#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ag8 s PRO 9 N 0.00 2.66 0.04 5.55 0.04 -1.26 -4.95 135.00 137.08 1ag8 s PRO 9 Ca 0.00 1.65 -0.30 0.00 0.04 0.00 0.00 61.00 62.38 1ag8 s PRO 9 Cb 0.00 -1.91 -0.07 0.00 0.04 0.00 0.00 34.50 32.56 1ag8 s PRO 9 CO 0.00 -1.41 1.60 0.99 0.04 0.00 0.00 177.00 178.22 1ag8 s THR 10 N -1.98 3.24 0.71 1.26 2.01 -1.26 -5.00 115.64 114.61 1ag8 s THR 10 Ca 0.73 0.64 -0.08 0.00 0.31 0.00 0.00 61.69 63.28 1ag8 s THR 10 Cb -0.26 -3.41 0.05 0.00 0.01 0.00 0.00 72.50 68.89 1ag8 s THR 10 CO 0.39 -0.01 1.04 -2.16 -0.69 0.00 0.00 174.62 173.20 1ag8 s PRO 11 N 2.73 2.35 -0.36 4.92 0.04 -1.26 -5.04 135.00 138.38 1ag8 s PRO 11 Ca 0.72 -0.05 -0.14 0.00 0.04 0.00 0.00 61.00 61.57 1ag8 s PRO 11 Cb -0.37 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.04 1ag8 s PRO 11 CO 0.31 -1.20 0.29 1.21 0.04 0.00 0.00 177.00 177.65 1ag8 s ASN 12 N -4.47 6.10 0.63 6.66 3.84 -1.26 -4.94 114.94 121.51 1ag8 s ASN 12 Ca 0.59 -0.50 0.32 0.00 0.21 0.00 0.00 52.86 53.48 1ag8 s ASN 12 Cb -0.11 -2.16 1.76 0.00 -0.55 0.00 0.00 41.25 40.19 1ag8 s ASN 12 CO 0.47 -0.32 2.05 1.56 -2.79 0.00 0.00 177.10 178.06 1ag8 h GLN 13 N 8.53 0.00 -2.26 0.43 1.08 -1.97 -3.15 115.11 117.78 1ag8 h GLN 13 Ca -0.30 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.32 1ag8 h GLN 13 Cb 1.14 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 28.17 1ag8 h GLN 13 CO 0.68 0.00 -0.89 1.04 -0.95 0.00 0.00 178.83 178.71 1ag8 n GLN 14 N -3.32 1.19 -2.16 1.46 6.02 -1.26 -4.99 117.38 114.32 1ag8 n GLN 14 Ca 0.00 -3.73 -0.40 0.00 -0.01 0.00 0.00 57.00 52.86 1ag8 n GLN 14 Cb 0.35 -1.70 -0.02 0.00 1.02 0.00 0.00 30.24 29.89 1ag8 n GLN 14 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1ag8 s PRO 15 N -1.28 4.28 0.28 -1.09 0.04 -1.19 -4.98 135.00 131.06 1ag8 s PRO 15 Ca 0.35 2.12 -0.29 0.00 0.04 0.00 0.00 61.00 63.21 1ag8 s PRO 15 Cb 0.11 -2.98 -0.10 0.00 0.04 0.00 0.00 34.50 31.57 1ag8 s PRO 15 CO -0.11 -0.21 1.15 -2.00 0.04 0.00 0.00 177.00 175.86 1ag8 s GLU 16 N -1.89 4.58 -0.35 4.56 2.12 -1.26 -5.00 118.70 121.46 1ag8 s GLU 16 Ca 0.51 1.89 -0.18 0.00 0.36 0.00 0.00 54.97 57.55 1ag8 s GLU 16 Cb -0.38 -3.17 -0.00 0.00 0.26 0.00 0.00 34.13 30.84 1ag8 s GLU 16 CO 0.49 0.11 0.49 0.08 -0.54 0.00 0.00 175.26 175.90 1ag8 s VAL 17 N -1.05 5.04 -0.13 3.70 1.01 -1.26 -4.94 120.40 122.77 1ag8 s VAL 17 Ca 0.46 0.30 0.18 0.00 0.00 0.00 0.00 61.98 62.92 1ag8 s VAL 17 Cb -0.33 -3.94 -0.23 0.00 0.00 0.00 0.00 36.38 31.87 1ag8 s VAL 17 CO 0.43 -0.20 0.43 0.18 0.00 0.00 0.00 175.10 175.95 1ag8 n LEU 18 N 5.69 0.32 -4.01 3.92 4.77 -1.26 -4.93 117.00 121.49 1ag8 n LEU 18 Ca -0.05 0.14 -0.23 0.00 -0.03 0.00 0.00 56.01 55.84 1ag8 n LEU 18 Cb 0.49 0.23 -0.16 0.00 -2.33 0.00 0.00 43.42 41.65 1ag8 n LEU 18 CO 0.44 0.27 -0.46 -0.31 -1.33 0.00 0.00 177.39 176.00 1ag8 s TYR 19 N -2.87 1.25 0.00 -1.77 2.02 -1.26 -5.01 117.35 109.71 1ag8 s TYR 19 Ca -0.07 -0.40 0.11 0.00 -0.37 0.00 0.00 57.07 56.34 1ag8 s TYR 19 Cb 0.09 -0.92 0.18 0.00 -0.40 0.00 0.00 41.96 40.91 1ag8 s TYR 19 CO 0.84 -0.20 1.01 0.27 -1.57 0.00 0.00 175.55 175.90 1ag8 n ASN 20 N 3.62 0.11 -1.04 2.29 6.94 -1.26 -4.75 115.26 121.18 1ag8 n ASN 20 Ca -0.21 -1.88 0.00 0.00 -0.02 0.00 0.00 54.58 52.46 1ag8 n ASN 20 Cb 0.52 -0.06 0.00 0.00 -2.36 0.00 0.00 39.78 37.88 1ag8 n ASN 20 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ag8 n GLN 21 N 0.21 2.96 -3.50 -3.83 6.02 -1.26 -0.78 117.38 117.19 1ag8 n GLN 21 Ca -0.06 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.56 1ag8 n GLN 21 Cb 0.86 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 32.06 1ag8 n GLN 21 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1ag8 s ILE 22 N -0.04 5.21 -0.27 5.09 1.01 -0.16 -4.66 121.20 127.38 1ag8 s ILE 22 Ca 0.00 0.70 -0.06 0.00 0.00 0.00 0.00 60.65 61.29 1ag8 s ILE 22 Cb 0.00 -3.68 -0.00 0.00 0.01 0.00 0.00 42.46 38.79 1ag8 s ILE 22 CO 0.00 0.45 0.05 0.12 0.00 0.00 0.00 174.94 175.56 1ag8 s PHE 23 N -0.07 3.10 0.00 3.97 5.36 -0.58 -1.54 117.98 128.21 1ag8 s PHE 23 Ca 0.21 -0.87 0.00 0.00 -0.96 0.00 0.00 56.93 55.30 1ag8 s PHE 23 Cb -0.14 -2.21 0.00 0.00 -0.34 0.00 0.00 43.02 40.32 1ag8 s PHE 23 CO 0.08 -0.53 0.00 -0.89 -1.46 0.00 0.00 175.22 172.42 1ag8 n ILE 24 N 4.86 0.00 -1.17 3.12 5.41 -0.86 -0.99 119.36 129.73 1ag8 n ILE 24 Ca -0.16 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.32 1ag8 n ILE 24 Cb 0.49 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 39.33 1ag8 n ILE 24 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1ag8 n ASN 25 N 0.00 7.21 -1.76 4.38 3.02 -1.26 -3.87 115.26 122.99 1ag8 n ASN 25 Ca 0.00 -2.53 -0.18 0.00 -0.03 0.00 0.00 54.58 51.85 1ag8 n ASN 25 Cb 0.00 -1.49 -0.03 0.00 -0.61 0.00 0.00 39.78 37.64 1ag8 n ASN 25 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ag8 n ASN 26 N 3.12 -5.14 -4.10 6.41 5.03 -1.26 -4.67 115.26 114.65 1ag8 n ASN 26 Ca 0.63 0.15 -0.18 0.00 0.87 0.00 0.00 54.58 56.05 1ag8 n ASN 26 Cb 0.53 -4.20 -0.13 0.00 -1.02 0.00 0.00 39.78 34.95 1ag8 n ASN 26 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1ag8 s GLU 27 N -4.35 0.78 -0.16 3.52 2.02 -1.26 -5.03 118.70 114.21 1ag8 s GLU 27 Ca 0.00 -0.68 -0.12 0.00 0.02 0.00 0.00 54.97 54.20 1ag8 s GLU 27 Cb 0.00 -0.74 -0.05 0.00 0.10 0.00 0.00 34.13 33.44 1ag8 s GLU 27 CO 0.00 0.18 0.21 -1.58 0.02 0.00 0.00 175.26 174.09 1ag8 s TRP 28 N -0.85 3.47 0.09 1.61 0.52 -1.26 -2.02 118.94 120.50 1ag8 s TRP 28 Ca -0.01 0.50 -0.09 0.00 0.02 0.00 0.00 56.10 56.52 1ag8 s TRP 28 Cb -0.07 -2.22 0.00 0.00 -1.15 0.00 0.00 33.47 30.03 1ag8 s TRP 28 CO 0.01 0.34 0.21 -1.01 0.02 0.00 0.00 176.95 176.51 1ag8 s HIS 29 N 0.18 0.14 0.70 -1.98 3.76 -0.59 -4.95 115.29 112.55 1ag8 s HIS 29 Ca 0.13 -0.56 -0.10 0.00 -0.15 0.00 0.00 55.06 54.37 1ag8 s HIS 29 Cb -0.12 -0.04 0.02 0.00 1.11 0.00 0.00 32.58 33.55 1ag8 s HIS 29 CO 0.02 -0.56 1.07 -0.51 -0.85 0.00 0.00 174.74 173.91 1ag8 s ASP 30 N -2.86 5.36 0.77 1.40 1.01 -1.26 -0.99 116.67 120.10 1ag8 s ASP 30 Ca 0.05 1.01 -0.12 0.00 0.71 0.00 0.00 52.55 54.20 1ag8 s ASP 30 Cb 0.05 -1.80 0.06 0.00 1.01 0.00 0.00 42.92 42.24 1ag8 s ASP 30 CO -0.11 -1.36 1.12 0.00 0.21 0.00 0.00 175.17 175.03 1ag8 s ALA 31 N -3.32 2.12 0.52 5.23 0.00 -1.26 -4.84 121.76 120.20 1ag8 s ALA 31 Ca 0.58 0.47 0.21 0.00 0.00 0.00 0.00 51.96 53.21 1ag8 s ALA 31 Cb -0.11 -3.34 1.33 0.00 0.00 0.00 0.00 23.12 21.00 1ag8 s ALA 31 CO 0.50 -1.89 2.07 0.28 0.00 0.00 0.00 175.76 176.72 1ag8 h VAL 32 N -0.95 0.87 0.00 0.00 2.07 -1.95 -0.15 116.25 116.14 1ag8 h VAL 32 Ca -0.45 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1ag8 h VAL 32 Cb 1.25 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1ag8 h VAL 32 CO 0.50 0.00 -0.22 -1.28 0.02 0.00 0.00 177.57 176.59 1ag8 h SER 33 N 0.00 0.00 0.00 0.57 0.87 -1.90 -3.47 113.55 109.63 1ag8 h SER 33 Ca 0.13 -0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1ag8 h SER 33 Cb 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1ag8 h SER 33 CO -0.00 0.03 0.00 0.29 -0.53 0.00 0.00 176.83 176.62 1ag8 n LYS 34 N -2.27 -0.54 -2.39 2.24 5.02 -0.07 -4.98 118.16 115.17 1ag8 n LYS 34 Ca 0.05 0.13 -0.36 0.00 -2.02 0.00 0.00 58.31 56.11 1ag8 n LYS 34 Cb 0.44 -3.76 -0.02 0.00 -0.02 0.00 0.00 35.03 31.67 1ag8 n LYS 34 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ag8 s LYS 35 N -0.76 3.83 0.07 1.97 1.02 -1.26 -4.88 119.74 119.73 1ag8 s LYS 35 Ca 0.00 1.60 -0.00 0.00 0.02 0.00 0.00 55.97 57.59 1ag8 s LYS 35 Cb 0.00 -2.34 -0.04 0.00 -0.52 0.00 0.00 37.83 34.93 1ag8 s LYS 35 CO 0.00 -0.45 -0.03 0.95 -0.92 0.00 0.00 175.35 174.90 1ag8 s THR 36 N -1.69 0.34 0.08 2.17 -4.23 -1.26 -1.23 115.64 109.82 1ag8 s THR 36 Ca 0.64 -1.86 0.04 0.00 -1.18 0.00 0.00 61.69 59.33 1ag8 s THR 36 Cb -0.24 -1.64 -0.03 0.00 1.34 0.00 0.00 72.50 71.93 1ag8 s THR 36 CO 0.29 -0.89 -0.11 0.72 -0.54 0.00 0.00 174.62 174.08 1ag8 s PHE 37 N -3.85 1.06 0.31 3.99 -0.12 0.86 -4.78 117.98 115.45 1ag8 s PHE 37 Ca 0.11 -0.55 -0.21 0.00 -0.05 0.00 0.00 56.93 56.23 1ag8 s PHE 37 Cb 0.07 -0.59 -0.09 0.00 -0.63 0.00 0.00 43.02 41.78 1ag8 s PHE 37 CO -0.07 0.01 0.84 -1.25 -0.05 0.00 0.00 175.22 174.71 1ag8 s PRO 38 N -2.16 4.31 -0.19 1.99 0.04 -1.26 0.04 135.00 137.77 1ag8 s PRO 38 Ca -0.00 1.04 -0.00 0.00 0.04 0.00 0.00 61.00 62.07 1ag8 s PRO 38 Cb -0.07 -2.64 0.01 0.00 0.04 0.00 0.00 34.50 31.84 1ag8 s PRO 38 CO 0.01 0.23 -0.15 -0.08 0.04 0.00 0.00 177.00 177.05 1ag8 s THR 39 N -1.76 2.48 0.41 1.26 -1.32 -0.28 -4.92 115.64 111.51 1ag8 s THR 39 Ca 0.51 -0.80 -0.02 0.00 -1.21 0.00 0.00 61.69 60.17 1ag8 s THR 39 Cb -0.15 -2.07 -0.03 0.00 -1.51 0.00 0.00 72.50 68.74 1ag8 s THR 39 CO 0.20 0.50 0.65 -0.69 -2.21 0.00 0.00 174.62 173.07 1ag8 s VAL 40 N 1.30 4.87 -0.43 5.08 1.01 -1.26 0.01 120.40 130.98 1ag8 s VAL 40 Ca 0.04 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 61.66 1ag8 s VAL 40 Cb -0.14 -3.81 0.06 0.00 0.00 0.00 0.00 36.38 32.50 1ag8 s VAL 40 CO -0.09 -0.63 0.31 0.21 0.00 0.00 0.00 175.10 174.90 1ag8 s ASN 41 N -4.09 5.89 0.62 3.32 3.84 0.10 -4.74 114.94 119.88 1ag8 s ASN 41 Ca 0.44 -1.30 0.29 0.00 0.21 0.00 0.00 52.86 52.49 1ag8 s ASN 41 Cb -0.10 -2.08 1.52 0.00 -0.55 0.00 0.00 41.25 40.04 1ag8 s ASN 41 CO 0.39 -0.55 1.91 1.55 -2.79 0.00 0.00 177.10 177.62 1ag8 h PRO 42 N 8.56 0.00 0.05 0.43 0.13 -1.76 0.54 132.00 139.95 1ag8 h PRO 42 Ca -0.26 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.64 1ag8 h PRO 42 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1ag8 h PRO 42 CO 0.79 0.00 -1.04 0.77 -0.23 0.00 0.00 178.00 178.29 1ag8 h SER 43 N 0.00 0.24 0.00 1.44 0.02 -1.88 -1.92 113.55 111.45 1ag8 h SER 43 Ca 0.13 -0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 1ag8 h SER 43 Cb 0.96 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.42 1ag8 h SER 43 CO -0.00 1.13 -1.48 0.35 -1.14 0.00 0.00 176.83 175.69 1ag8 n THR 44 N -3.53 0.09 -0.94 -2.27 -2.24 -0.69 -2.68 114.28 102.03 1ag8 n THR 44 Ca -0.04 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1ag8 n THR 44 Cb 0.92 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 1ag8 n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ag8 n GLY 45 N 2.01 0.83 3.88 3.38 0.00 0.18 -4.59 105.19 110.87 1ag8 n GLY 45 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1ag8 n GLY 45 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ag8 s ASP 46 N -2.67 6.61 -0.02 1.61 1.11 -1.25 -4.77 116.67 117.29 1ag8 s ASP 46 Ca 0.00 0.93 -0.30 0.00 0.18 0.00 0.00 52.55 53.36 1ag8 s ASP 46 Cb 0.00 -2.23 -0.04 0.00 1.07 0.00 0.00 42.92 41.72 1ag8 s ASP 46 CO 0.00 -0.12 1.20 -0.69 1.18 0.00 0.00 175.17 176.73 1ag8 s VAL 47 N -1.90 4.20 -0.10 -1.27 1.01 -1.26 -0.72 120.40 120.36 1ag8 s VAL 47 Ca 0.48 1.55 -0.26 0.00 0.00 0.00 0.00 61.98 63.74 1ag8 s VAL 47 Cb -0.11 -4.00 -0.23 0.00 0.00 0.00 0.00 36.38 32.05 1ag8 s VAL 47 CO 0.23 0.04 0.89 0.40 0.00 0.00 0.00 175.10 176.65 1ag8 h ILE 48 N 4.86 1.54 -1.61 2.22 2.04 -0.71 -3.47 117.51 122.38 1ag8 h ILE 48 Ca -0.37 -1.87 0.08 0.00 1.00 0.00 0.00 64.86 63.71 1ag8 h ILE 48 Cb 1.18 2.77 -0.02 0.00 -0.74 0.00 0.00 36.82 40.01 1ag8 h ILE 48 CO 0.86 0.47 0.24 0.00 0.00 0.00 0.00 178.15 179.71 1ag8 s HIS 50 N -3.51 2.65 0.08 0.00 3.76 -1.26 -1.12 115.29 115.88 1ag8 s HIS 50 Ca 0.08 -0.20 0.08 0.00 -0.15 0.00 0.00 55.06 54.87 1ag8 s HIS 50 Cb -0.00 -1.49 -0.03 0.00 1.11 0.00 0.00 32.58 32.17 1ag8 s HIS 50 CO 0.00 0.30 -0.21 0.08 -0.85 0.00 0.00 174.74 174.07 1ag8 s VAL 51 N -0.97 1.68 0.29 -0.90 1.01 0.11 -4.86 120.40 116.75 1ag8 s VAL 51 Ca 0.16 -1.39 -0.30 0.00 0.00 0.00 0.00 61.98 60.45 1ag8 s VAL 51 Cb -0.11 -1.50 -0.11 0.00 0.00 0.00 0.00 36.38 34.66 1ag8 s VAL 51 CO 0.07 0.05 1.61 0.00 0.00 0.00 0.00 175.10 176.82 1ag8 s ALA 52 N -1.01 3.76 -0.68 5.51 0.00 0.04 -0.10 121.76 129.29 1ag8 s ALA 52 Ca 0.07 1.58 -0.17 0.00 0.00 0.00 0.00 51.96 53.44 1ag8 s ALA 52 Cb -0.09 -3.65 0.14 0.00 0.00 0.00 0.00 23.12 19.51 1ag8 s ALA 52 CO 0.03 -0.99 0.73 -2.00 0.00 0.00 0.00 175.76 173.53 1ag8 s GLU 53 N -0.43 3.23 0.69 0.00 2.12 -0.37 -4.44 118.70 119.49 1ag8 s GLU 53 Ca 0.64 -1.71 -0.15 0.00 0.36 0.00 0.00 54.97 54.10 1ag8 s GLU 53 Cb -0.48 -4.39 0.02 0.00 0.26 0.00 0.00 34.13 29.54 1ag8 s GLU 53 CO 0.47 -1.47 1.15 0.20 -0.54 0.00 0.00 175.26 175.07 1ag8 s GLY 54 N 3.29 2.23 0.13 -1.50 0.00 0.31 -4.77 107.32 107.02 1ag8 s GLY 54 Ca 0.14 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.54 1ag8 s GLY 54 CO 0.00 1.05 0.17 1.34 0.00 0.00 0.00 173.10 175.66 1ag8 n ASP 55 N -2.53 -0.46 -0.23 1.64 -0.08 -1.26 -4.32 116.55 109.31 1ag8 n ASP 55 Ca 0.12 -1.77 0.04 0.00 -1.51 0.00 0.00 54.79 51.66 1ag8 n ASP 55 Cb 0.51 0.89 0.14 0.00 2.34 0.00 0.00 41.12 45.00 1ag8 n ASP 55 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1ag8 h LYS 56 N 0.00 0.14 -0.87 -0.67 3.64 -1.91 0.96 116.57 117.87 1ag8 h LYS 56 Ca -0.10 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1ag8 h LYS 56 Cb 0.46 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.20 1ag8 h LYS 56 CO 0.14 0.09 0.57 0.00 -2.27 0.00 0.00 179.45 177.99 1ag8 h ALA 57 N 1.63 1.45 -0.10 5.00 0.00 -1.97 0.32 119.26 125.59 1ag8 h ALA 57 Ca 0.38 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 55.05 1ag8 h ALA 57 Cb 0.65 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1ag8 h ALA 57 CO -0.57 0.47 -0.73 -0.44 0.00 0.00 0.00 179.25 177.97 1ag8 h ASP 58 N 1.09 0.60 -0.24 0.00 3.32 -1.31 -2.22 116.42 117.67 1ag8 h ASP 58 Ca 0.34 -0.39 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 1ag8 h ASP 58 Cb 0.01 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1ag8 h ASP 58 CO -0.10 1.14 0.03 0.58 -1.72 0.00 0.00 179.24 179.17 1ag8 h VAL 59 N 0.35 1.24 -0.39 -1.35 2.07 -0.10 -1.51 116.25 116.54 1ag8 h VAL 59 Ca -0.03 -0.80 0.07 0.00 0.82 0.00 0.00 66.70 66.75 1ag8 h VAL 59 Cb 1.32 1.30 -0.06 0.00 -1.52 0.00 0.00 31.29 32.32 1ag8 h VAL 59 CO 0.13 0.25 0.03 0.44 0.02 0.00 0.00 177.57 178.44 1ag8 h ASP 60 N 0.20 -0.10 -0.16 0.57 5.19 -0.32 0.20 116.42 122.00 1ag8 h ASP 60 Ca 0.07 0.08 -0.09 0.00 -0.62 0.00 0.00 57.03 56.47 1ag8 h ASP 60 Cb 0.35 0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.98 1ag8 h ASP 60 CO 0.01 -0.01 -0.20 0.08 -3.12 0.00 0.00 179.24 176.00 1ag8 h ARG 61 N 0.14 0.59 -0.54 3.56 0.11 -1.31 -1.29 114.38 115.65 1ag8 h ARG 61 Ca 0.19 -0.21 -0.04 0.00 0.10 0.00 0.00 59.98 60.02 1ag8 h ARG 61 Cb 0.26 -0.04 -0.02 0.00 1.11 0.00 0.00 29.97 31.27 1ag8 h ARG 61 CO -0.30 0.75 0.16 0.00 0.10 0.00 0.00 179.97 180.69 1ag8 h ALA 62 N 1.26 0.70 -0.73 0.08 0.00 -0.15 -0.44 119.26 119.98 1ag8 h ALA 62 Ca 0.08 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1ag8 h ALA 62 Cb 0.63 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1ag8 h ALA 62 CO 0.04 0.37 0.24 0.28 0.00 0.00 0.00 179.25 180.19 1ag8 h VAL 63 N 0.74 1.26 -0.09 0.00 2.07 -0.43 0.09 116.25 119.89 1ag8 h VAL 63 Ca 0.17 -0.88 0.03 0.00 0.82 0.00 0.00 66.70 66.84 1ag8 h VAL 63 Cb 0.29 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 1ag8 h VAL 63 CO -0.00 0.35 -0.11 0.11 0.02 0.00 0.00 177.57 177.93 1ag8 h LYS 64 N 1.08 -0.14 -0.72 1.57 6.56 -0.71 0.83 116.57 125.04 1ag8 h LYS 64 Ca 0.24 0.01 0.01 0.00 -1.06 0.00 0.00 60.65 59.85 1ag8 h LYS 64 Cb 0.29 0.03 -0.04 0.00 -0.57 0.00 0.00 32.23 31.94 1ag8 h LYS 64 CO -0.01 -0.09 0.47 0.00 -2.06 0.00 0.00 179.45 177.76 1ag8 h ALA 65 N 0.91 0.92 -0.25 3.86 0.00 -0.61 -2.23 119.26 121.86 1ag8 h ALA 65 Ca 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ag8 h ALA 65 Cb 0.25 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1ag8 h ALA 65 CO -0.18 0.31 0.12 0.00 0.00 0.00 0.00 179.25 179.50 1ag8 h ALA 66 N 1.27 0.32 -0.55 0.00 0.00 -0.52 -2.06 119.26 117.73 1ag8 h ALA 66 Ca 0.27 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.12 1ag8 h ALA 66 Cb -0.09 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1ag8 h ALA 66 CO -0.07 -0.11 0.30 -0.09 0.00 0.00 0.00 179.25 179.28 1ag8 h ARG 67 N 0.27 0.56 -0.76 0.00 9.65 -0.62 -0.97 114.38 122.50 1ag8 h ARG 67 Ca 0.09 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.94 1ag8 h ARG 67 Cb 0.13 -0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 28.55 1ag8 h ARG 67 CO -0.01 0.37 0.50 0.00 2.80 0.00 0.00 179.97 183.63 1ag8 h ALA 68 N 1.28 0.96 0.00 2.80 0.00 -1.27 -0.21 119.26 122.82 1ag8 h ALA 68 Ca 0.24 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1ag8 h ALA 68 Cb 0.11 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ag8 h ALA 68 CO -0.15 0.39 -0.03 0.00 0.00 0.00 0.00 179.25 179.47 1ag8 h ALA 69 N 1.27 1.05 -0.30 0.00 0.00 -0.58 -2.15 119.26 118.57 1ag8 h ALA 69 Ca 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ag8 h ALA 69 Cb -0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1ag8 h ALA 69 CO -0.06 0.03 0.00 0.34 0.00 0.00 0.00 179.25 179.57 1ag8 n PHE 70 N -3.20 0.38 -2.03 0.00 7.35 -0.12 -4.54 117.46 115.31 1ag8 n PHE 70 Ca -0.01 -0.19 -0.41 0.00 -0.76 0.00 0.00 57.45 56.08 1ag8 n PHE 70 Cb 0.21 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.02 1ag8 n PHE 70 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 1ag8 s GLN 71 N -1.62 4.28 0.08 -4.13 -1.52 -0.81 -4.89 119.66 111.05 1ag8 s GLN 71 Ca 0.36 2.31 -0.31 0.00 -1.95 0.00 0.00 55.36 55.76 1ag8 s GLN 71 Cb 0.20 -3.06 -0.11 0.00 -0.22 0.00 0.00 33.01 29.83 1ag8 s GLN 71 CO 0.29 -0.31 1.87 -0.11 -0.25 0.00 0.00 175.29 176.79 1ag8 n LEU 72 N 1.01 3.97 0.00 2.90 7.94 -1.26 -0.69 117.00 130.87 1ag8 n LEU 72 Ca 0.01 0.97 0.00 0.00 -1.11 0.00 0.00 56.01 55.88 1ag8 n LEU 72 Cb 0.41 -1.52 0.00 0.00 0.53 0.00 0.00 43.42 42.84 1ag8 n LEU 72 CO 0.60 0.14 0.00 0.61 -1.11 0.00 0.00 177.39 177.63 1ag8 n GLY 73 N 4.31 0.60 3.76 -3.96 0.00 -1.26 -5.09 105.19 103.55 1ag8 n GLY 73 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1ag8 n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ag8 s SER 74 N -1.97 4.88 0.31 1.61 0.01 0.14 -4.78 113.70 113.90 1ag8 s SER 74 Ca 0.00 2.10 0.03 0.00 1.31 0.00 0.00 55.95 59.38 1ag8 s SER 74 Cb 0.00 -2.56 0.60 0.00 0.21 0.00 0.00 66.02 64.27 1ag8 s SER 74 CO 0.00 -1.79 1.90 -0.65 0.41 0.00 0.00 173.24 173.11 1ag8 h PRO 75 N -0.03 0.92 -0.24 12.44 0.11 -1.89 0.23 132.00 143.55 1ag8 h PRO 75 Ca -0.47 -0.06 -0.14 0.00 0.11 0.00 0.00 66.00 65.44 1ag8 h PRO 75 Cb 1.26 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1ag8 h PRO 75 CO 0.53 0.61 -0.44 2.35 -0.21 0.00 0.00 178.00 180.83 1ag8 h TRP 76 N 0.95 0.72 0.04 0.65 -0.00 -1.92 0.67 115.95 117.05 1ag8 h TRP 76 Ca 0.40 -0.22 -0.23 0.00 -0.00 0.00 0.00 58.89 58.84 1ag8 h TRP 76 Cb 0.31 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 29.30 1ag8 h TRP 76 CO -0.00 0.93 -1.10 0.00 -0.00 0.00 0.00 178.44 178.27 1ag8 h ARG 77 N 0.48 0.08 0.00 2.65 3.08 -1.58 -3.25 114.38 115.84 1ag8 h ARG 77 Ca 0.03 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1ag8 h ARG 77 Cb 0.96 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.06 1ag8 h ARG 77 CO 0.09 1.04 -0.31 0.00 -1.07 0.00 0.00 179.97 179.72 1ag8 h ARG 78 N 0.02 0.00 -6.79 0.04 3.08 -0.54 -3.47 114.38 106.73 1ag8 h ARG 78 Ca -0.06 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.43 1ag8 h ARG 78 Cb 1.84 0.00 0.12 0.00 0.08 0.00 0.00 29.97 32.01 1ag8 h ARG 78 CO 0.15 0.05 0.48 -0.12 -1.07 0.00 0.00 179.97 179.46 1ag8 n MET 79 N -3.01 1.99 -2.10 0.04 1.56 0.22 -4.95 117.12 110.87 1ag8 n MET 79 Ca 0.03 0.70 -0.41 0.00 -0.27 0.00 0.00 57.70 57.75 1ag8 n MET 79 Cb 0.56 -2.34 -0.02 0.00 2.15 0.00 0.00 33.22 33.57 1ag8 n MET 79 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 1ag8 s ASP 80 N -0.45 6.75 0.33 6.12 1.01 -1.26 -4.90 116.67 124.28 1ag8 s ASP 80 Ca 0.59 2.70 0.05 0.00 0.71 0.00 0.00 52.55 56.60 1ag8 s ASP 80 Cb -0.53 -2.65 0.70 0.00 1.01 0.00 0.00 42.92 41.45 1ag8 s ASP 80 CO 0.60 -0.55 1.89 0.00 0.21 0.00 0.00 175.17 177.32 1ag8 h ALA 81 N 3.47 1.70 -0.84 5.23 0.00 -1.92 0.10 119.26 126.99 1ag8 h ALA 81 Ca -0.49 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.44 1ag8 h ALA 81 Cb 1.23 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 1ag8 h ALA 81 CO 0.66 0.11 0.56 0.66 0.00 0.00 0.00 179.25 181.24 1ag8 h SER 82 N 0.82 0.95 0.09 0.00 4.64 -1.90 -0.87 113.55 117.28 1ag8 h SER 82 Ca 0.42 -0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.63 1ag8 h SER 82 Cb 0.49 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1ag8 h SER 82 CO -0.18 0.68 -0.29 -0.33 -0.87 0.00 0.00 176.83 175.84 1ag8 h GLU 83 N 1.12 0.31 -0.81 4.77 4.39 -1.18 -0.11 114.58 123.07 1ag8 h GLU 83 Ca 0.31 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.87 1ag8 h GLU 83 Cb -0.09 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.50 1ag8 h GLU 83 CO -0.07 0.57 0.38 0.00 -1.16 0.00 0.00 179.01 178.73 1ag8 h ARG 84 N 0.27 1.17 -0.79 2.33 3.08 -0.68 -0.52 114.38 119.24 1ag8 h ARG 84 Ca 0.04 -0.17 -0.05 0.00 0.07 0.00 0.00 59.98 59.87 1ag8 h ARG 84 Cb 0.65 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 1ag8 h ARG 84 CO 0.05 0.90 0.31 0.78 -1.07 0.00 0.00 179.97 180.94 1ag8 h GLY 85 N 1.17 1.27 1.02 0.04 0.00 -0.49 -2.13 103.07 103.96 1ag8 h GLY 85 Ca 0.28 -0.70 -0.05 0.00 0.00 0.00 0.00 47.33 46.86 1ag8 h GLY 85 CO -0.03 0.66 0.24 3.21 0.00 0.00 0.00 176.54 180.61 1ag8 h ARG 86 N 1.15 1.02 -0.69 4.80 2.47 -0.17 -1.81 114.38 121.16 1ag8 h ARG 86 Ca 0.26 -0.20 -0.04 0.00 -1.26 0.00 0.00 59.98 58.74 1ag8 h ARG 86 Cb 0.23 -0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 28.36 1ag8 h ARG 86 CO -0.02 0.87 0.26 -0.07 0.56 0.00 0.00 179.97 181.57 1ag8 h LEU 87 N 0.96 0.96 -0.80 3.04 3.38 -0.84 -0.09 115.31 121.93 1ag8 h LEU 87 Ca 0.22 -0.18 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 1ag8 h LEU 87 Cb 0.25 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1ag8 h LEU 87 CO -0.01 0.88 -0.26 -0.07 0.09 0.00 0.00 178.44 179.08 1ag8 h LEU 88 N 0.99 0.63 -0.70 1.67 3.38 -1.11 -0.19 115.31 119.98 1ag8 h LEU 88 Ca 0.23 -0.23 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 1ag8 h LEU 88 Cb 0.23 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1ag8 h LEU 88 CO -0.02 0.87 -0.43 0.78 0.09 0.00 0.00 178.44 179.73 1ag8 h ASN 89 N 0.54 0.52 -0.20 -0.43 -0.26 -1.00 -1.24 115.58 113.51 1ag8 h ASN 89 Ca 0.07 -0.24 -0.03 0.00 -0.56 0.00 0.00 56.30 55.54 1ag8 h ASN 89 Cb 0.72 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 37.83 1ag8 h ASN 89 CO 0.06 0.89 -0.00 -0.09 -1.06 0.00 0.00 177.43 177.22 1ag8 h ARG 90 N 0.40 0.35 -0.41 0.81 9.65 -0.67 -1.48 114.38 123.04 1ag8 h ARG 90 Ca 0.03 -0.11 0.05 0.00 -1.10 0.00 0.00 59.98 58.85 1ag8 h ARG 90 Cb 0.92 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 29.42 1ag8 h ARG 90 CO 0.08 0.56 0.12 1.25 2.80 0.00 0.00 179.97 184.78 1ag8 h LEU 91 N 0.11 0.11 -0.32 3.80 5.85 -0.85 -1.41 115.31 122.59 1ag8 h LEU 91 Ca 0.06 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.88 1ag8 h LEU 91 Cb 0.40 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 1ag8 h LEU 91 CO 0.01 0.09 0.05 0.00 -0.34 0.00 0.00 178.44 178.25 1ag8 h ALA 92 N 1.28 0.32 -0.89 1.25 0.00 -1.03 -0.84 119.26 119.34 1ag8 h ALA 92 Ca 0.19 0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.28 1ag8 h ALA 92 Cb 0.20 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 1ag8 h ALA 92 CO -0.21 -0.36 0.52 -0.44 0.00 0.00 0.00 179.25 178.76 1ag8 h ASP 93 N 0.15 0.75 -0.35 0.00 3.32 -0.40 0.16 116.42 120.05 1ag8 h ASP 93 Ca 0.15 0.05 -0.09 0.00 0.02 0.00 0.00 57.03 57.16 1ag8 h ASP 93 Cb 0.18 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1ag8 h ASP 93 CO -0.22 0.40 -0.11 -0.07 -1.72 0.00 0.00 179.24 177.52 1ag8 h LEU 94 N 0.84 0.78 -0.53 1.55 3.38 -0.41 0.39 115.31 121.31 1ag8 h LEU 94 Ca 0.44 -0.24 -0.15 0.00 0.09 0.00 0.00 57.88 58.03 1ag8 h LEU 94 Cb 0.45 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1ag8 h LEU 94 CO -0.27 0.92 -0.41 0.40 0.09 0.00 0.00 178.44 179.17 1ag8 h ILE 95 N 0.71 1.29 -0.18 1.22 2.04 0.29 -2.16 117.51 120.73 1ag8 h ILE 95 Ca 0.12 -1.58 -0.13 0.00 1.00 0.00 0.00 64.86 64.26 1ag8 h ILE 95 Cb 0.60 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1ag8 h ILE 95 CO 0.04 0.51 -0.45 -0.08 0.00 0.00 0.00 178.15 178.17 1ag8 h GLU 96 N 0.61 0.45 -0.81 2.37 4.81 -0.41 0.17 114.58 121.76 1ag8 h GLU 96 Ca 0.05 -0.24 -0.04 0.00 -0.13 0.00 0.00 59.36 59.00 1ag8 h GLU 96 Cb 0.96 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.31 1ag8 h GLU 96 CO 0.09 0.81 0.37 -0.09 -0.73 0.00 0.00 179.01 179.46 1ag8 h ARG 97 N 0.36 1.18 -0.59 1.92 2.43 -0.73 -2.52 114.38 116.44 1ag8 h ARG 97 Ca 0.02 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 58.97 1ag8 h ARG 97 Cb 0.94 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.26 1ag8 h ARG 97 CO 0.08 0.92 0.05 -0.25 -1.51 0.00 0.00 179.97 179.26 1ag8 n ASP 98 N -4.30 5.46 -0.17 -3.80 8.00 -0.83 -4.70 116.55 116.21 1ag8 n ASP 98 Ca 0.08 -3.00 -0.02 0.00 0.71 0.00 0.00 54.79 52.56 1ag8 n ASP 98 Cb 0.16 -0.69 0.08 0.00 -0.02 0.00 0.00 41.12 40.65 1ag8 n ASP 98 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1ag8 h ARG 99 N 3.60 0.29 -0.21 -1.24 2.43 -0.51 -0.51 114.38 118.24 1ag8 h ARG 99 Ca 0.05 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1ag8 h ARG 99 Cb 2.02 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 31.50 1ag8 h ARG 99 CO 0.53 0.19 0.13 1.15 -1.51 0.00 0.00 179.97 180.46 1ag8 h THR 100 N 0.30 1.06 0.04 0.20 2.02 -1.84 -0.35 112.91 114.34 1ag8 h THR 100 Ca 0.27 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.31 1ag8 h THR 100 Cb 0.35 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 1ag8 h THR 100 CO -0.32 0.06 -0.02 0.22 0.37 0.00 0.00 175.52 175.84 1ag8 h TYR 101 N 0.27 -0.04 -0.83 3.16 3.20 -1.82 -1.69 116.97 119.22 1ag8 h TYR 101 Ca 0.08 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 1ag8 h TYR 101 Cb -0.01 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 1ag8 h TYR 101 CO -0.06 -0.02 0.48 -0.07 -1.64 0.00 0.00 178.16 176.85 1ag8 h LEU 102 N -0.06 1.00 -0.51 2.82 3.38 -0.98 0.02 115.31 120.99 1ag8 h LEU 102 Ca -0.00 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 1ag8 h LEU 102 Cb 0.05 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1ag8 h LEU 102 CO 0.01 0.78 -0.18 0.00 0.09 0.00 0.00 178.44 179.14 1ag8 h ALA 103 N 1.39 0.71 -0.23 1.53 0.00 -0.89 0.69 119.26 122.45 1ag8 h ALA 103 Ca 0.29 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1ag8 h ALA 103 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1ag8 h ALA 103 CO -0.05 0.68 0.00 0.00 0.00 0.00 0.00 179.25 179.88 1ag8 h ALA 104 N 0.89 0.31 -0.37 0.00 0.00 -0.90 -2.12 119.26 117.07 1ag8 h ALA 104 Ca 0.12 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1ag8 h ALA 104 Cb 0.77 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1ag8 h ALA 104 CO 0.06 0.03 -0.06 1.25 0.00 0.00 0.00 179.25 180.54 1ag8 h LEU 105 N 0.18 0.60 0.00 0.00 5.85 -0.94 0.84 115.31 121.84 1ag8 h LEU 105 Ca 0.07 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 1ag8 h LEU 105 Cb 0.40 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1ag8 h LEU 105 CO 0.01 0.71 -0.00 -0.08 -0.34 0.00 0.00 178.44 178.74 1ag8 h GLU 106 N 0.58 -0.00 -0.64 1.25 4.57 -0.70 -1.68 114.58 117.95 1ag8 h GLU 106 Ca 0.11 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.21 1ag8 h GLU 106 Cb 0.46 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.02 1ag8 h GLU 106 CO 0.02 0.03 0.09 1.15 -1.18 0.00 0.00 179.01 179.12 1ag8 h THR 107 N -0.03 1.26 -0.49 0.32 2.02 -1.04 0.21 112.91 115.14 1ag8 h THR 107 Ca -0.00 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.14 1ag8 h THR 107 Cb 0.03 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1ag8 h THR 107 CO 0.00 0.39 0.29 0.25 0.37 0.00 0.00 175.52 176.82 1ag8 h LEU 108 N 0.98 0.60 0.00 2.58 5.85 -0.59 0.19 115.31 124.92 1ag8 h LEU 108 Ca 0.19 -0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 1ag8 h LEU 108 Cb 0.45 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1ag8 h LEU 108 CO 0.01 0.49 -1.06 -0.78 -0.34 0.00 0.00 178.44 176.76 1ag8 h ASP 109 N 0.66 0.00 0.00 1.25 3.58 -1.23 -3.39 116.42 117.29 1ag8 h ASP 109 Ca 0.18 0.00 -0.42 0.00 0.42 0.00 0.00 57.03 57.21 1ag8 h ASP 109 Cb 0.00 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 40.98 1ag8 h ASP 109 CO -0.03 0.47 -2.51 -3.20 -2.88 0.00 0.00 179.24 171.09 1ag8 n ASN 110 N -2.97 1.97 0.00 2.28 2.85 0.71 -4.58 115.26 115.52 1ag8 n ASN 110 Ca -0.05 0.05 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1ag8 n ASN 110 Cb 0.77 -0.57 0.00 0.00 1.24 0.00 0.00 39.78 41.21 1ag8 n ASN 110 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ag8 n GLY 111 N 1.86 2.71 3.74 8.20 0.00 0.67 -4.33 105.19 118.04 1ag8 n GLY 111 Ca -0.50 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.15 1ag8 n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ag8 s LYS 112 N -0.40 2.89 0.33 1.61 -2.85 -1.26 -3.90 119.74 116.15 1ag8 s LYS 112 Ca 0.00 2.05 -0.29 0.00 -1.00 0.00 0.00 55.97 56.73 1ag8 s LYS 112 Cb 0.00 -2.02 -0.12 0.00 -2.06 0.00 0.00 37.83 33.63 1ag8 s LYS 112 CO 0.00 -1.33 1.48 -2.30 0.10 0.00 0.00 175.35 173.30 1ag8 n PRO 113 N -1.49 2.52 -0.31 1.78 -0.02 -1.26 -4.52 135.00 131.70 1ag8 n PRO 113 Ca 0.13 0.89 0.11 0.00 -2.02 0.00 0.00 63.50 62.61 1ag8 n PRO 113 Cb 0.47 -2.61 0.34 0.00 -0.02 0.00 0.00 33.50 31.68 1ag8 n PRO 113 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1ag8 h TYR 114 N 3.66 0.94 -0.88 6.00 3.20 -1.45 -0.11 116.97 128.33 1ag8 h TYR 114 Ca -0.48 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.44 1ag8 h TYR 114 Cb 1.25 -0.29 -0.05 0.00 1.54 0.00 0.00 36.73 39.18 1ag8 h TYR 114 CO 0.55 0.33 0.58 0.82 -1.64 0.00 0.00 178.16 178.80 1ag8 h ILE 115 N 0.78 1.20 -0.01 1.81 1.08 -1.90 -0.13 117.51 120.34 1ag8 h ILE 115 Ca 0.48 -0.40 -0.00 0.00 -0.39 0.00 0.00 64.86 64.55 1ag8 h ILE 115 Cb 0.70 -0.06 -0.00 0.00 -3.07 0.00 0.00 36.82 34.39 1ag8 h ILE 115 CO -0.25 0.21 -0.01 0.40 -0.69 0.00 0.00 178.15 177.81 1ag8 h ILE 116 N 1.16 1.41 -0.93 -0.67 1.08 -1.42 0.74 117.51 118.87 1ag8 h ILE 116 Ca 0.33 -1.22 0.14 0.00 -0.39 0.00 0.00 64.86 63.73 1ag8 h ILE 116 Cb -0.08 2.21 -0.09 0.00 -3.07 0.00 0.00 36.82 35.78 1ag8 h ILE 116 CO -0.08 0.32 0.54 0.28 -0.69 0.00 0.00 178.15 178.52 1ag8 h SER 117 N -0.48 0.73 0.16 1.72 0.02 -0.90 0.55 113.55 115.35 1ag8 h SER 117 Ca 0.00 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1ag8 h SER 117 Cb 0.53 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.01 1ag8 h SER 117 CO 0.00 0.33 -0.08 0.22 -1.14 0.00 0.00 176.83 176.17 1ag8 h TYR 118 N 0.79 -0.20 0.00 3.45 5.03 -0.98 0.86 116.97 125.91 1ag8 h TYR 118 Ca 0.49 -0.00 -0.08 0.00 2.58 0.00 0.00 58.73 61.72 1ag8 h TYR 118 Cb 0.63 0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.97 1ag8 h TYR 118 CO -0.04 -0.09 -0.37 -0.07 -1.32 0.00 0.00 178.16 176.26 1ag8 h LEU 119 N -1.05 0.00 0.00 2.82 3.38 -0.81 -3.29 115.31 116.36 1ag8 h LEU 119 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ag8 h LEU 119 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1ag8 h LEU 119 CO 0.04 0.37 0.00 0.52 0.09 0.00 0.00 178.44 179.46 1ag8 n VAL 120 N -3.39 0.00 -0.12 1.22 0.31 0.18 -4.44 118.33 112.08 1ag8 n VAL 120 Ca 0.01 0.18 -0.12 0.00 -0.01 0.00 0.00 64.34 64.39 1ag8 n VAL 120 Cb 0.56 -1.10 -0.07 0.00 -0.91 0.00 0.00 33.84 32.32 1ag8 n VAL 120 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1ag8 h ASP 121 N 0.00 -1.63 0.35 4.52 5.19 -1.23 -0.22 116.42 123.40 1ag8 h ASP 121 Ca 0.00 0.23 -0.07 0.00 -0.62 0.00 0.00 57.03 56.57 1ag8 h ASP 121 Cb 0.00 0.69 -0.01 0.00 0.18 0.00 0.00 39.33 40.19 1ag8 h ASP 121 CO 0.00 -0.39 -0.34 -0.07 -3.12 0.00 0.00 179.24 175.32 1ag8 h LEU 122 N -0.38 0.00 -0.01 1.55 3.38 -0.94 -0.19 115.31 118.72 1ag8 h LEU 122 Ca 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1ag8 h LEU 122 Cb 0.60 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1ag8 h LEU 122 CO -0.58 0.34 -0.00 -0.78 0.09 0.00 0.00 178.44 177.51 1ag8 h ASP 123 N 0.00 0.02 -0.23 -0.43 3.58 -1.48 -1.42 116.42 116.46 1ag8 h ASP 123 Ca -0.00 -0.39 -0.03 0.00 0.42 0.00 0.00 57.03 57.03 1ag8 h ASP 123 Cb 0.60 -0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.63 1ag8 h ASP 123 CO 0.04 0.40 