#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tuf s LEU 16 N 0.00 3.68 0.00 -2.13 0.20 -1.26 -1.14 118.68 118.03 1tuf s LEU 16 Ca 0.00 1.98 0.00 0.00 0.69 0.00 0.00 54.13 56.80 1tuf s LEU 16 Cb 0.00 -3.52 0.00 0.00 -0.43 0.00 0.00 46.19 42.24 1tuf s LEU 16 CO 0.00 -1.71 0.00 0.61 -0.29 0.00 0.00 176.35 174.96 1tuf n GLY 17 N 5.41 3.40 3.24 7.98 0.00 -1.26 -4.75 105.19 119.21 1tuf n GLY 17 Ca 0.26 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 1tuf n GLY 17 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tuf n ASN 18 N 0.00 5.32 0.12 1.61 3.02 -0.29 -4.85 115.26 120.18 1tuf n ASN 18 Ca 0.00 -3.11 0.12 0.00 -0.03 0.00 0.00 54.58 51.57 1tuf n ASN 18 Cb 0.00 -1.29 0.45 0.00 -0.61 0.00 0.00 39.78 38.33 1tuf n ASN 18 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1tuf n ASP 19 N 2.42 0.74 -0.88 6.41 8.00 -1.26 -3.66 116.55 128.31 1tuf n ASP 19 Ca 0.24 0.62 0.08 0.00 0.71 0.00 0.00 54.79 56.44 1tuf n ASP 19 Cb 0.38 -0.80 0.21 0.00 -0.02 0.00 0.00 41.12 40.89 1tuf n ASP 19 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1tuf n THR 20 N -2.25 1.02 -4.24 -3.53 -2.24 -1.26 -4.99 114.28 96.78 1tuf n THR 20 Ca 0.04 -1.01 -0.26 0.00 -2.27 0.00 0.00 64.05 60.55 1tuf n THR 20 Cb 0.33 0.49 -0.08 0.00 -2.10 0.00 0.00 70.33 68.97 1tuf n THR 20 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1tuf s VAL 21 N -1.02 3.54 0.31 2.28 -7.23 -1.24 -0.57 120.40 116.46 1tuf s VAL 21 Ca 0.32 -1.56 -0.07 0.00 -1.81 0.00 0.00 61.98 58.86 1tuf s VAL 21 Cb 0.17 -2.79 0.03 0.00 0.56 0.00 0.00 36.38 34.35 1tuf s VAL 21 CO 0.21 -0.15 0.54 -1.84 -0.31 0.00 0.00 175.10 173.55 1tuf n GLU 22 N -0.19 0.77 -3.72 4.82 0.28 -0.57 -5.00 120.64 117.03 1tuf n GLU 22 Ca -0.09 -2.04 -0.30 0.00 -0.16 0.00 0.00 57.16 54.57 1tuf n GLU 22 Cb 0.56 2.25 -0.14 0.00 1.43 0.00 0.00 31.44 35.54 1tuf n GLU 22 CO 0.00 0.00 0.00 -1.50 -0.16 0.00 0.00 177.13 175.47 1tuf s ILE 23 N -2.49 1.16 -0.31 3.84 2.07 -1.26 -0.89 121.20 123.32 1tuf s ILE 23 Ca 0.18 -2.01 -0.15 0.00 -1.41 0.00 0.00 60.65 57.26 1tuf s ILE 23 Cb -0.03 -1.84 -0.02 0.00 0.13 0.00 0.00 42.46 40.70 1tuf s ILE 23 CO 0.13 -0.79 0.38 -0.54 -1.91 0.00 0.00 174.94 172.21 1tuf s LYS 24 N 0.96 3.77 -1.17 3.50 1.02 -0.64 -4.56 119.74 122.62 1tuf s LYS 24 Ca 0.14 -0.19 -0.20 0.00 0.02 0.00 0.00 55.97 55.74 1tuf s LYS 24 Cb -0.21 -3.74 -0.01 0.00 -0.52 0.00 0.00 37.83 33.35 1tuf s LYS 24 CO -0.11 -0.43 0.76 -0.25 -0.92 0.00 0.00 175.35 174.40 1tuf n ASP 25 N 5.41 -4.78 -3.39 2.83 8.00 -1.26 -2.48 116.55 120.89 1tuf n ASP 25 Ca -0.08 -1.03 -0.24 0.00 0.71 0.00 0.00 54.79 54.15 1tuf n ASP 25 Cb 0.50 -3.29 0.06 0.00 -0.02 0.00 0.00 41.12 38.37 1tuf n ASP 25 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tuf n GLY 26 N -1.72 -0.54 3.27 0.44 0.00 -1.26 -4.98 105.19 100.40 1tuf n GLY 26 Ca -0.11 0.20 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 1tuf n GLY 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tuf s ARG 27 N -6.09 0.44 0.21 1.61 0.52 -1.03 -2.34 118.95 112.27 1tuf s ARG 27 Ca 0.48 0.53 -0.30 0.00 -0.52 0.00 0.00 55.73 55.92 1tuf s ARG 27 Cb -0.21 0.21 -0.08 0.00 0.52 0.00 0.00 34.95 35.39 1tuf s ARG 27 CO 0.59 -0.05 1.01 0.12 0.02 0.00 0.00 175.30 176.98 1tuf s PHE 28 N 0.20 3.80 0.00 -0.53 5.36 -0.56 -1.61 117.98 124.64 1tuf s PHE 28 Ca -0.00 1.79 0.04 0.00 -0.96 0.00 0.00 56.93 57.80 1tuf s PHE 28 Cb -0.03 -3.11 -0.01 0.00 -0.34 0.00 0.00 43.02 39.53 1tuf s PHE 28 CO 0.00 0.01 -0.12 -0.06 -1.46 0.00 0.00 175.22 173.60 1tuf s PHE 29 N -0.73 1.06 -0.20 10.12 0.40 -0.07 -1.41 117.98 127.16 1tuf s PHE 29 Ca 0.45 -0.24 0.01 0.00 -0.60 0.00 0.00 56.93 56.55 1tuf s PHE 29 Cb -0.27 -0.67 0.04 0.00 0.51 0.00 0.00 43.02 42.63 1tuf s PHE 29 CO 0.34 -0.01 -0.13 0.42 0.70 0.00 0.00 175.22 176.54 1tuf s ILE 30 N -0.44 1.80 -1.51 0.64 1.01 0.45 -1.51 121.20 121.66 1tuf s ILE 30 Ca 0.03 -1.06 -0.13 0.00 0.00 0.00 0.00 60.65 59.50 1tuf s ILE 30 Cb -0.05 -1.81 0.07 0.00 0.01 0.00 0.00 42.46 40.68 1tuf s ILE 30 CO -0.00 0.24 1.00 0.47 0.00 0.00 0.00 174.94 176.65 1tuf n ASP 31 N 4.64 -4.82 0.00 3.58 8.00 0.26 -1.11 116.55 127.10 1tuf n ASP 31 Ca -0.16 -0.76 0.00 0.00 0.71 0.00 0.00 54.79 54.58 1tuf n ASP 31 Cb 0.47 -4.02 0.00 0.00 -0.02 0.00 0.00 41.12 37.55 1tuf n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tuf n GLY 32 N -1.72 2.78 3.80 0.44 0.00 -1.26 -4.93 105.19 104.30 1tuf n GLY 32 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1tuf n GLY 32 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tuf s TYR 33 N -2.83 3.77 -0.28 1.61 2.02 -0.27 -5.01 117.35 116.37 1tuf s TYR 33 Ca 0.00 1.22 -0.29 0.00 -0.37 0.00 0.00 57.07 57.63 1tuf s TYR 33 Cb 0.00 -2.49 -0.01 0.00 -0.40 0.00 0.00 41.96 39.07 1tuf s TYR 33 CO 0.00 0.55 1.40 0.34 -1.57 0.00 0.00 175.55 176.27 1tuf s ASP 34 N -0.93 6.57 0.20 2.29 -1.08 -1.26 -0.41 116.67 122.05 1tuf s ASP 34 Ca 0.28 1.31 -0.10 0.00 -0.52 0.00 0.00 52.55 53.52 1tuf s ASP 34 Cb -0.19 -2.54 0.22 0.00 -1.46 0.00 0.00 42.92 38.96 1tuf s ASP 34 CO 0.18 -1.15 1.80 0.00 0.52 0.00 0.00 175.17 176.52 1tuf h ALA 35 N 9.78 0.85 -0.80 3.66 0.00 -1.60 -0.87 119.26 130.29 1tuf h ALA 35 Ca -0.28 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1tuf h ALA 35 Cb 1.11 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 1tuf h ALA 35 CO 1.03 0.02 0.51 0.82 0.00 0.00 0.00 179.25 181.63 1tuf h ILE 36 N 0.65 1.21 -0.12 0.00 2.04 -1.89 -1.10 117.51 118.30 1tuf h ILE 36 Ca 0.29 -0.42 -0.15 0.00 1.00 0.00 0.00 64.86 65.58 1tuf h ILE 36 Cb 0.18 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 1tuf h ILE 36 CO -0.18 0.21 -0.57 -0.33 0.00 0.00 0.00 178.15 177.28 1tuf h GLU 37 N 1.09 0.39 -0.33 2.37 5.08 -1.73 -1.79 114.58 119.67 1tuf h GLU 37 Ca 0.29 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1tuf h GLU 37 Cb -0.09 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1tuf h GLU 37 CO -0.06 0.85 0.11 -0.07 -1.00 0.00 0.00 179.01 178.84 1tuf h LEU 38 N 0.30 0.47 -1.26 1.33 3.38 -0.52 0.72 115.31 119.73 1tuf h LEU 38 Ca 0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1tuf h LEU 38 Cb 1.09 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 1tuf h LEU 38 CO 0.10 0.54 0.37 0.00 0.09 0.00 0.00 178.44 179.54 1tuf h ALA 39 N 0.95 1.44 -0.02 1.53 0.00 -1.12 0.11 119.26 122.15 1tuf h ALA 39 Ca 0.11 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1tuf h ALA 39 Cb 0.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1tuf h ALA 39 CO -0.00 0.47 -0.64 1.49 0.00 0.00 0.00 179.25 180.56 1tuf h GLU 40 N 0.88 0.09 0.16 0.00 4.57 -0.83 0.35 114.58 119.80 1tuf h GLU 40 Ca 0.23 -0.07 -0.33 0.00 -1.18 0.00 0.00 59.36 58.01 1tuf h GLU 40 Cb -0.01 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 1tuf h GLU 40 CO -0.04 0.70 -1.65 -0.22 -1.18 0.00 0.00 179.01 176.62 1tuf h LYS 41 N 0.06 0.34 -0.03 1.92 3.64 -0.10 -3.38 116.57 119.03 1tuf h LYS 41 Ca -0.01 -0.58 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 1tuf h LYS 41 Cb 1.15 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 1tuf h LYS 41 CO 0.09 1.23 0.00 1.19 -2.27 0.00 0.00 179.45 179.69 1tuf n PHE 42 N -3.53 0.02 -0.22 1.91 3.72 0.31 -5.09 117.46 114.57 1tuf n PHE 42 Ca -0.21 -0.01 0.03 0.00 -0.05 0.00 0.00 57.45 57.21 1tuf n PHE 42 Cb 1.06 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.60 1tuf n PHE 42 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1tuf n GLY 43 N 0.84 -1.54 3.13 1.37 0.00 0.11 -4.97 105.19 104.13 1tuf n GLY 43 Ca 0.09 -1.47 -0.11 0.00 0.00 0.00 0.00 46.02 44.53 1tuf n GLY 43 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tuf s THR 44 N -1.44 0.64 0.55 2.61 -4.23 -1.26 -4.20 115.64 108.31 1tuf s THR 44 Ca 0.00 -1.64 -0.19 0.00 -1.18 0.00 0.00 61.69 58.67 1tuf s THR 44 Cb 0.00 -1.32 -0.05 0.00 1.34 0.00 0.00 72.50 72.47 1tuf s THR 44 CO 0.00 -0.71 1.15 -2.16 -0.54 0.00 0.00 174.62 172.36 1tuf s PRO 45 N -3.06 3.27 -0.02 3.99 0.04 -1.26 -4.96 135.00 132.99 1tuf s PRO 45 Ca 0.04 1.66 0.01 0.00 0.04 0.00 0.00 61.00 62.75 1tuf s PRO 45 Cb 0.00 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.57 1tuf s PRO 45 CO -0.03 -0.93 -0.01 -1.17 0.04 0.00 0.00 177.00 174.90 1tuf s LEU 46 N -3.86 1.41 -0.09 -3.56 2.96 0.02 -3.79 118.68 111.78 1tuf s LEU 46 Ca 0.74 -0.04 -0.15 0.00 -0.22 0.00 0.00 54.13 54.45 1tuf s LEU 46 Cb -0.25 -0.22 -0.05 0.00 0.50 0.00 0.00 46.19 46.16 1tuf s LEU 46 CO 0.28 -0.06 0.38 -0.31 -1.32 0.00 0.00 176.35 175.33 1tuf s TYR 47 N 0.70 3.58 -0.20 5.38 2.02 -0.36 0.79 117.35 129.27 1tuf s TYR 47 Ca -0.07 0.83 0.01 0.00 -0.37 0.00 0.00 57.07 57.46 1tuf s TYR 47 Cb -0.10 -2.37 0.04 0.00 -0.40 0.00 0.00 41.96 39.13 1tuf s TYR 47 CO -0.01 0.39 -0.09 0.08 -1.57 0.00 0.00 175.55 174.35 1tuf s VAL 48 N -0.11 1.54 -0.15 0.71 1.01 0.13 -1.22 120.40 122.30 1tuf s VAL 48 Ca 0.22 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 61.17 1tuf s VAL 48 Cb -0.15 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1tuf s VAL 48 CO 0.09 0.13 0.06 -0.04 0.00 0.00 0.00 175.10 175.34 1tuf s MET 49 N 1.44 3.64 -0.42 2.72 -1.94 0.14 -0.82 119.30 124.06 1tuf s MET 49 Ca -0.02 -0.33 -0.18 0.00 -1.71 0.00 0.00 55.69 53.45 1tuf s MET 49 Cb -0.16 -3.10 0.02 0.00 2.01 0.00 0.00 34.83 33.60 1tuf s MET 49 CO -0.08 0.46 0.50 0.45 -0.01 0.00 0.00 175.02 176.34 1tuf s SER 50 N -0.17 6.24 0.14 3.03 0.15 0.27 -0.66 113.70 122.69 1tuf s SER 50 Ca 0.07 -0.52 -0.18 0.00 0.70 0.00 0.00 55.95 56.02 1tuf s SER 50 Cb -0.12 -2.25 0.00 0.00 -1.71 0.00 0.00 66.02 61.94 1tuf s SER 50 CO 0.01 -0.63 1.73 -0.08 1.20 0.00 0.00 173.24 175.48 1tuf h GLU 51 N 8.75 0.13 -0.42 5.44 4.81 -1.56 -2.56 114.58 129.17 1tuf h GLU 51 Ca -0.26 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 58.99 1tuf h GLU 51 Cb 1.11 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.42 1tuf h GLU 51 CO 0.82 0.09 0.20 0.93 -0.73 0.00 0.00 179.01 180.32 1tuf h GLU 52 N 0.13 0.40 -0.87 1.92 4.39 -1.94 -1.81 114.58 116.80 1tuf h GLU 52 Ca 0.12 -0.02 0.10 0.00 0.34 0.00 0.00 59.36 59.90 1tuf h GLU 52 Cb 0.13 -0.09 -0.06 0.00 -0.10 0.00 0.00 28.75 28.63 1tuf h GLU 52 CO -0.17 0.26 0.56 0.37 -1.16 0.00 0.00 179.01 178.88 1tuf h GLN 53 N 0.41 0.80 -0.47 2.33 5.75 -1.86 0.16 115.11 122.22 1tuf h GLN 53 Ca 0.18 -0.05 -0.09 0.00 -0.15 0.00 0.00 58.65 58.54 1tuf h GLN 53 Cb 0.09 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.44 1tuf h GLN 53 CO -0.13 0.53 -0.06 0.82 -2.65 0.00 0.00 178.83 177.33 1tuf h ILE 54 N 0.82 1.26 -0.53 2.39 2.04 -0.96 -0.06 117.51 122.46 1tuf h ILE 54 Ca 0.41 -1.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.08 1tuf h ILE 54 Cb 0.46 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 1tuf h ILE 54 CO -0.17 0.39 0.09 0.11 0.00 0.00 0.00 178.15 178.57 1tuf h LYS 55 N 0.76 0.88 0.18 2.37 1.57 -0.25 -1.30 116.57 120.79 1tuf h LYS 55 Ca 0.13 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1tuf h LYS 55 Cb 0.55 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1tuf h LYS 55 CO 0.03 0.86 -0.09 0.82 -0.57 0.00 0.00 179.45 180.50 1tuf h ILE 56 N 0.77 0.85 -0.75 1.86 2.04 -0.43 0.13 117.51 121.98 1tuf h ILE 56 Ca 0.16 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.89 1tuf h ILE 56 Cb 0.40 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.37 1tuf h ILE 56 CO 0.01 0.03 0.48 0.78 0.00 0.00 0.00 178.15 179.45 1tuf h ASN 57 N -0.31 0.88 -0.06 1.72 2.35 -0.93 -1.52 115.58 117.70 1tuf h ASN 57 Ca -0.03 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.66 1tuf h ASN 57 Cb 0.24 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.39 1tuf h ASN 57 CO 0.04 0.65 -0.10 0.22 -1.65 0.00 0.00 177.43 176.60 1tuf h TYR 58 N 1.02 0.21 -0.90 1.19 3.20 -1.00 -3.20 116.97 117.49 1tuf h TYR 58 Ca 0.27 -0.07 0.05 0.00 3.14 0.00 0.00 58.73 62.12 1tuf h TYR 58 Cb -0.08 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.08 1tuf h TYR 58 CO 0.00 0.67 0.57 -0.91 -1.64 0.00 0.00 178.16 176.85 1tuf h ASN 59 N -0.31 0.91 -0.69 -2.11 2.35 -0.49 -1.23 115.58 114.02 1tuf h ASN 59 Ca 0.01 0.01 0.12 0.00 -0.55 0.00 0.00 56.30 55.88 1tuf h ASN 59 Cb 0.65 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.79 1tuf h ASN 59 CO 0.02 0.60 0.46 0.03 -1.65 0.00 0.00 177.43 176.89 1tuf h ARG 60 N 1.06 0.44 -0.02 0.81 3.08 -1.30 0.41 114.38 118.86 1tuf h ARG 60 Ca 0.38 -0.03 -0.15 0.00 0.07 0.00 0.00 59.98 60.25 1tuf h ARG 60 Cb 0.12 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 1tuf h ARG 60 CO -0.16 0.29 -0.68 1.88 -1.07 0.00 0.00 179.97 180.23 1tuf h TYR 61 N 0.45 0.13 0.01 3.04 0.05 -1.24 -2.18 116.97 117.23 1tuf h TYR 61 Ca 0.33 -0.06 -0.02 0.00 0.05 0.00 0.00 58.73 59.04 1tuf h TYR 61 Cb 0.66 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.38 1tuf h TYR 61 CO -0.00 0.74 -0.07 0.82 -1.05 0.00 0.00 178.16 178.60 1tuf h ILE 62 N 0.06 1.71 -0.15 -2.88 1.08 -0.33 -2.96 117.51 114.04 1tuf h ILE 62 Ca -0.01 -2.18 -0.03 0.00 -0.39 0.00 0.00 64.86 62.25 1tuf h ILE 62 Cb 1.21 3.19 -0.01 0.00 -3.07 0.00 0.00 36.82 38.14 1tuf h ILE 62 CO 0.10 0.57 -0.04 -0.08 -0.69 0.00 0.00 178.15 178.01 1tuf h GLU 63 N -0.86 0.21 0.00 2.37 4.57 -0.39 -0.30 114.58 120.19 1tuf h GLU 63 Ca -0.01 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1tuf h GLU 63 Cb 0.98 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.53 1tuf h GLU 63 CO 0.01 0.27 -0.39 0.00 -1.18 0.00 0.00 179.01 177.73 1tuf h ALA 64 N 1.75 0.78 -0.01 2.92 0.00 -1.49 -3.34 119.26 119.87 1tuf h ALA 64 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1tuf h ALA 64 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1tuf h ALA 64 CO 0.01 0.00 -0.15 1.19 0.00 0.00 0.00 179.25 180.29 1tuf n PHE 65 N -2.52 0.00 0.33 0.00 3.72 -0.98 -4.54 117.46 113.47 1tuf n PHE 65 Ca 0.03 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.59 1tuf n PHE 65 Cb 0.48 0.00 0.84 0.00 -0.94 0.00 0.00 39.48 39.87 1tuf n PHE 65 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1tuf h LYS 66 N 1.07 0.00 0.00 -1.08 1.57 -1.19 0.24 116.57 117.18 1tuf h LYS 66 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1tuf h LYS 66 Cb 0.30 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 1tuf h LYS 66 CO 0.00 0.00 -0.07 -0.09 -0.57 0.00 0.00 179.45 178.72 1tuf h ARG 67 N 0.00 0.00 -0.01 3.15 2.43 -1.84 -2.75 114.38 115.35 1tuf h ARG 67 Ca 0.00 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.04 1tuf h ARG 67 Cb 0.61 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 1tuf h ARG 67 CO 0.00 0.07 -0.60 2.35 -1.51 0.00 0.00 179.97 180.28 1tuf h TRP 68 N 0.00 0.06 -0.72 2.20 2.91 -0.88 -2.93 115.95 116.59 1tuf h TRP 68 Ca -0.00 -0.02 -0.41 0.00 1.13 0.00 0.00 58.89 59.58 1tuf h TRP 68 Cb 0.19 -0.01 -0.22 0.00 -0.51 0.00 0.00 29.16 28.61 1tuf h TRP 68 CO 0.00 0.64 0.52 -1.91 -1.03 0.00 0.00 178.44 176.66 1tuf n GLU 69 N -3.83 2.00 0.00 2.65 2.13 -1.04 -3.02 120.64 119.53 1tuf