS 210 CO 0.69 0.00 -1.01 0.25 -3.07 0.00 0.00 177.93 174.79 1nft n THR 211 N -2.68 0.00 -0.28 6.12 -2.24 -1.26 -4.65 114.28 109.29 1nft n THR 211 Ca -0.02 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1nft n THR 211 Cb 0.26 0.88 0.13 0.00 -2.10 0.00 0.00 70.33 69.50 1nft n THR 211 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1nft h THR 212 N 0.00 1.00 -0.10 4.28 2.02 -1.69 -0.76 112.91 117.66 1nft h THR 212 Ca 0.00 -0.29 -0.04 0.00 0.77 0.00 0.00 66.41 66.85 1nft h THR 212 Cb 0.53 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1nft h THR 212 CO 0.00 0.16 -0.08 0.58 0.37 0.00 0.00 175.52 176.54 1nft h VAL 213 N 0.85 1.35 -0.13 3.16 2.07 -1.82 -2.27 116.25 119.46 1nft h VAL 213 Ca 0.35 -1.21 0.04 0.00 0.82 0.00 0.00 66.70 66.70 1nft h VAL 213 Cb 0.20 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1nft h VAL 213 CO -0.19 0.34 0.10 0.78 0.02 0.00 0.00 177.57 178.63 1nft h ASN 214 N -0.18 0.00 0.05 0.57 2.35 -1.70 0.60 115.58 117.26 1nft h ASN 214 Ca 0.02 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.51 1nft h ASN 214 Cb 0.59 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.98 1nft h ASN 214 CO 0.02 0.00 -1.01 -0.33 -1.65 0.00 0.00 177.43 174.46 1nft h GLU 215 N 0.00 0.60 0.00 0.81 5.08 -1.00 -3.27 114.58 116.80 1nft h GLU 215 Ca 0.06 -0.71 -0.29 0.00 -1.00 0.00 0.00 59.36 57.42 1nft h GLU 215 Cb 0.27 0.22 -0.05 0.00 0.50 0.00 0.00 28.75 29.68 1nft h GLU 215 CO -0.00 1.30 -1.89 0.09 -1.00 0.00 0.00 179.01 177.51 1nft n ASN 216 N -3.92 0.57 -3.01 1.42 3.02 -0.87 -4.70 115.26 107.77 1nft n ASN 216 Ca -0.12 0.27 -0.15 0.00 -0.03 0.00 0.00 54.58 54.55 1nft n ASN 216 Cb 0.87 0.37 -0.00 0.00 -0.61 0.00 0.00 39.78 40.41 1nft n ASN 216 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nft n ALA 217 N -2.58 2.24 -0.38 5.41 0.00 0.17 -4.99 120.51 120.38 1nft n ALA 217 Ca -0.21 -3.18 0.00 0.00 0.00 0.00 0.00 53.44 50.06 1nft n ALA 217 Cb 1.04 -0.95 0.14 0.00 0.00 0.00 0.00 19.45 19.69 1nft n ALA 217 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1nft h PRO 218 N 2.98 1.23 0.00 0.00 0.13 -1.63 -0.56 132.00 134.15 1nft h PRO 218 Ca 0.03 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1nft h PRO 218 Cb 1.04 -0.28 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1nft h PRO 218 CO 0.47 0.82 0.00 -0.40 -0.23 0.00 0.00 178.00 178.65 1nft n ASP 219 N -4.44 0.00 -0.93 1.44 5.68 -1.26 -3.66 116.55 113.38 1nft n ASP 219 Ca 0.14 -1.20 0.02 0.00 -0.50 0.00 0.00 54.79 53.25 1nft n ASP 219 Cb 0.10 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.09 1nft n ASP 219 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1nft n GLN 220 N -0.78 0.00 -0.28 0.11 6.02 -0.23 -4.92 117.38 117.30 1nft n GLN 220 Ca 0.11 -1.42 0.09 0.00 -0.01 0.00 0.00 57.00 55.77 1nft n GLN 220 Cb 0.05 -0.28 0.32 0.00 1.02 0.00 0.00 30.24 31.35 1nft n GLN 220 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 1nft h LYS 221 N 0.43 0.80 -0.02 -1.09 1.57 -1.61 -2.07 116.57 114.58 1nft h LYS 221 Ca -0.10 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1nft h LYS 221 Cb 1.61 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.74 1nft h LYS 221 CO 0.04 0.53 0.00 -0.25 -0.57 0.00 0.00 179.45 179.20 1nft n ASP 222 N -4.55 0.24 -0.05 0.86 8.00 -1.26 -1.76 116.55 118.04 1nft n ASP 222 Ca 0.16 -1.32 0.14 0.00 0.71 0.00 0.00 54.79 54.48 1nft n ASP 222 Cb 0.37 -0.01 0.64 0.00 -0.02 0.00 0.00 41.12 42.09 1nft n ASP 222 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1nft n GLU 223 N -0.69 0.43 -4.37 -1.24 1.02 -0.78 -4.82 120.64 110.19 1nft n GLU 223 Ca 0.17 -0.09 -0.22 0.00 -0.02 0.00 0.00 57.16 57.01 1nft n GLU 223 Cb 0.12 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 29.93 1nft n GLU 223 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1nft s TYR 224 N -2.63 1.90 0.23 -0.32 2.02 -0.72 -0.88 117.35 116.95 1nft s TYR 224 Ca 0.25 -0.47 -0.01 0.00 -0.37 0.00 0.00 57.07 56.47 1nft s TYR 224 Cb 0.20 -0.90 -0.03 0.00 -0.40 0.00 0.00 41.96 40.82 1nft s TYR 224 CO 0.50 0.42 0.20 -1.21 -1.57 0.00 0.00 175.55 173.88 1nft s GLU 225 N -3.16 1.33 -0.04 -0.62 2.02 -0.11 -4.33 118.70 113.79 1nft s GLU 225 Ca 0.20 -1.65 0.03 0.00 0.02 0.00 0.00 