0.08 0.24 -2.88 0.00 0.00 179.24 177.12 1ag8 h MET 124 N -0.37 0.44 0.04 0.28 2.86 -0.79 -0.27 114.93 117.12 1ag8 h MET 124 Ca 0.00 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1ag8 h MET 124 Cb 0.39 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.97 1ag8 h MET 124 CO 0.00 0.41 -0.02 0.28 1.06 0.00 0.00 176.91 178.64 1ag8 h VAL 125 N 0.44 1.13 -0.40 -2.22 2.07 -0.88 -1.43 116.25 114.95 1ag8 h VAL 125 Ca 0.10 -0.56 0.02 0.00 0.82 0.00 0.00 66.70 67.08 1ag8 h VAL 125 Cb 0.17 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1ag8 h VAL 125 CO -0.00 0.14 0.24 -0.07 0.02 0.00 0.00 177.57 177.89 1ag8 h LEU 126 N -0.31 0.38 -1.20 2.57 3.38 -0.81 -2.38 115.31 116.94 1ag8 h LEU 126 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1ag8 h LEU 126 Cb 0.28 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1ag8 h LEU 126 CO 0.01 0.28 0.20 0.11 0.09 0.00 0.00 178.44 179.13 1ag8 h LYS 127 N 0.48 0.76 0.34 1.13 1.57 -1.03 -0.49 116.57 119.33 1ag8 h LYS 127 Ca 0.16 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1ag8 h LYS 127 Cb 0.00 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1ag8 h LYS 127 CO -0.07 0.63 -0.16 0.00 -0.57 0.00 0.00 179.45 179.28 1ag8 h LEU 129 N -0.81 0.88 -1.09 0.00 3.38 -1.40 -0.53 115.31 115.74 1ag8 h LEU 129 Ca -0.05 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1ag8 h LEU 129 Cb 0.52 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1ag8 h LEU 129 CO 0.08 0.66 0.17 -0.09 0.09 0.00 0.00 178.44 179.35 1ag8 h ARG 130 N 1.03 0.82 0.57 1.13 9.65 -1.09 -1.06 114.38 125.43 1ag8 h ARG 130 Ca 0.28 -0.15 -0.03 0.00 -1.10 0.00 0.00 59.98 58.98 1ag8 h ARG 130 Cb -0.09 -0.13 0.01 0.00 -1.39 0.00 0.00 29.97 28.36 1ag8 h ARG 130 CO -0.06 0.71 -0.27 -0.92 2.80 0.00 0.00 179.97 182.23 1ag8 h TYR 131 N 0.80 -0.71 0.00 2.20 3.20 0.10 -3.15 116.97 119.41 1ag8 h TYR 131 Ca 0.18 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 1ag8 h TYR 131 Cb 0.23 0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.74 1ag8 h TYR 131 CO 0.01 -0.38 -0.03 1.88 -1.64 0.00 0.00 178.16 178.01 1ag8 h TYR 132 N -1.00 0.00 -0.32 -3.82 0.05 -1.04 -2.44 116.97 108.41 1ag8 h TYR 132 Ca -0.08 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.69 1ag8 h TYR 132 Cb 0.65 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.37 1ag8 h TYR 132 CO 0.00 0.03 0.15 0.00 -1.05 0.00 0.00 178.16 177.29 1ag8 h ALA 133 N 1.97 1.68 0.00 3.88 0.00 -1.15 -1.58 119.26 124.06 1ag8 h ALA 133 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ag8 h ALA 133 Cb 0.33 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ag8 h ALA 133 CO 0.00 0.27 -0.04 0.78 0.00 0.00 0.00 179.25 180.26 1ag8 h GLY 134 N 0.54 0.00 1.84 0.00 0.00 -1.50 -3.27 103.07 100.68 1ag8 h GLY 134 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.30 1ag8 h GLY 134 CO -0.02 0.00 -0.76 1.49 0.00 0.00 0.00 176.54 177.25 1ag8 h TRP 135 N 0.00 0.00 -0.91 5.60 -0.00 -1.36 -3.39 115.95 115.88 1ag8 h TRP 135 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 58.89 59.08 1ag8 h TRP 135 Cb 0.76 0.00 -0.17 0.00 -0.00 0.00 0.00 29.16 29.75 1ag8 h TRP 135 CO 0.00 0.63 -0.22 0.00 -0.00 0.00 0.00 178.44 178.86 1ag8 n ALA 136 N -2.28 0.23 -1.05 1.49 0.00 -1.17 -1.03 120.51 116.70 1ag8 n ALA 136 Ca -0.00 1.00 0.04 0.00 0.00 0.00 0.00 53.44 54.48 1ag8 n ALA 136 Cb 0.80 -0.61 0.29 0.00 0.00 0.00 0.00 19.45 19.93 1ag8 n ALA 136 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ag8 n ASP 137 N -5.48 4.24 0.00 0.00 5.68 -1.26 -4.53 116.55 115.19 1ag8 n ASP 137 Ca 0.15 -3.14 0.00 0.00 -0.50 0.00 0.00 54.79 51.30 1ag8 n ASP 137 Cb 0.47 -0.62 0.00 0.00 -1.14 0.00 0.00 41.12 39.83 1ag8 n ASP 137 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1ag8 n LYS 138 N -0.32 6.39 -2.12 0.11 5.02 -0.20 -4.85 118.16 122.18 1ag8 n LYS 138 Ca 0.28 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.15 1ag8 n LYS 138 Cb 1.07 -0.53 0.00 0.00 -0.02 0.00 0.00 35.03 35.55 1ag8 n LYS 138 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1ag8 n TYR 139 N -1.02 3.99 -0.85 2.13 9.36 -1.18 -4.95 117.16 124.63 1ag8 n TYR 139 Ca 0.00 -2.93 -0.30 0.00 3.32 0.00 0.00 57.90 57.99 1ag8 n TYR 139 Cb 0.00 -2.55 0.16 0.00 -0.63 0.00 0.00 39.34 36.33 1ag8 n TYR 139 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 1ag8 s HIS 140 N 3.39 1.86 0.00 2.98 3.76 -1.26 -4.84 115.29 121.18 1ag8 s HIS 140 Ca 0.49 1.57 0.00 0.00 -0.15 0.00 0.00 55.06 56.97 1ag8 s HIS 140 Cb 0.09 -3.22 0.00 0.00 1.11 0.00 0.00 32.58 30.57 1ag8 s HIS 140 CO -0.02 -2.74 0.00 0.41 -0.85 0.00 0.00 174.74 171.54 1ag8 n GLY 141 N -0.16 1.82 3.09 -2.22 0.00 -1.26 -4.87 105.19 101.59 1ag8 n GLY 141 Ca 0.09 -2.04 -0.11 0.00 0.00 0.00 0.00 46.02 43.96 1ag8 n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ag8 s LYS 142 N 2.24 0.61 -0.24 1.61 1.02 -1.21 -4.95 119.74 118.82 1ag8 s LYS 142 Ca 0.00 -0.96 -0.06 0.00 0.02 0.00 0.00 55.97 54.97 1ag8 s LYS 142 Cb 0.00 -0.19 -0.02 0.00 -0.52 0.00 0.00 37.83 37.11 1ag8 s LYS 142 CO 0.00 0.01 0.02 0.95 -0.92 0.00 0.00 175.35 175.41 1ag8 s THR 143 N -2.29 3.88 -0.17 2.17 -4.23 -1.26 -0.37 115.64 113.37 1ag8 s THR 143 Ca -0.02 -0.36 -0.06 0.00 -1.18 0.00 0.00 61.69 60.07 1ag8 s THR 143 Cb -0.04 -2.82 -0.03 0.00 1.34 0.00 0.00 72.50 70.95 1ag8 s THR 143 CO -0.02 0.35 0.02 -0.63 -0.54 0.00 0.00 174.62 173.80 1ag8 s ILE 144 N 1.55 4.39 -0.97 2.99 1.01 -0.23 -4.99 121.20 124.95 1ag8 s ILE 144 Ca 0.06 -0.18 -0.07 0.00 0.00 0.00 0.00 60.65 60.47 1ag8 s ILE 144 Cb -0.15 -2.96 -0.08 0.00 0.01 0.00 0.00 42.46 39.28 1ag8 s ILE 144 CO 0.01 0.47 2.44 -0.81 0.00 0.00 0.00 174.94 177.04 1ag8 n PRO 145 N 3.58 2.42 -0.86 2.79 -0.04 -1.26 -3.99 135.00 137.65 1ag8 n PRO 145 Ca -0.17 -1.54 -0.30 0.00 -0.04 0.00 0.00 63.50 61.45 1ag8 n PRO 145 Cb 0.52 -2.45 0.16 0.00 -0.04 0.00 0.00 33.50 31.69 1ag8 n PRO 145 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1ag8 s ILE 146 N 2.79 2.40 0.68 0.52 2.07 -1.26 -5.00 121.20 123.39 1ag8 s ILE 146 Ca 0.49 0.13 -0.12 0.00 -1.41 0.00 0.00 60.65 59.74 1ag8 s ILE 146 Cb 0.14 -2.31 -0.00 0.00 0.13 0.00 0.00 42.46 40.42 1ag8 s ILE 146 CO -0.04 -0.17 1.06 -1.81 -1.91 0.00 0.00 174.94 172.07 1ag8 s ASP 147 N -2.90 5.47 0.00 4.50 1.01 -1.26 -4.86 116.67 118.63 1ag8 s ASP 147 Ca 0.65 1.65 0.00 0.00 0.71 0.00 0.00 52.55 55.56 1ag8 s ASP 147 Cb -0.21 -2.50 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1ag8 s ASP 147 CO 0.58 -1.38 0.00 0.61 0.21 0.00 0.00 175.17 175.19 1ag8 n GLY 148 N -1.82 -1.31 3.16 0.21 0.00 -1.26 -4.56 105.19 99.61 1ag8 n GLY 148 Ca 0.08 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 44.11 1ag8 n GLY 148 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ag8 n ASP 149 N -1.24 4.74 -4.11 1.61 8.00 -1.26 -4.77 116.55 119.53 1ag8 n ASP 149 Ca 0.00 -2.95 -0.10 0.00 0.71 0.00 0.00 54.79 52.44 1ag8 n ASP 149 Cb 0.00 -1.62 -0.09 0.00 -0.02 0.00 0.00 41.12 39.39 1ag8 n ASP 149 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1ag8 s TYR 150 N 2.48 0.79 -0.26 1.24 2.02 -1.26 -1.37 117.35 120.99 1ag8 s TYR 150 Ca 0.46 -1.13 0.01 0.00 -0.37 0.00 0.00 57.07 56.05 1ag8 s TYR 150 Cb 0.07 -0.36 0.07 0.00 -0.40 0.00 0.00 41.96 41.34 1ag8 s TYR 150 CO -0.00 -0.63 -0.03 0.12 -1.57 0.00 0.00 175.55 173.45 1ag8 s PHE 151 N -4.05 2.58 -0.03 2.71 5.36 0.57 -4.81 117.98 120.31 1ag8 s PHE 151 Ca 0.26 -1.97 0.02 0.00 -0.96 0.00 0.00 56.93 54.27 1ag8 s PHE 151 Cb 0.06 -1.81 -0.03 0.00 -0.34 0.00 0.00 43.02 40.90 1ag8 s PHE 151 CO 0.04 -0.82 -0.05 0.45 -1.46 0.00 0.00 175.22 173.39 1ag8 s SER 152 N 1.33 4.78 0.15 6.13 0.15 -1.26 -0.85 113.70 124.14 1ag8 s SER 152 Ca -0.02 -0.05 -0.19 0.00 0.70 0.00 0.00 55.95 56.39 1ag8 s SER 152 Cb -0.19 -1.19 0.05 0.00 -1.71 0.00 0.00 66.02 62.98 1ag8 s SER 152 CO -0.08 0.32 0.50 -0.72 1.20 0.00 0.00 173.24 174.46 1ag8 s TYR 153 N -0.93 -0.33 0.12 3.44 -0.85 -0.81 -1.07 117.35 116.92 1ag8 s TYR 153 Ca 0.15 0.05 0.10 0.00 -0.52 0.00 0.00 57.07 56.85 1ag8 s TYR 153 Cb -0.11 0.40 -0.04 0.00 0.38 0.00 0.00 41.96 42.59 1ag8 s TYR 153 CO 0.05 -0.80 -0.21 0.95 -1.52 0.00 0.00 175.55 174.02 1ag8 s THR 154 N -3.79 2.62 -0.09 -3.49 -4.23 0.50 -0.54 115.64 106.61 1ag8 s THR 154 Ca 0.03 -1.59 0.03 0.00 -1.18 0.00 0.00 61.69 58.98 1ag8 s THR 154 Cb 0.00 -2.19 -0.01 0.00 1.34 0.00 0.00 72.50 71.64 1ag8 s THR 154 CO -0.11 0.10 -0.18 -0.13 -0.54 0.00 0.00 174.62 173.76 1ag8 s ARG 155 N -2.10 2.95 -0.68 3.99 0.52 0.73 -3.35 118.95 121.02 1ag8 s ARG 155 Ca 0.16 -0.78 -0.12 0.00 -0.52 0.00 0.00 55.73 54.47 1ag8 s ARG 155 Cb -0.10 -2.40 0.17 0.00 0.52 0.00 0.00 34.95 33.14 1ag8 s ARG 155 CO 0.08 0.32 0.59 -1.01 0.02 0.00 0.00 175.30 175.31 1ag8 s HIS 156 N 0.03 3.54 0.44 -0.53 3.76 -1.26 -1.28 115.29 119.99 1ag8 s HIS 156 Ca -0.07 -1.90 0.04 0.00 -0.15 0.00 0.00 55.06 52.99 1ag8 s HIS 156 Cb -0.15 -3.68 0.01 0.00 1.11 0.00 0.00 32.58 29.87 1ag8 s HIS 156 CO 0.05 -0.98 0.62 -1.21 -0.85 0.00 0.00 174.74 172.37 1ag8 s GLU 157 N 0.67 2.88 0.53 1.40 2.02 0.14 -4.88 118.70 121.47 1ag8 s GLU 157 Ca 0.12 -0.87 -0.19 0.00 0.02 0.00 0.00 54.97 54.05 1ag8 s GLU 157 Cb -0.19 -2.65 -0.06 0.00 0.10 0.00 0.00 34.13 31.33 1ag8 s GLU 157 CO -0.04 -0.31 1.07 -2.14 0.02 0.00 0.00 175.26 173.86 1ag8 s PRO 158 N -4.47 3.53 0.52 0.39 0.02 -1.26 -0.30 135.00 133.43 1ag8 s PRO 158 Ca 0.51 1.38 0.30 0.00 0.02 0.00 0.00 61.00 63.22 1ag8 s PRO 158 Cb -0.10 -2.05 1.20 0.00 0.02 0.00 0.00 34.50 33.57 1ag8 s PRO 158 CO 0.35 -0.66 1.93 0.28 -0.33 0.00 0.00 177.00 178.57 1ag8 h VAL 159 N 1.13 0.16 0.00 3.83 2.07 -1.81 -3.39 116.25 118.23 1ag8 h VAL 159 Ca -0.49 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.33 1ag8 h VAL 159 Cb 1.23 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 1ag8 h VAL 159 CO 0.58 0.06 0.00 0.61 0.02 0.00 0.00 177.57 178.84 1ag8 n GLY 160 N 0.10 0.33 3.62 2.17 0.00 -1.26 -4.79 105.19 105.37 1ag8 n GLY 160 Ca 0.01 -1.61 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 1ag8 n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ag8 s VAL 161 N 0.00 4.37 -0.19 1.61 1.01 -1.26 -2.15 120.40 123.78 1ag8 s VAL 161 Ca 0.00 1.51 -0.06 0.00 0.00 0.00 0.00 61.98 63.44 1ag8 s VAL 161 Cb 0.00 -4.47 -0.03 0.00 0.00 0.00 0.00 36.38 31.88 1ag8 s VAL 161 CO 0.00 -0.68 0.03 0.00 0.00 0.00 0.00 175.10 174.44 1ag8 s GLY 163 N 0.75 2.33 -0.19 0.00 0.00 0.73 -1.04 107.32 109.90 1ag8 s GLY 163 Ca 0.01 -0.28 -0.00 0.00 0.00 0.00 0.00 44.72 44.45 1ag8 s GLY 163 CO 0.02 0.63 -0.05 1.20 0.00 0.00 0.00 173.10 174.90 1ag8 s GLN 164 N 0.50 1.42 -0.25 2.90 -0.21 -0.21 -0.68 119.66 123.12 1ag8 s GLN 164 Ca 0.23 -0.64 -0.08 0.00 0.02 0.00 0.00 55.36 54.89 1ag8 s GLN 164 Cb -0.14 -2.18 -0.03 0.00 1.00 0.00 0.00 33.01 31.66 1ag8 