n GLU 69 Ca -0.01 -2.24 0.00 0.00 0.66 0.00 0.00 57.16 55.56 1tuf n GLU 69 Cb 0.60 -1.88 0.00 0.00 0.27 0.00 0.00 31.44 30.44 1tuf n GLU 69 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1tuf n GLU 70 N -0.57 0.00 0.00 5.31 1.02 -1.15 -4.38 120.64 120.88 1tuf n GLU 70 Ca 0.44 0.00 0.14 0.00 -0.02 0.00 0.00 57.16 57.72 1tuf n GLU 70 Cb 1.14 -0.23 0.51 0.00 -0.02 0.00 0.00 31.44 32.84 1tuf n GLU 70 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1tuf n GLU 71 N -2.63 0.70 0.00 3.49 1.02 -1.12 -4.12 120.64 117.98 1tuf n GLU 71 Ca 0.00 -0.32 0.00 0.00 -0.02 0.00 0.00 57.16 56.82 1tuf n GLU 71 Cb 0.19 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 1tuf n GLU 71 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1tuf n THR 72 N -0.87 0.00 -1.56 2.62 -2.24 -1.17 -5.01 114.28 106.05 1tuf n THR 72 Ca 0.13 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.77 1tuf n THR 72 Cb 0.31 0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.60 1tuf n THR 72 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tuf n GLY 73 N 1.21 1.11 3.79 3.38 0.00 -1.25 -4.98 105.19 108.46 1tuf n GLY 73 Ca 0.00 -0.37 -0.25 0.00 0.00 0.00 0.00 46.02 45.40 1tuf n GLY 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tuf s LYS 74 N -3.45 2.28 0.19 1.61 -0.14 -1.26 -4.99 119.74 113.99 1tuf s LYS 74 Ca 0.00 -1.86 -0.11 0.00 -1.36 0.00 0.00 55.97 52.64 1tuf s LYS 74 Cb 0.00 -2.04 -0.07 0.00 -1.68 0.00 0.00 37.83 34.04 1tuf s LYS 74 CO 0.00 -0.24 0.54 -1.21 -0.76 0.00 0.00 175.35 173.68 1tuf s GLU 75 N -4.01 3.86 -0.23 1.68 2.02 -1.26 -3.80 118.70 116.95 1tuf s GLU 75 Ca 0.39 0.34 -0.01 0.00 0.02 0.00 0.00 54.97 55.70 1tuf s GLU 75 Cb 0.01 -2.77 0.02 0.00 0.10 0.00 0.00 34.13 31.50 1tuf s GLU 75 CO 0.22 0.39 -0.09 0.12 0.02 0.00 0.00 175.26 175.91 1tuf s PHE 76 N -1.67 2.99 -0.11 1.61 5.36 -1.26 -1.46 117.98 123.44 1tuf s PHE 76 Ca 0.43 -1.53 0.01 0.00 -0.96 0.00 0.00 56.93 54.88 1tuf s PHE 76 Cb -0.13 -2.02 -0.01 0.00 -0.34 0.00 0.00 43.02 40.52 1tuf s PHE 76 CO 0.20 -0.73 -0.15 0.42 -1.46 0.00 0.00 175.22 173.50 1tuf s ILE 77 N 1.33 2.86 -0.49 3.12 1.01 0.03 -5.00 121.20 124.06 1tuf s ILE 77 Ca 0.02 -0.74 -0.15 0.00 0.00 0.00 0.00 60.65 59.78 1tuf s ILE 77 Cb -0.16 -2.17 0.09 0.00 0.01 0.00 0.00 42.46 40.23 1tuf s ILE 77 CO -0.06 0.54 0.42 -0.69 0.00 0.00 0.00 174.94 175.14 1tuf s VAL 78 N 0.21 5.12 -0.64 2.92 1.01 -1.26 -2.10 120.40 125.65 1tuf s VAL 78 Ca -0.10 -1.24 -0.19 0.00 0.00 0.00 0.00 61.98 60.46 1tuf s VAL 78 Cb -0.16 -4.14 0.11 0.00 0.00 0.00 0.00 36.38 32.20 1tuf s VAL 78 CO 0.06 -0.67 0.76 0.00 0.00 0.00 0.00 175.10 175.24 1tuf s ALA 79 N 1.60 3.45 0.20 5.51 0.00 -0.02 0.06 121.76 132.58 1tuf s ALA 79 Ca 0.04 -2.35 -0.32 0.00 0.00 0.00 0.00 51.96 49.32 1tuf s ALA 79 Cb -0.26 -3.59 -0.13 0.00 0.00 0.00 0.00 23.12 19.14 1tuf s ALA 79 CO 0.05 -2.42 1.63 0.98 0.00 0.00 0.00 175.76 176.00 1tuf n TYR 80 N 6.22 2.54 -2.50 0.00 9.36 -0.51 -3.61 117.16 128.67 1tuf n TYR 80 Ca -0.04 0.18 -0.40 0.00 3.32 0.00 0.00 57.90 60.95 1tuf n TYR 80 Cb 0.43 -2.60 -0.03 0.00 -0.63 0.00 0.00 39.34 36.51 1tuf n TYR 80 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1tuf s ALA 81 N 0.86 2.63 0.00 2.98 0.00 0.05 0.15 121.76 128.42 1tuf s ALA 81 Ca 0.75 -1.76 0.00 0.00 0.00 0.00 0.00 51.96 50.94 1tuf s ALA 81 Cb -0.58 -4.41 0.00 0.00 0.00 0.00 0.00 23.12 18.13 1tuf s ALA 81 CO 0.37 -3.58 0.08 0.66 0.00 0.00 0.00 175.76 173.30 1tuf n TYR 82 N 9.62 0.00 0.00 0.00 4.02 -0.87 -4.29 117.16 125.64 1tuf n TYR 82 Ca 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.10 1tuf n TYR 82 Cb 0.50 -0.18 0.00 0.00 -0.02 0.00 0.00 39.34 39.64 1tuf n TYR 82 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1tuf n ALA 84 N 1.69 0.00 -3.16 -0.72 0.00 -1.26 -2.92 120.51 114.14 1tuf n ALA 84 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1tuf n ALA 84 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1tuf n ALA 84 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1tuf s ASN 85 N 0.00 -0.07 -0.27 0.00 3.84 -1.26 0.39 114.94 117.57 1tuf s ASN 85 Ca 0.00 0.06 0.09 0.00 0.21 0.00 0.00 52.86 53.22 1tuf s ASN 85 Cb 0.00 1.06 0.48 0.00 -0.55 0.00 0.00 41.25 42.24 1tuf s ASN 85 CO 0.00 -0.01 1.39 0.00 -2.79 0.00 0.00 177.10 175.69 1tuf n ALA 86 N 5.26 4.17 -1.76 1.71 0.00 -1.15 -4.77 120.51 123.97 1tuf n ALA 86 Ca -0.09 -3.22 -0.41 0.00 0.00 0.00 0.00 53.44 49.72 1tuf n ALA 86 Cb 0.55 -0.62 -0.01 0.00 0.00 0.00 0.00 19.45 19.38 1tuf n ALA 86 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1tuf s ASN 87 N -2.78 6.33 0.23 0.00 3.84 -1.26 -4.79 114.94 116.51 1tuf s ASN 87 Ca 0.43 3.02 -0.06 0.00 0.21 0.00 0.00 52.86 56.46 1tuf s ASN 87 Cb 0.40 -2.65 0.39 0.00 -0.55 0.00 0.00 41.25 38.84 1tuf s ASN 87 CO -0.03 -0.92 1.71 0.25 -2.79 0.00 0.00 177.10 175.33 1tuf h LEU 88 N 4.05 0.13 -1.02 3.21 6.46 -1.96 -0.83 115.31 125.35 1tuf h LEU 88 Ca -0.49 0.12 -0.05 0.00 -0.12 0.00 0.00 57.88 57.34 1tuf h LEU 88 Cb 1.23 0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 41.26 1tuf h LEU 88 CO 0.73 0.05 0.14 0.00 -0.62 0.00 0.00 178.44 178.73 1tuf h ALA 89 N 1.53 1.21 0.24 1.25 0.00 -1.90 -0.49 119.26 121.10 1tuf h ALA 89 Ca 0.38 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1tuf h ALA 89 Cb 0.58 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1tuf h ALA 89 CO -0.42 0.55 -0.12 0.82 0.00 0.00 0.00 179.25 180.08 1tuf h ILE 90 N 0.81 0.70 -0.47 0.00 1.08 -1.68 -1.32 117.51 116.64 1tuf h ILE 90 Ca 0.18 -0.89 0.05 0.00 -0.39 0.00 0.00 64.86 63.81 1tuf h ILE 90 Cb 0.29 1.12 -0.03 0.00 -3.07 0.00 0.00 36.82 35.14 1tuf h ILE 90 CO -0.00 0.16 0.31 0.71 -0.69 0.00 0.00 178.15 178.64 1tuf h THR 91 N -0.86 0.98 -0.06 -0.27 1.35 -1.19 0.15 112.91 113.01 1tuf h THR 91 Ca -0.03 -0.14 -0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1tuf h THR 91 Cb 0.51 0.53 -0.00 0.00 -1.73 0.00 0.00 68.15 67.46 1tuf h THR 91 CO 0.05 0.08 0.02 -0.09 -0.25 0.00 0.00 175.52 175.33 1tuf h ARG 92 N 0.42 0.09 -0.13 4.72 9.65 -1.05 0.10 114.38 128.17 1tuf h ARG 92 Ca 0.20 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 1tuf h ARG 92 Cb 0.27 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.83 1tuf h ARG 92 CO -0.05 0.27 0.09 1.25 2.80 0.00 0.00 179.97 184.32 1tuf h LEU 93 N -0.11 0.15 -1.55 3.80 7.12 0.07 -0.01 115.31 124.78 1tuf h LEU 93 Ca 0.02 -0.00 -0.03 0.00 0.13 0.00 0.00 57.88 58.00 1tuf h LEU 93 Cb 0.22 -0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 40.30 1tuf h LEU 93 CO -0.00 0.11 -0.02 -0.07 -0.13 0.00 0.00 178.44 178.33 1tuf h LEU 94 N 0.18 0.24 -0.14 2.25 3.38 -0.69 -2.25 115.31 118.28 1tuf h LEU 94 Ca 0.05 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1tuf h LEU 94 Cb -0.02 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1tuf h LEU 94 CO -0.01 0.31 0.02 0.00 0.09 0.00 0.00 178.44 178.85 1tuf h ALA 95 N 1.73 0.19 -0.26 1.53 0.00 0.19 -2.04 119.26 120.59 1tuf h ALA 95 Ca 0.06 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.88 1tuf h ALA 95 Cb 0.21 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1tuf h ALA 95 CO 0.01 -0.15 0.20 0.87 0.00 0.00 0.00 179.25 180.17 1tuf h LYS 96 N 0.01 0.00 0.00 0.00 1.57 -0.47 0.72 116.57 118.40 1tuf h LYS 96 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1tuf h LYS 96 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1tuf h LYS 96 CO 0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 1tuf n LEU 97 N -4.36 0.00 -0.01 2.94 4.77 -0.96 -4.84 117.00 114.53 1tuf n LEU 97 Ca 0.03 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1tuf n LEU 97 Cb 0.35 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1tuf n LEU 97 CO 0.34 0.00 -0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1tuf n GLY 98 N 0.75 0.45 3.82 -0.72 0.00 0.25 -5.03 105.19 104.70 1tuf n GLY 98 Ca 0.14 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 1tuf n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tuf n GLY 100 N -1.59 2.08 2.81 0.00 0.00 0.11 -4.63 105.19 103.96 1tuf n GLY 100 Ca 0.08 -2.16 -0.14 0.00 0.00 0.00 0.00 46.02 43.80 1tuf n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tuf s ALA 101 N -2.20 0.04 -0.49 4.61 0.00 0.18 -1.42 121.76 122.48 1tuf s ALA 101 Ca 0.16 0.20 -0.12 0.00 0.00 0.00 0.00 51.96 52.20 1tuf s ALA 101 Cb -0.01 -0.16 0.12 0.00 0.00 0.00 0.00 23.12 23.07 1tuf s ALA 101 CO 0.10 -0.07 0.40 0.34 0.00 0.00 0.00 175.76 176.53 1tuf s ASP 102 N 0.66 5.89 -0.02 0.00 2.15 0.39 -1.96 116.67 123.78 1tuf s ASP 102 Ca -0.06 -1.83 -0.03 0.00 0.43 0.00 0.00 52.55 51.06 1tuf s ASP 102 Cb -0.08 -2.09 -0.04 0.00 -0.30 0.00 0.00 42.92 40.41 1tuf s ASP 102 CO -0.02 -0.75 0.18 0.68 -0.17 0.00 0.00 175.17 175.09 1tuf s VAL 103 N 1.46 5.44 -0.07 1.11 -7.23 -0.37 -2.05 120.40 118.69 1tuf s VAL 103 Ca 0.05 -0.11 0.11 0.00 -1.81 0.00 0.00 61.98 60.22 1tuf s VAL 103 Cb -0.27 -3.52 0.16 0.00 0.56 0.00 0.00 36.38 33.31 1tuf s VAL 103 CO 0.01 0.36 1.05 0.55 -0.31 0.00 0.00 175.10 176.77 1tuf n VAL 104 N 1.08 1.24 -3.67 1.32 3.14 -1.26 -0.92 118.33 119.25 1tuf n VAL 104 Ca -0.12 -1.45 -0.03 0.00 -2.96 0.00 0.00 64.34 59.78 1tuf n VAL 104 Cb 0.53 0.12 -0.01 0.00 -1.06 0.00 0.00 33.84 33.41 1tuf n VAL 104 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1tuf s SER 105 N -1.99 -0.17 0.37 6.55 1.04 -1.26 -4.70 113.70 113.55 1tuf s SER 105 Ca 0.18 -0.24 0.08 0.00 0.48 0.00 0.00 55.95 56.45 1tuf s SER 105 Cb 0.16 0.36 0.82 0.00 0.10 0.00 0.00 66.02 67.45 1tuf s SER 105 CO 0.02 -0.65 1.93 1.23 0.98 0.00 0.00 173.24 176.75 1tuf h GLY 106 N 2.00 0.99 1.18 7.32 0.00 -1.97 -1.44 103.07 111.14 1tuf h GLY 106 Ca -0.24 -0.28 -0.14 0.00 0.00 0.00 0.00 47.33 46.67 1tuf h GLY 106 CO 0.27 0.16 -0.27 -1.33 0.00 0.00 0.00 176.54 175.37 1tuf h GLY 107 N 0.68 1.01 1.34 4.60 0.00 -1.99 -0.97 103.07 107.74 1tuf h GLY 107 Ca 0.36 -0.92 -0.18 0.00 0.00 0.00 0.00 47.33 46.59 1tuf h GLY 107 CO -0.14 0.84 -0.59 0.83 0.00 0.00 0.00 176.54 177.48 1tuf h GLU 108 N 0.79 0.68 -0.58 4.80 5.08 -1.81 -1.14 114.58 122.40 1tuf h GLU 108 Ca 0.09 -0.45 -0.03 0.00 -1.00 0.00 0.00 59.36 57.97 1tuf h GLU 108 Cb 0.84 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 1tuf h GLU 108 CO 0.07 1.07 0.25 1.25 -1.00 0.00 0.00 179.01 180.66 1tuf h LEU 109 N 0.51 0.78 -0.23 1.33 6.46 -1.20 0.24 115.31 123.21 1tuf h LEU 109 Ca 0.00 -0.15 0.02 0.00 -0.12 0.00 0.00 57.88 57.63 1tuf h LEU 109 Cb 1.17 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 40.88 1tuf h LEU 109 CO 0.12 0.72 0.09 0.22 -0.62 0.00 0.00 178.44 178.97 1tuf h TYR 110 N 0.80 0.17 -0.59 1.25 3.20 -0.97 -0.58 116.97 120.24 1tuf h TYR 110 Ca 0.20 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.97 1tuf h TYR 110 Cb 0.16 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 1tuf h TYR 110 CO 0.00 0.09 -0.04 0.82 -1.64 0.00 0.00 178.16 177.39 1tuf h ILE 111 N 0.21 1.27 -0.03 1.81 2.04 -0.97 -1.36 117.51 120.47 1tuf h ILE 111 Ca 0.10 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1tuf h ILE 111 Cb 0.05 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1tuf h ILE 111 CO -0.09 0.43 0.02 0.00 0.00 0.00 0.00 178.15 178.51 1tuf h ALA 112 N 0.97 0.04 -0.37 1.87 0.00 -0.13 0.34 119.26 121.97 1tuf h ALA 112 Ca 0.16 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1tuf h ALA 112 Cb 0.61 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1tuf h ALA 112 CO 0.04 -0.47 -0.05 0.87 0.00 0.00 0.00 179.25 179.64 1tuf h LYS 113 N 0.03 0.60 0.00 0.00 1.79 -1.06 -1.73 116.57 116.21 1tuf h LYS 113 Ca 0.01 -0.16 -0.09 0.00 -2.18 0.00 0.00 60.65 58.23 1tuf h LYS 113 Cb -0.00 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.56 1tuf h LYS 113 CO -0.01 0.66 -0.43 -0.07 -1.08 0.00 0.00 179.45 178.52 1tuf h LEU 114 N 0.57 0.00 0.00 2.94 3.38 -0.79 -2.12 115.31 119.28 1tuf h LEU 114 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1tuf h LEU 114 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1tuf h LEU 114 CO 0.02 0.43 0.00 -1.20 0.09 0.00 0.00 178.44 177.78 1tuf n SER 115 N -3.64 0.00 -2.36 -0.43 7.64 0.11 -4.88 113.62 110.06 1tuf n SER 115 Ca -0.01 -1.11 -0.15 0.00 1.01 0.00 0.00 58.87 58.62 1tuf n SER 115 Cb 0.52 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.77 1tuf n SER 115 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1tuf n ASN 116 N -0.93 -4.67 -4.62 6.43 4.05 -0.80 -4.70 115.26 110.02 1tuf n ASN 116 Ca 0.20 -0.32 -0.40 0.00 0.45 0.00 0.00 54.58 54.52 1tuf n ASN 116 Cb 0.09 -3.28 -0.07 0.00 1.23 0.00 0.00 39.78 37.75 1tuf n ASN 116 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1tuf s VAL 117 N -3.17 5.05 0.22 3.44 1.01 -0.91 -4.92 120.40 121.12 1tuf s VAL 117 Ca 0.34 0.93 -0.31 0.00 0.00 0.00 0.00 61.98 62.94 1tuf s VAL 117 Cb -0.15 -3.85 -0.14 0.00 0.00 0.00 0.00 36.38 32.24 1tuf s VAL 117 CO 0.43 0.08 1.25 -2.65 0.00 0.00 0.00 175.10 174.20 1tuf n PRO 118 N 5.57 1.57 -0.03 2.72 -0.02 -1.26 -4.64 135.00 138.91 1tuf n PRO 118 Ca -0.03 0.56 0.07 0.00 -2.02 0.00 0.00 63.50 62.08 1tuf n PRO 118 Cb 0.50 -2.11 0.46 0.00 -0.02 0.00 0.00 33.50 32.33 1tuf n PRO 118 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1tuf h SER 119 N 3.54 0.42 0.02 2.55 0.02 -1.86 -0.31 113.55 117.94 1tuf h SER 119 Ca -0.44 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1tuf h SER 119 Cb 1.31 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1tuf h SER 119 CO 0.71 0.28 0.00 1.17 -1.14 0.00 0.00 176.83 177.85 1tuf n LYS 120 N -4.48 0.12 -1.05 3.45 4.81 -1.26 -0.81 118.16 118.94 1tuf n LYS 120 Ca 0.06 0.62 -0.06 0.00 -0.87 0.00 0.00 58.31 58.05 1tuf n LYS 120 Cb 0.19 -1.90 0.15 0.00 0.02 0.00 0.00 35.03 33.49 1tuf n LYS 120 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1tuf n LYS 121 N -2.17 2.22 -4.06 1.64 5.02 -0.13 -4.56 118.16 116.12 1tuf n LYS 121 Ca -0.01 -3.50 -0.29 0.00 -2.02 0.00 0.00 58.31 52.49 1tuf n LYS 121 Cb 0.04 -1.87 -0.17 0.00 -0.02 0.00 0.00 35.03 33.01 1tuf n LYS 121 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1tuf s ILE 122 N -3.66 1.36 -0.03 -0.18 1.01 -0.55 -0.65 121.20 118.50 1tuf s ILE 122 Ca 0.44 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.63 1tuf s ILE 122 Cb 0.40 -1.30 -0.03 0.00 0.01 0.00 0.00 42.46 41.54 1tuf s ILE 122 CO -0.02 0.42 -0.15 0.68 0.00 0.00 0.00 174.94 175.87 1tuf s VAL 123 N 1.47 3.01 -0.29 2.92 -7.23 -0.83 -1.98 120.40 117.47 1tuf s VAL 123 Ca 0.03 -0.80 -0.05 0.00 -1.81 0.00 0.00 61.98 59.35 1tuf s VAL 123 Cb -0.13 -2.19 0.03 0.00 0.56 0.00 0.00 36.38 34.64 1tuf s VAL 123 CO -0.08 0.55 0.04 0.12 -0.31 0.00 0.00 175.10 175.41 1tuf s PHE 124 N -0.77 3.17 0.34 2.82 2.19 -0.60 -1.23 117.98 123.90 1tuf s PHE 124 Ca 0.12 -1.37 0.07 0.00 0.33 0.00 0.00 56.93 56.08 1tuf s PHE 124 Cb -0.11 -2.19 -0.03 0.00 -1.31 0.00 0.00 43.02 39.39 1tuf s PHE 124 CO 0.01 -0.69 0.30 -0.80 1.83 0.00 0.00 175.22 175.88 1tuf s ASN 125 N 1.39 