54.97 53.57 1nft s GLU 225 Cb -0.04 0.30 -0.03 0.00 0.10 0.00 0.00 34.13 34.46 1nft s GLU 225 CO 0.08 -0.46 -0.11 -0.51 0.02 0.00 0.00 175.26 174.28 1nft s LEU 226 N -3.18 2.93 -0.31 1.80 1.43 0.09 -0.87 118.68 120.58 1nft s LEU 226 Ca 0.37 -0.15 -0.19 0.00 -1.03 0.00 0.00 54.13 53.13 1nft s LEU 226 Cb 0.05 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.62 1nft s LEU 226 CO 0.14 0.33 0.58 -0.76 0.23 0.00 0.00 176.35 176.87 1nft s LEU 227 N -0.94 4.17 0.13 1.79 1.43 0.50 -1.31 118.68 124.45 1nft s LEU 227 Ca 0.13 0.34 -0.06 0.00 -1.03 0.00 0.00 54.13 53.51 1nft s LEU 227 Cb -0.11 -2.73 -0.06 0.00 0.03 0.00 0.00 46.19 43.32 1nft s LEU 227 CO 0.02 -0.44 0.39 0.00 0.23 0.00 0.00 176.35 176.55 1nft n LEU 229 N 0.28 0.00 -1.23 0.00 4.77 -1.26 -2.64 117.00 116.91 1nft n LEU 229 Ca -0.04 0.33 0.12 0.00 -0.03 0.00 0.00 56.01 56.39 1nft n LEU 229 Cb 0.52 -0.33 0.26 0.00 -2.33 0.00 0.00 43.42 41.54 1nft n LEU 229 CO 0.47 -0.16 0.73 -0.90 -1.33 0.00 0.00 177.39 176.20 1nft n ASP 230 N -1.33 3.64 0.00 -1.43 5.75 -1.26 -4.94 116.55 116.99 1nft n ASP 230 Ca 0.07 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.85 1nft n ASP 230 Cb 0.13 -0.35 0.00 0.00 -1.03 0.00 0.00 41.12 39.88 1nft n ASP 230 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1nft n GLY 231 N 1.57 1.21 3.95 6.12 0.00 -1.08 -5.09 105.19 111.88 1nft n GLY 231 Ca 0.21 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 1nft n GLY 231 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nft s SER 232 N -1.76 5.19 -0.03 1.61 1.04 -1.26 -4.72 113.70 113.76 1nft s SER 232 Ca 0.00 0.21 0.07 0.00 0.48 0.00 0.00 55.95 56.71 1nft s SER 232 Cb 0.00 -1.05 -0.02 0.00 0.10 0.00 0.00 66.02 65.05 1nft s SER 232 CO 0.00 -1.25 -0.25 -0.13 0.98 0.00 0.00 173.24 172.59 1nft s ARG 233 N -4.92 2.17 0.18 4.02 0.52 -1.26 -1.90 118.95 117.76 1nft s ARG 233 Ca 0.57 -0.90 0.03 0.00 -0.52 0.00 0.00 55.73 54.91 1nft s ARG 233 Cb -0.10 -2.01 -0.05 0.00 0.52 0.00 0.00 34.95 33.30 1nft s ARG 233 CO 0.41 0.50 -0.02 -0.65 0.02 0.00 0.00 175.30 175.56 1nft s GLN 234 N -0.47 1.16 0.65 3.54 -0.21 -0.43 -4.93 119.66 118.97 1nft s GLN 234 Ca 0.06 -1.55 -0.18 0.00 0.02 0.00 0.00 55.36 53.71 1nft s GLN 234 Cb -0.11 -0.41 -0.02 0.00 1.00 0.00 0.00 33.01 33.48 1nft s GLN 234 CO 0.00 -0.09 1.14 -2.30 -2.12 0.00 0.00 175.29 171.92 1nft n PRO 235 N -0.28 0.93 -0.27 2.91 -0.02 -1.26 -0.74 135.00 136.28 1nft n PRO 235 Ca -0.07 0.37 0.26 0.00 -2.02 0.00 0.00 63.50 62.04 1nft n PRO 235 Cb 0.63 -2.37 0.61 0.00 -0.02 0.00 0.00 33.50 32.35 1nft n PRO 235 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1nft h VAL 236 N 0.36 0.54 -0.00 -1.45 2.07 -1.85 0.20 116.25 116.12 1nft h VAL 236 Ca -0.50 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1nft h VAL 236 Cb 1.35 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1nft h VAL 236 CO 0.51 0.04 -0.03 0.47 0.02 0.00 0.00 177.57 178.58 1nft n ASP 237 N -4.43 0.44 -1.88 0.57 8.00 -1.26 -3.78 116.55 114.21 1nft n ASP 237 Ca 0.22 -0.91 -0.18 0.00 0.71 0.00 0.00 54.79 54.64 1nft n ASP 237 Cb 0.93 -0.05 0.11 0.00 -0.02 0.00 0.00 41.12 42.09 1nft n ASP 237 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1nft n ASN 238 N -0.77 4.30 0.24 -2.24 4.13 0.70 -4.59 115.26 117.04 1nft n ASN 238 Ca 0.19 -3.14 0.10 0.00 1.68 0.00 0.00 54.58 53.41 1nft n ASN 238 Cb 0.22 -0.80 0.62 0.00 -1.54 0.00 0.00 39.78 38.29 1nft n ASN 238 CO 0.00 0.00 0.00 0.10 0.28 0.00 0.00 177.26 177.64 1nft h TYR 239 N 0.90 0.00 0.00 3.10 -0.00 -1.76 -2.13 116.97 117.08 1nft h TYR 239 Ca 0.43 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 59.12 1nft h TYR 239 Cb 1.95 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 38.67 1nft h TYR 239 CO 1.07 0.17 -0.20 0.87 -0.00 0.00 0.00 178.16 180.07 1nft h LYS 240 N 0.00 0.00 -0.41 0.10 1.57 -1.94 -2.32 116.57 113.58 1nft h LYS 240 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1nft h LYS 240 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1nft h LYS 240 CO 0.02 0.20 0.00 0.25 -0.57 0.00 0.00 179.45 179.35 1nft n THR 241 N -3.66 1.02 -2.91 -0.16 -2.24 -0.84 -4.76 114.28 100.73 1nft n THR 241 Ca -0.01 -1.01 -0.14 0.00 -2.27 0.00 0.00 64.05 60.62 1nft n THR 