s GLN 164 CO 0.08 -0.50 0.08 0.42 -2.12 0.00 0.00 175.29 173.26 1ag8 s ILE 165 N 1.59 4.41 0.17 1.08 1.01 0.09 -0.79 121.20 128.76 1ag8 s ILE 165 Ca -0.01 -0.15 0.10 0.00 0.00 0.00 0.00 60.65 60.59 1ag8 s ILE 165 Cb -0.16 -3.07 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 1ag8 s ILE 165 CO -0.07 0.32 -0.22 0.27 0.00 0.00 0.00 174.94 175.24 1ag8 s ILE 166 N 1.63 2.12 0.85 2.92 -4.36 -0.84 -1.51 121.20 122.00 1ag8 s ILE 166 Ca 0.06 -1.93 -0.12 0.00 -0.26 0.00 0.00 60.65 58.40 1ag8 s ILE 166 Cb -0.15 -1.97 0.19 0.00 1.25 0.00 0.00 42.46 41.77 1ag8 s ILE 166 CO 0.04 -0.16 1.15 -0.81 0.24 0.00 0.00 174.94 175.41 1ag8 n PRO 167 N 0.40 -0.94 0.00 0.37 -0.04 -1.22 -3.02 135.00 130.55 1ag8 n PRO 167 Ca -0.14 -2.02 0.12 0.00 -0.04 0.00 0.00 63.50 61.42 1ag8 n PRO 167 Cb 0.56 -1.11 0.08 0.00 -0.04 0.00 0.00 33.50 32.99 1ag8 n PRO 167 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1ag8 n TRP 168 N -3.47 0.00 -0.00 0.54 4.27 -1.26 -4.38 117.44 113.14 1ag8 n TRP 168 Ca 0.15 0.00 -0.15 0.00 -3.89 0.00 0.00 57.50 53.61 1ag8 n TRP 168 Cb 0.53 -0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.44 1ag8 n TRP 168 CO 0.00 0.00 0.00 -2.95 -2.29 0.00 0.00 177.69 172.45 1ag8 h ASN 169 N 3.65 0.82 -2.15 -0.67 -1.07 -1.97 -3.37 115.58 110.82 1ag8 h ASN 169 Ca 0.00 -0.54 -0.57 0.00 0.07 0.00 0.00 56.30 55.26 1ag8 h ASN 169 Cb 0.88 -0.24 -0.39 0.00 -2.07 0.00 0.00 38.32 36.49 1ag8 h ASN 169 CO 0.00 1.32 -1.00 0.49 0.07 0.00 0.00 177.43 178.31 1ag8 n PHE 170 N -3.91 0.09 -0.14 4.14 3.01 -1.26 -5.03 117.46 114.35 1ag8 n PHE 170 Ca -0.06 -3.60 -0.10 0.00 1.01 0.00 0.00 57.45 54.70 1ag8 n PHE 170 Cb 0.73 -0.24 -0.07 0.00 -0.01 0.00 0.00 39.48 39.89 1ag8 n PHE 170 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1ag8 h PRO 171 N 4.47 -0.23 -0.61 -1.08 0.11 -1.76 0.20 132.00 133.10 1ag8 h PRO 171 Ca 0.14 0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.18 1ag8 h PRO 171 Cb 0.86 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.99 1ag8 h PRO 171 CO 0.49 -0.15 0.06 -0.07 -0.21 0.00 0.00 178.00 178.12 1ag8 h LEU 172 N -0.23 1.00 -0.34 2.35 3.38 -1.94 -2.78 115.31 116.75 1ag8 h LEU 172 Ca 0.07 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 1ag8 h LEU 172 Cb 0.41 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1ag8 h LEU 172 CO -0.49 1.02 -0.16 0.25 0.09 0.00 0.00 178.44 179.15 1ag8 h LEU 173 N 0.96 0.73 -1.00 1.67 5.85 -1.79 -1.25 115.31 120.48 1ag8 h LEU 173 Ca 0.18 -0.40 -0.06 0.00 0.84 0.00 0.00 57.88 58.44 1ag8 h LEU 173 Cb 0.48 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1ag8 h LEU 173 CO 0.02 0.97 0.09 0.24 -0.34 0.00 0.00 178.44 179.42 1ag8 h MET 174 N 0.49 0.81 -0.35 1.25 2.86 -0.61 0.54 114.93 119.92 1ag8 h MET 174 Ca 0.08 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 1ag8 h MET 174 Cb 0.69 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 1ag8 h MET 174 CO 0.05 0.76 0.15 0.37 1.06 0.00 0.00 176.91 179.29 1ag8 h GLN 175 N 0.78 0.53 -0.76 1.72 4.15 -1.36 -2.72 115.11 117.45 1ag8 h GLN 175 Ca 0.17 -0.09 -0.06 0.00 0.77 0.00 0.00 58.65 59.44 1ag8 h GLN 175 Cb 0.34 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.91 1ag8 h GLN 175 CO 0.00 0.50 0.25 0.00 -1.93 0.00 0.00 178.83 177.66 1ag8 h ALA 176 N 1.00 1.01 0.00 3.38 0.00 -0.49 -0.80 119.26 123.36 1ag8 h ALA 176 Ca 0.12 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1ag8 h ALA 176 Cb 0.17 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1ag8 h ALA 176 CO -0.01 0.67 -0.14 -1.49 0.00 0.00 0.00 179.25 178.28 1ag8 h TRP 177 N 1.12 0.00 0.00 0.00 4.06 -0.73 -1.15 115.95 119.25 1ag8 h TRP 177 Ca 0.25 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 61.13 1ag8 h TRP 177 Cb 0.29 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.44 1ag8 h TRP 177 CO 0.02 0.14 -0.42 0.87 -3.56 0.00 0.00 178.44 175.49 1ag8 h LYS 178 N 0.00 0.00 -0.41 0.49 1.79 -1.17 -3.40 116.57 113.88 1ag8 h LYS 178 Ca -0.00 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.39 1ag8 h LYS 178 Cb 0.27 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.90 1ag8 h LYS 178 CO 0.02 0.77 -0.05 -0.07 -1.08 0.00 0.00 179.45 179.04 1ag8 h LEU 179 N -1.00 0.67 0.06 2.94 3.38 -1.10 -3.03 115.31 117.23 1ag8 h LEU 179 Ca -0.10 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1ag8 h LEU 179 Cb 0.91 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1ag8 h LEU 179 CO -0.06 0.78 -0.21 1.23 0.09 0.00 0.00 178.44 180.26 1ag8 h GLY 180 N 0.95 -1.18 1.30 0.83 0.00 -1.41 -0.34 103.07 103.23 1ag8 h GLY 180 Ca 0.12 0.56 -0.05 0.00 0.00 0.00 0.00 47.33 47.96 1ag8 h GLY 180 CO 0.02 -0.38 0.14 -0.56 0.00 0.00 0.00 176.54 175.76 1ag8 h PRO 181 N -0.31 0.88 0.41 4.80 0.13 -1.76 -1.77 132.00 134.38 1ag8 h PRO 181 Ca -0.00 -0.18 -0.02 0.00 -0.87 0.00 0.00 66.00 64.92 1ag8 h PRO 181 Cb 0.30 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.31 1ag8 h PRO 181 CO -0.11 0.79 -0.20 0.00 -0.23 0.00 0.00 178.00 178.25 1ag8 h ALA 182 N 1.31 -0.56 -0.56 -0.56 0.00 -1.44 -2.59 119.26 114.86 1ag8 h ALA 182 Ca 0.18 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1ag8 h ALA 182 Cb 0.30 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1ag8 h ALA 182 CO -0.00 -0.72 -0.04 -0.07 0.00 0.00 0.00 179.25 178.41 1ag8 h LEU 183 N -0.73 1.02 -2.35 0.00 3.38 -1.07 -1.90 115.31 113.66 1ag8 h LEU 183 Ca -0.06 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1ag8 h LEU 183 Cb 0.52 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ag8 h LEU 183 CO 0.09 1.10 0.00 0.00 0.09 0.00 0.00 178.44 179.72 1ag8 h ALA 184 N 0.95 1.66 0.00 1.53 0.00 -1.33 -1.32 119.26 120.75 1ag8 h ALA 184 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ag8 h ALA 184 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1ag8 h ALA 184 CO 0.04 -0.00 -0.69 2.41 0.00 0.00 0.00 179.25 181.00 1ag8 n THR 185 N -4.03 0.06 -0.27 0.00 -1.04 -0.98 -4.14 114.28 103.87 1ag8 n THR 185 Ca -0.03 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 1ag8 n THR 185 Cb 0.09 0.35 0.00 0.00 -1.82 0.00 0.00 70.33 68.94 1ag8 n THR 185 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ag8 n GLY 186 N 1.46 0.84 3.95 3.41 0.00 -0.50 -4.25 105.19 110.11 1ag8 n GLY 186 Ca 0.04 -0.30 -0.25 0.00 0.00 0.00 0.00 46.02 45.52 1ag8 n GLY 186 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ag8 s ASN 187 N -2.27 4.62 0.15 1.61 -0.87 -0.75 -4.78 114.94 112.65 1ag8 s ASN 187 Ca 0.00 0.14 0.10 0.00 -1.57 0.00 0.00 52.86 51.52 1ag8 s ASN 187 Cb 0.00 -0.71 -0.04 0.00 -0.02 0.00 0.00 41.25 40.48 1ag8 s ASN 187 CO 0.00 -1.68 -0.18 0.68 -2.57 0.00 0.00 177.10 173.35 1ag8 s VAL 188 N -3.19 2.78 -0.01 1.60 -7.23 -0.92 -4.61 120.40 108.84 1ag8 s VAL 188 Ca 0.62 -1.66 0.06 0.00 -1.81 0.00 0.00 61.98 59.19 1ag8 s VAL 188 Cb -0.09 -2.31 -0.02 0.00 0.56 0.00 0.00 36.38 34.53 1ag8 s VAL 188 CO 0.44 0.01 -0.19 -0.69 -0.31 0.00 0.00 175.10 174.36 1ag8 s VAL 189 N -1.37 1.49 -0.28 1.32 1.01 0.11 -0.88 120.40 121.80 1ag8 s VAL 189 Ca 0.20 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.33 1ag8 s VAL 189 Cb -0.10 -1.25 0.08 0.00 0.00 0.00 0.00 36.38 35.12 1ag8 s VAL 189 CO 0.11 0.38 0.02 -0.69 0.00 0.00 0.00 175.10 174.93 1ag8 s VAL 190 N -0.49 1.41 -0.13 2.92 1.01 -0.20 -1.11 120.40 123.81 1ag8 s VAL 190 Ca 0.07 -1.47 -0.03 0.00 0.00 0.00 0.00 61.98 60.55 1ag8 s VAL 190 Cb -0.07 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 1ag8 s VAL 190 CO -0.00 -0.40 -0.02 -0.32 0.00 0.00 0.00 175.10 174.36 1ag8 s MET 191 N 1.39 3.40 -0.25 2.72 1.75 0.77 -1.05 119.30 128.03 1ag8 s MET 191 Ca 0.03 -0.48 -0.05 0.00 -1.25 0.00 0.00 55.69 53.94 1ag8 s MET 191 Cb -0.18 -2.86 -0.01 0.00 2.84 0.00 0.00 34.83 34.62 1ag8 s MET 191 CO -0.13 0.42 0.02 0.21 -0.65 0.00 0.00 175.02 174.89 1ag8 s LYS 192 N -0.12 3.37 0.12 4.11 2.47 0.03 0.20 119.74 129.92 1ag8 s LYS 192 Ca 0.03 -0.65 -0.00 0.00 -1.56 0.00 0.00 55.97 53.79 1ag8 s LYS 192 Cb -0.13 -3.18 -0.04 0.00 -1.46 0.00 0.00 37.83 33.02 1ag8 s LYS 192 CO 0.02 -0.26 0.29 0.14 0.16 0.00 0.00 175.35 175.71 1ag8 s VAL 193 N 1.51 5.30 0.16 4.02 -7.23 -1.14 -1.98 120.40 121.04 1ag8 s VAL 193 Ca 0.05 -0.38 -0.32 0.00 -1.81 0.00 0.00 61.98 59.53 1ag8 s VAL 193 Cb -0.15 -3.68 -0.10 0.00 0.56 0.00 0.00 36.38 33.01 1ag8 s VAL 193 CO -0.00 0.00 1.56 0.00 -0.31 0.00 0.00 175.10 176.35 1ag8 s ALA 194 N -1.67 3.77 0.56 1.32 0.00 -1.17 -3.94 121.76 120.63 1ag8 s ALA 194 Ca 0.37 1.36 0.26 0.00 0.00 0.00 0.00 51.96 53.95 1ag8 s ALA 194 Cb -0.12 -3.62 1.49 0.00 0.00 0.00 0.00 23.12 20.88 1ag8 s ALA 194 CO 0.28 -0.77 2.03 1.05 0.00 0.00 0.00 175.76 178.35 1ag8 h GLU 195 N 6.80 0.00 0.00 0.00 9.09 -1.91 0.11 114.58 128.68 1ag8 h GLU 195 Ca -0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.98 1ag8 h GLU 195 Cb 1.20 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.30 1ag8 h GLU 195 CO 0.91 0.00 0.00 1.96 0.05 0.00 0.00 179.01 181.93 1ag8 h GLN 196 N 0.00 0.00 -0.61 1.06 7.50 -1.90 -3.39 115.11 117.78 1ag8 h GLN 196 Ca 0.17 0.00 -0.32 0.00 0.50 0.00 0.00 58.65 59.00 1ag8 h GLN 196 Cb 0.78 0.00 -0.22 0.00 0.05 0.00 0.00 27.48 28.09 1ag8 h GLN 196 CO -0.00 0.00 -0.68 -2.37 -1.50 0.00 0.00 178.83 174.28 1ag8 n THR 197 N -2.93 -0.19 0.10 -0.54 5.66 -0.00 -4.73 114.28 111.65 1ag8 n THR 197 Ca 0.03 -2.29 0.11 0.00 -3.05 0.00 0.00 64.05 58.85 1ag8 n THR 197 Cb 0.43 0.53 -0.01 0.00 -1.55 0.00 0.00 70.33 69.73 1ag8 n THR 197 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1ag8 n PRO 198 N 1.37 0.61 0.04 1.09 -0.04 -1.02 -4.56 135.00 132.49 1ag8 n PRO 198 Ca 0.13 0.12 -0.15 0.00 -0.04 0.00 0.00 63.50 63.55 1ag8 n PRO 198 Cb 0.61 -1.82 -0.09 0.00 -0.04 0.00 0.00 33.50 32.16 1ag8 n PRO 198 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1ag8 h LEU 199 N 0.00 -1.63 -0.94 1.53 3.38 -1.90 -2.65 115.31 113.11 1ag8 h LEU 199 Ca -0.01 0.19 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1ag8 h LEU 199 Cb 1.03 0.62 -0.05 0.00 0.09 0.00 0.00 40.66 42.35 1ag8 h LEU 199 CO 0.00 -0.51 0.62 0.71 0.09 0.00 0.00 178.44 179.35 1ag8 h THR 200 N -0.65 1.23 -0.53 0.22 1.35 -1.88 -2.34 112.91 110.31 1ag8 h THR 200 Ca 0.02 -0.43 -0.01 0.00 -0.55 0.00 0.00 66.41 65.44 1ag8 h THR 200 Cb 0.71 -0.14 -0.03 0.00 -1.73 0.00 0.00 68.15 66.97 1ag8 h THR 200 CO -0.37 0.23 0.28 0.00 -0.25 0.00 0.00 175.52 175.41 1ag8 h ALA 201 N 1.35 1.50 -0.23 6.62 0.00 -1.81 -1.90 119.26 124.78 1ag8 h ALA 201 Ca 0.35 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.97 1ag8 h ALA 201 Cb -0.12 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.46 1ag8 h ALA 201 CO -0.08 0.41 -0.64 -0.07 0.00 0.00 0.00 179.25 178.87 1ag8 h LEU 202 N 0.74 0.96 -0.57 0.00 3.38 -1.07 -1.94 115.31 116.81 1ag8 h LEU 202 Ca 0.19 -0.58 