5.31 0.00 6.13 0.01 -0.10 -0.78 114.94 126.90 1tuf s ASN 125 Ca -0.00 -0.49 0.00 0.00 -0.71 0.00 0.00 52.86 51.66 1tuf s ASN 125 Cb -0.18 -0.98 0.00 0.00 0.41 0.00 0.00 41.25 40.50 1tuf s ASN 125 CO 0.00 -0.36 0.00 0.61 -1.51 0.00 0.00 177.10 175.84 1tuf n GLY 126 N -1.38 4.81 0.34 0.66 0.00 -1.26 -4.27 105.19 104.09 1tuf n GLY 126 Ca -0.02 -0.84 0.13 0.00 0.00 0.00 0.00 46.02 45.29 1tuf n GLY 126 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1tuf n ASN 127 N 0.00 1.31 -3.18 1.61 6.94 -1.26 -4.40 115.26 116.28 1tuf n ASN 127 Ca 0.00 -1.12 -0.22 0.00 -0.02 0.00 0.00 54.58 53.22 1tuf n ASN 127 Cb 0.00 0.16 -0.05 0.00 -2.36 0.00 0.00 39.78 37.52 1tuf n ASN 127 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1tuf s LYS 129 N -1.57 4.47 0.32 0.00 1.02 -1.26 -5.03 119.74 117.69 1tuf s LYS 129 Ca 0.37 1.51 -0.05 0.00 0.02 0.00 0.00 55.97 57.81 1tuf s LYS 129 Cb 0.23 -3.48 -0.05 0.00 -0.52 0.00 0.00 37.83 34.01 1tuf s LYS 129 CO -0.10 -0.21 0.60 0.95 -0.92 0.00 0.00 175.35 175.66 1tuf s THR 130 N 1.46 4.99 0.28 2.17 -4.23 -1.26 -4.92 115.64 114.13 1tuf s THR 130 Ca 0.53 0.10 0.02 0.00 -1.18 0.00 0.00 61.69 61.15 1tuf s THR 130 Cb -0.22 -3.75 0.27 0.00 1.34 0.00 0.00 72.50 70.13 1tuf s THR 130 CO 0.25 -0.41 1.73 0.50 -0.54 0.00 0.00 174.62 176.15 1tuf h LYS 131 N 1.44 0.51 -0.41 3.99 3.64 -1.98 0.57 116.57 124.34 1tuf h LYS 131 Ca -0.48 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 58.94 1tuf h LYS 131 Cb 1.19 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.84 1tuf h LYS 131 CO 0.65 0.34 0.07 1.49 -2.27 0.00 0.00 179.45 179.73 1tuf h GLU 132 N 0.52 0.19 -0.29 1.90 4.57 -2.00 0.10 114.58 119.57 1tuf h GLU 132 Ca 0.52 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 58.57 1tuf h GLU 132 Cb 0.86 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.40 1tuf h GLU 132 CO -0.44 0.13 -0.30 0.93 -1.18 0.00 0.00 179.01 178.14 1tuf h GLU 133 N 0.20 0.61 -0.10 1.92 5.08 -1.37 -2.74 114.58 118.18 1tuf h GLU 133 Ca 0.20 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1tuf h GLU 133 Cb 0.24 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1tuf h GLU 133 CO -0.27 0.84 0.04 0.82 -1.00 0.00 0.00 179.01 179.44 1tuf h ILE 134 N 0.52 1.15 -0.56 3.13 2.04 -0.15 -1.26 117.51 122.38 1tuf h ILE 134 Ca 0.06 -0.45 0.10 0.00 1.00 0.00 0.00 64.86 65.57 1tuf h ILE 134 Cb 0.79 1.27 -0.07 0.00 -0.74 0.00 0.00 36.82 38.06 1tuf h ILE 134 CO 0.06 0.13 0.15 0.40 0.00 0.00 0.00 178.15 178.90 1tuf h ILE 135 N -0.00 0.71 -0.68 -0.67 2.04 -0.97 0.12 117.51 118.07 1tuf h ILE 135 Ca 0.03 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 65.83 1tuf h ILE 135 Cb 0.18 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 36.60 1tuf h ILE 135 CO -0.00 0.05 0.41 -0.03 0.00 0.00 0.00 178.15 178.58 1tuf h MET 136 N 0.30 0.77 -0.50 2.37 4.05 -1.20 0.98 114.93 121.70 1tuf h MET 136 Ca 0.29 -0.05 -0.09 0.00 -0.28 0.00 0.00 59.70 59.57 1tuf h MET 136 Cb 0.39 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.00 1tuf h MET 136 CO -0.34 0.51 -0.04 0.78 0.23 0.00 0.00 176.91 178.05 1tuf h GLY 137 N 0.79 0.99 0.59 1.39 0.00 0.05 -1.67 103.07 105.21 1tuf h GLY 137 Ca 0.28 -0.76 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 1tuf h GLY 137 CO -0.13 0.70 -0.03 -2.22 0.00 0.00 0.00 176.54 174.87 1tuf h ILE 138 N 0.78 1.21 -0.93 2.60 2.04 -0.39 -1.09 117.51 121.74 1tuf h ILE 138 Ca 0.14 -0.93 0.07 0.00 1.00 0.00 0.00 64.86 65.15 1tuf h ILE 138 Cb 0.58 1.82 -0.07 0.00 -0.74 0.00 0.00 36.82 38.41 1tuf h ILE 138 CO 0.03 0.23 0.58 -0.33 0.00 0.00 0.00 178.15 178.67 1tuf h GLU 139 N -0.49 1.01 0.00 2.37 4.39 -0.85 0.18 114.58 121.20 1tuf h GLU 139 Ca -0.01 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1tuf h GLU 139 Cb 0.43 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1tuf h GLU 139 CO 0.01 0.67 0.00 0.00 -1.16 0.00 0.00 179.01 178.53 1tuf n ALA 140 N -2.36 2.03 -3.72 3.43 0.00 -0.63 -4.93 120.51 114.34 1tuf n ALA 140 Ca 0.14 -0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.21 1tuf n ALA 140 Cb 0.21 -1.35 0.03 0.00 0.00 0.00 0.00 19.45 18.34 1tuf n ALA 140 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1tuf n ASN 141 N -1.44 -4.01 -4.76 0.00 4.05 0.63 -4.76 115.26 104.97 1tuf n ASN 141 Ca 0.07 -0.99 -0.33 0.00 0.45 0.00 0.00 54.58 53.78 1tuf n ASN 141 Cb 0.23 -3.45 0.05 0.00 1.23 0.00 0.00 39.78 37.85 1tuf n ASN 141 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 1tuf s ILE 142 N -3.57 3.15 0.16 -1.44 -4.36 -0.96 -4.52 121.20 109.66 1tuf s ILE 142 Ca 0.34 0.53 -0.21 0.00 -0.26 0.00 0.00 60.65 61.05 1tuf s ILE 142 Cb -0.12 -3.04 0.06 0.00 1.25 0.00 0.00 42.46 40.61 1tuf s ILE 142 CO 0.86 -0.34 1.63 -0.09 0.24 0.00 0.00 174.94 177.24 1tuf h ARG 143 N -0.09 -0.18 -2.51 0.37 2.43 -0.32 -3.42 114.38 110.66 1tuf h ARG 143 Ca -0.47 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 58.65 1tuf h ARG 143 Cb 1.25 0.04 -0.18 0.00 -0.42 0.00 0.00 29.97 30.66 1tuf h ARG 143 CO 0.53 -0.12 0.05 0.00 -1.51 0.00 0.00 179.97 178.93 1tuf s ALA 144 N -6.11 -1.42 -0.41 2.80 0.00 -1.12 -4.64 121.76 110.86 1tuf s ALA 144 Ca -0.15 0.84 -0.13 0.00 0.00 0.00 0.00 51.96 52.53 1tuf s ALA 144 Cb 0.13 0.19 0.04 0.00 0.00 0.00 0.00 23.12 23.48 1tuf s ALA 144 CO 0.69 -0.42 0.27 -0.06 0.00 0.00 0.00 175.76 176.24 1tuf s PHE 145 N -1.79 3.26 -1.13 0.00 0.08 0.57 -1.56 117.98 117.41 1tuf s PHE 145 Ca -0.09 -0.93 -0.22 0.00 0.12 0.00 0.00 56.93 55.81 1tuf s PHE 145 Cb -0.01 -2.66 -0.02 0.00 -0.57 0.00 0.00 43.02 39.75 1tuf s PHE 145 CO 0.04 -0.68 1.83 -0.80 -0.10 0.00 0.00 175.22 175.50 1tuf s ASN 146 N 1.82 5.67 0.29 1.36 0.01 0.04 -0.32 114.94 123.81 1tuf s ASN 146 Ca 0.03 -1.62 -0.29 0.00 -0.71 0.00 0.00 52.86 50.27 1tuf s ASN 146 Cb -0.20 -2.58 -0.13 0.00 0.41 0.00 0.00 41.25 38.74 1tuf s ASN 146 CO 0.07 -2.36 1.22 0.52 -1.51 0.00 0.00 177.10 175.04 1tuf n VAL 147 N 7.37 1.66 -0.06 1.60 0.31 -0.74 -4.56 118.33 123.91 1tuf n VAL 147 Ca 0.43 -0.42 -0.05 0.00 -0.01 0.00 0.00 64.34 64.29 1tuf n VAL 147 Cb 0.47 -1.30 -0.10 0.00 -0.91 0.00 0.00 33.84 31.99 1tuf n VAL 147 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1tuf n ASP 148 N 1.34 1.74 -3.98 4.52 -0.08 -1.26 -0.86 116.55 117.97 1tuf n ASP 148 Ca 0.09 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.27 1tuf n ASP 148 Cb 0.33 0.89 -0.06 0.00 2.34 0.00 0.00 41.12 44.62 1tuf n ASP 148 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1tuf s SER 149 N -4.54 -0.07 0.29 1.67 1.04 -1.26 -3.89 113.70 106.94 1tuf s SER 149 Ca -0.06 -0.90 0.08 0.00 0.48 0.00 0.00 55.95 55.55 1tuf s SER 149 Cb 0.04 0.54 0.44 0.00 0.10 0.00 0.00 66.02 67.15 1tuf s SER 149 CO 0.54 -1.07 1.67 0.40 0.98 0.00 0.00 173.24 175.77 1tuf h ILE 150 N 2.33 1.35 -0.39 -1.02 2.04 -1.97 -2.16 117.51 117.68 1tuf h ILE 150 Ca -0.28 -1.71 -0.04 0.00 1.00 0.00 0.00 64.86 63.82 1tuf h ILE 150 Cb 1.25 1.86 -0.02 0.00 -0.74 0.00 0.00 36.82 39.17 1tuf h ILE 150 CO 0.39 0.50 0.06 -1.28 0.00 0.00 0.00 178.15 177.82 1tuf h SER 151 N 0.11 0.56 -0.21 1.72 0.87 -1.99 -1.07 113.55 113.54 1tuf h SER 151 Ca 0.00 -0.09 -0.15 0.00 -1.23 0.00 0.00 61.79 60.32 1tuf h SER 151 Cb 0.91 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.73 1tuf h SER 151 CO 0.07 0.59 -0.46 -0.08 -0.53 0.00 0.00 176.83 176.41 1tuf h GLU 152 N 0.58 0.68 -0.20 2.24 4.81 -1.83 -2.82 114.58 118.04 1tuf h GLU 152 Ca 0.13 -0.45 -0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1tuf h GLU 152 Cb 0.28 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1tuf h GLU 152 CO 0.00 1.08 0.12 1.25 -0.73 0.00 0.00 179.01 180.73 1tuf h LEU 153 N 0.38 0.24 -1.73 1.64 6.46 -1.00 0.77 115.31 122.07 1tuf h LEU 153 Ca 0.00 -0.04 0.02 0.00 -0.12 0.00 0.00 57.88 57.74 1tuf h LEU 153 Cb 1.07 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.93 1tuf h LEU 153 CO 0.10 0.21 0.22 0.40 -0.62 0.00 0.00 178.44 178.75 1tuf h ILE 154 N 0.25 1.03 -0.01 4.05 2.04 -1.26 0.56 117.51 124.18 1tuf h ILE 154 Ca 0.07 -0.12 -0.05 0.00 1.00 0.00 0.00 64.86 65.76 1tuf h ILE 154 Cb 0.01 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1tuf h ILE 154 CO -0.01 0.07 -0.20 0.25 0.00 0.00 0.00 178.15 178.25 1tuf h LEU 155 N 0.36 0.19 -0.04 1.44 6.46 -1.12 -2.07 115.31 120.52 1tuf h LEU 155 Ca 0.13 -0.76 0.02 0.00 -0.12 0.00 0.00 57.88 57.15 1tuf h LEU 155 Cb 0.09 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 39.94 1tuf h LEU 155 CO -0.03 0.92 -0.06 0.40 -0.62 0.00 0.00 178.44 179.05 1tuf h ILE 156 N -0.53 0.83 -0.10 4.05 2.04 -0.47 0.25 117.51 123.57 1tuf h ILE 156 Ca -0.02 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.85 1tuf h ILE 156 Cb 0.94 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 1tuf h ILE 156 CO 0.04 0.00 0.02 -1.13 0.00 0.00 0.00 178.15 177.08 1tuf h ASN 157 N -0.09 0.01 -0.43 1.72 -0.73 -0.99 0.21 115.58 115.29 1tuf h ASN 157 Ca 0.04 0.01 -0.02 0.00 1.87 0.00 0.00 56.30 58.20 1tuf h ASN 157 Cb 0.14 0.02 -0.02 0.00 0.27 0.00 0.00 38.32 38.73 1tuf h ASN 157 CO -0.10 0.02 0.21 -0.33 -0.37 0.00 0.00 177.43 176.86 1tuf h GLU 158 N 0.07 0.67 -0.09 6.67 4.39 -1.17 -1.64 114.58 123.48 1tuf h GLU 158 Ca 0.05 -0.08 -0.23 0.00 0.34 0.00 0.00 59.36 59.43 1tuf h GLU 158 Cb 0.03 -0.13 0.01 0.00 -0.10 0.00 0.00 28.75 28.57 1tuf h GLU 158 CO -0.06 0.54 -0.85 1.15 -1.16 0.00 0.00 179.01 178.63 1tuf h THR 159 N 0.67 1.30 -0.80 1.13 2.02 0.13 -2.72 112.91 114.64 1tuf h THR 159 Ca 0.17 -2.11 -0.05 0.00 0.77 0.00 0.00 66.41 65.19 1tuf h THR 159 Cb 0.11 2.13 -0.04 0.00 -1.74 0.00 0.00 68.15 68.61 1tuf h THR 159 CO -0.02 0.66 0.32 0.00 0.37 0.00 0.00 175.52 176.85 1tuf h ALA 160 N 0.60 1.05 -0.89 6.16 0.00 -0.32 -1.42 119.26 124.43 1tuf h ALA 160 Ca -0.07 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.70 1tuf h ALA 160 Cb 1.48 -0.31 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 1tuf h ALA 160 CO 0.17 0.67 0.56 -0.22 0.00 0.00 0.00 179.25 180.43 1tuf h LYS 161 N 1.17 1.00 -0.57 0.00 3.64 -1.23 0.24 116.57 120.82 1tuf h LYS 161 Ca 0.27 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.57 1tuf h LYS 161 Cb 0.21 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 1tuf h LYS 161 CO -0.02 0.66 0.28 0.93 -2.27 0.00 0.00 179.45 179.03 1tuf h GLU 162 N 1.03 0.81 0.00 1.90 5.08 -1.03 -2.46 114.58 119.92 1tuf h GLU 162 Ca 0.38 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1tuf h GLU 162 Cb 0.14 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1tuf h GLU 162 CO -0.16 0.65 0.00 -0.07 -1.00 0.00 0.00 179.01 178.43 1tuf h LEU 163 N 0.77 0.00 0.12 1.33 3.38 -0.45 -3.47 115.31 116.98 1tuf h LEU 163 Ca 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 1tuf h LEU 163 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1tuf h LEU 163 CO -0.03 0.00 -0.03 0.61 0.09 0.00 0.00 178.44 179.09 1tuf n GLY 164 N 0.65 0.39 3.63 0.83 0.00 0.76 -5.04 105.19 106.41 1tuf n GLY 164 Ca 0.03 -0.93 -0.29 0.00 0.00 0.00 0.00 46.02 44.82 1tuf n GLY 164 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tuf s GLU 165 N -3.17 2.06 -0.08 1.61 0.41 -0.78 -5.03 118.70 113.72 1tuf s GLU 165 Ca 0.00 -2.28 0.03 0.00 -0.41 0.00 0.00 54.97 52.31 1tuf s GLU 165 Cb 0.00 -1.07 -0.02 0.00 -1.78 0.00 0.00 34.13 31.26 1tuf s GLU 165 CO 0.00 -0.41 -0.18 0.99 -0.49 0.00 0.00 175.26 175.17 1tuf s THR 166 N -3.04 2.64 -0.12 3.63 2.01 -1.26 -4.29 115.64 115.21 1tuf s THR 166 Ca 0.16 -0.85 -0.04 0.00 0.31 0.00 0.00 61.69 61.27 1tuf s THR 166 Cb 0.02 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 1tuf s THR 166 CO 0.09 0.56 0.04 0.00 -0.69 0.00 0.00 174.62 174.62 1tuf s ALA 167 N -0.15 3.40 -0.06 7.40 0.00 -0.23 -4.95 121.76 127.18 1tuf s ALA 167 Ca -0.02 -0.76 -0.24 0.00 0.00 0.00 0.00 51.96 50.94 1tuf s ALA 167 Cb -0.14 -1.67 -0.04 0.00 0.00 0.00 0.00 23.12 21.28 1tuf s ALA 167 CO 0.04 0.48 0.72 -0.80 0.00 0.00 0.00 175.76 176.20 1tuf s ASN 168 N -0.56 7.02 -0.07 0.00 0.01 -1.26 -0.30 114.94 119.77 1tuf s ASN 168 Ca 0.10 1.23 0.01 0.00 -0.71 0.00 0.00 52.86 53.49 1tuf s ASN 168 Cb -0.12 -2.42 0.02 0.00 0.41 0.00 0.00 41.25 39.14 1tuf s ASN 168 CO 0.02 -0.12 -0.08 0.68 -1.51 0.00 0.00 177.10 176.10 1tuf s VAL 169 N 0.77 0.85 0.44 1.60 -7.23 -0.40 -0.31 120.40 116.12 1tuf s VAL 169 Ca 0.38 -0.28 0.06 0.00 -1.81 0.00 0.00 61.98 60.34 1tuf s VAL 169 Cb -0.18 -0.83 0.06 0.00 0.56 0.00 0.00 36.38 35.99 1tuf s VAL 169 CO 0.19 0.30 0.52 0.00 -0.31 0.00 0.00 175.10 175.81 1tuf n ALA 170 N 4.17 0.86 -3.71 1.32 0.00 0.56 -1.96 120.51 121.75 1tuf n ALA 170 Ca -0.21 -1.64 -0.20 0.00 0.00 0.00 0.00 53.44 51.39 1tuf n ALA 170 Cb 0.51 0.52 -0.17 0.00 0.00 0.00 0.00 19.45 20.31 1tuf n ALA 170 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1tuf s PHE 171 N -1.87 0.31 -0.30 0.00 0.40 -0.83 -1.80 117.98 113.89 1tuf s PHE 171 Ca 0.40 0.06 -0.27 0.00 -0.60 0.00 0.00 56.93 56.52 1tuf s PHE 171 Cb -0.03 -0.56 0.01 0.00 0.51 0.00 0.00 43.02 42.95 1tuf s PHE 171 CO 0.25 -0.22 0.97 0.50 0.70 0.00 0.00 175.22 177.42 1tuf s ARG 172 N 1.80 4.06 0.23 0.44 3.52 -0.04 0.19 118.95 129.15 1tuf s ARG 172 Ca 0.01 0.94 0.11 0.00 -0.13 0.00 0.00 55.73 56.65 1tuf s ARG 172 Cb -0.12 -3.72 -0.05 0.00 -1.56 0.00 0.00 34.95 29.50 1tuf s ARG 172 CO -0.03 -0.78 -0.15 0.96 -0.81 0.00 0.00 175.30 174.48 1tuf s ILE 173 N 3.34 2.77 -0.57 4.11 -4.36 0.56 -0.18 121.20 126.87 1tuf s ILE 173 Ca 0.40 -2.05 -0.04 0.00 -0.26 0.00 0.00 60.65 58.71 1tuf s ILE 173 Cb -0.13 -2.41 0.15 0.00 1.25 0.00 0.00 42.46 41.32 1tuf s ILE 173 CO 0.13 -0.25 0.40 0.20 0.24 0.00 0.00 174.94 175.66 1tuf s ASN 174 N -3.15 5.38 0.65 4.36 0.01 -0.72 -4.62 114.94 116.85 1tuf s ASN 174 Ca 0.26 -2.57 -0.17 0.00 -0.71 0.00 0.00 52.86 49.67 1tuf s ASN 174 Cb -0.07 -1.88 -0.06 0.00 0.41 0.00 0.00 41.25 39.65 1tuf s ASN 174 CO 0.14 -0.45 0.56 -2.65 -1.51 0.00 0.00 177.10 173.19 1tuf n PRO 175 N 3.90 0.43 -1.00 -0.60 -0.02 -1.26 -2.84 135.00 133.61 1tuf n PRO 175 Ca 0.04 0.18 -0.27 0.00 -2.02 0.00 0.00 63.50 61.43 1tuf n PRO 175 Cb 0.39 -1.80 -0.04 0.00 -0.02 0.00 0.00 33.50 32.03 1tuf n PRO 175 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1tuf n ASN 176 N -0.00 6.47 -4.74 2.55 2.85 -1.26 -4.91 115.26 116.22 1tuf n ASN 176 Ca 0.11 -2.42 -0.38 0.00 -0.11 0.00 0.00 54.58 51.78 1tuf n ASN 176 Cb 0.49 -1.30 0.06 0.00 1.24 0.00 0.00 39.78 40.27 1tuf n ASN 176 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1tuf s VAL 177 N 2.51 2.01 -0.31 3.44 1.01 -1.26 -4.93 120.40 122.87 1tuf s VAL 177 Ca 0.55 0.00 -0.28 0.00 0.00 0.00 0.00 61.98 62.26 1tuf s VAL 177 Cb 0.16 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 33.55 1tuf s VAL 177 CO -0.04 -0.00 1.01 0.21 0.00 0.00 0.00 175.10 176.28 1tuf s ASN 178 N -1.22 6.89 0.55 3.32 3.84 -1.26 -4.91 114.94 122.15 1tuf s ASN 178 Ca 0.79 1.00 0.28 0.00 0.21 0.00 0.00 52.86 55.15 1tuf s ASN 178 Cb -0.39 -2.51 1.45 0.00 -0.55 0.00 0.00 41.25 