241 Cb 0.32 0.49 0.01 0.00 -2.10 0.00 0.00 70.33 69.06 1nft n THR 241 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nft s ASN 243 N -1.55 1.63 0.15 0.00 2.20 -1.19 -4.59 114.94 111.59 1nft s ASN 243 Ca 0.32 -1.02 0.21 0.00 -0.94 0.00 0.00 52.86 51.43 1nft s ASN 243 Cb 0.23 0.02 -0.06 0.00 -2.00 0.00 0.00 41.25 39.44 1nft s ASN 243 CO -0.17 -0.37 0.95 0.79 -2.94 0.00 0.00 177.10 175.36 1nft n TRP 244 N -0.16 0.94 -3.62 1.54 7.02 0.27 -4.69 117.44 118.74 1nft n TRP 244 Ca -0.11 0.29 -0.06 0.00 -1.02 0.00 0.00 57.50 56.60 1nft n TRP 244 Cb 0.61 -0.99 -0.05 0.00 -2.42 0.00 0.00 31.31 28.46 1nft n TRP 244 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1nft s ALA 245 N -3.23 -2.05 0.05 6.99 0.00 -1.23 -4.77 121.76 117.52 1nft s ALA 245 Ca -0.02 1.75 -0.25 0.00 0.00 0.00 0.00 51.96 53.44 1nft s ALA 245 Cb 0.09 -1.29 -0.05 0.00 0.00 0.00 0.00 23.12 21.87 1nft s ALA 245 CO 0.80 -0.24 0.78 0.50 0.00 0.00 0.00 175.76 177.61 1nft s ARG 246 N -0.65 4.51 -0.30 0.00 3.52 -1.26 -0.95 118.95 123.82 1nft s ARG 246 Ca 0.04 1.09 -0.08 0.00 -0.13 0.00 0.00 55.73 56.65 1nft s ARG 246 Cb -0.02 -3.37 -0.01 0.00 -1.56 0.00 0.00 34.95 30.00 1nft s ARG 246 CO -0.06 0.27 0.12 0.08 -0.81 0.00 0.00 175.30 174.90 1nft s VAL 247 N -0.02 4.36 0.80 7.11 1.01 0.67 -4.66 120.40 129.67 1nft s VAL 247 Ca 0.39 -0.47 -0.11 0.00 0.00 0.00 0.00 61.98 61.80 1nft s VAL 247 Cb -0.21 -3.20 0.07 0.00 0.00 0.00 0.00 36.38 33.04 1nft s VAL 247 CO 0.23 0.11 1.09 0.00 0.00 0.00 0.00 175.10 176.54 1nft s ALA 248 N 1.58 2.10 0.87 5.51 0.00 -1.26 -0.35 121.76 130.20 1nft s ALA 248 Ca 0.04 0.22 -0.11 0.00 0.00 0.00 0.00 51.96 52.11 1nft s ALA 248 Cb -0.17 -3.26 0.12 0.00 0.00 0.00 0.00 23.12 19.81 1nft s ALA 248 CO 0.05 -1.91 1.14 0.00 0.00 0.00 0.00 175.76 175.04 1nft s ALA 249 N -2.90 1.70 0.37 0.00 0.00 -0.29 -3.70 121.76 116.95 1nft s ALA 249 Ca 0.62 0.56 -0.27 0.00 0.00 0.00 0.00 51.96 52.87 1nft s ALA 249 Cb -0.17 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.43 1nft s ALA 249 CO 0.56 -2.47 1.30 -1.01 0.00 0.00 0.00 175.76 174.14 1nft s HIS 250 N -2.63 2.92 0.04 0.00 3.76 -1.26 -4.58 115.29 113.55 1nft s HIS 250 Ca 0.66 1.42 0.06 0.00 -0.15 0.00 0.00 55.06 57.05 1nft s HIS 250 Cb -0.22 -3.66 -0.02 0.00 1.11 0.00 0.00 32.58 29.78 1nft s HIS 250 CO 0.56 -1.96 -0.16 0.00 -0.85 0.00 0.00 174.74 172.33 1nft s ALA 251 N -1.22 1.35 -0.24 -1.40 0.00 -0.77 -0.90 121.76 118.58 1nft s ALA 251 Ca 0.54 -0.90 -0.29 0.00 0.00 0.00 0.00 51.96 51.30 1nft s ALA 251 Cb -0.38 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.52 1nft s ALA 251 CO 0.50 0.27 1.08 0.08 0.00 0.00 0.00 175.76 177.69 1nft s VAL 252 N -0.85 4.60 0.12 0.00 1.01 -0.44 -1.05 120.40 123.80 1nft s VAL 252 Ca 0.03 1.92 -0.00 0.00 0.00 0.00 0.00 61.98 63.93 1nft s VAL 252 Cb -0.08 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 1nft s VAL 252 CO 0.01 -0.22 0.29 0.68 0.00 0.00 0.00 175.10 175.86 1nft s VAL 253 N 3.32 5.31 0.14 2.92 -7.23 -0.27 -1.00 120.40 123.59 1nft s VAL 253 Ca 0.46 -0.41 -0.17 0.00 -1.81 0.00 0.00 61.98 60.04 1nft s VAL 253 Cb -0.15 -3.68 0.04 0.00 0.56 0.00 0.00 36.38 33.14 1nft s VAL 253 CO 0.09 0.00 0.45 0.00 -0.31 0.00 0.00 175.10 175.33 1nft s ALA 254 N -1.66 -1.04 0.62 1.32 0.00 -0.79 -3.23 121.76 116.98 1nft s ALA 254 Ca 0.36 0.01 -0.18 0.00 0.00 0.00 0.00 51.96 52.15 1nft s ALA 254 Cb -0.12 0.76 -0.02 0.00 0.00 0.00 0.00 23.12 23.73 1nft s ALA 254 CO 0.28 -0.69 1.21 1.03 0.00 0.00 0.00 175.76 177.59 1nft s ARG 255 N -3.81 2.83 -0.76 0.00 0.52 -1.26 -1.64 118.95 114.83 1nft s ARG 255 Ca 0.04 1.82 -0.23 0.00 -0.52 0.00 0.00 55.73 56.83 1nft s ARG 255 Cb 0.01 -1.91 0.06 0.00 0.52 0.00 0.00 34.95 33.63 1nft s ARG 255 CO -0.11 -1.32 1.14 0.34 0.02 0.00 0.00 175.30 175.38 1nft s ASP 256 N -1.67 6.27 0.22 0.23 2.15 -1.26 -4.73 116.67 117.88 1nft s ASP 256 Ca 0.77 -1.03 -0.22 0.00 0.43 0.00 0.00 52.55 52.51 1nft s ASP 256 Cb -0.30 -2.48 0.06 0.00 -0.30 0.00 0.00 42.92 39.90 1nft s ASP 256 CO 0.35 -1.52 0.93 1.51 -0.17 0.00 0.00 175.17 176.27 1nft s ASP 257 N 3.86 -0.09 -0.01 -0.34 1.47 -1.26 -5.04 116.67 115.26 1nft s ASP 257 Ca 0.30 -0.66 0.04 0.00 1.18 0.00 0.00 52.55 53.41 1nft s ASP 257 Cb -0.11 0.59 0.12 0.00 -0.34 0.00 0.00 42.92 43.19 1nft s ASP 257 CO 0.06 -1.13 1.04 -0.46 0.68 0.00 0.00 175.17 175.37 1nft n ASN 258 N -0.89 0.91 0.20 2.11 6.94 -1.26 -2.22 115.26 121.04 1nft n ASN 258 Ca -0.05 -2.03 0.15 0.00 -0.02 0.00 0.00 54.58 52.63 1nft n ASN 258 Cb 0.60 -0.16 0.55 0.00 -2.36 0.00 0.00 39.78 38.41 1nft n ASN 258 CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 1nft h LYS 259 N 0.79 0.00 -0.67 -3.83 3.64 -1.96 -3.30 116.57 111.24 1nft h LYS 259 Ca 0.00 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.52 1nft h LYS 259 Cb 0.28 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 31.98 1nft h LYS 259 CO 0.01 0.00 0.03 0.28 -2.27 0.00 0.00 179.45 177.51 1nft h VAL 260 N 0.00 0.46 0.00 2.00 2.07 -1.73 0.14 116.25 119.19 1nft h VAL 260 Ca 0.00 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 1nft h VAL 260 Cb 0.51 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 1nft h VAL 260 CO 0.00 0.03 -0.17 -0.33 0.02 0.00 0.00 177.57 177.11 1nft h GLU 261 N 0.14 0.00 -0.16 1.57 4.39 -1.85 -0.86 114.58 117.81 1nft h GLU 261 Ca 0.36 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.87 1nft h GLU 261 Cb 0.60 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.26 1nft h GLU 261 CO -0.56 0.17 -0.64 -0.44 -1.16 0.00 0.00 179.01 176.38 1nft h ASP 262 N 0.00 0.84 -0.05 1.42 3.32 -0.97 0.15 116.42 121.13 1nft h ASP 262 Ca -0.00 -0.61 -0.00 0.00 0.02 0.00 0.00 57.03 56.43 1nft h ASP 262 Cb 0.35 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1nft h ASP 262 CO 0.02 1.32 0.02 0.40 -1.72 0.00 0.00 179.24 179.28 1nft h ILE 263 N 0.42 1.12 -0.82 0.35 2.04 -0.68 0.26 117.51 120.20 1nft h ILE 263 Ca -0.04 -0.34 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 1nft h ILE 263 Cb 1.27 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 38.57 1nft h ILE 263 CO 0.13 0.10 0.45 -0.25 0.00 0.00 0.00 178.15 178.58 1nft h TRP 264 N -0.06 1.13 -0.74 1.37 2.91 -1.12 0.34 115.95 119.78 1nft h TRP 264 Ca 0.02 -0.03 0.01 0.00 1.13 0.00 0.00 58.89 60.02 1nft h TRP 264 Cb 0.14 -0.36 -0.04 0.00 -0.51 0.00 0.00 29.16 28.39 1nft h TRP 264 CO -0.03 0.79 0.49 0.77 -1.03 0.00 0.00 178.44 179.43 1nft h SER 265 N 1.15 0.83 -0.25 2.65 0.02 -0.28 0.88 113.55 118.54 1nft h SER 265 Ca 0.29 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.18 1nft h SER 265 Cb 0.03 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 1nft h SER 265 CO -0.05 0.59 0.02 0.15 -1.14 0.00 0.00 176.83 176.40 1nft h PHE 266 N 0.97 0.47 -0.60 3.45 3.57 0.86 -2.91 116.94 122.74 1nft h PHE 266 Ca 0.28 -0.08 -0.10 0.00 3.53 0.00 0.00 57.97 61.60 1nft h PHE 266 Cb -0.07 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 1nft h PHE 266 CO -0.00 0.58 0.00 -0.07 -2.23 0.00 0.00 178.31 176.59 1nft h LEU 267 N 0.22 1.05 -0.85 0.59 4.07 -0.32 -0.11 115.31 119.95 1nft h LEU 267 Ca 0.07 -0.31 -0.07 0.00 0.08 0.00 0.00 57.88 57.65 1nft h LEU 267 Cb 0.38 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.82 1nft h LEU 267 CO 0.01 1.10 0.06 -1.28 -1.08 0.00 0.00 178.44 177.24 1nft h SER 268 N 0.97 0.87 -0.01 -0.43 0.87 -0.84 0.07 113.55 115.05 1nft h SER 268 Ca 0.17 -0.20 -0.15 0.00 -1.23 0.00 0.00 61.79 60.38 1nft h SER 268 Cb 0.56 -0.23 0.01 0.00 -0.44 0.00 0.00 62.40 62.30 1nft h SER 268 CO 0.03 0.90 -0.59 0.50 -0.53 0.00 0.00 176.83 177.14 1nft h LYS 269 N 0.85 0.42 -0.52 2.24 1.63 -1.29 -2.14 116.57 117.76 1nft h LYS 269 Ca 0.17 -0.44 0.09 0.00 -0.85 0.00 0.00 60.65 59.62 1nft h LYS 269 Cb 0.43 0.12 -0.07 0.00 -0.60 0.00 0.00 32.23 32.11 1nft h LYS 269 CO 0.01 1.10 0.12 0.00 -3.45 0.00 0.00 179.45 177.23 1nft h ALA 270 N 0.33 0.60 -0.48 5.00 0.00 -0.80 -0.49 119.26 123.43 1nft h ALA 270 Ca -0.07 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1nft h ALA 270 Cb 1.29 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1nft h ALA 270 CO 0.12 -0.29 0.08 0.37 0.00 0.00 0.00 179.25 179.52 1nft h GLN 271 N 0.26 0.74 -0.57 0.00 4.15 -1.02 0.18 115.11 118.85 1nft h GLN 271 Ca 0.26 -0.16 -0.04 0.00 0.77 0.00 0.00 58.65 59.49 1nft h GLN 271 Cb 0.35 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.91 1nft h GLN 271 CO -0.33 0.69 0.20 1.03 -1.93 0.00 0.00 178.83 178.49 1nft h