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1ag8 h LEU 202 Cb 0.04 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 1ag8 h LEU 202 CO -0.03 1.37 0.29 0.22 0.09 0.00 0.00 178.44 180.38 1ag8 h TYR 203 N 0.60 0.80 -0.21 1.13 3.20 -1.07 -1.55 116.97 119.88 1ag8 h TYR 203 Ca -0.02 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 1ag8 h TYR 203 Cb 1.26 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 1ag8 h TYR 203 CO 0.08 0.60 -0.00 0.28 -1.64 0.00 0.00 178.16 177.48 1ag8 h VAL 204 N 0.77 1.14 -0.78 1.81 2.07 -1.31 -1.52 116.25 118.43 1ag8 h VAL 204 Ca 0.20 -0.53 0.07 0.00 0.82 0.00 0.00 66.70 67.26 1ag8 h VAL 204 Cb 0.08 0.98 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 1ag8 h VAL 204 CO -0.03 0.18 0.46 0.00 0.02 0.00 0.00 177.57 178.20 1ag8 h ALA 205 N 1.70 1.07 -0.09 1.67 0.00 -0.47 0.36 119.26 123.51 1ag8 h ALA 205 Ca 0.07 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1ag8 h ALA 205 Cb 0.21 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1ag8 h ALA 205 CO 0.00 0.16 -0.44 -0.97 0.00 0.00 0.00 179.25 178.00 1ag8 h ASN 206 N 0.83 0.22 0.08 0.00 -1.24 -0.91 -2.41 115.58 112.14 1ag8 h ASN 206 Ca 0.35 -0.09 -0.08 0.00 0.71 0.00 0.00 56.30 57.18 1ag8 h ASN 206 Cb 0.21 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 1ag8 h ASN 206 CO -0.19 0.63 -0.27 -0.07 -1.29 0.00 0.00 177.43 176.24 1ag8 h LEU 207 N 0.17 0.31 -0.59 0.34 3.38 -0.66 -1.02 115.31 117.23 1ag8 h LEU 207 Ca 0.01 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.90 1ag8 h LEU 207 Cb 0.85 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1ag8 h LEU 207 CO 0.07 0.58 0.38 0.40 0.09 0.00 0.00 178.44 179.96 1ag8 h ILE 208 N 0.28 1.12 0.22 1.22 2.04 -0.50 0.46 117.51 122.34 1ag8 h ILE 208 Ca 0.04 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 1ag8 h ILE 208 Cb 0.63 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1ag8 h ILE 208 CO 0.05 0.14 -0.11 0.50 0.00 0.00 0.00 178.15 178.73 1ag8 h LYS 209 N 0.76 -0.28 -0.77 2.37 3.64 -1.17 -2.72 116.57 118.39 1ag8 h LYS 209 Ca 0.23 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.72 1ag8 h LYS 209 Cb -0.04 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.79 1ag8 h LYS 209 CO -0.07 -0.12 0.51 1.49 -2.27 0.00 0.00 179.45 178.99 1ag8 h GLU 210 N -0.39 0.70 0.00 1.90 4.81 -0.76 -0.54 114.58 120.30 1ag8 h GLU 210 Ca -0.03 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1ag8 h GLU 210 Cb 0.30 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 1ag8 h GLU 210 CO 0.05 0.46 -0.05 0.00 -0.73 0.00 0.00 179.01 178.74 1ag8 h ALA 211 N 1.61 1.35 0.00 2.92 0.00 0.20 -3.46 119.26 121.88 1ag8 h ALA 211 Ca 0.35 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1ag8 h ALA 211 Cb 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ag8 h ALA 211 CO -0.13 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.59 1ag8 n GLY 212 N -0.98 1.18 3.76 0.00 0.00 -0.21 -4.89 105.19 104.06 1ag8 n GLY 212 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1ag8 n GLY 212 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ag8 s PHE 213 N -2.00 3.29 0.48 1.61 0.40 -1.08 -4.97 117.98 115.71 1ag8 s PHE 213 Ca 0.00 1.55 -0.23 0.00 -0.60 0.00 0.00 56.93 57.65 1ag8 s PHE 213 Cb 0.00 -3.48 -0.07 0.00 0.51 0.00 0.00 43.02 39.98 1ag8 s PHE 213 CO 0.00 -1.23 1.28 -2.14 0.70 0.00 0.00 175.22 173.83 1ag8 s PRO 214 N -1.68 3.55 0.35 0.24 0.02 -1.26 -4.81 135.00 131.41 1ag8 s PRO 214 Ca 0.48 2.07 -0.28 0.00 0.02 0.00 0.00 61.00 63.29 1ag8 s PRO 214 Cb -0.36 -2.43 -0.12 0.00 0.02 0.00 0.00 34.50 31.61 1ag8 s PRO 214 CO 0.46 -0.81 1.31 -2.30 -0.33 0.00 0.00 177.00 175.34 1ag8 n PRO 215 N -0.56 2.18 0.00 5.54 -0.02 -1.26 -2.43 135.00 138.46 1ag8 n PRO 215 Ca 0.08 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1ag8 n PRO 215 Cb 0.46 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 1ag8 n PRO 215 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ag8 n GLY 216 N 0.73 2.24 0.28 -1.23 0.00 -1.25 -4.68 105.19 101.28 1ag8 n GLY 216 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 1ag8 n GLY 216 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ag8 h VAL 217 N 0.00 1.27 -3.27 1.61 2.07 -1.78 -3.31 116.25 112.85 1ag8 h VAL 217 Ca 0.00 -1.40 -0.43 0.00 0.82 0.00 0.00 66.70 65.69 1ag8 h VAL 217 Cb 0.00 1.19 -0.38 0.00 -1.52 0.00 0.00 31.29 30.58 1ag8 h VAL 217 CO 0.00 0.48 -0.77 -0.69 0.02 0.00 0.00 177.57 176.61 1ag8 s VAL 218 N -4.61 0.37 -0.12 2.57 1.01 -1.26 0.10 120.40 118.45 1ag8 s VAL 218 Ca -0.11 0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1ag8 s VAL 218 Cb 0.12 -0.52 0.01 0.00 0.00 0.00 0.00 36.38 35.99 1ag8 s VAL 218 CO 0.86 0.26 -0.17 0.20 0.00 0.00 0.00 175.10 176.25 1ag8 s ASN 219 N 1.93 2.61 -0.17 3.32 0.01 -0.27 -4.72 114.94 117.65 1ag8 s ASN 219 Ca 0.04 -0.47 -0.02 0.00 -0.71 0.00 0.00 52.86 51.69 1ag8 s ASN 219 Cb -0.12 -1.18 -0.02 0.00 0.41 0.00 0.00 41.25 40.34 1ag8 s ASN 219 CO -0.05 0.02 -0.07 -0.69 -1.51 0.00 0.00 177.10 174.80 1ag8 s VAL 220 N 1.01 3.39 -0.28 1.60 1.01 -0.16 -0.16 120.40 126.80 1ag8 s VAL 220 Ca -0.05 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 61.44 1ag8 s VAL 220 Cb -0.15 -2.49 0.07 0.00 0.00 0.00 0.00 36.38 33.82 1ag8 s VAL 220 CO -0.03 0.48 -0.05 -0.63 0.00 0.00 0.00 175.10 174.87 1ag8 s ILE 221 N 0.78 2.01 0.37 2.22 1.01 0.13 -1.53 121.20 126.19 1ag8 s ILE 221 Ca -0.03 -1.74 -0.25 0.00 0.00 0.00 0.00 60.65 58.64 1ag8 s ILE 221 Cb -0.15 -2.27 -0.10 0.00 0.01 0.00 0.00 42.46 39.96 1ag8 s ILE 221 CO 0.02 -0.23 1.00 -2.16 0.00 0.00 0.00 174.94 173.56 1ag8 s PRO 222 N 1.13 4.35 0.00 2.79 0.04 -1.26 -2.89 135.00 139.15 1ag8 s PRO 222 Ca -0.02 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.42 1ag8 s PRO 222 Cb -0.19 -2.62 0.00 0.00 0.04 0.00 0.00 34.50 31.73 1ag8 s PRO 222 CO -0.07 0.05 0.00 0.41 0.04 0.00 0.00 177.00 177.43 1ag8 n GLY 223 N 0.33 -0.55 3.83 0.56 0.00 -1.25 -0.53 105.19 107.57 1ag8 n GLY 223 Ca 0.04 -0.79 -0.22 0.00 0.00 0.00 0.00 46.02 45.05 1ag8 n GLY 223 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ag8 s PHE 224 N -3.49 3.02 0.00 1.61 0.08 -1.26 -3.27 117.98 114.67 1ag8 s PHE 224 Ca 0.00 -0.19 -0.03 0.00 0.12 0.00 0.00 56.93 56.83 1ag8 s PHE 224 Cb 0.00 -1.55 -0.02 0.00 -0.57 0.00 0.00 43.02 40.88 1ag8 s PHE 224 CO 0.00 0.39 0.83 0.78 -0.10 0.00 0.00 175.22 177.13 1ag8 h GLY 225 N 1.41 -0.12 1.86 4.36 0.00 -1.95 -0.25 103.07 108.37 1ag8 h GLY 225 Ca -0.47 0.04 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1ag8 h GLY 225 CO 0.60 -0.04 0.00 -1.55 0.00 0.00 0.00 176.54 175.54 1ag8 n PRO 226 N -2.37 0.01 0.00 4.80 -0.04 -1.26 -0.93 135.00 135.21 1ag8 n PRO 226 Ca -0.01 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.85 1ag8 n PRO 226 Cb 0.05 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.01 1ag8 n PRO 226 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1ag8 n THR 227 N -1.43 0.00 0.02 0.52 -2.24 -1.20 -4.39 114.28 105.56 1ag8 n THR 227 Ca 0.01 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.68 1ag8 n THR 227 Cb 0.02 -0.95 0.03 0.00 -2.10 0.00 0.00 70.33 67.32 1ag8 n THR 227 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ag8 h ALA 228 N -1.92 0.59 0.14 6.98 0.00 -1.17 -2.67 119.26 121.21 1ag8 h ALA 228 Ca 0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 1ag8 h ALA 228 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ag8 h ALA 228 CO 0.00 0.72 -0.07 0.78 0.00 0.00 0.00 179.25 180.69 1ag8 h GLY 229 N 1.10 -0.19 1.23 0.00 0.00 -0.49 -2.83 103.07 101.89 1ag8 h GLY 229 Ca -0.02 0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.39 1ag8 h GLY 229 CO 0.12 -0.07 0.52 0.00 0.00 0.00 0.00 176.54 177.11 1ag8 h ALA 230 N 0.45 1.44 0.00 3.60 0.00 -1.08 -1.44 119.26 122.23 1ag8 h ALA 230 Ca -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1ag8 h ALA 230 Cb 0.30 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ag8 h ALA 230 CO 0.03 0.52 -0.09 0.00 0.00 0.00 0.00 179.25 179.71 1ag8 h ALA 231 N 1.51 1.85 0.02 0.00 0.00 -1.35 -1.45 119.26 119.85 1ag8 h ALA 231 Ca 0.29 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1ag8 h ALA 231 Cb -0.12 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ag8 h ALA 231 CO -0.06 0.11 -0.25 0.82 0.00 0.00 0.00 179.25 179.87 1ag8 h ILE 232 N 0.00 1.62 -0.47 0.00 2.04 -1.06 -2.80 117.51 116.85 1ag8 h ILE 232 Ca -0.00 -2.16 0.06 0.00 1.00 0.00 0.00 64.86 63.75 1ag8 h ILE 232 Cb 0.16 3.04 -0.03 0.00 -0.74 0.00 0.00 36.82 39.26 1ag8 h ILE 232 CO 0.01 0.58 0.32 0.00 0.00 0.00 0.00 178.15 179.06 1ag8 h ALA 233 N 0.15 1.92 -0.40 1.87 0.00 -0.89 -2.61 119.26 119.29 1ag8 h ALA 233 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ag8 h ALA 233 Cb 1.10 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1ag8 h ALA 233 CO 0.05 -0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.16 1ag8 n SER 234 N -4.48 3.10 -4.73 0.00 3.41 -0.58 -3.74 113.62 106.59 1ag8 n SER 234 Ca 0.06 -1.95 -0.42 0.00 -0.26 0.00 0.00 58.87 56.30 1ag8 n SER 234 Cb 0.24 -0.27 -0.02 0.00 -0.26 0.00 0.00 64.21 63.90 1ag8 n SER 234 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1ag8 s HIS 235 N -1.03 2.98 -1.46 7.33 5.04 -0.99 -4.69 115.29 122.48 1ag8 s HIS 235 Ca 0.29 0.79 0.20 0.00 -1.54 0.00 0.00 55.06 54.80 1ag8 s HIS 235 Cb 0.15 -3.92 1.03 0.00 0.04 0.00 0.00 32.58 29.88 1ag8 s HIS 235 CO 0.20 -3.22 1.63 0.39 -2.34 0.00 0.00 174.74 171.41 1ag8 n GLU 236 N 3.03 0.30 -0.13 2.88 -0.58 -1.26 -3.24 120.64 121.64 1ag8 n GLU 236 Ca 0.10 0.09 0.05 0.00 -0.42 0.00 0.00 57.16 56.98 1ag8 n GLU 236 Cb 0.39 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 29.83 1ag8 n GLU 236 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1ag8 n ASP 237 N -1.27 1.63 -4.53 1.62 2.03 -1.26 -4.91 116.55 109.85 1ag8 n ASP 237 Ca 0.10 -2.45 -0.37 0.00 0.52 0.00 0.00 54.79 52.58 1ag8 n ASP 237 Cb 0.16 -0.25 -0.12 0.00 -0.72 0.00 0.00 41.12 40.19 1ag8 n ASP 237 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1ag8 s VAL 238 N -1.66 4.90 0.07 5.18 1.01 -1.20 -4.76 120.40 123.94 1ag8 s VAL 238 Ca 0.16 0.03 0.13 0.00 0.00 0.00 0.00 61.98 62.30 1ag8 s VAL 238 Cb 0.14 -3.