39.25 1tuf s ASN 178 CO 0.43 -0.80 1.94 -0.65 -2.79 0.00 0.00 177.10 175.24 1tuf h PRO 179 N 8.02 0.00 0.15 0.43 0.11 -1.92 -2.67 132.00 136.13 1tuf h PRO 179 Ca -0.21 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.89 1tuf h PRO 179 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1tuf h PRO 179 CO 1.00 0.00 -0.07 0.87 -0.21 0.00 0.00 178.00 179.58 1tuf h LYS 180 N 0.00 -0.20 0.00 1.05 1.79 -1.95 -3.08 116.57 114.19 1tuf h LYS 180 Ca 0.29 0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.81 1tuf h LYS 180 Cb 1.25 0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 31.90 1tuf h LYS 180 CO -0.00 -0.11 -0.26 1.79 -1.08 0.00 0.00 179.45 179.78 1tuf h THR 181 N -1.05 0.41 -2.92 -0.16 1.35 -1.96 -3.33 112.91 105.25 1tuf h THR 181 Ca -0.02 0.00 -0.61 0.00 -0.55 0.00 0.00 66.41 65.23 1tuf h THR 181 Cb 0.18 0.41 -0.41 0.00 -1.73 0.00 0.00 68.15 66.60 1tuf h THR 181 CO 0.03 0.00 -0.66 -1.00 -0.25 0.00 0.00 175.52 173.64 1tuf s HIS 182 N -6.06 3.03 0.19 4.73 3.76 -1.02 -4.98 115.29 114.94 1tuf s HIS 182 Ca -0.15 -3.12 -0.14 0.00 -0.15 0.00 0.00 55.06 51.49 1tuf s HIS 182 Cb 0.09 -2.31 0.18 0.00 1.11 0.00 0.00 32.58 31.65 1tuf s HIS 182 CO 0.66 -0.60 1.66 -1.35 -0.85 0.00 0.00 174.74 174.26 1tuf h PRO 183 N 5.43 0.05 0.26 8.40 0.11 -1.65 -2.51 132.00 142.09 1tuf h PRO 183 Ca 0.18 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 1tuf h PRO 183 Cb 0.79 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1tuf h PRO 183 CO 0.64 0.03 -0.13 0.87 -0.21 0.00 0.00 178.00 179.21 1tuf h LYS 184 N 0.05 -0.34 -0.86 1.05 1.57 -1.94 -2.32 116.57 113.79 1tuf h LYS 184 Ca 0.25 0.02 0.18 0.00 -1.87 0.00 0.00 60.65 59.23 1tuf h LYS 184 Cb 0.39 0.08 -0.11 0.00 0.08 0.00 0.00 32.23 32.66 1tuf h LYS 184 CO -0.47 -0.04 0.41 0.82 -0.57 0.00 0.00 179.45 179.59 1tuf h ILE 185 N -0.63 0.60 -0.07 1.86 1.08 -1.87 0.28 117.51 118.77 1tuf h ILE 185 Ca -0.04 -0.17 -0.01 0.00 -0.39 0.00 0.00 64.86 64.25 1tuf h ILE 185 Cb 0.45 0.05 -0.00 0.00 -3.07 0.00 0.00 36.82 34.25 1tuf h ILE 185 CO 0.06 0.09 0.01 0.28 -0.69 0.00 0.00 178.15 177.90 1tuf h SER 186 N 0.51 0.11 -0.09 1.72 0.02 -1.41 -2.27 113.55 112.14 1tuf h SER 186 Ca 0.50 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1tuf h SER 186 Cb 0.84 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.35 1tuf h SER 186 CO -0.44 0.34 0.06 0.74 -1.14 0.00 0.00 176.83 176.38 1tuf h THR 187 N -0.12 1.04 -0.40 -2.27 2.02 -0.68 -2.11 112.91 110.38 1tuf h THR 187 Ca 0.02 -0.08 0.08 0.00 0.77 0.00 0.00 66.41 67.20 1tuf h THR 187 Cb 0.27 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 1tuf h THR 187 CO 0.00 0.03 0.27 1.23 0.37 0.00 0.00 175.52 177.43 1tuf h GLY 188 N 0.11 0.25 1.47 2.16 0.00 -0.45 0.13 103.07 106.73 1tuf h GLY 188 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1tuf h GLY 188 CO -0.01 0.05 -0.42 1.41 0.00 0.00 0.00 176.54 177.58 1tuf h LEU 189 N 0.19 0.00 0.00 3.11 3.38 -0.98 -3.27 115.31 117.75 1tuf h LEU 189 Ca 0.18 -0.11 -0.18 0.00 0.09 0.00 0.00 57.88 57.86 1tuf h LEU 189 Cb 0.47 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1tuf h LEU 189 CO -0.03 0.06 -1.88 0.29 0.09 0.00 0.00 178.44 176.97 1tuf n LYS 190 N -2.30 1.39 0.04 1.13 5.02 -0.52 -4.59 118.16 118.32 1tuf n LYS 190 Ca 0.04 -0.04 0.11 0.00 -2.02 0.00 0.00 58.31 56.40 1tuf n LYS 190 Cb 0.46 -1.36 0.02 0.00 -0.02 0.00 0.00 35.03 34.13 1tuf n LYS 190 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1tuf n LYS 191 N -2.38 0.34 -2.04 1.97 2.85 0.33 -4.97 118.16 114.26 1tuf n LYS 191 Ca -0.17 0.01 -0.29 0.00 -1.05 0.00 0.00 58.31 56.81 1tuf n LYS 191 Cb 0.80 -1.62 0.17 0.00 -0.65 0.00 0.00 35.03 33.73 1tuf n LYS 191 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 1tuf s ASN 192 N -4.15 3.35 0.06 -5.58 0.02 -1.23 -5.02 114.94 102.41 1tuf s ASN 192 Ca 0.03 0.17 0.24 0.00 -1.02 0.00 0.00 52.86 52.28 1tuf s ASN 192 Cb 0.14 -0.28 0.39 0.00 0.02 0.00 0.00 41.25 41.53 1tuf s ASN 192 CO 0.80 -2.57 1.34 2.29 0.02 0.00 0.00 177.10 178.98 1tuf n LYS 193 N -3.60 0.18 -1.96 -0.60 2.85 -1.26 -4.97 118.16 108.80 1tuf n LYS 193 Ca 0.15 0.04 -0.29 0.00 -1.05 0.00 0.00 58.31 57.17 1tuf n LYS 193 Cb 0.60 -1.60 0.10 0.00 -0.65 0.00 0.00 35.03 33.47 1tuf n LYS 193 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1tuf s PHE 194 N -3.10 2.77 0.40 5.58 0.08 -1.26 -4.99 117.98 117.45 1tuf s PHE 194 Ca 0.08 0.64 0.00 0.00 0.12 0.00 0.00 56.93 57.77 1tuf s PHE 194 Cb 0.15 -3.52 0.00 0.00 -0.57 0.00 0.00 43.02 39.08 1tuf s PHE 194 CO 0.72 -1.83 0.00 0.41 -0.10 0.00 0.00 175.22 174.42 1tuf n GLY 195 N -3.31 -2.12 3.49 4.36 0.00 -1.26 -4.87 105.19 101.49 1tuf n GLY 195 Ca 0.09 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 45.01 1tuf n GLY 195 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tuf s LEU 196 N -6.31 3.89 0.12 0.99 1.43 0.75 -4.83 118.68 114.73 1tuf s LEU 196 Ca 0.00 -0.26 -0.31 0.00 -1.03 0.00 0.00 54.13 52.53 1tuf s LEU 196 Cb 0.00 -2.02 -0.11 0.00 0.03 0.00 0.00 46.19 44.09 1tuf s LEU 196 CO 0.00 -0.10 1.83 -0.67 0.23 0.00 0.00 176.35 177.64 1tuf n ASP 197 N 5.00 4.03 0.07 2.29 -0.08 -1.26 -1.75 116.55 124.84 1tuf n ASP 197 Ca -0.15 0.99 -0.09 0.00 -1.51 0.00 0.00 54.79 54.04 1tuf n ASP 197 Cb 0.51 -1.54 -0.06 0.00 2.34 0.00 0.00 41.12 42.37 1tuf n ASP 197 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1tuf h VAL 198 N 4.63 0.51 -0.89 5.18 2.07 -1.88 -2.18 116.25 123.70 1tuf h VAL 198 Ca -0.46 -1.02 0.19 0.00 0.82 0.00 0.00 66.70 66.24 1tuf h VAL 198 Cb 1.22 0.88 -0.11 0.00 -1.52 0.00 0.00 31.29 31.76 1tuf h VAL 198 CO 0.95 0.14 0.42 -0.08 0.02 0.00 0.00 177.57 179.02 1tuf h GLU 199 N -0.98 0.48 0.00 1.57 4.81 -1.92 0.18 114.58 118.72 1tuf h GLU 199 Ca -0.03 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1tuf h GLU 199 Cb 0.44 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1tuf h GLU 199 CO 0.05 0.32 0.00 -1.13 -0.73 0.00 0.00 179.01 177.51 1tuf n SER 200 N -4.97 0.05 0.00 1.04 3.41 -1.26 -4.87 113.62 107.02 1tuf n SER 200 Ca 0.20 0.51 0.00 0.00 -0.26 0.00 0.00 58.87 59.33 1tuf n SER 200 Cb 0.58 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 1tuf n SER 200 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tuf n GLY 201 N 0.19 0.44 0.13 5.00 0.00 0.62 -4.95 105.19 106.62 1tuf n GLY 201 Ca 0.04 -0.96 -0.21 0.00 0.00 0.00 0.00 46.02 44.89 1tuf n GLY 201 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1tuf h ILE 202 N 0.00 1.02 -0.78 -0.61 2.04 -1.62 -2.55 117.51 115.01 1tuf h ILE 202 Ca 0.00 -2.62 -0.02 0.00 1.00 0.00 0.00 64.86 63.23 1tuf h ILE 202 Cb 0.29 2.76 -0.04 0.00 -0.74 0.00 0.00 36.82 39.10 1tuf h ILE 202 CO 0.00 0.84 0.41 0.00 0.00 0.00 0.00 178.15 179.40 1tuf h ALA 203 N 0.26 1.00 -0.28 1.87 0.00 -1.61 0.12 119.26 120.61 1tuf h ALA 203 Ca -0.31 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 1tuf h ALA 203 Cb 2.07 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.55 1tuf h ALA 203 CO 0.17 0.52 -0.09 1.98 0.00 0.00 0.00 179.25 181.84 1tuf h MET 204 N 1.08 0.56 -0.83 0.00 1.85 -1.85 -1.75 114.93 113.98 1tuf h MET 204 Ca 0.27 -0.22 0.07 0.00 -0.61 0.00 0.00 59.70 59.21 1tuf h MET 204 Cb 0.05 -0.03 -0.06 0.00 0.43 0.00 0.00 31.60 31.99 1tuf h MET 204 CO -0.04 0.77 0.50 -0.22 -0.40 0.00 0.00 176.91 177.52 1tuf h LYS 205 N 0.31 0.88 0.68 0.39 3.64 -0.98 -0.19 116.57 121.29 1tuf h LYS 205 Ca 0.07 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 1tuf h LYS 205 Cb 0.58 -0.20 0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1tuf h LYS 205 CO 0.03 0.58 -0.33 0.00 -2.27 0.00 0.00 179.45 177.47 1tuf h ALA 206 N 1.41 -0.93 -0.67 5.00 0.00 -0.61 -1.04 119.26 122.43 1tuf h ALA 206 Ca 0.37 -0.20 0.12 0.00 0.00 0.00 0.00 54.91 55.20 1tuf h ALA 206 Cb 0.22 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 18.28 1tuf h ALA 206 CO -0.19 -0.86 0.23 0.82 0.00 0.00 0.00 179.25 179.25 1tuf h ILE 207 N -1.22 0.69 -0.35 0.00 2.04 -1.23 0.24 117.51 117.68 1tuf h ILE 207 Ca -0.09 -0.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 1tuf h ILE 207 Cb 0.70 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1tuf h ILE 207 CO 0.15 0.07 0.02 0.11 0.00 0.00 0.00 178.15 178.50 1tuf h LYS 208 N 0.39 0.54 -0.29 2.37 1.57 -1.05 -1.30 116.57 118.78 1tuf h LYS 208 Ca 0.35 -0.11 -0.10 0.00 -1.87 0.00 0.00 60.65 58.93 1tuf h LYS 208 Cb 0.50 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1tuf h LYS 208 CO -0.37 0.55 -0.23 1.98 -0.57 0.00 0.00 179.45 180.81 1tuf h MET 209 N 0.52 0.56 -0.32 3.15 4.05 0.73 -2.99 114.93 120.61 1tuf h MET 209 Ca 0.11 -0.21 -0.14 0.00 -0.28 0.00 0.00 59.70 59.18 1tuf h MET 209 Cb 0.31 -0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.07 1tuf h MET 209 CO 0.01 0.74 -0.35 0.00 0.23 0.00 0.00 176.91 177.54 1tuf h ALA 210 N 1.26 0.48 -0.16 0.39 0.00 -0.03 -3.02 119.26 118.17 1tuf h ALA 210 Ca 0.07 -0.43 0.05 0.00 0.00 0.00 0.00 54.91 54.60 1tuf h ALA 210 Cb 0.66 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1tuf h ALA 210 CO 0.05 0.55 0.20 -0.07 0.00 0.00 0.00 179.25 179.97 1tuf h LEU 211 N 0.59 0.00 -1.09 0.00 3.38 -1.12 0.14 115.31 117.21 1tuf h LEU 211 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1tuf h LEU 211 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1tuf h LEU 211 CO 0.09 0.00 -0.07 -0.62 0.09 0.00 0.00 178.44 177.93 1tuf n GLU 212 N -3.74 1.64 -3.40 1.13 -0.58 -1.14 -4.89 120.64 109.66 1tuf n GLU 212 Ca 0.01 -1.09 -0.36 0.00 -0.42 0.00 0.00 57.16 55.30 1tuf n GLU 212 Cb 0.31 -1.48 -0.06 0.00 -0.57 0.00 0.00 31.44 29.65 1tuf n GLU 212 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 1tuf s MET 213 N -2.11 3.97 0.00 3.49 -1.94 0.03 -5.00 119.30 117.74 1tuf s MET 213 Ca 0.33 0.46 0.28 0.00 -1.71 0.00 0.00 55.69 55.04 1tuf s MET 213 Cb 0.20 -3.01 0.99 0.00 2.01 0.00 0.00 34.83 35.02 1tuf s MET 213 CO 0.37 0.53 1.72 0.39 -0.01 0.00 0.00 175.02 178.03 1tuf n GLU 214 N 1.04 0.46 -0.06 2.03 1.02 -1.26 -4.17 120.64 119.70 1tuf n GLU 214 Ca -0.07 -0.19 0.05 0.00 -0.02 0.00 0.00 57.16 56.93 1tuf n GLU 214 Cb 0.52 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.52 1tuf n GLU 214 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1tuf n TYR 215 N -1.10 0.00 -4.33 -0.32 4.02 -1.26 -4.99 117.16 109.17 1tuf n TYR 215 Ca 0.11 -0.73 -0.22 0.00 -0.01 0.00 0.00 57.90 57.05 1tuf n TYR 215 Cb 0.31 -0.10 -0.13 0.00 -0.02 0.00 0.00 39.34 39.40 1tuf n TYR 215 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1tuf s VAL 216 N -1.93 1.46 -0.27 -0.72 -7.23 -1.26 -1.07 120.40 109.38 1tuf s VAL 216 Ca 0.17 -1.33 0.01 0.00 -1.81 0.00 0.00 61.98 59.01 1tuf s VAL 216 Cb 0.15 -1.33 0.08 0.00 0.56 0.00 0.00 36.38 35.84 1tuf s VAL 216 CO 0.02 -0.04 0.01 0.21 -0.31 0.00 0.00 175.10 174.99 1tuf s ASN 217 N -1.61 4.02 0.14 4.85 3.04 0.58 -4.89 114.94 121.07 1tuf s ASN 217 Ca 0.04 -1.47 -0.31 0.00 0.04 0.00 0.00 52.86 51.16 1tuf s ASN 217 Cb -0.09 -1.15 -0.09 0.00 -1.54 0.00 0.00 41.25 38.38 1tuf s ASN 217 CO 0.03 -0.32 1.58 0.68 -3.04 0.00 0.00 177.10 176.04 1tuf s VAL 218 N 1.39 2.77 0.00 -5.21 -7.23 -1.26 -1.27 120.40 109.59 1tuf s VAL 218 Ca 0.02 0.48 0.00 0.00 -1.81 0.00 0.00 61.98 60.67 1tuf s VAL 218 Cb -0.18 -3.31 0.00 0.00 0.56 0.00 0.00 36.38 33.45 1tuf s VAL 218 CO -0.12 0.03 0.09 1.33 -0.31 0.00 0.00 175.10 176.12 1tuf n VAL 219 N 4.18 0.00 -3.45 1.32 0.24 -0.83 -4.86 118.33 114.93 1tuf n VAL 219 Ca 0.14 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 62.15 1tuf n VAL 219 Cb 0.39 1.13 0.00 0.00 -1.47 0.00 0.00 33.84 33.89 1tuf n VAL 219 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tuf n GLY 220 N 0.40 -1.36 3.20 7.63 0.00 -1.26 0.42 105.19 114.22 1tuf n GLY 220 Ca 0.00 -1.06 -0.18 0.00 0.00 0.00 0.00 46.02 44.78 1tuf n GLY 220 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1tuf s VAL 221 N -2.96 1.18 0.09 1.61 -7.23 -0.78 -1.96 120.40 110.36 1tuf s VAL 221 Ca 0.00 -1.47 0.04 0.00 -1.81 0.00 0.00 61.98 58.74 1tuf s VAL 221 Cb 0.00 -1.26 -0.03 0.00 0.56 0.00 0.00 36.38 35.65 1tuf s VAL 221 CO 0.00 -0.31 -0.10 -2.28 -0.31 0.00 0.00 175.10 172.10 1tuf s HIS 222 N -1.65 1.07 -0.27 2.82 5.04 0.51 -1.05 115.29 121.76 1tuf s HIS 222 Ca 0.02 -0.63 -0.21 0.00 -1.54 0.00 0.00 55.06 52.71 1tuf s HIS 222 Cb -0.08 -0.59 0.07 0.00 0.04 0.00 0.00 32.58 32.03 1tuf s HIS 222 CO 0.02 0.01 0.69 0.00 -2.34 0.00 0.00 174.74 173.12 1tuf s HIS 224 N 0.87 1.02 -0.78 0.00 5.04 -1.26 -1.53 115.29 118.65 1tuf s HIS 224 Ca -0.04 -0.56 0.23 0.00 -1.54 0.00 0.00 55.06 53.15 1tuf s HIS 224 Cb -0.05 -0.99 0.14 0.00 0.04 0.00 0.00 32.58 31.72 1tuf s HIS 224 CO -0.07 -0.47 1.13 0.44 -2.34 0.00 0.00 174.74 173.42 1tuf n ILE 225 N 5.06 0.10 -3.99 0.89 -5.35 -1.26 -5.02 119.36 109.78 1tuf n ILE 225 Ca -0.09 -0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.25 1tuf n ILE 225 Cb 0.49 0.33 0.00 0.00 -1.74 0.00 0.00 39.64 38.72 1tuf n ILE 225 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1tuf n GLY 226 N 1.42 -1.05 3.14 3.28 0.00 -1.26 -4.86 105.19 105.86 1tuf n GLY 226 Ca 0.03 -1.19 -0.10 0.00 0.00 0.00 0.00 46.02 44.76 1tuf n GLY 226 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tuf s SER 227 N -4.00 0.11 -1.46 1.61 0.15 -1.26 -3.82 113.70 105.03 1tuf s SER 227 Ca 0.00 -0.43 -0.09 0.00 0.70 0.00 0.00 55.95 56.13 1tuf s SER 227 Cb 0.00 0.25 0.04 0.00 -1.71 0.00 0.00 66.02 64.60 1tuf s SER 227 CO 0.00 -0.51 0.82 1.67 1.20 0.00 0.00 173.24 176.42 1tuf n GLN 228 N 0.82 -5.48 -2.94 5.44 -0.06 -1.20 -4.94 117.38 109.02 1tuf n GLN 228 Ca -0.19 0.72 -0.41 0.00 -2.00 0.00 0.00 57.00 55.11 1tuf n GLN 228 Cb 0.58 -5.61 -0.05 0.00 -4.06 0.00 0.00 30.24 21.11 1tuf n GLN 228 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1tuf s LEU 229 N -6.96 4.08 -0.57 1.69 1.43 -0.77 -4.50 118.68 113.09 1tuf s LEU 229 Ca 0.49 0.97 0.01 0.00 -1.03 0.00 0.00 54.13 54.58 1tuf s LEU 229 Cb -0.23 -3.12 0.43 0.00 0.03 0.00 0.00 46.19 43.30 1tuf s LEU 229 CO 0.61 -0.47 1.71 0.35 0.23 0.00 0.00 176.35 178.77 1tuf n THR 230 N 5.20 3.20 -3.68 5.49 -2.24 -1.26 -0.19 114.28 120.80 1tuf n THR 230 Ca 0.04 -3.69 -0.10 0.00 -2.27 0.00 0.00 64.05 58.03 1tuf n THR 230 Cb 0.48 -1.18 -0.10 0.00 -2.10 0.00 0.00 70.33 67.43 1tuf n THR 230 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1tuf s ASP 231 N -2.38 -0.62 0.43 3.42 2.15 -1.26 -4.49 116.67 113.92 1tuf s ASP 231 Ca 0.57 1.05 0.29 0.00 0.43 0.00 0.00 52.55 54.89 1tuf s ASP 231 Cb 0.46 0.93 1.09 0.00 -0.30 0.00 0.00 42.92 45.10 1tuf s ASP 231 CO -0.08 -0.21 1.85 0.16 -0.17 0.00 0.00 175.17 176.73 1tuf h ILE 232 N 5.43 0.00 -0.24 4.11 3.07 -1.96 -3.32 117.51 124.60 1tuf h ILE 232 Ca -0.35 -0.50 0.06 0.00 1.55 0.00 0.00 64.86 65.62 1tuf h ILE 232 Cb 1.19 1.43 -0.07 0.00 -0.27 0.00 0.00 36.82 39.09 1tuf h ILE 232 CO 0.26 0.00 -0.33 -1.28 -1.05 0.00 0.00 178.15 175.75 1tuf h SER 233 N 0.00 -1.05 -0.77 2.16 0.87 -1.99 0.16 113.55 112.93 1tuf h SER 233 Ca 0.00 0.17 0.05 0.00 -1.23 0.00 0.00 61.79 60.78 1tuf h SER 233 Cb 0.56 0.46 -0.06 0.00 -0.44 0.00 0.00 62.40 62.92 1tuf h SER 233 CO 0.00 -0.34 0.47 -0.65 -0.53 0.00 0.00 176.83 175.77 1tuf h PRO 234 N -0.34 0.85 -0.72 2.24 0.11 -2.00 -1.07 132.00 131.07 1tuf h PRO 234 Ca 0.13 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.16 1tuf h PRO 234 Cb 0.54 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.43 1tuf h PRO 234 CO -0.43 0.56 0.35 0.74 -0.21 0.00 0.00 178.00 179.01 1tuf h PHE 235 N 0.87 1.03 -0.00 0.65 0.04 -1.51 0.24 116.94 118.26 1tuf h PHE 235 Ca 0.33 -0.05 -0.00 0.00 2.80 0.00 0.00 57.97 61.05 1tuf h PHE 235 Cb 0.14 -0.32 -0.00 0.00 2.20 0.00 0.00 35.95 37.96 1tuf h PHE 235 CO -0.05 0.76 0.00 0.82 -0.60 0.00 0.00 178.31 179.25 1tuf h ILE 236 N 1.01 1.04 -0.74 -0.55 2.04 -0.15 -1.05 117.51 119.11 1tuf h ILE 236 Ca 0.25 -0.12 0.03 0.00 1.00 0.00 0.00 64.86 66.02 1tuf h ILE 236 Cb 0.11 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 37.27 1tuf h ILE 236 CO -0.03 0.03 0.47 -0.08 0.00 0.00 0.00 178.15 178.54 1tuf h GLU 237 N -0.05 0.89 0.37 2.37 4.57 -0.80 -1.03 114.58 120.91 1tuf h GLU 237 Ca 0.00 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1tuf h GLU 237 Cb 0.05 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.44 1tuf h GLU 237 CO -0.00 0.59 -0.19 1.49 -1.18 0.00 0.00 179.01 179.72 1tuf h GLU 238 N 0.92 -0.50 -0.48 1.92 4.81 -0.30 -1.18 114.58 119.76 1tuf h GLU 238 Ca 0.30 0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.65 1tuf h GLU 238 Cb 0.01 0.11 -0.07 0.00 0.63 0.00 0.00 28.75 29.43 1tuf h GLU 238 CO -0.11 -0.33 0.05 1.15 -0.73 0.00 0.00 179.01 179.04 1tuf h THR 239 N -0.52 0.68 0.21 0.32 2.02 -0.89 0.14 112.91 114.87 1tuf h THR 239 Ca -0.05 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 1tuf h THR 239 Cb 0.41 0.49 -0.00 0.00 -1.74 0.00 0.00 68.15 67.31 1tuf h THR 239 CO 0.07 0.03 -0.13 -0.09 0.37 0.00 0.00 175.52 175.77 1tuf h ARG 240 N 0.17 -0.31 -0.40 6.66 1.12 -0.98 0.96 114.38 121.61 1tuf h ARG 240 Ca 0.24 0.02 -0.04 0.00 -1.11 0.00 0.00 59.98 59.09 1tuf h ARG 240 Cb 0.34 0.07 -0.02 0.00 -0.01 0.00 0.00 29.97 30.35 1tuf h ARG 240 CO -0.36 -0.21 0.08 0.87 -3.11 0.00 0.00 179.97 177.24 1tuf h LYS 241 N -0.32 0.59 -0.12 0.20 6.56 -0.83 0.19 116.57 122.83 1tuf h LYS 241 Ca -0.02 -0.11 -0.04 0.00 -1.06 0.00 0.00 60.65 59.42 1tuf h LYS 241 Cb 0.27 -0.10 -0.00 0.00 -0.57 0.00 0.00 32.23 31.83 1tuf h LYS 241 CO 0.02 0.56 -0.08 0.28 -2.06 0.00 0.00 179.45 178.18 1tuf h VAL 242 N 0.58 1.33 -0.52 0.50 2.07 -0.45 -2.76 116.25 117.00 1tuf h VAL 242 Ca 0.13 -1.15 -0.03 0.00 0.82 0.00 0.00 66.70 66.47 1tuf h VAL 242 Cb 0.25 1.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.83 1tuf h VAL 242 CO -0.00 0.33 0.19 0.24 0.02 0.00 0.00 177.57 178.35 1tuf h MET 243 N -0.10 0.75 -0.64 1.57 2.86 -0.46 -1.42 114.93 117.50 1tuf h MET 243 Ca 0.03 -0.12 0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1tuf h MET 243 Cb 0.56 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 1tuf h MET 243 CO 0.02 0.63 0.42 -0.44 1.06 0.00 0.00 176.91 178.61 1tuf h ASP 244 N 0.74 0.68 0.39 1.22 3.32 -0.54 -1.02 116.42 121.22 1tuf h ASP 244 Ca 0.18 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.09 1tuf h ASP 244 Cb 0.17 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1tuf h ASP 244 CO -0.01 0.48 -0.55 0.15 -1.72 0.00 0.00 179.24 177.59 1tuf h PHE 245 N 0.80 0.21 -0.63 4.55 3.57 -0.98 -2.47 116.94 122.00 1tuf h PHE 245 Ca 0.25 -0.07 -0.08 0.00 3.53 0.00 0.00 57.97 61.60 1tuf h PHE 245 Cb 0.02 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 1tuf h PHE 245 CO -0.00 0.68 0.08 0.28 -2.23 0.00 0.00 178.31 177.12 1tuf h VAL 246 N 0.13 1.26 -0.33 1.41 2.07 -0.69 0.06 116.25 120.16 1tuf h VAL 246 Ca -0.00 -1.04 -0.15 0.00 0.82 0.00 0.00 66.70 66.33 1tuf h VAL 246 Cb 1.01 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1tuf h VAL 246 CO 0.08 0.38 -0.39 -0.37 0.02 0.00 0.00 177.57 177.30 1tuf h VAL 247 N 0.97 1.28 -0.19 2.57 -1.51 -1.31 -0.69 116.25 117.37 1tuf h VAL 247 Ca 0.19 -1.56 -0.01 0.00 -1.23 0.00 0.00 66.70 64.09 1tuf h VAL 247 Cb 0.45 1.44 -0.01 0.00 -2.13 0.00 0.00 31.29 31.04 1tuf h VAL 247 CO 0.02 0.51 0.06 -0.08 -1.23 0.00 0.00 177.57 176.85 1tuf h GLU 248 N 0.65 0.27 -0.10 5.19 4.81 -0.96 0.48 114.58 124.92 1tuf h GLU 248 Ca 0.06 -0.03 -0.17 0.00 -0.13 0.00 0.00 59.36 59.09 1tuf h GLU 248 Cb 0.94 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 30.28 1tuf h GLU 248 CO 0.09 0.24 -0.59 -0.07 -0.73 0.00 0.00 179.01 177.94 1tuf h LEU 249 N 0.27 0.69 -0.61 1.64 3.38 -0.43 -3.16 115.31 117.08 1tuf h LEU 249 Ca 0.07 -0.66 0.04 0.00 0.09 0.00 0.00 57.88 57.43 1tuf h LEU 249 Cb 0.08 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 1tuf h LEU 249 CO -0.01 1.24 0.35 0.50 0.09 0.00 0.00 178.44 180.61 1tuf h LYS 250 N 0.19 0.65 0.00 1.13 3.11 -0.18 0.11 116.57 121.57 1tuf h LYS 250 Ca -0.05 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.76 1tuf h LYS 250 Cb 1.24 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 32.32 1tuf h LYS 250 CO 0.12 0.43 0.03 0.93 -2.81 0.00 0.00 179.45 178.14 1tuf h GLU 251 N 0.66 0.00 -0.02 1.90 5.08 -0.94 0.57 114.58 121.83 1tuf h GLU 251 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 1tuf h GLU 251 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1tuf h GLU 251 CO -0.15 0.00 -0.19 0.39 -1.00 0.00 0.00 179.01 178.06 1tuf n GLU 252 N -2.60 1.81 -1.69 2.33 -0.58 0.21 -4.95 120.64 115.17 1tuf n GLU 252 Ca -0.02 -1.49 0.00 0.00 -0.42 0.00 0.00 57.16 55.23 1tuf n GLU 252 Cb 0.07 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 29.50 1tuf n GLU 252 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1tuf n GLY 253 N 1.33 0.94 2.95 0.62 0.00 0.20 -5.07 105.19 106.16 1tuf n GLY 253 Ca 0.11 -0.51 -0.29 0.00 0.00 0.00 0.00 46.02 45.33 1tuf n GLY 253 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tuf s ILE 254 N -2.55 1.31 0.07 -0.61 1.01 -0.20 -4.98 121.20 115.25 1tuf s ILE 254 Ca 0.00 -0.63 -0.11 0.00 0.00 0.00 0.00 60.65 59.90 1tuf s ILE 254 Cb 0.00 -1.37 -0.06 0.00 0.01 0.00 0.00 42.46 41.04 1tuf s ILE 254 CO 0.00 0.27 0.42 -1.61 0.00 0.00 0.00 174.94 174.02 1tuf s GLU 255 N 1.57 3.82 -0.22 2.79 2.02 -1.26 -2.63 118.70 124.79 1tuf s GLU 255 Ca 0.02 0.27 -0.04 0.00 0.02 0.00 0.00 54.97 55.24 1tuf s GLU 255 Cb -0.14 -3.03 -0.01 0.00 0.10 0.00 0.00 34.13 31.04 1tuf s GLU 255 CO -0.09 0.58 -0.05 0.42 0.02 0.00 0.00 175.26 176.15 1tuf s ILE 256 N -1.34 3.38 0.01 -1.63 -1.09 -1.26 -4.88 121.20 114.39 1tuf s ILE 256 Ca 0.32 -0.49 -0.17 0.00 -2.23 0.00 0.00 60.65 58.07 1tuf s ILE 256 Cb -0.15 -2.53 -0.35 0.00 -1.58 0.00 0.00 42.46 37.86 1tuf s ILE 256 CO 0.17 0.43 0.98 -0.08 -1.23 0.00 0.00 174.94 175.21 1tuf h GLU 257 N 8.02 0.50 -6.19 2.79 4.81 -1.81 -3.42 114.58 119.28 1tuf h GLU 257 Ca -0.41 -0.84 -0.57 0.00 -0.13 0.00 0.00 59.36 57.42 1tuf h GLU 257 Cb 1.16 0.31 -0.22 0.00 0.63 0.00 0.00 28.75 30.63 1tuf h GLU 257 CO 0.60 1.40 -0.83 -0.51 -0.73 0.00 0.00 179.01 178.94 1tuf s ASP 258 N -7.45 2.57 -0.27 1.04 1.01 0.17 -0.91 116.67 112.83 1tuf s ASP 258 Ca -0.10 -0.67 -0.00 0.00 0.71 0.00 0.00 52.55 52.49 1tuf s ASP 258 Cb 0.03 -0.15 0.08 0.00 1.01 0.00 0.00 42.92 43.89 1tuf s ASP 258 CO 0.92 0.08 0.04 -0.69 0.21 0.00 0.00 175.17 175.73 1tuf s VAL 259 N -1.11 1.11 -0.31 -1.27 1.01 0.10 -1.86 120.40 118.06 1tuf s VAL 259 Ca 0.07 -1.28 -0.13 0.00 0.00 0.00 0.00 61.98 60.63 1tuf s VAL 259 Cb -0.10 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 1tuf s VAL 259 CO 0.04 -0.43 0.28 0.21 0.00 0.00 0.00 175.10 175.20 1tuf s ASN 260 N 1.54 6.11 -0.07 3.32 3.84 -0.22 -1.23 114.94 128.24 1tuf s ASN 260 Ca 0.04 -0.15 0.20 0.00 0.21 0.00 0.00 52.86 53.16 1tuf s ASN 260 Cb -0.18 -2.16 0.70 0.00 -0.55 0.00 0.00 41.25 39.07 1tuf s ASN 260 CO -0.15 -0.21 1.61 0.18 -2.79 0.00 0.00 177.10 175.73 1tuf n LEU 261 N 5.21 4.49 0.00 3.21 4.77 0.14 -0.81 117.00 134.01 1tuf n LEU 261 Ca -0.11 -2.26 0.00 0.00 -0.03 0.00 0.00 56.01 53.60 1tuf n LEU 261 Cb 0.50 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 1tuf n LEU 261 CO 0.37 0.89 0.00 0.61 -1.33 0.00 0.00 177.39 177.93 1tuf n GLY 262 N 1.38 0.48 0.00 -0.72 0.00 -0.58 -4.48 105.19 101.27 1tuf n GLY 262 Ca 0.26 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1tuf n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tuf n GLY 263 N 0.00 5.27 0.00 -0.02 0.00 -1.21 -0.10 105.19 109.13 1tuf n GLY 263 Ca 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1tuf n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tuf n GLY 264 N 2.83 1.65 3.66 -0.02 0.00 -1.25 -4.56 105.19 107.50 1tuf n GLY 264 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1tuf n GLY 264 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1tuf s LEU 265 N 0.00 4.15 0.95 0.99 2.96 -1.26 -1.84 118.68 124.63 1tuf s LEU 265 Ca 0.00 1.10 -0.12 0.00 -0.22 0.00 0.00 54.13 54.89 1tuf s LEU 265 Cb 0.00 -3.18 0.08 0.00 0.50 0.00 0.00 46.19 43.59 1tuf s LEU 265 CO 0.00 -0.41 0.65 0.61 -1.32 0.00 0.00 176.35 175.88 1tuf n GLY 266 N 3.56 -1.49 3.39 7.98 0.00 0.74 -4.22 105.19 115.15 1tuf n GLY 266 Ca 0.04 -0.75 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 1tuf n GLY 266 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tuf s ILE 267 N -2.47 2.24 -0.36 -0.61 1.09 -1.26 -4.87 121.20 114.95 1tuf s ILE 267 Ca 0.60 -1.79 -0.03 0.00 -1.10 0.00 0.00 60.65 58.34 1tuf s ILE 267 Cb -0.22 -1.99 -0.06 0.00 -1.06 0.00 0.00 42.46 39.14 1tuf s ILE 267 CO 0.64 0.05 1.67 -2.65 -0.10 0.00 0.00 174.94 174.56 1tuf n PRO 268 N 0.83 1.09 -0.06 2.79 -0.02 -1.26 -4.60 135.00 133.77 1tuf n PRO 268 Ca -0.17 -0.82 -0.10 0.00 -2.02 0.00 0.00 63.50 60.39 1tuf n PRO 268 Cb 0.53 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.93 1tuf n PRO 268 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 1tuf h TYR 269 N 6.16 0.32 -3.36 6.00 0.05 -1.91 -3.38 116.97 120.85 1tuf h TYR 269 Ca 0.22 -0.01 -0.60 0.00 0.05 0.00 0.00 58.73 58.40 1tuf h TYR 269 Cb 0.27 -0.10 -0.09 0.00 1.01 0.00 0.00 36.73 37.82 1tuf h TYR 269 CO 1.72 0.27 0.32 0.71 -1.05 0.00 0.00 178.16 180.13 1tuf s TYR 270 N -5.90 3.33 -2.23 4.88 2.02 -1.26 -4.34 117.35 113.86 1tuf s TYR 270 Ca -0.13 1.04 0.20 0.00 -0.37 0.00 0.00 57.07 57.81 1tuf s TYR 270 Cb 0.08 -2.95 0.82 0.00 -0.40 0.00 0.00 41.96 39.52 1tuf s TYR 270 CO 0.70 -0.31 1.58 1.63 -1.57 0.00 0.00 175.55 177.58 1tuf n LYS 271 N 5.62 1.59 -0.03 -0.62 4.76 -1.26 -4.00 118.16 124.21 1tuf n LYS 271 Ca 0.03 -0.88 -0.07 0.00 -2.87 0.00 0.00 58.31 54.52 1tuf n LYS 271 Cb 0.48 -1.38 -0.13 0.00 -1.84 0.00 0.00 35.03 32.16 1tuf n LYS 271 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1tuf n ASP 272 N 0.10 0.64 -4.54 4.39 5.75 -1.26 -4.75 116.55 116.88 1tuf n ASP 272 Ca 0.16 0.30 -0.30 0.00 -0.01 0.00 0.00 54.79 54.93 1tuf n ASP 272 Cb 0.28 0.29 -0.11 0.00 -1.03 0.00 0.00 41.12 40.55 1tuf n ASP 272 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1tuf s LYS 273 N -2.66 2.15 -0.04 0.11 -2.85 -1.26 -5.12 119.74 110.08 1tuf s LYS 273 Ca -0.06 -0.97 -0.15 0.00 -1.00 0.00 0.00 55.97 53.79 1tuf s LYS 273 Cb 0.08 -2.29 -0.05 0.00 -2.06 0.00 0.00 37.83 33.51 1tuf s LYS 273 CO 0.83 0.53 0.40 -0.65 0.10 0.00 0.00 175.35 176.56 1tuf s GLN 274 N -1.84 4.00 0.35 1.78 -0.21 -1.26 -4.92 119.66 117.57 1tuf s GLN 274 Ca 0.18 0.37 0.07 0.00 0.02 0.00 0.00 55.36 56.01 1tuf s GLN 274 Cb -0.11 -3.27 -0.07 0.00 1.00 0.00 0.00 33.01 30.56 1tuf s GLN 274 CO 0.10 0.57 -0.03 0.96 -2.12 0.00 0.00 175.29 174.77 1tuf s ILE 275 N -0.67 1.90 0.44 1.08 -4.36 -1.26 -5.12 121.20 113.21 1tuf s ILE 275 Ca 0.23 -2.09 -0.24 0.00 -0.26 0.00 0.00 60.65 58.29 1tuf s ILE 275 Cb -0.16 -2.75 -0.09 0.00 1.25 0.00 0.00 42.46 40.71 1tuf s ILE 275 CO 0.12 -0.13 1.16 -2.65 0.24 0.00 0.00 174.94 173.68 1tuf n PRO 276 N -0.80 1.62 -3.44 0.37 -0.02 -1.26 -5.03 135.00 126.44 1tuf n PRO 276 Ca -0.05 0.58 -0.23 0.00 -2.02 0.00 0.00 63.50 61.78 1tuf n PRO 276 Cb 0.65 -2.25 0.03 0.00 -0.02 0.00 0.00 33.50 31.91 1tuf n PRO 276 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1tuf s THR 277 N -1.25 1.82 0.35 3.45 -4.23 -1.26 -4.93 115.64 109.59 1tuf s THR 277 Ca 0.64 -1.23 0.04 0.00 -1.18 0.00 0.00 61.69 59.96 1tuf s THR 277 Cb -0.51 -2.06 0.19 0.00 1.34 0.00 0.00 72.50 71.46 1tuf s THR 277 CO 0.56 0.00 1.92 1.56 -0.54 0.00 0.00 174.62 178.12 1tuf h GLN 278 N 0.40 0.58 0.44 3.99 7.50 -1.96 -2.03 115.11 124.04 1tuf h GLN 278 Ca -0.32 -0.10 -0.02 0.00 0.50 0.00 0.00 58.65 58.71 1tuf h GLN 278 Cb 1.30 -0.10 0.00 0.00 0.05 0.00 0.00 27.48 28.73 1tuf h GLN 278 CO 0.48 0.53 -0.21 -0.22 -1.50 0.00 0.00 178.83 177.91 1tuf h LYS 279 N 0.57 -0.57 -1.00 1.46 1.63 -1.90 0.12 116.57 116.87 1tuf h LYS 279 Ca 0.13 0.04 0.11 0.00 -0.85 0.00 0.00 60.65 60.08 1tuf h LYS 279 Cb 0.21 0.13 -0.08 0.00 -0.60 0.00 0.00 32.23 31.89 1tuf h LYS 279 CO -0.00 -0.37 0.63 -0.44 -3.45 0.00 0.00 179.45 175.82 1tuf h ASP 280 N -0.62 0.95 -0.13 4.20 3.32 -1.87 -0.72 116.42 121.56 1tuf h ASP 280 Ca -0.06 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 56.90 1tuf h ASP 280 Cb 0.47 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1tuf h ASP 280 CO 0.10 0.53 -0.35 0.25 -1.72 0.00 0.00 179.24 178.06 1tuf h LEU 281 N 1.04 0.66 0.06 1.55 7.12 -1.03 -2.29 115.31 122.42 1tuf h LEU 281 Ca 0.48 -0.28 -0.00 0.00 0.13 0.00 0.00 57.88 58.21 1tuf h LEU 281 Cb 0.41 -0.18 0.00 0.00 -0.53 0.00 0.00 40.66 40.36 1tuf h LEU 281 CO -0.24 0.95 -0.03 0.00 -0.13 0.00 0.00 178.44 178.99 1tuf h ALA 282 N 1.08 -0.08 -0.40 1.25 0.00 0.56 -1.68 119.26 120.00 1tuf h ALA 282 Ca 0.06 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1tuf h ALA 282 Cb 0.85 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 1tuf h ALA 282 CO 0.07 -0.42 0.18 -0.44 0.00 0.00 0.00 179.25 178.65 1tuf h ASP 283 N -0.33 0.25 -0.21 0.00 3.32 -1.17 0.27 116.42 118.55 1tuf h ASP 283 Ca -0.01 0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.10 1tuf h ASP 283 Cb 0.29 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 1tuf h ASP 283 CO 0.01 0.19 0.03 0.00 -1.72 0.00 0.00 179.24 177.75 1tuf h ALA 284 N 1.22 0.21 0.34 3.45 0.00 -1.35 -1.29 119.26 121.85 1tuf h ALA 284 Ca 0.17 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1tuf h ALA 284 Cb 0.10 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1tuf h ALA 284 CO -0.14 -0.39 -0.17 0.82 0.00 0.00 0.00 179.25 179.37 1tuf h ILE 285 N 0.12 0.42 -0.48 0.00 2.04 -0.99 -2.70 117.51 115.92 1tuf h ILE 285 Ca 0.10 -0.73 0.09 0.00 1.00 0.00 0.00 64.86 65.32 1tuf h ILE 285 Cb 0.10 0.67 -0.10 0.00 -0.74 0.00 0.00 36.82 36.75 1tuf h ILE 285 CO -0.14 0.09 -0.28 0.40 0.00 0.00 0.00 178.15 178.23 1tuf h ILE 286 N -0.98 0.26 -0.20 -0.67 2.04 -0.49 0.28 117.51 117.75 1tuf h ILE 286 Ca -0.05 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.82 1tuf h ILE 286 Cb 0.51 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1tuf h ILE 286 CO 0.08 0.00 0.10 0.78 0.00 0.00 0.00 178.15 179.10 1tuf h ASN 287 N -0.17 0.14 -0.57 1.72 2.35 -1.35 -0.13 115.58 117.58 1tuf h ASN 287 Ca 0.21 0.01 0.05 0.00 -0.55 0.00 0.00 56.30 56.02 1tuf h ASN 287 Cb 0.51 -0.02 -0.05 0.00 0.05 0.00 0.00 38.32 38.82 1tuf h ASN 287 CO -0.58 0.11 0.30 0.74 -1.65 0.00 0.00 177.43 176.35 1tuf h THR 288 N 0.21 0.96 0.26 2.81 2.02 -0.91 -2.55 112.91 115.71 1tuf h THR 288 Ca 0.08 -0.20 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 1tuf h THR 288 Cb 0.02 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.76 1tuf h THR 288 CO -0.06 0.10 -0.22 0.24 0.37 0.00 0.00 175.52 175.96 1tuf h MET 289 N 0.57 -0.48 -0.92 6.66 2.86 -0.09 -2.88 114.93 120.65 1tuf h MET 289 Ca 0.25 0.03 0.22 0.00 -2.06 0.00 0.00 59.70 58.14 1tuf h MET 289 Cb 0.15 0.11 -0.07 0.00 0.06 0.00 0.00 31.60 31.85 1tuf h MET 289 CO -0.16 -0.32 0.62 -0.07 1.06 0.00 0.00 176.91 178.03 1tuf h LEU 290 N -0.49 0.35 0.00 1.22 3.38 -0.66 -0.52 115.31 118.59 1tuf h LEU 290 Ca -0.01 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1tuf h LEU 290 Cb 0.44 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1tuf h LEU 290 CO -0.03 0.13 0.00 0.29 0.09 0.00 0.00 178.44 178.92 1tuf n LYS 291 N -4.49 0.00 -0.02 1.13 5.02 -0.99 0.73 118.16 119.54 1tuf n LYS 291 Ca 0.20 0.01 0.02 0.00 -2.02 0.00 0.00 58.31 56.52 1tuf n LYS 291 Cb 0.76 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 34.30 1tuf n LYS 291 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1tuf n TYR 292 N -0.98 0.00 0.07 2.13 4.02 -0.20 -4.72 117.16 117.48 1tuf n TYR 292 Ca 0.00 -0.58 0.21 0.00 -0.01 0.00 0.00 57.90 57.52 1tuf n TYR 292 Cb 0.00 -0.07 0.70 0.00 -0.02 0.00 0.00 39.34 39.95 1tuf n TYR 292 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1tuf h LYS 293 N 0.00 0.00 0.00 -0.72 3.64 0.18 -2.71 116.57 116.97 1tuf h LYS 293 Ca 0.00 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 1tuf h LYS 293 Cb 0.64 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 1tuf h LYS 293 CO 0.00 0.00 -0.67 0.38 -2.27 0.00 0.00 179.45 176.89 1tuf h ASP 294 N 0.00 0.00 -0.58 4.20 3.04 -1.84 -3.41 116.42 117.83 1tuf h ASP 294 Ca 0.22 -0.16 0.10 0.00 -3.24 0.00 0.00 57.03 53.96 1tuf h ASP 294 Cb 1.34 0.00 -0.08 0.00 -1.04 0.00 0.00 39.33 39.55 1tuf h ASP 294 CO -0.00 0.94 0.14 0.11 -2.04 0.00 0.00 179.24 178.39 1tuf h LYS 295 N -1.00 0.28 -4.56 4.15 1.57 -1.86 -3.44 116.57 111.71 1tuf h LYS 295 Ca -0.09 -0.02 -0.24 0.00 -1.87 0.00 0.00 60.65 58.43 1tuf h LYS 295 Cb 0.70 -0.06 -0.19 0.00 0.08 0.00 0.00 32.23 32.76 1tuf h LYS 295 CO -0.06 0.18 -0.72 0.14 -0.57 0.00 0.00 179.45 178.43 1tuf s VAL 296 N -6.11 0.56 0.24 0.50 -7.23 -1.04 -5.01 120.40 102.31 1tuf s VAL 296 Ca -0.13 -1.43 -0.31 0.00 -1.81 0.00 0.00 61.98 58.31 1tuf s VAL 296 Cb 0.17 -1.04 -0.11 0.00 0.56 0.00 0.00 36.38 35.96 1tuf s VAL 296 CO 0.74 -0.60 1.58 -0.70 -0.31 0.00 0.00 175.10 175.81 1tuf s GLU 297 N -2.52 4.17 -0.31 4.82 2.12 -1.26 -4.48 118.70 121.23 1tuf s GLU 297 Ca -0.01 2.49 -0.28 0.00 0.36 0.00 0.00 54.97 57.52 1tuf s GLU 297 Cb -0.03 -3.08 -0.02 0.00 0.26 0.00 0.00 34.13 31.26 1tuf s GLU 297 CO -0.02 -0.61 1.81 -1.64 -0.54 0.00 0.00 175.26 174.26 1tuf s MET 298 N 0.18 3.36 0.85 4.30 -1.94 -1.26 -4.95 119.30 119.83 1tuf s MET 298 Ca 0.66 1.48 -0.12 0.00 -1.71 0.00 0.00 55.69 56.01 1tuf s MET 298 Cb -0.46 -4.20 0.14 0.00 2.01 0.00 0.00 34.83 32.32 1tuf s MET 298 CO 0.41 -1.83 1.19 -1.25 -0.01 0.00 0.00 175.02 173.53 1tuf s PRO 299 N 5.63 1.38 0.47 2.03 0.04 -1.26 -4.86 135.00 138.43 1tuf s PRO 299 Ca 0.81 -0.32 -0.23 0.00 0.04 0.00 0.00 61.00 61.29 1tuf s PRO 299 Cb -0.23 -1.98 -0.07 0.00 0.04 0.00 0.00 34.50 32.25 1tuf s PRO 299 CO 0.34 -1.88 1.26 -0.80 0.04 0.00 0.00 177.00 175.96 1tuf s ASN 300 N -4.72 5.95 -0.15 6.66 0.01 -0.08 -4.83 114.94 117.77 1tuf s ASN 300 Ca 0.67 2.54 -0.03 0.00 -0.71 0.00 0.00 52.86 55.34 1tuf s ASN 300 Cb -0.07 -2.62 -0.03 0.00 0.41 0.00 0.00 41.25 38.94 1tuf s ASN 300 CO 0.50 -1.09 -0.05 -0.22 -1.51 0.00 0.00 177.10 174.73 1tuf s LEU 301 N -2.99 3.21 -0.03 0.60 2.96 -0.54 -0.72 118.68 121.17 1tuf s LEU 301 Ca 0.64 -0.14 0.03 0.00 -0.22 0.00 0.00 54.13 54.44 1tuf s LEU 301 Cb -0.35 -1.77 -0.00 0.00 0.50 0.00 0.00 46.19 44.57 1tuf s LEU 301 CO 0.43 0.18 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.88 1tuf s ILE 302 N 0.30 1.04 0.09 6.68 1.01 -0.36 -0.79 121.20 129.17 1tuf s ILE 302 Ca -0.04 -0.52 0.08 0.00 0.00 0.00 0.00 60.65 60.17 1tuf s ILE 302 Cb -0.14 -0.90 -0.03 0.00 0.01 0.00 0.00 42.46 41.40 1tuf s ILE 302 CO 0.03 0.31 -0.21 -0.76 0.00 0.00 0.00 174.94 174.31 1tuf s LEU 303 N 0.02 2.27 -0.63 2.97 1.43 -0.89 -0.68 118.68 123.17 1tuf s LEU 303 Ca -0.01 -0.65 0.05 0.00 -1.03 0.00 0.00 54.13 52.48 1tuf s LEU 303 Cb -0.09 -0.90 0.30 0.00 0.03 0.00 0.00 46.19 45.53 1tuf s LEU 303 CO 0.01 0.08 0.89 -0.62 0.23 0.00 0.00 176.35 176.94 1tuf n GLU 304 N 1.23 3.00 -2.19 1.70 1.02 0.86 -0.84 120.64 125.42 1tuf n GLU 304 Ca -0.19 -4.77 -0.40 0.00 -0.02 0.00 0.00 57.16 51.78 1tuf n GLU 304 Cb 0.53 -2.26 -0.02 0.00 -0.02 0.00 0.00 31.44 29.67 1tuf n GLU 304 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 1tuf s PRO 305 N -3.01 4.30 0.00 3.49 0.02 -1.24 -3.35 135.00 135.22 1tuf s PRO 305 Ca 0.44 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.54 1tuf s PRO 305 Cb 0.21 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.74 1tuf s PRO 305 CO -0.07 -0.18 0.00 0.41 -0.33 0.00 0.00 177.00 176.83 1tuf n GLY 306 N 0.82 0.06 0.35 0.52 0.00 -1.26 -0.77 105.19 104.91 1tuf n GLY 306 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.05 1tuf n GLY 306 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1tuf h ARG 307 N 0.00 0.94 -0.54 1.61 2.43 -1.90 -2.04 114.38 114.88 1tuf h ARG 307 Ca 0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1tuf h ARG 307 Cb 0.00 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.34 1tuf h ARG 307 CO 0.00 0.62 0.00 -1.13 -1.51 0.00 0.00 179.97 177.95 1tuf n SER 308 N -4.44 0.54 0.00 -3.80 3.41 -1.26 -1.86 113.62 106.22 1tuf n SER 308 Ca 0.09 -1.61 0.00 0.00 -0.26 0.00 0.00 58.87 57.09 1tuf n SER 308 Cb 0.08 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 1tuf n SER 308 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1tuf n LEU 309 N -0.09 1.17 -0.00 1.04 4.77 -0.78 -4.83 117.00 118.27 1tuf n LEU 309 Ca 0.00 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.99 1tuf n LEU 309 Cb 0.14 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.22 1tuf n LEU 309 CO 0.00 0.19 -0.52 1.33 -1.33 0.00 0.00 177.39 177.07 1tuf n VAL 310 N -1.84 0.00 -0.15 4.08 0.24 -1.12 -4.62 118.33 114.92 1tuf n VAL 310 Ca 0.00 -0.03 -0.10 0.00 -2.04 0.00 0.00 64.34 62.17 1tuf n VAL 310 Cb 0.28 0.39 -0.06 0.00 -1.47 0.00 0.00 33.84 32.98 1tuf n VAL 310 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1tuf h ALA 311 N 0.11 -0.49 0.00 2.33 0.00 -1.58 -1.08 119.26 118.55 1tuf h ALA 311 Ca -0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1tuf h ALA 311 Cb 0.12 0.97 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1tuf h ALA 311 CO 0.00 -0.90 0.00 0.25 0.00 0.00 0.00 179.25 178.60 1tuf n THR 312 N -5.40 0.41 1.06 0.00 -2.24 -1.26 -1.94 114.28 104.91 1tuf n THR 312 Ca -0.01 0.10 0.12 0.00 -2.27 0.00 0.00 64.05 61.99 1tuf n THR 312 Cb 0.35 -0.82 0.20 0.00 -2.10 0.00 0.00 70.33 67.97 1tuf n THR 312 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tuf n ALA 313 N -1.24 3.63 -2.67 6.98 0.00 -0.41 -4.74 120.51 122.06 1tuf n ALA 313 Ca 0.09 -0.42 -0.34 0.00 0.00 0.00 0.00 53.44 52.76 1tuf n ALA 313 Cb 0.13 -1.04 -0.11 0.00 0.00 0.00 0.00 19.45 18.42 1tuf n ALA 313 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1tuf s GLY 314 N -2.84 1.74 0.01 0.00 0.00 -1.10 -0.57 107.32 104.56 1tuf s GLY 314 Ca 0.14 -0.86 0.04 0.00 0.00 0.00 0.00 44.72 44.05 1tuf s GLY 314 CO 0.67 -0.54 -0.13 -0.19 0.00 0.00 0.00 173.10 172.91 1tuf s TYR 315 N -0.63 1.17 -0.20 1.90 1.51 -0.00 -1.28 117.35 119.82 1tuf s TYR 315 Ca 0.10 -0.26 -0.03 0.00 -1.01 0.00 0.00 57.07 55.87 1tuf s TYR 315 Cb -0.12 -0.73 -0.00 0.00 -0.11 0.00 0.00 41.96 41.00 1tuf s TYR 315 CO 0.02 -0.00 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.21 1tuf s LEU 316 N -0.59 2.74 -0.14 -1.29 2.96 -0.61 0.17 118.68 121.93 1tuf s LEU 316 Ca 0.04 -0.43 -0.07 0.00 -0.22 0.00 0.00 54.13 53.45 1tuf s LEU 316 Cb -0.06 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 1tuf s LEU 316 CO 0.00 0.01 0.13 -0.76 -1.32 0.00 0.00 176.35 174.40 1tuf s LEU 317 N 1.30 4.28 -0.07 -0.68 1.43 0.24 -1.36 118.68 123.80 1tuf s LEU 317 Ca 0.04 0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 53.49 1tuf s LEU 317 Cb -0.14 -2.05 0.04 0.00 0.03 0.00 0.00 46.19 44.07 1tuf s LEU 317 CO -0.04 0.35 0.16 -0.83 0.23 0.00 0.00 176.35 176.22 1tuf s GLY 318 N -0.66 -0.01 0.30 -3.19 0.00 -0.90 -0.80 107.32 102.05 1tuf s GLY 318 Ca 0.13 0.65 -0.28 0.00 0.00 0.00 0.00 44.72 45.22 1tuf s GLY 318 CO 0.02 1.26 1.02 1.25 0.00 0.00 0.00 173.10 176.65 1tuf s LYS 319 N 1.60 4.61 -0.20 2.90 2.20 -1.26 -1.83 119.74 127.75 1tuf s LYS 319 Ca -0.05 1.58 -0.21 0.00 -0.36 0.00 0.00 55.97 56.93 1tuf s LYS 319 Cb -0.12 -3.04 -0.02 0.00 -1.51 0.00 0.00 37.83 33.15 1tuf s LYS 319 CO -0.06 0.25 0.67 0.54 -0.36 0.00 0.00 175.35 176.39 1tuf s VAL 320 N -1.33 4.99 -0.20 4.02 0.11 -0.46 -1.18 120.40 126.34 1tuf s VAL 320 Ca 0.47 1.26 0.18 0.00 -2.93 0.00 0.00 61.98 60.96 1tuf s VAL 320 Cb -0.26 -3.98 -0.27 0.00 -1.53 0.00 0.00 36.38 30.34 1tuf s VAL 320 CO 0.33 0.08 0.48 1.41 -3.33 0.00 0.00 175.10 174.08 1tuf n HIS 321 N 5.20 0.00 -3.75 1.54 -0.00 0.23 -1.58 115.22 116.87 1tuf n HIS 321 Ca -0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.59 1tuf n HIS 321 Cb 0.49 -0.33 -0.08 0.00 -0.00 0.00 0.00 29.99 30.07 1tuf n HIS 321 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1tuf s HIS 322 N -3.16 -0.17 -0.21 4.41 3.76 -1.21 -4.91 115.29 113.79 1tuf s HIS 322 Ca -0.04 0.17 0.00 0.00 -0.15 0.00 0.00 55.06 55.04 1tuf s HIS 322 Cb 0.12 0.11 0.06 0.00 1.11 0.00 0.00 32.58 33.98 1tuf s HIS 322 CO 0.76 -0.45 -0.05 0.42 -0.85 0.00 0.00 174.74 174.58 1tuf s ILE 323 N -1.87 1.33 -0.19 0.60 1.01 -1.26 -1.03 121.20 119.79 1tuf s ILE 323 Ca -0.10 -1.01 -0.03 0.00 0.00 0.00 0.00 60.65 59.52 1tuf s ILE 323 Cb -0.03 -1.60 -0.01 0.00 0.01 0.00 0.00 42.46 40.84 1tuf s ILE 323 CO 0.01 -0.05 -0.08 -0.75 0.00 0.00 0.00 174.94 174.07 1tuf s LYS 324 N 1.50 3.35 -0.20 2.79 2.20 0.34 -4.98 119.74 124.74 1tuf s LYS 324 Ca -0.04 -0.65 -0.10 0.00 -0.36 0.00 0.00 55.97 54.82 1tuf s LYS 324 Cb -0.18 -2.88 -0.05 0.00 -1.51 0.00 0.00 37.83 33.22 1tuf s LYS 324 CO -0.07 -0.09 0.13 -2.00 -0.36 0.00 0.00 175.35 172.96 1tuf s GLU 325 N 1.17 4.17 0.30 4.03 2.12 -1.26 0.58 118.70 129.81 1tuf s GLU 325 Ca 0.02 -0.22 0.08 0.00 0.36 0.00 0.00 54.97 55.21 1tuf s GLU 325 Cb -0.14 -3.41 -0.06 0.00 0.26 0.00 0.00 34.13 30.78 1tuf s GLU 325 CO -0.02 0.31 -0.09 0.95 -0.54 0.00 0.00 175.26 175.86 1tuf s THR 326 N 0.33 1.98 -0.15 -1.70 -4.23 0.75 -4.98 115.64 107.64 1tuf s THR 326 Ca 0.08 -2.19 0.23 0.00 -1.18 0.00 0.00 61.69 58.63 1tuf s THR 326 Cb -0.11 -2.49 0.23 0.00 1.34 0.00 0.00 72.50 71.47 1tuf s THR 326 CO -0.02 -0.29 1.72 1.55 -0.54 0.00 0.00 174.62 177.04 1tuf h PRO 327 N 2.19 0.00 0.00 3.99 0.13 -2.05 -3.10 132.00 133.16 1tuf h PRO 327 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1tuf h PRO 327 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1tuf h PRO 327 CO 0.68 0.00 -0.33 1.55 -0.23 0.00 0.00 178.00 179.67 1tuf n VAL 328 N -2.32 0.00 -3.79 1.56 3.14 -1.26 -5.09 118.33 110.57 1tuf n VAL 328 Ca -0.01 -0.17 -0.12 0.00 -2.96 0.00 0.00 64.34 61.07 1tuf n VAL 328 Cb 0.05 0.68 -0.09 0.00 -1.06 0.00 0.00 33.84 33.41 1tuf n VAL 328 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1tuf s THR 329 N -0.99 0.07 -0.36 1.55 2.01 -1.17 -5.12 115.64 111.63 1tuf s THR 329 Ca 0.00 -0.60 -0.06 0.00 0.31 0.00 0.00 61.69 61.34 1tuf s THR 329 Cb 0.00 -0.66 0.06 0.00 0.01 0.00 0.00 72.50 71.91 1tuf s THR 329 CO 0.00 -0.33 0.13 -0.75 -0.69 0.00 0.00 174.62 172.98 1tuf s LYS 330 N -1.66 2.52 -0.03 4.92 2.20 -1.26 -0.18 119.74 126.24 1tuf s LYS 330 Ca -0.12 -1.32 -0.19 0.00 -0.36 0.00 0.00 55.97 53.99 1tuf s LYS 330 Cb -0.05 -3.50 -0.05 0.00 -1.51 0.00 0.00 37.83 32.72 1tuf s LYS 330 CO 0.02 -0.76 0.53 -1.58 -0.36 0.00 0.00 175.35 173.20 1tuf s TRP 331 N 1.36 3.64 -0.26 4.03 0.52 0.20 -1.13 118.94 127.30 1tuf s TRP 331 Ca -0.00 1.08 -0.03 0.00 0.02 0.00 0.00 56.10 57.17 1tuf s TRP 331 Cb -0.21 -2.54 0.02 0.00 -1.15 0.00 0.00 33.47 29.59 1tuf s TRP 331 CO 0.01 0.35 -0.02 0.08 0.02 0.00 0.00 176.95 177.39 1tuf s VAL 332 N -0.12 3.22 -0.18 4.03 1.01 0.87 -0.50 120.40 128.73 1tuf s VAL 332 Ca 0.28 -0.87 -0.12 0.00 0.00 0.00 0.00 61.98 61.28 1tuf s VAL 332 Cb -0.17 -2.62 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 1tuf s VAL 332 CO 0.15 0.20 0.22 -0.04 0.00 0.00 0.00 175.10 175.62 1tuf s MET 333 N 1.39 4.22 0.12 2.72 1.00 -0.20 -1.84 119.30 126.72 1tuf s MET 333 Ca 0.02 -0.05 0.07 0.00 0.00 0.00 0.00 55.69 55.73 1tuf s MET 333 Cb -0.16 -3.43 -0.04 0.00 0.00 0.00 0.00 34.83 31.20 1tuf s MET 333 CO -0.03 0.25 -0.18 0.96 0.00 0.00 0.00 175.02 176.03 1tuf s ILE 334 N 0.47 1.60 -2.00 2.53 -4.36 -0.96 -0.60 121.20 117.88 1tuf s ILE 334 Ca 0.13 -1.67 0.04 0.00 -0.26 0.00 0.00 60.65 58.89 1tuf s ILE 334 Cb -0.12 -1.59 0.11 0.00 1.25 0.00 0.00 42.46 42.11 1tuf s ILE 334 CO 0.01 -0.23 0.67 -0.90 0.24 0.00 0.00 174.94 174.73 1tuf n ASP 335 N 0.75 0.00 -4.80 4.36 5.68 -0.33 -3.85 116.55 118.37 1tuf n ASP 335 Ca -0.17 -0.76 -0.35 0.00 -0.50 0.00 0.00 54.79 53.01 1tuf n ASP 335 Cb 0.55 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.46 1tuf n ASP 335 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1tuf s ALA 336 N -2.00 3.63 0.27 2.12 0.00 -1.26 -4.14 121.76 120.37 1tuf s ALA 336 Ca 0.06 -0.76 0.05 0.00 0.00 0.00 0.00 51.96 51.31 1tuf s ALA 336 Cb 0.03 -1.71 -0.02 0.00 0.00 0.00 0.00 23.12 21.42 1tuf s ALA 336 CO 0.05 0.64 0.18 0.41 0.00 0.00 0.00 175.76 177.03 1tuf n GLY 337 N 1.75 3.27 0.26 0.00 0.00 -1.26 -4.00 105.19 105.21 1tuf n GLY 337 Ca -0.17 -1.91 0.12 0.00 0.00 0.00 0.00 46.02 44.06 1tuf n GLY 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tuf h MET 338 N 0.00 0.00 -0.18 1.61 -0.00 -1.91 -2.05 114.93 112.40 1tuf h MET 338 Ca -0.19 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.41 1tuf h MET 338 Cb 0.90 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.49 1tuf h MET 338 CO 0.29 0.13 -0.28 -2.95 -0.00 0.00 0.00 176.91 174.10 1tuf h ASN 339 N 0.00 0.35 -0.13 -0.10 -1.07 -1.89 -2.42 115.58 110.32 1tuf h ASN 339 