SER 272 N 0.71 0.80 0.42 -0.69 0.87 -0.44 -0.38 113.55 114.84 1nft h SER 272 Ca 0.15 -0.19 -0.31 0.00 -1.23 0.00 0.00 61.79 60.21 1nft h SER 272 Cb 0.32 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 62.06 1nft h SER 272 CO 0.00 0.78 -1.56 0.44 -0.53 0.00 0.00 176.83 175.96 1nft h ASP 273 N 0.78 0.42 0.00 6.23 3.32 -0.64 -3.39 116.42 123.15 1nft h ASP 273 Ca 0.19 -0.59 -0.03 0.00 0.02 0.00 0.00 57.03 56.61 1nft h ASP 273 Cb 0.24 -0.14 -0.07 0.00 0.22 0.00 0.00 39.33 39.59 1nft h ASP 273 CO -0.01 1.49 -0.52 0.49 -1.72 0.00 0.00 179.24 178.97 1nft n PHE 274 N -3.47 0.00 -0.03 4.55 3.72 0.58 -4.66 117.46 118.15 1nft n PHE 274 Ca -0.17 -1.18 0.00 0.00 -0.05 0.00 0.00 57.45 56.05 1nft n PHE 274 Cb 1.05 -0.21 0.00 0.00 -0.94 0.00 0.00 39.48 39.38 1nft n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nft n GLY 275 N -0.83 -0.08 0.24 1.37 0.00 -0.15 -1.07 105.19 104.67 1nft n GLY 275 Ca 0.15 -1.58 0.08 0.00 0.00 0.00 0.00 46.02 44.67 1nft n GLY 275 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1nft h VAL 276 N 0.00 0.90 -0.50 1.61 3.04 -1.84 -2.24 116.25 117.22 1nft h VAL 276 Ca 0.00 -0.69 0.00 0.00 -1.01 0.00 0.00 66.70 65.00 1nft h VAL 276 Cb 0.00 1.40 0.00 0.00 -2.01 0.00 0.00 31.29 30.68 1nft h VAL 276 CO 0.00 0.18 0.00 -0.90 -1.01 0.00 0.00 177.57 175.84 1nft n ASP 277 N -3.98 5.09 -4.74 3.17 5.75 -1.26 -5.01 116.55 115.57 1nft n ASP 277 Ca -0.02 -2.87 -0.38 0.00 -0.01 0.00 0.00 54.79 51.52 1nft n ASP 277 Cb 0.27 -0.63 0.05 0.00 -1.03 0.00 0.00 41.12 39.78 1nft n ASP 277 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1nft s THR 278 N -2.61 2.11 -2.65 2.12 -1.32 -0.84 -4.92 115.64 107.53 1nft s THR 278 Ca 0.50 0.08 0.22 0.00 -1.21 0.00 0.00 61.69 61.28 1nft s THR 278 Cb 0.38 -3.04 0.19 0.00 -1.51 0.00 0.00 72.50 68.53 1nft s THR 278 CO 0.15 -0.01 1.20 0.29 -2.21 0.00 0.00 174.62 174.05 1nft n LYS 279 N -1.32 2.04 -1.70 7.08 4.76 -1.26 -4.99 118.16 122.76 1nft n LYS 279 Ca 0.12 -1.83 -0.29 0.00 -2.87 0.00 0.00 58.31 53.45 1nft n LYS 279 Cb 0.46 -1.42 0.12 0.00 -1.84 0.00 0.00 35.03 32.35 1nft n LYS 279 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1nft s SER 280 N -1.76 3.87 0.10 4.39 0.15 -1.26 -4.99 113.70 114.20 1nft s SER 280 Ca 0.26 0.85 0.15 0.00 0.70 0.00 0.00 55.95 57.91 1nft s SER 280 Cb 0.18 -1.36 -0.11 0.00 -1.71 0.00 0.00 66.02 63.02 1nft s SER 280 CO 0.27 -2.31 0.99 -2.24 1.20 0.00 0.00 173.24 171.15 1nft h ASP 281 N -1.34 0.00 -3.41 5.45 2.03 -1.99 -3.44 116.42 113.73 1nft h ASP 281 Ca -0.48 0.00 -0.54 0.00 -0.73 0.00 0.00 57.03 55.28 1nft h ASP 281 Cb 1.33 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.80 1nft h ASP 281 CO 0.62 0.68 0.34 0.12 -1.03 0.00 0.00 179.24 179.97 1nft s PHE 282 N -2.86 3.65 -0.12 4.15 5.36 -1.26 -5.03 117.98 121.88 1nft s PHE 282 Ca -0.01 1.66 0.01 0.00 -0.96 0.00 0.00 56.93 57.63 1nft s PHE 282 Cb 0.08 -3.09 -0.01 0.00 -0.34 0.00 0.00 43.02 39.66 1nft s PHE 282 CO 0.80 0.00 -0.16 -1.01 -1.46 0.00 0.00 175.22 173.39 1nft s HIS 283 N 0.98 2.74 0.27 10.12 3.76 -1.26 -4.83 115.29 127.06 1nft s HIS 283 Ca 0.51 -0.70 -0.02 0.00 -0.15 0.00 0.00 55.06 54.70 1nft s HIS 283 Cb -0.21 -1.79 0.35 0.00 1.11 0.00 0.00 32.58 32.04 1nft s HIS 283 CO 0.27 -0.23 1.77 1.25 -0.85 0.00 0.00 174.74 176.95 1nft h LEU 284 N 6.60 0.74 -7.82 0.89 5.85 -1.39 -3.40 115.31 116.78 1nft h LEU 284 Ca -0.26 -0.18 -0.68 0.00 0.84 0.00 0.00 57.88 57.61 1nft h LEU 284 Cb 1.21 -0.20 -0.36 0.00 0.37 0.00 0.00 40.66 41.69 1nft h LEU 284 CO 0.53 0.81 -0.64 -0.36 -0.34 0.00 0.00 178.44 178.44 1nft s PHE 285 N -4.99 3.58 0.00 1.25 0.08 -1.26 -4.55 117.98 112.09 1nft s PHE 285 Ca -0.09 -2.51 0.00 0.00 0.12 0.00 0.00 56.93 54.45 1nft s PHE 285 Cb 0.15 -2.88 0.00 0.00 -0.57 0.00 0.00 43.02 39.71 1nft s PHE 285 CO 0.81 -0.93 0.00 0.41 -0.10 0.00 0.00 175.22 175.40 1nft n GLY 286 N 4.48 4.05 3.63 4.36 0.00 -1.26 -4.65 105.19 115.80 1nft n GLY 286 Ca -0.03 0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1nft n GLY 286 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nft s PRO 287 N 0.00 0.26 0.92 1.61 0.04 -1.26 -4.54 135.00 132.03 1nft s PRO 287 Ca 0.00 0.77 -0.11 0.00 0.04 0.00 0.00 61.00 61.70 1nft s PRO 287 