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 1ag8 s VAL 238 CO 0.01 0.29 1.50 0.44 0.00 0.00 0.00 175.10 177.34 1ag8 h ASP 239 N 8.29 0.00 -4.82 3.32 3.32 -1.34 -3.44 116.42 121.75 1ag8 h ASP 239 Ca -0.36 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.57 1ag8 h ASP 239 Cb 1.18 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.53 1ag8 h ASP 239 CO 0.56 0.63 -0.26 -0.75 -1.72 0.00 0.00 179.24 177.71 1ag8 s LYS 240 N -3.16 0.65 -0.03 3.56 2.36 -1.07 -1.81 119.74 120.25 1ag8 s LYS 240 Ca 0.01 -0.07 0.05 0.00 -2.55 0.00 0.00 55.97 53.42 1ag8 s LYS 240 Cb 0.10 0.29 -0.01 0.00 -1.05 0.00 0.00 37.83 37.16 1ag8 s LYS 240 CO 0.75 -0.17 -0.19 0.08 1.55 0.00 0.00 175.35 177.38 1ag8 s VAL 241 N -1.09 1.49 -0.17 4.02 1.01 0.42 -0.19 120.40 125.89 1ag8 s VAL 241 Ca -0.11 -0.79 -0.00 0.00 0.00 0.00 0.00 61.98 61.08 1ag8 s VAL 241 Cb -0.05 -1.26 0.04 0.00 0.00 0.00 0.00 36.38 35.12 1ag8 s VAL 241 CO 0.04 0.42 -0.07 0.00 0.00 0.00 0.00 175.10 175.49 1ag8 s ALA 242 N -0.26 1.67 -0.02 5.51 0.00 0.14 -2.26 121.76 126.53 1ag8 s ALA 242 Ca 0.03 -0.95 0.07 0.00 0.00 0.00 0.00 51.96 51.11 1ag8 s ALA 242 Cb -0.09 -1.17 -0.02 0.00 0.00 0.00 0.00 23.12 21.85 1ag8 s ALA 242 CO 0.00 -0.77 -0.23 0.12 0.00 0.00 0.00 175.76 174.88 1ag8 s PHE 243 N 1.55 2.08 -0.13 0.00 5.36 -0.88 -0.73 117.98 125.23 1ag8 s PHE 243 Ca 0.00 -0.41 -0.01 0.00 -0.96 0.00 0.00 56.93 55.55 1ag8 s PHE 243 Cb -0.15 -1.34 0.03 0.00 -0.34 0.00 0.00 43.02 41.22 1ag8 s PHE 243 CO -0.08 -0.05 -0.04 0.99 -1.46 0.00 0.00 175.22 174.58 1ag8 s THR 244 N -0.50 0.85 -1.08 0.12 2.01 -0.57 -0.91 115.64 115.56 1ag8 s THR 244 Ca 0.08 -0.33 0.00 0.00 0.31 0.00 0.00 61.69 61.75 1ag8 s THR 244 Cb -0.09 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.42 1ag8 s THR 244 CO -0.01 0.21 0.00 0.61 -0.69 0.00 0.00 174.62 174.75 1ag8 n GLY 245 N 4.98 -0.77 3.81 4.40 0.00 -0.49 -3.40 105.19 113.72 1ag8 n GLY 245 Ca -0.11 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.28 1ag8 n GLY 245 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ag8 s SER 246 N -4.00 6.31 0.30 1.61 1.04 -1.26 -3.29 113.70 114.41 1ag8 s SER 246 Ca 0.00 1.79 0.00 0.00 0.48 0.00 0.00 55.95 58.23 1ag8 s SER 246 Cb 0.00 -2.54 0.47 0.00 0.10 0.00 0.00 66.02 64.05 1ag8 s SER 246 CO 0.00 -0.80 1.86 0.74 0.98 0.00 0.00 173.24 176.02 1ag8 h THR 247 N 1.15 1.21 -0.05 2.02 2.02 -1.92 0.67 112.91 118.02 1ag8 h THR 247 Ca -0.48 -0.74 0.03 0.00 0.77 0.00 0.00 66.41 65.99 1ag8 h THR 247 Cb 1.21 0.67 -0.04 0.00 -1.74 0.00 0.00 68.15 68.24 1ag8 h THR 247 CO 0.59 0.28 -0.18 -0.08 0.37 0.00 0.00 175.52 176.50 1ag8 h GLU 248 N 0.75 -0.26 0.00 6.66 4.81 -1.94 -0.79 114.58 123.81 1ag8 h GLU 248 Ca 0.17 0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.29 1ag8 h GLU 248 Cb 0.25 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 1ag8 h GLU 248 CO -0.01 -0.17 -0.59 0.28 -0.73 0.00 0.00 179.01 177.79 1ag8 h VAL 249 N -0.27 1.40 -0.78 0.32 2.07 -1.90 -2.98 116.25 114.11 1ag8 h VAL 249 Ca 0.07 -2.03 0.11 0.00 0.82 0.00 0.00 66.70 65.67 1ag8 h VAL 249 Cb 0.37 2.10 -0.08 0.00 -1.52 0.00 0.00 31.29 32.16 1ag8 h VAL 249 CO -0.20 0.58 0.39 1.23 0.02 0.00 0.00 177.57 179.59 1ag8 h GLY 250 N 1.82 1.20 0.64 2.17 0.00 0.51 0.75 103.07 110.15 1ag8 h GLY 250 Ca -0.01 -0.24 0.06 0.00 0.00 0.00 0.00 47.33 47.14 1ag8 h GLY 250 CO 0.08 0.03 0.23 0.45 0.00 0.00 0.00 176.54 177.33 1ag8 h HIS 251 N 0.63 0.42 -0.99 5.60 3.86 -1.11 -1.95 115.15 121.61 1ag8 h HIS 251 Ca 0.40 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.64 1ag8 h HIS 251 Cb 0.47 -0.11 -0.05 0.00 1.06 0.00 0.00 27.41 28.78 1ag8 h HIS 251 CO -0.10 0.18 0.66 -0.07 0.86 0.00 0.00 177.93 179.46 1ag8 h LEU 252 N 0.45 1.14 -0.03 2.43 3.38 -0.95 -0.72 115.31 121.00 1ag8 h LEU 252 Ca 0.24 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1ag8 h LEU 252 Cb 0.19 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1ag8 h LEU 252 CO -0.20 0.83 0.02 0.40 0.09 0.00 0.00 178.44 179.57 1ag8 h ILE 253 N 1.35 1.11 -0.74 1.22 1.08 -0.45 0.26 117.51 121.33 1ag8 h ILE 253 Ca 0.37 -0.31 -0.06 0.00 -0.39 0.00 0.00 64.86 64.46 1ag8 h ILE 253 Cb -0.15 1.26 -0.03 0.00 -3.07 0.00 0.00 36.82 34.82 1ag8 h ILE 253 CO -0.08 0.09 0.24 -0.61 -0.69 0.00 0.00 178.15 177.09 1ag8 h GLN 254 N -0.07 1.15 -0.57 2.37 4.15 -1.06 -0.90 115.11 120.19 1ag8 h GLN 254 Ca 0.01 -0.24 -0.10 0.00 0.77 0.00 0.00 58.65 59.09 1ag8 h GLN 254 Cb 0.13 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 1ag8 h GLN 254 CO -0.00 0.98 -0.04 0.28 -1.93 0.00 0.00 178.83 178.11 1ag8 h VAL 255 N 1.10 1.27 -0.50 2.39 2.07 -1.04 -2.42 116.25 119.12 1ag8 h VAL 255 Ca 0.24 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.57 1ag8 h VAL 255 Cb 0.30 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1ag8 h VAL 255 CO -0.01 0.43 0.33 0.00 0.02 0.00 0.00 177.57 178.34 1ag8 h ALA 256 N 0.96 0.64 -0.61 1.67 0.00 -0.48 -0.48 119.26 120.96 1ag8 h ALA 256 Ca 0.16 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1ag8 h ALA 256 Cb 0.60 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1ag8 h ALA 256 CO 0.04 0.09 0.39 0.00 0.00 0.00 0.00 179.25 179.77 1ag8 h ALA 257 N 1.18 0.78 -0.36 0.00 0.00 -1.00 -2.69 119.26 117.17 1ag8 h ALA 257 Ca 0.18 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 1ag8 h ALA 257 Cb -0.07 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1ag8 h ALA 257 CO -0.04 0.16 -0.20 0.78 0.00 0.00 0.00 179.25 179.95 1ag8 h GLY 258 N 0.78 0.84 2.00 0.00 0.00 -1.00 0.14 103.07 105.83 1ag8 h GLY 258 Ca 0.24 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.80 1ag8 h GLY 258 CO -0.08 0.70 0.00 0.50 0.00 0.00 0.00 176.54 177.66 1ag8 h LYS 259 N 0.56 0.00 0.00 4.80 1.79 -0.91 -3.42 116.57 119.39 1ag8 h LYS 259 Ca 0.08 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1ag8 h LYS 259 Cb 0.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 1ag8 h LYS 259 CO 0.06 0.00 0.00 -1.13 -1.08 0.00 0.00 179.45 177.30 1ag8 n SER 260 N -2.52 0.00 0.19 0.86 3.41 -1.03 -5.00 113.62 109.53 1ag8 n SER 260 Ca -0.01 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.69 1ag8 n SER 260 Cb 0.12 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.20 1ag8 n SER 260 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1ag8 h ASN 261 N 0.00 0.00 -1.54 4.04 -1.24 -1.79 -3.47 115.58 111.58 1ag8 h ASN 261 Ca 0.00 0.00 -0.26 0.00 0.71 0.00 0.00 56.30 56.75 1ag8 h ASN 261 Cb 0.00 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.02 1ag8 h ASN 261 CO 0.00 0.17 -0.31 0.18 -1.29 0.00 0.00 177.43 176.19 1ag8 n LEU 262 N -3.15 -1.43 -4.75 0.34 4.32 0.49 -4.96 117.00 107.86 1ag8 n LEU 262 Ca 0.03 0.07 -0.35 0.00 -0.02 0.00 0.00 56.01 55.74 1ag8 n LEU 262 Cb 0.60 -1.99 0.05 0.00 -1.62 0.00 0.00 43.42 40.46 1ag8 n LEU 262 CO 0.36 -0.26 0.81 -1.59 -1.22 0.00 0.00 177.39 175.49 1ag8 s LYS 263 N -4.27 2.73 0.30 3.23 -2.85 -1.26 -4.96 119.74 112.66 1ag8 s LYS 263 Ca 0.00 1.74 -0.29 0.00 -1.00 0.00 0.00 55.97 56.41 1ag8 s LYS 263 Cb 0.00 -1.91 -0.10 0.00 -2.06 0.00 0.00 37.83 33.76 1ag8 s LYS 263 CO 0.00 -1.37 1.38 1.03 0.10 0.00 0.00 175.35 176.48 1ag8 s ARG 264 N -3.60 4.30 -0.01 1.78 3.00 -0.75 -4.84 118.95 118.83 1ag8 s ARG 264 Ca 0.75 2.28 0.04 0.00 0.00 0.00 0.00 55.73 58.81 1ag8 s ARG 264 Cb -0.28 -3.08 -0.01 0.00 0.00 0.00 0.00 34.95 31.58 1ag8 s ARG 264 CO 0.37 -0.31 -0.14 0.08 0.00 0.00 0.00 175.30 175.30 1ag8 s VAL 265 N -0.69 1.13 -0.01 3.52 1.01 -1.26 -0.43 120.40 123.68 1ag8 s VAL 265 Ca 0.53 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.90 1ag8 s VAL 265 Cb -0.41 -0.95 -0.00 0.00 0.00 0.00 0.00 36.38 35.02 1ag8 s VAL 265 CO 0.50 0.31 -0.06 0.42 0.00 0.00 0.00 175.10 176.27 1ag8 s THR 266 N -0.36 0.46 -0.03 3.92 -4.23 -0.96 -4.94 115.64 109.50 1ag8 s THR 266 Ca 0.05 -0.24 0.03 0.00 -1.18 0.00 0.00 61.69 60.35 1ag8 s THR 266 Cb -0.06 -0.39 0.00 0.00 1.34 0.00 0.00 72.50 73.40 1ag8 s THR 266 CO -0.00 0.13 -0.10 -0.76 -0.54 0.00 0.00 174.62 173.35 1ag8 s LEU 267 N -0.11 1.80 -0.28 4.79 1.43 -0.65 -2.08 118.68 123.59 1ag8 s LEU 267 Ca 0.02 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 52.94 1ag8 s LEU 267 Cb -0.03 -0.59 0.07 0.00 0.03 0.00 0.00 46.19 45.68 1ag8 s LEU 267 CO -0.00 0.07 -0.03 -0.70 0.23 0.00 0.00 176.35 175.92 1ag8 s GLU 268 N 0.17 1.68 0.00 1.70 2.56 -0.09 0.16 118.70 124.88 1ag8 s GLU 268 Ca -0.03 -1.35 0.00 0.00 0.00 0.00 0.00 54.97 53.59 1ag8 s GLU 268 Cb -0.09 -2.79 0.00 0.00 2.00 0.00 0.00 34.13 33.25 1ag8 s GLU 268 CO 0.01 -0.72 0.00 0.44 -0.56 0.00 0.00 175.26 174.43 1ag8 n ILE 269 N 4.50 0.00 -0.39 -3.70 -5.35 -0.44 -1.39 119.36 112.59 1ag8 n ILE 269 Ca -0.07 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.13 1ag8 n ILE 269 Cb 0.43 0.00 0.25 0.00 -1.74 0.00 0.00 39.64 38.58 1ag8 n ILE 269 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ag8 n GLY 270 N 3.62 -3.05 3.71 3.28 0.00 -1.21 -4.80 105.19 106.73 1ag8 n GLY 270 Ca 0.00 -1.32 -0.07 0.00 0.00 0.00 0.00 46.02 44.63 1ag8 n GLY 270 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ag8 s GLY 271 N -2.56 -0.27 -0.38 -0.02 0.00 -1.23 -4.37 107.32 98.49 1ag8 s GLY 271 Ca 0.61 0.12 0.11 0.00 0.00 0.00 0.00 44.72 45.56 1ag8 s GLY 271 CO 0.56 0.03 1.24 1.17 0.00 0.00 0.00 173.10 176.10 1ag8 n LYS 272 N -0.42 1.17 -1.68 2.90 3.00 -1.26 -4.43 118.16 117.44 1ag8 n LYS 272 Ca -0.07 -2.21 -0.45 0.00 -0.00 0.00 0.00 58.31 55.57 1ag8 n LYS 272 Cb 0.61 -0.41 -0.04 0.00 0.00 0.00 0.00 35.03 35.19 1ag8 n LYS 272 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1ag8 n SER 273 N -0.41 3.21 -4.76 3.14 7.64 -1.19 -4.57 113.62 116.67 1ag8 n SER 273 Ca 0.01 1.09 -0.39 0.00 1.01 0.00 0.00 58.87 60.59 1ag8 n SER 273 Cb 0.83 -1.45 -0.06 0.00 -1.01 0.00 0.00 64.21 62.53 1ag8 n SER 273 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1ag8 s PRO 274 N 0.79 4.33 -0.40 1.43 0.04 -1.26 -1.08 135.00 138.84 1ag8 s PRO 274 Ca 0.77 0.77 -0.01 0.00 0.04 0.00 0.00 61.00 62.57 1ag8 s PRO 274 Cb -0.65 -3.34 0.11 0.00 0.04 0.00 0.00 34.50 30.67 1ag8 s PRO 274 CO 0.38 0.38 0.17 1.21 0.04 0.00 0.00 177.00 179.18 1ag8 s ASN 275 N -0.25 5.09 -0.34 6.66 3.04 0.71 -1.90 114.94 127.94 1ag8 s ASN 275 Ca 0.32 -2.12 -0.23 0.00 0.04 0.00 0.00 52.86 50.87 1ag8 s ASN 275 Cb -0.19 -1.77 0.00 0.00 -1.54 0.00 0.00 41.25 37.76 1ag8 s ASN 275 CO 0.18 -0.48 0.75 -0.63 -3.04 0.00 0.00 177.10 173.88 1ag8 s ILE 276 N 1.00 4.78 -0.34 -5.21 1.01 -0.26 -0.87 121.20 121.31 1ag8 s ILE 276 Ca 0.10 0.91 -0.08 0.00 0.00 0.00 0.00 60.65 61.57 1ag8 s ILE 276 Cb -0.22 -4.16 0.02 0.00 0.01 0.00 0.00 42.46 38.12 1ag8 s ILE 276 CO -0.05 -0.35 0.14 -0.63 0.00 0.00 0.00 174.94 174.05 1ag8 s ILE 277 N 2.98 4.19 0.38 2.92 1.09 0.18 -0.94 121.20 132.01 1ag8 s ILE 277 Ca 0.30 -0.86 -0.18 0.00 -1.10 0.00 0.00 60.65 58.82 1ag8 s ILE 277 Cb -0.14 -3.29 -0.10 0.00 -1.06 0.00 0.00 42.46 37.88 1ag8 s ILE 277 CO 0.15 -0.11 0.84 -0.04 -0.10 0.00 0.00 174.94 175.68 1ag8 s MET 278 N 1.50 4.09 0.62 2.79 -1.94 -0.67 -2.27 119.30 123.43 1ag8 s MET 278 Ca 0.01 0.87 0.27 0.00 -1.71 0.00 0.00 55.69 55.14 1ag8 s MET 278 Cb -0.19 -2.30 1.42 0.00 2.01 0.00 0.00 34.83 35.77 1ag8 s MET 278 CO 0.04 0.05 1.82 0.66 -0.01 0.00 0.00 175.02 177.58 1ag8 h SER 279 N 2.01 0.00 -0.25 3.03 4.64 -1.88 0.32 113.55 121.42 1ag8 h SER 279 