Ca -0.00 -0.12 -0.21 0.00 0.07 0.00 0.00 56.30 56.04 1tuf h ASN 339 Cb 0.38 -0.10 0.01 0.00 -2.07 0.00 0.00 38.32 36.55 1tuf h ASN 339 CO 0.02 0.63 -0.72 0.44 0.07 0.00 0.00 177.43 177.87 1tuf h ASP 340 N 0.31 0.87 -2.56 6.14 3.32 -1.63 -0.18 116.42 122.69 1tuf h ASP 340 Ca 0.04 -0.64 -0.40 0.00 0.02 0.00 0.00 57.03 56.06 1tuf h ASP 340 Cb 0.66 -0.26 -0.37 0.00 0.22 0.00 0.00 39.33 39.59 1tuf h ASP 340 CO 0.05 1.37 -0.69 -0.32 -1.72 0.00 0.00 179.24 177.93 1tuf s MET 341 N -3.70 0.21 0.42 3.56 1.75 -1.03 -4.35 119.30 116.16 1tuf s MET 341 Ca -0.11 -0.13 0.24 0.00 -1.25 0.00 0.00 55.69 54.44 1tuf s MET 341 Cb 0.08 -1.12 0.51 0.00 2.84 0.00 0.00 34.83 37.14 1tuf s MET 341 CO 0.89 -0.86 1.67 0.52 -0.65 0.00 0.00 175.02 176.58 1tuf h MET 342 N 8.34 0.00 -0.55 4.11 2.86 -1.66 -3.39 114.93 124.63 1tuf h MET 342 Ca -0.16 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.56 1tuf h MET 342 Cb 1.09 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.65 1tuf h MET 342 CO 0.34 0.00 -0.46 -0.09 1.06 0.00 0.00 176.91 177.76 1tuf h ARG 343 N 0.00 -0.24 0.20 1.72 2.43 -1.88 -1.17 114.38 115.44 1tuf h ARG 343 Ca 0.00 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1tuf h ARG 343 Cb 0.91 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.48 1tuf h ARG 343 CO 0.00 -0.16 -0.38 -1.35 -1.51 0.00 0.00 179.97 176.57 1tuf h PRO 344 N -0.25 -0.64 -0.17 0.20 0.11 -1.79 -1.76 132.00 127.70 1tuf h PRO 344 Ca 0.16 0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.28 1tuf h PRO 344 Cb 0.57 0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.81 1tuf h PRO 344 CO -0.67 -0.43 -0.06 0.00 -0.21 0.00 0.00 178.00 176.64 1tuf h ALA 345 N -0.15 1.59 0.21 -0.75 0.00 -1.67 0.57 119.26 119.05 1tuf h ALA 345 Ca 0.01 -0.16 -0.32 0.00 0.00 0.00 0.00 54.91 54.45 1tuf h ALA 345 Cb 0.66 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 18.38 1tuf h ALA 345 CO -0.17 0.30 -1.40 0.52 0.00 0.00 0.00 179.25 178.50 1tuf h MET 346 N 0.25 0.44 0.00 0.00 2.86 -1.03 -3.40 114.93 114.05 1tuf h MET 346 Ca 0.06 -0.75 0.00 0.00 -2.06 0.00 0.00 59.70 56.95 1tuf h MET 346 Cb 0.27 0.28 0.00 0.00 0.06 0.00 0.00 31.60 32.21 1tuf h MET 346 CO 0.01 1.36 0.00 0.66 1.06 0.00 0.00 176.91 180.00 1tuf n TYR 347 N -3.64 0.00 -1.93 -0.22 4.01 -0.68 -4.98 117.16 109.72 1tuf n TYR 347 Ca -0.14 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.43 1tuf n TYR 347 Cb 1.08 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 40.07 1tuf n TYR 347 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1tuf n GLU 348 N -0.41 -1.28 -1.78 -0.72 1.02 0.20 -4.96 120.64 112.72 1tuf n GLU 348 Ca 0.00 0.96 -0.33 0.00 -0.02 0.00 0.00 57.16 57.77 1tuf n GLU 348 Cb 0.01 -5.30 0.04 0.00 -0.02 0.00 0.00 31.44 26.18 1tuf n GLU 348 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1tuf s ALA 349 N -2.75 2.50 0.13 0.62 0.00 -1.24 -5.00 121.76 116.02 1tuf s ALA 349 Ca 0.00 0.52 -0.19 0.00 0.00 0.00 0.00 51.96 52.30 1tuf s ALA 349 Cb 0.00 -3.31 -0.07 0.00 0.00 0.00 0.00 23.12 19.74 1tuf s ALA 349 CO 0.00 -1.23 0.61 -0.47 0.00 0.00 0.00 175.76 174.67 1tuf s TYR 350 N -2.36 3.73 -0.04 0.00 6.14 -1.26 -4.47 117.35 119.09 1tuf s TYR 350 Ca 0.66 1.27 -0.01 0.00 0.64 0.00 0.00 57.07 59.63 1tuf s TYR 350 Cb -0.20 -2.51 0.03 0.00 0.42 0.00 0.00 41.96 39.70 1tuf s TYR 350 CO 0.41 0.49 0.08 -1.01 0.64 0.00 0.00 175.55 176.16 1tuf s HIS 351 N -1.29 -0.04 0.30 4.97 3.76 -1.26 -4.86 115.29 116.87 1tuf s HIS 351 Ca 0.34 0.27 -0.29 0.00 -0.15 0.00 0.00 55.06 55.24 1tuf s HIS 351 Cb -0.18 -0.20 -0.10 0.00 1.11 0.00 0.00 32.58 33.21 1tuf s HIS 351 CO 0.20 -0.13 1.33 -1.58 -0.85 0.00 0.00 174.74 173.71 1tuf s HIS 352 N 1.21 3.07 -0.03 1.40 2.46 -1.26 -4.84 115.29 117.31 1tuf s HIS 352 Ca -0.08 1.34 0.02 0.00 0.47 0.00 0.00 55.06 56.81 1tuf s HIS 352 Cb -0.12 -3.69 0.01 0.00 -0.13 0.00 0.00 32.58 28.64 1tuf s HIS 352 CO -0.04 -1.97 -0.07 0.42 -2.47 0.00 0.00 174.74 170.61 1tuf s ILE 353 N -0.83 0.61 0.22 0.89 1.01 -1.26 -0.87 121.20 120.97 1tuf s ILE 353 Ca 0.51 -0.25 -0.04 0.00 0.00 0.00 0.00 60.65 60.88 1tuf s ILE 353 Cb -0.40 -0.57 -0.03 0.00 0.01 0.00 0.00 42.46 41.48 1tuf s ILE 353 CO 0.50 0.21 0.23 0.27 0.00 0.00 0.00 174.94 176.14 1tuf s ILE 354 N 0.36 0.00 -0.22 2.92 -4.36 -0.77 -4.91 121.20 114.23 1tuf s ILE 354 Ca -0.05 -1.85 -0.12 0.00 -0.26 0.00 0.00 60.65 58.37 1tuf s ILE 354 Cb -0.09 -2.43 -0.05 0.00 1.25 0.00 0.00 42.46 41.14 1tuf s ILE 354 CO 0.00 0.00 0.24 0.21 0.24 0.00 0.00 174.94 175.63 1tuf s ASN 355 N -3.13 6.26 0.00 4.36 3.84 -1.26 -0.46 114.94 124.54 1tuf s ASN 355 Ca 0.35 0.29 0.02 0.00 0.21 0.00 0.00 52.86 53.73 1tuf s ASN 355 Cb 0.05 -2.15 0.11 0.00 -0.55 0.00 0.00 41.25 38.71 1tuf s ASN 355 CO 0.12 0.04 0.81 0.00 -2.79 0.00 0.00 177.10 175.27 1tuf s LYS 357 N -2.43 2.36 -0.32 0.00 2.36 -1.26 -1.50 119.74 118.95 1tuf s LYS 357 Ca 0.02 -0.63 -0.24 0.00 -2.55 0.00 0.00 55.97 52.58 1tuf s LYS 357 Cb 0.01 -1.89 0.00 0.00 -1.05 0.00 0.00 37.83 34.90 1tuf s LYS 357 CO 0.03 0.04 0.80 0.08 1.55 0.00 0.00 175.35 177.85 1tuf s VAL 358 N 0.68 4.77 0.19 4.02 1.01 -0.99 -4.81 120.40 125.27 1tuf s VAL 358 Ca -0.13 1.12 0.04 0.00 0.00 0.00 0.00 61.98 63.01 1tuf s VAL 358 Cb -0.16 -4.17 -0.03 0.00 0.00 0.00 0.00 36.38 32.01 1tuf s VAL 358 CO 0.03 -0.31 0.26 -0.54 0.00 0.00 0.00 175.10 174.54 1tuf s LYS 359 N 3.02 3.25 -0.19 2.72 -0.14 -1.26 -4.92 119.74 122.22 1tuf s LYS 359 Ca 0.33 -0.76 -0.01 0.00 -1.36 0.00 0.00 55.97 54.16 1tuf s LYS 359 Cb -0.14 -2.82 0.08 0.00 -1.68 0.00 0.00 37.83 33.27 1tuf s LYS 359 CO 0.14 0.48 2.24 0.09 -0.76 0.00 0.00 175.35 177.54 1tuf n ASN 360 N -0.79 5.97 -3.64 2.83 3.02 -1.26 -4.76 115.26 116.63 1tuf n ASN 360 Ca -0.08 -2.80 -0.06 0.00 -0.03 0.00 0.00 54.58 51.61 1tuf n ASN 360 Cb 0.55 -1.14 -0.07 0.00 -0.61 0.00 0.00 39.78 38.52 1tuf n ASN 360 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1tuf s GLU 361 N -0.91 0.41 0.30 3.52 2.12 -1.26 -5.07 118.70 117.80 1tuf s GLU 361 Ca 0.27 0.56 0.06 0.00 0.36 0.00 0.00 54.97 56.21 1tuf s GLU 361 Cb 0.18 0.17 -0.02 0.00 0.26 0.00 0.00 34.13 34.72 1tuf s GLU 361 CO -0.02 -0.06 0.42 0.15 -0.54 0.00 0.00 175.26 175.20 1tuf s LYS 362 N 0.57 3.21 -0.29 4.30 -0.14 -1.26 -0.67 119.74 125.47 1tuf s LYS 362 Ca -0.00 -0.93 -0.18 0.00 -1.36 0.00 0.00 55.97 53.50 1tuf s LYS 362 Cb -0.05 -2.82 0.13 0.00 -1.68 0.00 0.00 37.83 33.41 1tuf s LYS 362 CO -0.10 0.20 0.93 -2.00 -0.76 0.00 0.00 175.35 173.63 1tuf s GLU 363 N -4.09 0.46 -0.20 1.68 2.12 0.09 -4.68 118.70 114.09 1tuf s GLU 363 Ca 0.41 0.75 -0.23 0.00 0.36 0.00 0.00 54.97 56.26 1tuf s GLU 363 Cb -0.09 0.12 -0.02 0.00 0.26 0.00 0.00 34.13 34.40 1tuf s GLU 363 CO 0.30 -0.09 0.73 0.08 -0.54 0.00 0.00 175.26 175.74 1tuf s VAL 364 N 1.20 4.94 0.30 3.70 1.01 -1.26 -1.39 120.40 128.90 1tuf s VAL 364 Ca -0.07 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.31 1tuf s VAL 364 Cb -0.04 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.28 1tuf s VAL 364 CO -0.14 0.05 0.33 0.68 0.00 0.00 0.00 175.10 176.02 1tuf s VAL 365 N 2.16 0.00 -0.07 2.92 -7.23 0.29 -4.64 120.40 113.82 1tuf s VAL 365 Ca 0.33 -1.81 0.05 0.00 -1.81 0.00 0.00 61.98 58.74 1tuf s VAL 365 Cb -0.16 -2.52 -0.01 0.00 0.56 0.00 0.00 36.38 34.25 1tuf s VAL 365 CO 0.11 0.00 -0.24 -0.44 -0.31 0.00 0.00 175.10 174.21 1tuf s SER 366 N -3.24 3.02 -0.24 4.85 0.01 -0.28 -0.71 113.70 117.09 1tuf s SER 366 Ca 0.35 -0.52 -0.08 0.00 1.31 0.00 0.00 55.95 57.02 1tuf s SER 366 Cb 0.02 -1.03 -0.03 0.00 0.21 0.00 0.00 66.02 65.19 1tuf s SER 366 CO 0.20 0.21 0.08 -0.63 0.41 0.00 0.00 173.24 173.50 1tuf s ILE 367 N 0.03 4.48 0.18 1.44 1.09 -0.50 -0.09 121.20 127.83 1tuf s ILE 367 Ca -0.09 -0.12 0.05 0.00 -1.10 0.00 0.00 60.65 59.39 1tuf s ILE 367 Cb -0.15 -3.08 -0.05 0.00 -1.06 0.00 0.00 42.46 38.12 1tuf s ILE 367 CO 0.05 0.35 -0.09 0.00 -0.10 0.00 0.00 174.94 175.16 1tuf s ALA 368 N 1.41 1.66 0.42 9.38 0.00 -0.77 -0.41 121.76 133.45 1tuf s ALA 368 Ca 0.05 -1.59 0.00 0.00 0.00 0.00 0.00 51.96 50.42 1tuf s ALA 368 Cb -0.15 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.08 1tuf s ALA 368 CO 0.04 -0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.12 1tuf n GLY 369 N -0.29 0.66 1.20 0.00 0.00 -1.00 -2.28 105.19 103.49 1tuf n GLY 369 Ca -0.09 -1.92 0.10 0.00 0.00 0.00 0.00 46.02 44.11 1tuf n GLY 369 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tuf n GLY 370 N 5.00 2.64 3.78 -0.02 0.00 -1.25 -4.74 105.19 110.60 1tuf n GLY 370 Ca 0.00 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 1tuf n GLY 370 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tuf s LEU 371 N -1.16 4.42 -1.26 0.99 1.43 -1.26 -4.93 118.68 116.91 1tuf s LEU 371 Ca 0.43 1.78 -0.09 0.00 -1.03 0.00 0.00 54.13 55.22 1tuf s LEU 371 Cb 0.23 -3.82 -0.12 0.00 0.03 0.00 0.00 46.19 42.52 1tuf s LEU 371 CO 0.27 0.01 2.99 0.00 0.23 0.00 0.00 176.35 179.86 1tuf s GLU 373 N 2.07 -0.01 0.37 0.00 2.56 -1.26 -5.05 118.70 117.38 1tuf s GLU 373 Ca 0.66 0.26 0.08 0.00 0.00 0.00 0.00 54.97 55.97 1tuf s GLU 373 Cb 0.20 -0.41 0.80 0.00 2.00 0.00 0.00 34.13 36.72 1tuf s GLU 373 CO -0.05 -0.24 1.94 0.66 -0.56 0.00 0.00 175.26 177.01 1tuf h SER 374 N 7.84 0.62 0.36 -1.70 4.64 -2.04 -1.43 113.55 121.85 1tuf h SER 374 Ca -0.30 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1tuf h SER 374 Cb 1.12 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1tuf h SER 374 CO 0.32 0.38 0.00 -1.54 -0.87 0.00 0.00 176.83 175.12 1tuf n SER 375 N -4.50 0.00 -3.74 4.97 3.41 -1.26 -4.41 113.62 108.09 1tuf n SER 375 Ca 0.12 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.31 1tuf n SER 375 Cb 0.31 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.95 1tuf n SER 375 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1tuf n ASP 376 N -1.28 3.27 -3.92 4.04 2.03 -0.54 -4.05 116.55 116.09 1tuf n ASP 376 Ca 0.09 -2.77 -0.20 0.00 0.52 0.00 0.00 54.79 52.43 1tuf n ASP 376 Cb 0.15 -1.42 -0.16 0.00 -0.72 0.00 0.00 41.12 38.98 1tuf n ASP 376 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1tuf s VAL 377 N 4.29 0.63 0.00 5.18 1.01 -1.26 -2.38 120.40 127.87 1tuf s VAL 377 Ca 0.53 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.27 1tuf s VAL 377 Cb 0.13 -0.62 -0.28 0.00 0.00 0.00 0.00 36.38 35.61 1tuf s VAL 377 CO 0.02 0.24 0.86 -0.26 0.00 0.00 0.00 175.10 175.95 1tuf h PHE 378 N 7.01 0.48 -1.76 5.22 0.04 -1.06 -3.37 116.94 123.50 1tuf h PHE 378 Ca -0.37 -0.35 0.02 0.00 2.80 0.00 0.00 57.97 60.07 1tuf h PHE 378 Cb 1.16 -0.02 -0.21 0.00 2.20 0.00 0.00 35.95 39.08 1tuf h PHE 378 CO 0.49 1.40 0.38 0.20 -0.60 0.00 0.00 178.31 180.18 1tuf s GLY 379 N -4.95 -0.40 0.08 -1.45 0.00 -1.07 -4.68 107.32 94.85 1tuf s GLY 379 Ca -0.09 1.76 0.10 0.00 0.00 0.00 0.00 44.72 46.48 1tuf s GLY 379 CO 0.86 1.05 -0.26 0.50 0.00 0.00 0.00 173.10 175.25 1tuf s ARG 380 N -1.05 1.59 -1.65 2.90 0.52 -1.26 -1.41 118.95 118.58 1tuf s ARG 380 Ca -0.05 -1.20 -0.17 0.00 -0.52 0.00 0.00 55.73 53.79 1tuf s ARG 380 Cb -0.01 -1.90 0.14 0.00 0.52 0.00 0.00 34.95 33.70 1tuf s ARG 380 CO 0.05 0.47 0.82 -0.25 0.02 0.00 0.00 175.30 176.41 1tuf n ASP 381 N 1.40 -3.52 -4.79 0.23 8.00 -1.09 -4.92 116.55 111.86 1tuf n ASP 381 Ca -0.17 -0.96 -0.38 0.00 0.71 0.00 0.00 54.79 53.98 1tuf n ASP 381 Cb 0.52 -3.03 -0.06 0.00 -0.02 0.00 0.00 41.12 38.54 1tuf n ASP 381 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1tuf s ARG 382 N -6.85 4.18 -0.23 -1.24 1.81 0.11 -4.76 118.95 111.97 1tuf s ARG 382 Ca 0.69 0.60 -0.16 0.00 -1.72 0.00 0.00 55.73 55.14 1tuf s ARG 382 Cb -0.37 -3.29 -0.04 0.00 -0.45 0.00 0.00 34.95 30.80 1tuf s ARG 382 CO 0.90 0.50 0.42 -2.00 -0.68 0.00 0.00 175.30 174.45 1tuf s GLU 383 N -0.57 4.11 0.27 3.54 2.12 -1.26 -0.55 118.70 126.35 1tuf s GLU 383 Ca 0.27 0.19 0.02 0.00 0.36 0.00 0.00 54.97 55.81 1tuf s GLU 383 Cb -0.18 -3.59 -0.05 0.00 0.26 0.00 0.00 34.13 30.57 1tuf s GLU 383 CO 0.15 -0.16 0.10 -0.51 -0.54 0.00 0.00 175.26 174.30 1tuf s LEU 384 N 1.71 1.67 0.29 2.70 1.43 -0.49 -4.90 118.68 121.09 1tuf s LEU 384 Ca 0.18 -1.40 -0.29 0.00 -1.03 0.00 0.00 54.13 51.59 1tuf s LEU 384 Cb -0.15 0.01 -0.10 0.00 0.03 0.00 0.00 46.19 45.99 1tuf s LEU 384 CO 0.09 -0.74 1.26 -1.81 0.23 0.00 0.00 176.35 175.38 1tuf s ASP 385 N -3.33 6.92 -0.18 2.29 1.11 -1.26 -0.73 116.67 121.48 1tuf s ASP 385 Ca 0.37 2.52 -0.16 0.00 0.18 0.00 0.00 52.55 55.46 1tuf s ASP 385 Cb 0.08 -2.63 -0.07 0.00 1.07 0.00 0.00 42.92 41.36 1tuf s ASP 385 CO 0.14 -0.44 0.73 0.29 1.18 0.00 0.00 175.17 177.07 1tuf n LYS 386 N 1.37 0.00 -2.76 8.23 4.76 0.16 -4.83 118.16 125.09 1tuf n LYS 386 Ca 0.01 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.05 1tuf n LYS 386 Cb 0.43 -0.54 -0.05 0.00 -1.84 0.00 0.00 35.03 33.02 1tuf n LYS 386 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1tuf s VAL 387 N 1.93 4.27 0.05 -0.18 1.01 -1.26 -4.89 120.40 121.32 1tuf s VAL 387 Ca 0.42 2.06 0.04 0.00 0.00 0.00 0.00 61.98 64.50 1tuf s VAL 387 Cb -0.54 -4.32 -0.02 0.00 0.00 0.00 0.00 36.38 31.50 1tuf s VAL 387 CO 0.25 0.42 -0.11 -0.70 0.00 0.00 0.00 175.10 174.97 1tuf s GLU 388 N -0.68 0.70 0.18 2.72 2.12 -1.26 -5.07 118.70 117.41 1tuf s GLU 388 Ca 0.43 -0.76 -0.33 0.00 0.36 0.00 0.00 54.97 54.67 1tuf s GLU 388 Cb -0.25 -0.61 -0.13 0.00 0.26 0.00 0.00 34.13 33.40 1tuf s GLU 388 CO 0.31 0.14 1.62 0.28 -0.54 0.00 0.00 175.26 177.06 1tuf n VAL 389 N 1.65 0.01 0.00 3.70 0.31 -1.26 -1.02 118.33 121.72 1tuf n VAL 389 Ca -0.20 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1tuf n VAL 389 Cb 0.55 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.81 1tuf n VAL 389 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1tuf n GLY 390 N 3.56 2.66 3.70 2.92 0.00 -0.62 -5.04 105.19 112.38 1tuf n GLY 390 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1tuf n GLY 390 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tuf s ASP 391 N -0.47 3.58 -0.23 1.61 1.01 -0.19 -4.63 116.67 117.35 1tuf s ASP 391 Ca 0.00 2.18 -0.02 0.00 0.71 0.00 0.00 52.55 55.42 1tuf s ASP 391 Cb 0.00 -2.57 0.02 0.00 1.01 0.00 0.00 42.92 41.38 1tuf s ASP 391 CO 0.00 -2.67 -0.07 -0.69 0.21 0.00 0.00 175.17 171.95 1tuf s VAL 392 N -2.49 2.91 0.42 -1.27 1.01 -1.26 -1.36 120.40 118.36 1tuf s VAL 392 Ca 0.68 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.76 1tuf s VAL 392 Cb -0.24 -2.40 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1tuf s VAL 392 CO 0.54 0.31 0.70 -0.76 0.00 0.00 0.00 175.10 175.88 1tuf s LEU 393 N 1.37 3.79 -0.05 3.92 1.43 -0.76 -1.22 118.68 127.16 1tuf s LEU 393 Ca 0.02 0.79 0.02 0.00 -1.03 0.00 0.00 54.13 53.93 1tuf s LEU 393 Cb -0.15 -3.70 0.02 0.00 0.03 0.00 0.00 46.19 42.38 1tuf s LEU 393 CO -0.05 -0.45 -0.09 0.00 0.23 0.00 0.00 176.35 175.99 1tuf s ALA 394 N -2.53 0.96 -0.16 4.21 0.00 0.40 -2.12 121.76 122.51 1tuf s ALA 394 Ca 0.45 -0.25 -0.04 0.00 0.00 0.00 0.00 51.96 52.12 1tuf