Cb 0.00 -1.70 0.14 0.00 0.04 0.00 0.00 34.50 32.99 1nft s PRO 287 CO 0.00 -2.91 1.10 -1.25 0.04 0.00 0.00 177.00 173.97 1nft s PRO 288 N -4.78 1.05 0.00 0.56 0.04 -1.25 -4.44 135.00 126.19 1nft s PRO 288 Ca 0.66 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.82 1nft s PRO 288 Cb -0.21 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.57 1nft s PRO 288 CO 0.60 -2.47 0.00 0.41 0.04 0.00 0.00 177.00 175.57 1nft n GLY 289 N -0.44 1.10 3.68 0.56 0.00 -1.26 -5.07 105.19 103.76 1nft n GLY 289 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1nft n GLY 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nft s LYS 290 N -0.58 4.37 0.03 1.61 3.01 -1.26 -4.90 119.74 122.02 1nft s LYS 290 Ca 0.00 1.51 0.12 0.00 -1.01 0.00 0.00 55.97 56.59 1nft s LYS 290 Cb 0.00 -3.57 -0.20 0.00 -1.01 0.00 0.00 37.83 33.05 1nft s LYS 290 CO 0.00 -0.42 0.90 0.87 0.51 0.00 0.00 175.35 177.21 1nft h LYS 291 N 7.34 0.00 -6.09 1.68 1.57 -1.97 -3.46 116.57 115.63 1nft h LYS 291 Ca -0.31 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 57.90 1nft h LYS 291 Cb 1.14 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.40 1nft h LYS 291 CO 0.88 0.61 0.56 0.34 -0.57 0.00 0.00 179.45 181.27 1nft s ASP 292 N -6.25 7.10 0.25 0.86 -1.08 -1.26 -4.94 116.67 111.36 1nft s ASP 292 Ca -0.02 1.36 -0.05 0.00 -0.52 0.00 0.00 52.55 53.32 1nft s ASP 292 Cb 0.09 -2.51 0.50 0.00 -1.46 0.00 0.00 42.92 39.53 1nft s ASP 292 CO 0.82 -0.48 1.65 -0.65 0.52 0.00 0.00 175.17 177.03 1nft h PRO 293 N 7.28 0.17 0.00 4.34 0.11 -1.96 0.21 132.00 142.15 1nft h PRO 293 Ca -0.27 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.82 1nft h PRO 293 Cb 1.12 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1nft h PRO 293 CO 0.88 0.11 -0.05 -0.24 -0.21 0.00 0.00 178.00 178.49 1nft h VAL 294 N 0.17 0.25 -0.02 3.15 3.04 -2.00 -0.73 116.25 120.11 1nft h VAL 294 Ca 0.44 -0.33 0.00 0.00 -1.01 0.00 0.00 66.70 65.79 1nft h VAL 294 Cb 0.79 1.26 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 1nft h VAL 294 CO -0.61 0.05 -0.06 0.18 -1.01 0.00 0.00 177.57 176.11 1nft n LEU 295 N -3.34 2.28 -4.79 3.16 4.32 0.71 -4.79 117.00 114.54 1nft n LEU 295 Ca -0.02 -0.76 -0.38 0.00 -0.02 0.00 0.00 56.01 54.83 1nft n LEU 295 Cb 0.19 -0.01 -0.06 0.00 -1.62 0.00 0.00 43.42 41.93 1nft n LEU 295 CO 0.26 0.38 0.24 -0.54 -1.22 0.00 0.00 177.39 176.51 1nft s LYS 296 N -2.07 4.20 -1.29 3.23 1.02 -0.28 -4.53 119.74 120.02 1nft s LYS 296 Ca 0.30 0.65 -0.00 0.00 0.02 0.00 0.00 55.97 56.94 1nft s LYS 296 Cb 0.20 -3.29 -0.00 0.00 -0.52 0.00 0.00 37.83 34.22 1nft s LYS 296 CO 0.35 0.52 0.74 -0.25 -0.92 0.00 0.00 175.35 175.79 1nft n ASP 297 N 2.23 -1.39 -4.66 2.83 8.00 -1.26 -4.91 116.55 117.39 1nft n ASP 297 Ca -0.10 -0.79 -0.43 0.00 0.71 0.00 0.00 54.79 54.18 1nft n ASP 297 Cb 0.51 -4.21 -0.02 0.00 -0.02 0.00 0.00 41.12 37.38 1nft n ASP 297 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1nft s LEU 298 N -6.61 4.11 0.00 0.64 1.02 -1.26 -4.14 118.68 112.44 1nft s LEU 298 Ca 0.01 1.40 0.00 0.00 0.02 0.00 0.00 54.13 55.56 1nft s LEU 298 Cb -0.00 -3.54 0.00 0.00 0.02 0.00 0.00 46.19 42.67 1nft s LEU 298 CO 0.80 -0.65 0.00 0.18 0.02 0.00 0.00 176.35 176.70 1nft n LEU 299 N 6.21 0.00 -4.26 1.79 4.32 -1.26 -4.80 117.00 119.00 1nft n LEU 299 Ca 0.12 0.00 -0.14 0.00 -0.02 0.00 0.00 56.01 55.96 1nft n LEU 299 Cb 0.46 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.16 1nft n LEU 299 CO 0.52 0.00 -0.34 -0.36 -1.22 0.00 0.00 177.39 175.99 1nft s PHE 300 N 0.00 1.29 0.47 -1.77 0.08 -1.26 -4.46 117.98 112.33 1nft s PHE 300 Ca 0.00 -0.96 -0.23 0.00 0.12 0.00 0.00 56.93 55.85 1nft s PHE 300 Cb 0.00 -0.73 -0.07 0.00 -0.57 0.00 0.00 43.02 41.65 1nft s PHE 300 CO 0.00 -0.13 1.26 0.15 -0.10 0.00 0.00 175.22 176.40 1nft s LYS 301 N -3.88 3.64 0.46 0.44 1.02 -1.26 -4.39 119.74 115.77 1nft s LYS 301 Ca 0.24 2.03 0.23 0.00 0.02 0.00 0.00 55.97 58.49 1nft s LYS 301 Cb 0.06 -2.47 1.13 0.00 -0.52 0.00 0.00 37.83 36.03 1nft s LYS 301 CO 0.04 -0.72 1.94 -0.44 -0.92 0.00 0.00 175.35 175.25 1nft h ASP 302 N 2.07 0.00 0.23 2.83 3.32 -1.89 -1.70 116.42 121.27 1nft h ASP 302 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1nft h ASP 302 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1nft h ASP 302 CO 0.60 0.21 -0.08 -1.54 -1.72 0.00 0.00 179.24 176.71 1nft n SER 303 N -3.65 0.61 -4.77 6.45 3.41 -1.26 -3.75 113.62 110.67 1nft n SER 303 Ca -0.01 -0.82 -0.40 0.00 -0.26 0.00 0.00 58.87 57.37 1nft n SER 303 Cb 0.34 -0.04 -0.01 0.00 -0.26 0.00 0.00 64.21 64.24 1nft n SER 303 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nft s ALA 304 N -2.32 3.41 -1.14 7.33 0.00 -0.64 -4.50 121.76 123.90 1nft s ALA 304 Ca 0.33 1.29 0.12 0.00 0.00 0.00 0.00 51.96 53.70 1nft s ALA 304 Cb 0.20 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.83 1nft s ALA 304 CO 0.44 -0.77 0.72 0.44 0.00 0.00 0.00 175.76 176.59 1nft n ILE 305 N 0.48 0.00 0.00 0.00 -5.35 0.04 -4.83 119.36 109.69 1nft n ILE 305 Ca 0.02 -0.38 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 1nft n ILE 305 Cb 0.42 1.15 0.00 0.00 -1.74 0.00 0.00 39.64 39.47 1nft n ILE 305 CO 0.00 0.00 0.00 1.15 -1.76 0.00 0.00 176.55 175.94 1nft n MET 306 N -0.15 -1.83 -4.81 6.28 0.00 -1.24 -4.45 117.12 110.92 1nft n MET 306 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 57.70 57.49 1nft n MET 306 Cb 0.26 0.00 -0.15 0.00 0.00 0.00 0.00 33.22 33.33 1nft n MET 306 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1nft s LEU 307 N 0.00 2.11 0.03 3.17 1.43 -1.26 -1.70 118.68 122.46 1nft s LEU 307 Ca 0.00 -0.45 0.06 0.00 -1.03 0.00 0.00 54.13 52.70 1nft s LEU 307 Cb 0.00 -1.01 -0.02 0.00 0.03 0.00 0.00 46.19 45.19 1nft s LEU 307 CO 0.00 0.20 -0.17 -0.54 0.23 0.00 0.00 176.35 176.08 1nft s LYS 308 N -0.86 1.17 0.11 1.70 1.02 -0.27 -4.89 119.74 117.71 1nft s LYS 308 Ca 0.08 -0.76 -0.31 0.00 0.02 0.00 0.00 55.97 55.00 1nft s LYS 308 Cb -0.08 -1.19 -0.07 0.00 -0.52 0.00 0.00 37.83 35.96 1nft s LYS 308 CO 0.01 0.31 1.28 0.50 -0.92 0.00 0.00 175.35 176.53 1nft s ARG 309 N -0.94 4.39 -0.11 1.68 6.06 -1.26 -0.28 118.95 128.49 1nft s ARG 309 Ca 0.05 1.93 -0.28 0.00 -2.50 0.00 0.00 55.73 54.92 1nft s ARG 309 Cb -0.08 -3.28 -0.02 0.00 0.06 0.00 0.00 34.95 31.64 1nft s ARG 309 CO 0.01 -0.31 0.94 0.08 -2.50 0.00 0.00 175.30 173.52 1nft s VAL 310 N 0.88 4.83 0.23 7.11 1.01 -0.75 -4.90 120.40 128.80 1nft s VAL 310 Ca 0.60 1.91 -0.27 0.00 0.00 0.00 0.00 61.98 64.22 1nft s VAL 310 Cb -0.33 -4.26 -0.16 0.00 0.00 0.00 0.00 36.38 31.63 1nft s VAL 310 CO 0.31 0.04 0.55 -2.65 0.00 0.00 0.00 175.10 173.35 1nft n PRO 311 N 4.90 0.17 0.17 2.72 -0.02 -1.26 -4.82 135.00 136.86 1nft n PRO 311 Ca 0.07 0.06 0.15 0.00 -2.02 0.00 0.00 63.50 61.76 1nft n PRO 311 Cb 0.49 -1.11 0.75 0.00 -0.02 0.00 0.00 33.50 33.61 1nft n PRO 311 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1nft h SER 312 N 1.07 0.00 0.22 2.55 0.02 -1.95 -1.41 113.55 114.05 1nft h SER 312 Ca -0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1nft h SER 312 Cb 1.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.97 1nft h SER 312 CO 0.57 0.00 -0.14 0.18 -1.14 0.00 0.00 176.83 176.29 1nft n LEU 313 N -4.14 0.87 -4.71 5.07 4.77 -1.26 -4.82 117.00 112.78 1nft n LEU 313 Ca 0.02 -0.20 -0.42 0.00 -0.03 0.00 0.00 56.01 55.38 1nft n LEU 313 Cb 0.32 -0.11 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 1nft n LEU 313 CO 0.32 0.16 0.65 -0.04 -1.33 0.00 0.00 177.39 177.14 1nft s MET 314 N -2.37 4.51 0.00 3.23 -1.94 -0.53 -5.01 119.30 117.18 1nft s MET 314 Ca 0.30 1.31 0.00 0.00 -1.71 0.00 0.00 55.69 55.59 1nft s MET 314 Cb 0.20 -3.48 0.00 0.00 2.01 0.00 0.00 34.83 33.56 1nft s MET 314 CO 0.46 -0.08 0.00 -0.40 -0.01 0.00 0.00 175.02 174.99 1nft n ASP 315 N 4.10 0.07 -0.11 3.03 5.75 -1.26 -4.76 116.55 123.37 1nft n ASP 315 Ca 0.05 -0.67 -0.10 0.00 -0.01 0.00 0.00 54.79 54.06 1nft n ASP 315 Cb 0.51 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.57 1nft n ASP 315 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1nft h SER 316 N 0.00 0.50 -0.61 -1.12 4.64 -1.92 0.20 113.55 115.24 1nft h SER 316 Ca 0.00 -0.24 0.08 0.00 -0.47 0.00 0.00 61.79 61.17 1nft h SER 316 Cb 0.00 -0.13 -0.07 0.00 -0.31 0.00 0.00 62.40 61.89 1nft h SER 316 CO 0.00 0.61 0.26 -0.61 -0.87 0.00 0.00 176.83 176.22 1nft h GLN 317 N 0.37 0.45 -0.22 4.77 4.15 -1.95 0.46 115.11 123.14 1nft h GLN 317 Ca 0.10 -0.03 -0.18 0.00 0.77 0.00 