s ALA 394 Cb -0.10 -0.47 -0.03 0.00 0.00 0.00 0.00 23.12 22.52 1tuf s ALA 394 CO 0.40 0.07 -0.02 -1.50 0.00 0.00 0.00 175.76 174.71 1tuf s ILE 395 N 0.71 4.00 0.54 0.00 2.07 -0.47 -1.84 121.20 126.22 1tuf s ILE 395 Ca -0.12 -0.32 -0.10 0.00 -1.41 0.00 0.00 60.65 58.70 1tuf s ILE 395 Cb -0.14 -2.77 -0.05 0.00 0.13 0.00 0.00 42.46 39.63 1tuf s ILE 395 CO 0.02 0.48 0.93 -0.36 -1.91 0.00 0.00 174.94 174.10 1tuf s PHE 396 N 0.43 3.57 -1.19 3.50 0.40 -0.04 -1.57 117.98 123.07 1tuf s PHE 396 Ca -0.03 1.16 -0.09 0.00 -0.60 0.00 0.00 56.93 57.38 1tuf s PHE 396 Cb -0.14 -2.59 -0.02 0.00 0.51 0.00 0.00 43.02 40.78 1tuf s PHE 396 CO 0.03 -0.47 0.79 -0.25 0.70 0.00 0.00 175.22 176.01 1tuf n ASP 397 N -2.30 -3.88 -0.49 1.36 8.00 -0.87 -4.47 116.55 113.89 1tuf n ASP 397 Ca 0.04 -0.86 0.04 0.00 0.71 0.00 0.00 54.79 54.73 1tuf n ASP 397 Cb 0.54 -4.12 0.11 0.00 -0.02 0.00 0.00 41.12 37.63 1tuf n ASP 397 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1tuf n VAL 398 N -3.99 0.88 0.23 2.53 0.24 -0.41 -4.59 118.33 113.22 1tuf n VAL 398 Ca -0.18 -0.94 0.08 0.00 -2.04 0.00 0.00 64.34 61.26 1tuf n VAL 398 Cb 0.63 0.58 0.57 0.00 -1.47 0.00 0.00 33.84 34.16 1tuf n VAL 398 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1tuf h GLY 399 N 1.63 0.00 -5.40 7.63 0.00 -1.50 -3.28 103.07 102.15 1tuf h GLY 399 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 1tuf h GLY 399 CO 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 176.54 175.82 1tuf s ALA 400 N -4.33 2.82 -1.46 3.60 0.00 -1.26 -4.45 121.76 116.68 1tuf s ALA 400 Ca -0.03 -0.89 -0.11 0.00 0.00 0.00 0.00 51.96 50.93 1tuf s ALA 400 Cb 0.14 -1.26 0.05 0.00 0.00 0.00 0.00 23.12 22.06 1tuf s ALA 400 CO 0.65 0.39 0.97 0.66 0.00 0.00 0.00 175.76 178.43 1tuf n TYR 401 N 2.94 -2.43 0.00 0.00 4.01 0.16 -4.89 117.16 116.95 1tuf n TYR 401 Ca -0.18 0.87 0.00 0.00 -0.16 0.00 0.00 57.90 58.43 1tuf n TYR 401 Cb 0.53 -4.32 0.00 0.00 -0.31 0.00 0.00 39.34 35.24 1tuf n TYR 401 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1tuf n GLY 402 N -1.74 -0.07 0.18 2.72 0.00 -1.23 -4.53 105.19 100.51 1tuf n GLY 402 Ca 0.01 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.08 1tuf n GLY 402 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1tuf h ILE 403 N 0.00 0.89 0.00 -0.61 6.09 -1.77 -2.88 117.51 119.24 1tuf h ILE 403 Ca 0.00 -1.64 0.00 0.00 -1.37 0.00 0.00 64.86 61.85 1tuf h ILE 403 Cb 0.00 2.00 0.00 0.00 0.47 0.00 0.00 36.82 39.29 1tuf h ILE 403 CO 0.00 0.39 0.00 -1.54 -3.07 0.00 0.00 178.15 173.93 1tuf n SER 404 N -3.49 0.51 0.00 2.19 3.41 -1.26 -2.09 113.62 112.89 1tuf n SER 404 Ca 0.00 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 1tuf n SER 404 Cb 0.54 -0.75 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 1tuf n SER 404 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1tuf n MET 405 N -2.09 2.58 -1.98 4.33 2.81 -1.11 -5.04 117.12 116.63 1tuf n MET 405 Ca 0.02 -1.38 -0.33 0.00 -1.81 0.00 0.00 57.70 54.19 1tuf n MET 405 Cb 0.18 -0.97 0.02 0.00 -0.71 0.00 0.00 33.22 31.74 1tuf n MET 405 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1tuf s ALA 406 N -0.88 2.60 0.00 3.04 0.00 -0.89 -4.70 121.76 120.94 1tuf s ALA 406 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.54 1tuf s ALA 406 Cb 0.00 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1tuf s ALA 406 CO 0.00 -1.01 0.00 0.27 0.00 0.00 0.00 175.76 175.02 1tuf n ASN 407 N -1.99 0.00 -1.13 0.00 6.94 -0.08 -5.02 115.26 113.98 1tuf n ASN 407 Ca 0.10 -0.91 0.02 0.00 -0.02 0.00 0.00 54.58 53.77 1tuf n ASN 407 Cb 0.52 0.00 0.24 0.00 -2.36 0.00 0.00 39.78 38.18 1tuf n ASN 407 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1tuf n ASN 408 N -1.87 3.46 -4.61 0.53 3.02 -1.25 -4.46 115.26 110.08 1tuf n ASN 408 Ca 0.00 -3.32 -0.43 0.00 -0.03 0.00 0.00 54.58 50.79 1tuf n ASN 408 Cb 0.00 -0.61 -0.01 0.00 -0.61 0.00 0.00 39.78 38.56 1tuf n ASN 408 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tuf n TYR 409 N -0.73 1.43 -2.54 3.10 9.36 -1.26 -0.30 117.16 126.21 1tuf n TYR 409 Ca 0.29 0.64 -0.17 0.00 3.32 0.00 0.00 57.90 61.98 1tuf n TYR 409 Cb 1.02 -2.28 0.01 0.00 -0.63 0.00 0.00 39.34 37.46 1tuf n TYR 409 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1tuf n ASN 410 N 0.99 -5.02 -4.00 2.98 5.03 -1.26 -3.27 115.26 110.72 1tuf n ASN 410 Ca 0.08 -0.11 -0.41 0.00 0.87 0.00 0.00 54.58 55.02 1tuf n ASN 410 Cb 0.34 -4.01 0.02 0.00 -1.02 0.00 0.00 39.78 35.11 1tuf n ASN 410 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1tuf n ALA 411 N -2.39 -2.53 -2.95 5.41 0.00 0.58 -4.98 120.51 113.66 1tuf n ALA 411 Ca -0.15 -0.48 -0.30 0.00 0.00 0.00 0.00 53.44 52.51 1tuf n ALA 411 Cb 0.63 -2.80 -0.17 0.00 0.00 0.00 0.00 19.45 17.11 1tuf n ALA 411 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1tuf s ARG 412 N -7.07 2.45 0.65 0.00 0.52 -0.88 -5.10 118.95 109.52 1tuf s ARG 412 Ca 0.43 -0.80 -0.13 0.00 -0.52 0.00 0.00 55.73 54.71 1tuf s ARG 412 Cb -0.22 -2.01 -0.01 0.00 0.52 0.00 0.00 34.95 33.23 1tuf s ARG 412 CO 0.95 0.27 1.06 0.20 0.02 0.00 0.00 175.30 177.80 1tuf s GLY 413 N 0.07 1.91 0.37 -3.53 0.00 -1.26 -3.94 107.32 100.94 1tuf s GLY 413 Ca -0.08 0.26 -0.25 0.00 0.00 0.00 0.00 44.72 44.64 1tuf s GLY 413 CO 0.05 0.58 1.09 0.50 0.00 0.00 0.00 173.10 175.31 1tuf s ARG 414 N -4.52 4.23 0.95 2.90 3.00 -1.26 -4.83 118.95 119.42 1tuf s ARG 414 Ca 0.61 1.66 -0.11 0.00 0.00 0.00 0.00 55.73 57.89 1tuf s ARG 414 Cb -0.15 -2.71 0.17 0.00 0.00 0.00 0.00 34.95 32.25 1tuf s ARG 414 CO 0.45 -0.12 1.10 -1.25 0.00 0.00 0.00 175.30 175.49 1tuf s PRO 415 N -2.22 0.74 0.59 3.54 0.04 -1.26 -2.82 135.00 133.60 1tuf s PRO 415 Ca 0.55 1.22 -0.14 0.00 0.04 0.00 0.00 61.00 62.67 1tuf s PRO 415 Cb -0.26 -1.72 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 1tuf s PRO 415 CO 0.33 -2.71 1.02 1.03 0.04 0.00 0.00 177.00 176.71 1tuf s ARG 416 N -4.68 3.62 -0.03 4.56 0.52 -1.25 -4.52 118.95 117.17 1tuf s ARG 416 Ca 0.66 0.90 0.01 0.00 -0.52 0.00 0.00 55.73 56.78 1tuf s ARG 416 Cb -0.22 -2.08 0.02 0.00 0.52 0.00 0.00 34.95 33.19 1tuf s ARG 416 CO 0.59 -0.55 -0.01 -1.64 0.02 0.00 0.00 175.30 173.71 1tuf s MET 417 N -4.62 0.41 0.13 3.54 -1.94 -0.24 -1.22 119.30 115.35 1tuf s MET 417 Ca 0.58 0.00 0.10 0.00 -1.71 0.00 0.00 55.69 54.67 1tuf s MET 417 Cb -0.12 -0.52 -0.04 0.00 2.01 0.00 0.00 34.83 36.17 1tuf s MET 417 CO 0.44 -0.09 -0.25 0.14 -0.01 0.00 0.00 175.02 175.24 1tuf s VAL 418 N 0.81 2.14 -0.20 -6.03 -7.23 -0.36 0.26 120.40 109.79 1tuf s VAL 418 Ca -0.09 -1.72 -0.02 0.00 -1.81 0.00 0.00 61.98 58.34 1tuf s VAL 418 Cb -0.12 -1.91 -0.00 0.00 0.56 0.00 0.00 36.38 34.91 1tuf s VAL 418 CO -0.01 0.04 -0.09 -0.22 -0.31 0.00 0.00 175.10 174.51 1tuf s LEU 419 N -2.06 2.70 -0.28 1.32 2.96 0.10 -0.69 118.68 122.74 1tuf s LEU 419 Ca 0.13 -0.43 -0.14 0.00 -0.22 0.00 0.00 54.13 53.46 1tuf s LEU 419 Cb -0.10 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 1tuf s LEU 419 CO 0.06 0.02 0.34 0.42 -1.32 0.00 0.00 176.35 175.86 1tuf s THR 420 N 1.23 5.20 0.29 3.68 -4.23 0.16 -1.31 115.64 120.66 1tuf s THR 420 Ca 0.03 0.41 0.03 0.00 -1.18 0.00 0.00 61.69 60.97 1tuf s THR 420 Cb -0.14 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 69.97 1tuf s THR 420 CO -0.04 0.13 0.17 -0.94 -0.54 0.00 0.00 174.62 173.40 1tuf s SER 421 N 1.68 1.38 0.56 3.99 1.04 -0.29 -1.37 113.70 120.69 1tuf s SER 421 Ca 0.13 -1.55 0.33 0.00 0.48 0.00 0.00 55.95 55.34 1tuf s SER 421 Cb -0.16 0.39 1.65 0.00 0.10 0.00 0.00 66.02 68.01 1tuf s SER 421 CO 0.10 -0.89 2.11 0.11 0.98 0.00 0.00 173.24 175.66 1tuf h LYS 422 N 2.26 0.00 0.00 4.02 1.79 -1.97 -0.10 116.57 122.57 1tuf h LYS 422 Ca -0.33 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.09 1tuf h LYS 422 Cb 1.25 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.89 1tuf h LYS 422 CO 0.51 0.06 -0.21 0.87 -1.08 0.00 0.00 179.45 179.60 1tuf h LYS 423 N 0.00 0.00 0.00 3.15 6.56 -1.98 -3.49 116.57 120.81 1tuf h LYS 423 Ca -0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1tuf h LYS 423 Cb 0.31 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.97 1tuf h LYS 423 CO 0.01 0.21 0.00 0.41 -2.06 0.00 0.00 179.45 178.02 1tuf n GLY 424 N 0.30 0.81 3.63 3.86 0.00 -0.05 -5.06 105.19 108.67 1tuf n GLY 424 Ca 0.01 -2.01 -0.35 0.00 0.00 0.00 0.00 46.02 43.67 1tuf n GLY 424 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1tuf s VAL 425 N -1.56 4.93 -0.01 1.61 -7.23 -1.26 -1.14 120.40 115.74 1tuf s VAL 425 Ca 0.00 0.02 0.05 0.00 -1.81 0.00 0.00 61.98 60.25 1tuf s VAL 425 Cb 0.00 -3.25 -0.01 0.00 0.56 0.00 0.00 36.38 33.67 1tuf s VAL 425 CO 0.00 0.42 -0.17 -0.36 -0.31 0.00 0.00 175.10 174.68 1tuf s PHE 426 N 0.67 1.50 -0.48 2.82 0.40 -0.43 -4.94 117.98 117.53 1tuf s PHE 426 Ca 0.05 -0.29 -0.29 0.00 -0.60 0.00 0.00 56.93 55.80 1tuf s PHE 426 Cb -0.13 -0.96 0.02 0.00 0.51 0.00 0.00 43.02 42.47 1tuf s PHE 426 CO 0.01 -0.01 1.22 -1.17 0.70 0.00 0.00 175.22 175.98 1tuf s LEU 427 N -0.49 3.59 0.00 -0.37 2.96 -1.26 0.00 118.68 123.11 1tuf s LEU 427 Ca 0.06 0.51 0.23 0.00 -0.22 0.00 0.00 54.13 54.71 1tuf s LEU 427 Cb -0.07 -3.49 0.14 0.00 0.50 0.00 0.00 46.19 43.27 1tuf s LEU 427 CO -0.00 -1.35 1.17 2.30 -1.32 0.00 0.00 176.35 177.15 1tuf n ILE 428 N 6.90 0.00 -3.67 6.68 -5.35 0.14 -4.86 119.36 119.19 1tuf n ILE 428 Ca 0.13 -0.16 -0.09 0.00 -0.27 0.00 0.00 62.75 62.36 1tuf n ILE 428 Cb 0.49 0.95 -0.10 0.00 -1.74 0.00 0.00 39.64 39.24 1tuf n ILE 428 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1tuf s ARG 429 N -2.63 0.36 0.21 6.28 3.52 -0.60 -4.74 118.95 121.35 1tuf s ARG 429 Ca 0.17 0.94 -0.17 0.00 -0.13 0.00 0.00 55.73 56.54 1tuf s ARG 429 Cb 0.18 0.18 -0.08 0.00 -1.56 0.00 0.00 34.95 33.67 1tuf s ARG 429 CO 0.63 -0.21 0.66 -2.00 -0.81 0.00 0.00 175.30 173.58 1tuf s GLU 430 N 2.09 4.11 0.65 5.12 2.56 -1.26 -1.08 118.70 130.88 1tuf s GLU 430 Ca -0.05 0.69 -0.12 0.00 0.00 0.00 0.00 54.97 55.49 1tuf s GLU 430 Cb -0.10 -2.82 -0.02 0.00 2.00 0.00 0.00 34.13 33.19 1tuf s GLU 430 CO -0.13 0.38 1.05 -0.98 -0.56 0.00 0.00 175.26 175.02 1tuf s ARG 431 N -2.15 3.20 0.00 4.30 1.70 -1.26 -4.73 118.95 120.01 1tuf s ARG 431 Ca 0.43 0.99 -0.17 0.00 -0.47 0.00 0.00 55.73 56.51 1tuf s ARG 431 Cb -0.15 -2.02 -0.06 0.00 -0.57 0.00 0.00 34.95 32.15 1tuf s ARG 431 CO 0.20 -0.89 0.46 -1.21 -1.08 0.00 0.00 175.30 172.78 1tuf s GLU 432 N -4.75 4.06 0.69 3.89 2.02 -1.13 -5.01 118.70 118.48 1tuf s GLU 432 Ca 0.59 0.51 0.00 0.00 0.02 0.00 0.00 54.97 56.09 1tuf s GLU 432 Cb -0.14 -3.26 0.11 0.00 0.10 0.00 0.00 34.13 30.94 1tuf s GLU 432 CO 0.48 0.59 0.95 0.95 0.02 0.00 0.00 175.26 178.25 1tuf s THR 433 N -0.81 2.22 0.43 3.63 -4.23 -1.26 -4.55 115.64 111.08 1tuf s THR 433 Ca 0.25 -0.63 0.12 0.00 -1.18 0.00 0.00 61.69 60.25 1tuf s THR 433 Cb -0.17 -2.59 0.21 0.00 1.34 0.00 0.00 72.50 71.28 1tuf s THR 433 CO 0.14 0.00 2.01 1.88 -0.54 0.00 0.00 174.62 178.11 1tuf h TYR 434 N -0.39 0.18 -0.36 3.99 0.05 -1.98 -1.69 116.97 116.77 1tuf h TYR 434 Ca -0.37 -0.01 -0.07 0.00 0.05 0.00 0.00 58.73 58.33 1tuf h TYR 434 Cb 1.27 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 38.94 1tuf h TYR 434 CO -0.06 0.24 -0.08 0.00 -1.05 0.00 0.00 178.16 177.20 1tuf h ALA 435 N 1.78 1.20 -0.35 3.88 0.00 -1.99 -2.82 119.26 120.95 1tuf h ALA 435 Ca 0.04 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1tuf h ALA 435 Cb 0.21 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1tuf h ALA 435 CO 0.01 0.52 0.10 -0.44 0.00 0.00 0.00 179.25 179.44 1tuf h ASP 436 N 0.56 0.52 -1.26 0.00 3.32 -1.68 -1.74 116.42 116.14 1tuf h ASP 436 Ca 0.11 -0.21 0.37 0.00 0.02 0.00 0.00 57.03 57.31 1tuf h ASP 436 Cb 0.48 -0.14 -0.09 0.00 0.22 0.00 0.00 39.33 39.80 1tuf h ASP 436 CO 0.03 0.60 0.85 -0.07 -1.72 0.00 0.00 179.24 178.92 1tuf h LEU 437 N 0.41 0.21 -2.78 1.55 3.38 -1.28 0.24 115.31 117.05 1tuf h LEU 437 Ca 0.11 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1tuf h LEU 437 Cb 0.27 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1tuf h LEU 437 CO -0.00 -0.02 0.00 2.30 0.09 0.00 0.00 178.44 180.80 1tuf n ILE 438 N -4.44 0.92 0.16 1.22 -5.35 -1.03 -4.66 119.36 106.19 1tuf n ILE 438 Ca 0.31 -0.96 0.10 0.00 -0.27 0.00 0.00 62.75 61.93 1tuf n ILE 438 Cb 1.26 0.55 0.53 0.00 -1.74 0.00 0.00 39.64 40.25 1tuf n ILE 438 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tuf n ALA 439 N 0.38 1.07 0.36 -1.28 0.00 0.07 -1.62 120.51 119.49 1tuf n ALA 439 Ca 0.10 0.18 0.04 0.00 0.00 0.00 0.00 53.44 53.75 1tuf n ALA 439 Cb 0.39 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1tuf n ALA 439 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1tuf n LYS 440 N -2.19 2.04 -3.06 0.00 4.76 -1.26 -5.02 118.16 113.43 1tuf n LYS 440 Ca -0.01 -0.58 -0.35 0.00 -2.87 0.00 0.00 58.31 54.50 1tuf n LYS 440 Cb 0.04 -1.04 -0.06 0.00 -1.84 0.00 0.00 35.03 32.13 1tuf n LYS 440 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1tuf s ASP 441 N -1.16 7.03 -0.04 4.39 1.01 -0.64 -5.08 116.67 122.19 1tuf s ASP 441 Ca 0.07 1.45 0.01 0.00 0.71 0.00 0.00 52.55 54.78 1tuf s ASP 441 Cb 0.07 -2.43 0.02 0.00 1.01 0.00 0.00 42.92 41.59 1tuf s ASP 441 CO 0.20 -0.04 -0.02 -0.63 0.21 0.00 0.00 175.17 174.90 1tuf s ILE 442 N -1.64 0.33 -0.24 0.77 1.01 -1.26 -5.06 121.20 115.11 1tuf s ILE 442 Ca 0.46 0.01 -0.19 0.00 0.00 0.00 0.00 60.65 60.94 1tuf s ILE 442 Cb -0.15 -0.40 -0.03 0.00 0.01 0.00 0.00 42.46 41.89 1tuf s ILE 442 CO 0.20 0.18 0.54 -0.69 0.00 0.00 0.00 174.94 175.18 1tuf s VAL 443 N 1.05 5.06 0.85 2.92 1.01 -1.26 -5.05 120.40 124.98 1tuf s VAL 443 Ca -0.09 0.96 -0.12 0.00 0.00 0.00 0.00 61.98 62.72 1tuf s VAL 443 Cb -0.14 -3.86 0.11 0.00 0.00 0.00 0.00 36.38 32.49 1tuf s VAL 443 CO -0.01 0.10 1.18 -2.65 0.00 0.00 0.00 175.10 173.71 1tuf n PRO 444 N 5.36 -0.06 -0.12 2.72 -0.02 -1.26 -4.78 135.00 136.83 1tuf n PRO 444 Ca -0.03 0.06 -0.05 0.00 -2.02 0.00 0.00 63.50 61.46 1tuf n PRO 444 Cb 0.50 -2.41 0.02 0.00 -0.02 0.00 0.00 33.50 31.58 1tuf n PRO 444 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1tuf h PRO 445 N -1.28 -0.06 0.00 0.52 0.11 -2.01 -1.20 132.00 128.07 1tuf h PRO 445 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1tuf h PRO 445 Cb 1.29 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1tuf h PRO 445 CO 0.44 -0.04 0.00 -2.39 -0.21 0.00 0.00 178.00 175.80 1tuf n HIS 446 N -5.35 0.00 0.23 0.65 1.44 -1.26 -1.89 115.22 109.04 1tuf n HIS 446 Ca 0.03 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.77 1tuf n HIS 446 Cb 0.26 0.00 0.03 0.00 0.12 0.00 0.00 29.99 30.40 1tuf n HIS 446 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1tuf n LEU 447 N -0.97 1.63 0.00 2.39 4.77 -0.47 -5.27 117.00 119.08 1tuf n LEU 447 Ca 0.11 -1.10 0.11 0.00 -0.03 0.00 0.00 56.01 55.10 1tuf n LEU 447 Cb 0.05 -0.01 0.63 0.00 -2.33 0.00 0.00 43.42 41.76 1tuf n LEU 447 CO 0.08 0.35 0.82 0.18 -1.33 0.00 0.00 177.39 177.49