0.00 58.65 59.31 1nft h GLN 317 Cb 0.31 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.90 1nft h GLN 317 CO 0.00 0.30 -0.59 -0.07 -1.93 0.00 0.00 178.83 176.54 1nft h LEU 318 N 0.46 0.80 -0.34 -2.39 -0.00 -1.85 -1.21 115.31 110.79 1nft h LEU 318 Ca 0.30 -0.45 -0.04 0.00 -0.00 0.00 0.00 57.88 57.69 1nft h LEU 318 Cb 0.33 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 40.75 1nft h LEU 318 CO -0.27 1.21 0.06 0.22 -0.00 0.00 0.00 178.44 179.66 1nft h TYR 319 N 0.54 0.59 0.00 1.13 3.20 -0.52 -3.14 116.97 118.78 1nft h TYR 319 Ca 0.00 -0.08 -0.16 0.00 3.14 0.00 0.00 58.73 61.63 1nft h TYR 319 Cb 1.17 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 39.26 1nft h TYR 319 CO 0.06 0.62 -0.76 -0.07 -1.64 0.00 0.00 178.16 176.38 1nft h LEU 320 N 0.39 0.00 0.00 2.82 3.38 -0.87 -3.47 115.31 117.56 1nft h LEU 320 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1nft h LEU 320 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1nft h LEU 320 CO 0.01 0.76 0.00 0.61 0.09 0.00 0.00 178.44 179.90 1nft n GLY 321 N 0.86 1.73 0.16 0.83 0.00 -0.46 -4.60 105.19 103.70 1nft n GLY 321 Ca -0.00 -1.72 -0.07 0.00 0.00 0.00 0.00 46.02 44.22 1nft n GLY 321 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1nft h PHE 322 N 0.00 0.37 -0.02 1.61 3.57 -1.90 -0.71 116.94 119.86 1nft h PHE 322 Ca 0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 1nft h PHE 322 Cb 0.00 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.62 1nft h PHE 322 CO 0.00 0.21 0.01 0.93 -2.23 0.00 0.00 178.31 177.23 1nft h GLU 323 N 0.41 0.03 0.00 1.11 3.07 -1.90 -0.75 114.58 116.55 1nft h GLU 323 Ca 0.15 -0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.01 1nft h GLU 323 Cb 0.04 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1nft h GLU 323 CO -0.09 0.11 -0.00 -0.92 -1.40 0.00 0.00 179.01 176.71 1nft h TYR 324 N -0.06 -0.00 -0.36 4.33 3.20 -1.80 -2.48 116.97 119.79 1nft h TYR 324 Ca 0.01 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1nft h TYR 324 Cb 0.09 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 1nft h TYR 324 CO -0.04 0.19 0.24 -0.92 -1.64 0.00 0.00 178.16 175.99 1nft h TYR 325 N -0.20 0.46 0.00 -3.82 5.03 -1.00 -1.86 116.97 115.57 1nft h TYR 325 Ca -0.00 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.29 1nft h TYR 325 Cb 0.20 -0.15 -0.00 0.00 1.55 0.00 0.00 36.73 38.32 1nft h TYR 325 CO -0.01 0.29 -0.14 0.66 -1.32 0.00 0.00 178.16 177.65 1nft h SER 326 N 0.49 0.00 -0.07 -2.11 4.64 -1.16 -0.81 113.55 114.54 1nft h SER 326 Ca 0.13 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.31 1nft h SER 326 Cb -0.05 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.05 1nft h SER 326 CO -0.03 0.14 -0.53 0.00 -0.87 0.00 0.00 176.83 175.54 1nft h ALA 327 N 1.86 0.15 -0.26 5.18 0.00 -0.94 -2.51 119.26 122.75 1nft h ALA 327 Ca -0.00 -0.53 -0.19 0.00 0.00 0.00 0.00 54.91 54.19 1nft h ALA 327 Cb 0.72 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1nft h ALA 327 CO 0.02 0.37 -0.59 0.82 0.00 0.00 0.00 179.25 179.87 1nft h ILE 328 N 0.04 1.28 -0.95 0.00 1.08 -1.19 -2.63 117.51 115.13 1nft h ILE 328 Ca -0.05 -1.78 0.14 0.00 -0.39 0.00 0.00 64.86 62.79 1nft h ILE 328 Cb 1.20 1.69 -0.08 0.00 -3.07 0.00 0.00 36.82 36.56 1nft h ILE 328 CO 0.11 0.58 0.60 1.56 -0.69 0.00 0.00 178.15 180.31 1nft h GLN 329 N 0.63 0.79 0.00 2.37 1.08 -1.22 -0.66 115.11 118.11 1nft h GLN 329 Ca 0.00 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1nft h GLN 329 Cb 1.19 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 28.44 1nft h GLN 329 CO 0.13 0.53 0.00 0.77 -0.95 0.00 0.00 178.83 179.30 1nft h SER 330 N 0.82 0.00 -0.39 1.46 0.02 -1.08 -3.16 113.55 111.22 1nft h SER 330 Ca 0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.44 1nft h SER 330 Cb 0.66 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.20 1nft h SER 330 CO -0.25 0.00 0.00 0.23 -1.14 0.00 0.00 176.83 175.67 1nft n MET 331 N -2.36 1.95 0.00 3.45 2.81 -0.25 -4.93 117.12 117.79 1nft n MET 331 Ca 0.03 -1.43 0.00 0.00 -1.81 0.00 0.00 57.70 54.48 1nft n MET 331 Cb 0.29 -1.33 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 1nft n MET 331 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02