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1ag8 h SER 279 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1ag8 h SER 279 CO 0.63 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.69 1ag8 n ASP 280 N -3.29 2.28 -4.78 4.97 5.75 -1.26 -4.94 116.55 115.28 1ag8 n ASP 280 Ca 0.05 -1.82 -0.35 0.00 -0.01 0.00 0.00 54.79 52.65 1ag8 n ASP 280 Cb 0.62 -0.16 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 1ag8 n ASP 280 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ag8 s ALA 281 N -1.68 2.70 -0.45 2.12 0.00 0.10 -4.15 121.76 120.40 1ag8 s ALA 281 Ca 0.34 0.78 -0.28 0.00 0.00 0.00 0.00 51.96 52.80 1ag8 s ALA 281 Cb 0.19 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.96 1ag8 s ALA 281 CO 0.27 -0.76 1.65 0.34 0.00 0.00 0.00 175.76 177.27 1ag8 s ASP 282 N -1.86 5.91 0.15 0.00 2.15 -1.26 -4.90 116.67 116.86 1ag8 s ASP 282 Ca 0.72 0.80 -0.27 0.00 0.43 0.00 0.00 52.55 54.23 1ag8 s ASP 282 Cb -0.23 -2.53 -0.00 0.00 -0.30 0.00 0.00 42.92 39.85 1ag8 s ASP 282 CO 0.27 -1.78 1.58 0.24 -0.17 0.00 0.00 175.17 175.31 1ag8 h MET 283 N 12.46 -0.35 -0.62 4.34 2.86 -1.95 0.30 114.93 131.97 1ag8 h MET 283 Ca -0.29 0.02 0.12 0.00 -2.06 0.00 0.00 59.70 57.49 1ag8 h MET 283 Cb 1.14 0.08 -0.12 0.00 0.06 0.00 0.00 31.60 32.76 1ag8 h MET 283 CO 1.11 -0.23 -0.25 -0.44 1.06 0.00 0.00 176.91 178.16 1ag8 h ASP 284 N -0.36 -0.88 -0.01 1.22 3.32 -1.99 0.29 116.42 118.00 1ag8 h ASP 284 Ca 0.13 0.21 -0.00 0.00 0.02 0.00 0.00 57.03 57.39 1ag8 h ASP 284 Cb 0.58 0.49 -0.00 0.00 0.22 0.00 0.00 39.33 40.63 1ag8 h ASP 284 CO -0.51 -0.27 -0.00 -0.25 -1.72 0.00 0.00 179.24 176.50 1ag8 h TRP 285 N -0.09 0.01 -0.86 4.55 2.91 -1.89 -2.42 115.95 118.16 1ag8 h TRP 285 Ca 0.28 -0.00 0.08 0.00 1.13 0.00 0.00 58.89 60.37 1ag8 h TRP 285 Cb 0.52 -0.00 -0.07 0.00 -0.51 0.00 0.00 29.16 29.10 1ag8 h TRP 285 CO -0.59 0.34 0.52 0.00 -1.03 0.00 0.00 178.44 177.69 1ag8 h ALA 286 N 0.67 1.21 -0.24 2.65 0.00 0.07 0.14 119.26 123.76 1ag8 h ALA 286 Ca 0.00 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1ag8 h ALA 286 Cb 0.34 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1ag8 h ALA 286 CO 0.00 0.22 -0.05 0.28 0.00 0.00 0.00 179.25 179.69 1ag8 h VAL 287 N 0.92 1.28 -0.18 0.00 2.07 -0.44 0.33 116.25 120.23 1ag8 h VAL 287 Ca 0.39 -1.05 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 1ag8 h VAL 287 Cb 0.26 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1ag8 h VAL 287 CO -0.20 0.33 0.02 -0.08 0.02 0.00 0.00 177.57 177.65 1ag8 h GLU 288 N 0.21 0.31 -0.30 1.57 4.81 -1.04 -1.93 114.58 118.20 1ag8 h GLU 288 Ca 0.06 -0.09 -0.06 0.00 -0.13 0.00 0.00 59.36 59.15 1ag8 h GLU 288 Cb 0.51 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1ag8 h GLU 288 CO 0.02 0.49 -0.05 1.96 -0.73 0.00 0.00 179.01 180.70 1ag8 h GLN 289 N 0.08 0.48 -0.52 1.92 1.08 -0.71 -1.55 115.11 115.89 1ag8 h GLN 289 Ca 0.05 -0.11 -0.08 0.00 -1.45 0.00 0.00 58.65 57.06 1ag8 h GLN 289 Cb 0.34 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 1ag8 h GLN 289 CO 0.01 0.55 0.00 0.00 -0.95 0.00 0.00 178.83 178.44 1ag8 h ALA 290 N 1.49 0.70 -0.16 3.87 0.00 -0.79 0.31 119.26 124.68 1ag8 h ALA 290 Ca 0.09 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1ag8 h ALA 290 Cb 0.39 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1ag8 h ALA 290 CO 0.02 0.51 0.08 1.25 0.00 0.00 0.00 179.25 181.11 1ag8 h HIS 291 N 0.78 0.22 -0.45 0.00 -0.00 -0.91 -2.97 115.15 111.83 1ag8 h HIS 291 Ca 0.15 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.48 1ag8 h HIS 291 Cb 0.52 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.84 1ag8 h HIS 291 CO 0.04 0.25 0.19 0.35 -0.00 0.00 0.00 177.93 178.75 1ag8 h PHE 292 N 0.14 0.67 -1.02 5.26 3.57 -1.11 0.57 116.94 125.03 1ag8 h PHE 292 Ca 0.05 -0.05 0.24 0.00 3.53 0.00 0.00 57.97 61.75 1ag8 h PHE 292 Cb 0.10 -0.20 -0.11 0.00 2.79 0.00 0.00 35.95 38.53 1ag8 h PHE 292 CO -0.03 0.57 0.62 0.00 -2.23 0.00 0.00 178.31 177.24 1ag8 h ALA 293 N 1.03 1.93 0.00 2.41 0.00 -0.24 -1.86 119.26 122.54 1ag8 h ALA 293 Ca 0.15 0.09 -0.25 0.00 0.00 0.00 0.00 54.91 54.90 1ag8 h ALA 293 Cb 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1ag8 h ALA 293 CO -0.01 -0.36 -1.95 -0.11 0.00 0.00 0.00 179.25 176.81 1ag8 n LEU 294 N -4.77 1.82 0.18 0.00 0.00 -1.15 -1.21 117.00 111.87 1ag8 n LEU 294 Ca 0.26 -0.06 0.12 0.00 0.00 0.00 0.00 56.01 56.33 1ag8 n LEU 294 Cb 0.76 -0.24 0.24 0.00 0.00 0.00 0.00 43.42 44.19 1ag8 n LEU 294 CO 0.20 0.61 0.80 -0.26 0.00 0.00 0.00 177.39 178.75 1ag8 h PHE 295 N 0.00 0.00 -2.40 1.96 0.04 -0.83 -3.33 116.94 112.37 1ag8 h PHE 295 Ca -0.38 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 59.79 1ag8 h PHE 295 Cb 1.68 0.00 0.07 0.00 2.20 0.00 0.00 35.95 39.91 1ag8 h PHE 295 CO 0.01 0.00 0.59 0.34 -0.60 0.00 0.00 178.31 178.65 1ag8 n PHE 296 N -2.79 2.01 -3.51 -0.55 7.35 -0.71 -2.61 117.46 116.65 1ag8 n PHE 296 Ca 0.04 0.45 -0.19 0.00 -0.76 0.00 0.00 57.45 57.00 1ag8 n PHE 296 Cb 0.50 -2.44 0.08 0.00 0.35 0.00 0.00 39.48 37.96 1ag8 n PHE 296 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1ag8 n ASN 297 N 2.43 -2.34 -2.46 -2.13 5.15 -1.26 -2.00 115.26 112.64 1ag8 n ASN 297 Ca 0.14 -0.65 -0.16 0.00 -0.60 0.00 0.00 54.58 53.31 1ag8 n ASN 297 Cb 0.29 -4.89 -0.01 0.00 -0.53 0.00 0.00 39.78 34.64 1ag8 n ASN 297 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ag8 n GLN 298 N -4.25 -2.15 -0.93 1.20 3.00 -1.10 -0.49 117.38 112.66 1ag8 n GLN 298 Ca -0.26 0.74 0.00 0.00 -0.01 0.00 0.00 57.00 57.47 1ag8 n GLN 298 Cb 0.66 -5.37 0.00 0.00 0.00 0.00 0.00 30.24 25.53 1ag8 n GLN 298 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ag8 n GLY 299 N -0.90 0.31 2.58 1.08 0.00 -0.85 -3.17 105.19 104.25 1ag8 n GLY 299 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1ag8 n GLY 299 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ag8 n GLN 300 N -1.24 4.65 -3.93 1.61 6.02 0.35 -2.79 117.38 122.05 1ag8 n GLN 300 Ca 0.00 -3.77 -0.16 0.00 -0.01 0.00 0.00 57.00 53.06 1ag8 n GLN 300 Cb 0.19 -2.63 -0.16 0.00 1.02 0.00 0.00 30.24 28.66 1ag8 n GLN 300 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ag8 s ALA 304 N -2.42 3.55 -1.21 0.00 0.00 -0.96 -4.81 121.76 115.92 1ag8 s ALA 304 Ca 0.51 1.54 -0.19 0.00 0.00 0.00 0.00 51.96 53.82 1ag8 s ALA 304 Cb 0.37 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 1ag8 s ALA 304 CO 0.18 -1.02 1.96 0.41 0.00 0.00 0.00 175.76 177.29 1ag8 n GLY 305 N 0.50 2.80 0.30 0.00 0.00 -0.35 -3.19 105.19 105.25 1ag8 n GLY 305 Ca 0.01 -1.30 0.19 0.00 0.00 0.00 0.00 46.02 44.91 1ag8 n GLY 305 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ag8 h SER 306 N 7.61 0.00 -3.31 1.61 0.02 -1.38 -3.39 113.55 114.71 1ag8 h SER 306 Ca 0.43 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.78 1ag8 h SER 306 Cb 0.77 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.91 1ag8 h SER 306 CO 1.65 0.01 -0.75 -0.13 -1.14 0.00 0.00 176.83 176.47 1ag8 s ARG 307 N -3.84 0.94 -0.66 3.45 0.52 -0.91 -4.02 118.95 114.44 1ag8 s ARG 307 Ca -0.01 -1.36 -0.23 0.00 -0.52 0.00 0.00 55.73 53.61 1ag8 s ARG 307 Cb 0.10 -2.28 0.07 0.00 0.52 0.00 0.00 34.95 33.36 1ag8 s ARG 307 CO 0.51 -1.00 0.98 0.99 0.02 0.00 0.00 175.30 176.79 1ag8 s THR 308 N 1.30 4.30 -0.25 0.02 2.01 -0.60 -0.21 115.64 122.21 1ag8 s THR 308 Ca 0.11 -0.28 -0.21 0.00 0.31 0.00 0.00 61.69 61.63 1ag8 s THR 308 Cb -0.19 -4.69 -0.02 0.00 0.01 0.00 0.00 72.50 67.62 1ag8 s THR 308 CO -0.18 -1.46 0.65 -0.36 -0.69 0.00 0.00 174.62 172.58 1ag8 s PHE 309 N 4.15 3.29 -0.12 4.92 0.40 -0.05 -0.16 117.98 130.40 1ag8 s PHE 309 Ca 0.23 0.86 0.02 0.00 -0.60 0.00 0.00 56.93 57.44 1ag8 s PHE 309 Cb -0.16 -2.86 -0.01 0.00 0.51 0.00 0.00 43.02 40.50 1ag8 s PHE 309 CO 0.11 -0.33 -0.18 0.08 0.70 0.00 0.00 175.22 175.60 1ag8 s VAL 310 N 2.51 2.55 0.10 -0.44 1.01 0.29 -0.64 120.40 125.79 1ag8 s VAL 310 Ca 0.27 -0.84 -0.31 0.00 0.00 0.00 0.00 61.98 61.11 1ag8 s VAL 310 Cb -0.15 -2.04 -0.10 0.00 0.00 0.00 0.00 36.38 34.09 1ag8 s VAL 310 CO 0.08 0.54 1.79 -1.58 0.00 0.00 0.00 175.10 175.93 1ag8 s GLN 311 N 0.42 4.15 0.32 2.72 2.00 -0.96 -1.74 119.66 126.57 1ag8 s GLN 311 Ca -0.14 2.52 0.15 0.00 -2.00 0.00 0.00 55.36 55.89 1ag8 s GLN 311 Cb -0.17 -3.62 1.09 0.00 0.80 0.00 0.00 33.01 31.11 1ag8 s GLN 311 CO 0.06 -0.82 1.43 -0.85 -0.50 0.00 0.00 175.29 174.62 1ag8 n GLU 312 N 5.75 -0.06 -0.02 1.67 0.28 -0.10 -0.54 120.64 127.62 1ag8 n GLU 312 Ca 0.17 1.28 0.19 0.00 -0.16 0.00 0.00 57.16 58.65 1ag8 n GLU 312 Cb 0.39 -2.23 0.66 0.00 1.43 0.00 0.00 31.44 31.69 1ag8 n GLU 312 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1ag8 h ASP 313 N 0.00 0.06 -0.03 -1.84 5.19 -1.90 -2.45 116.42 115.46 1ag8 h ASP 313 Ca 0.71 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 57.13 1ag8 h ASP 313 Cb 1.81 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 41.31 1ag8 h ASP 313 CO -0.74 0.03 0.00 2.30 -3.12 0.00 0.00 179.24 177.71 1ag8 n ILE 314 N -4.40 0.42 0.13 0.35 -5.35 0.30 -4.84 119.36 105.97 1ag8 n ILE 314 Ca 0.10 -0.71 -0.16 0.00 -0.27 0.00 0.00 62.75 61.71 1ag8 n ILE 314 Cb 0.58 0.81 -0.10 0.00 -1.74 0.00 0.00 39.64 39.19 1ag8 n ILE 314 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 1ag8 h TYR 315 N 0.37 -1.49 -0.39 4.28 3.20 -0.82 -1.16 116.97 120.96 1ag8 h TYR 315 Ca 0.00 0.04 0.08 0.00 3.14 0.00 0.00 58.73 61.99 1ag8 h TYR 315 Cb 0.28 0.63 -0.09 0.00 1.54 0.00 0.00 36.73 39.09 1ag8 h TYR 315 CO 0.02 -0.59 -0.21 0.00 -1.64 0.00 0.00 178.16 175.73 1ag8 h ALA 316 N -0.61 0.05 -0.25 1.82 0.00 -1.89 0.50 119.26 118.89 1ag8 h ALA 316 Ca -0.01 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1ag8 h ALA 316 Cb 0.76 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1ag8 h ALA 316 CO -0.26 -0.59 0.13 1.49 0.00 0.00 0.00 179.25 180.02 1ag8 h GLU 317 N -0.15 0.35 -0.48 0.00 4.81 -1.90 -1.97 114.58 115.24 1ag8 h GLU 317 Ca 0.19 -0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.42 1ag8 h GLU 317 Cb 0.44 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.71 1ag8 h GLU 317 CO -0.48 0.33 0.22 0.35 -0.73 0.00 0.00 179.01 178.70 1ag8 h PHE 318 N 0.28 0.40 0.14 0.92 3.04 -0.73 -1.50 116.94 119.48 1ag8 h PHE 318 Ca 0.09 0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.07 1ag8 h PHE 318 Cb 0.09 -0.11 -0.02 0.00 2.56 0.00 0.00 35.95 38.47 1ag8 h PHE 318 CO -0.03 0.18 -0.20 0.28 -2.02 0.00 0.00 178.31 176.52 1ag8 h VAL 319 N 0.43 0.56 -0.49 1.41 2.07 -0.67 0.42 116.25 119.99 1ag8 h VAL 319 Ca 0.22 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.72 1ag8 h VAL 319 Cb 0.17 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1ag8 h VAL 319 CO -0.18 0.00 0.21 1.05 0.02 0.00 0.00 177.57 178.67 1ag8 h GLU 320 N -0.39 0.69 -0.50 1.57 4.11 -1.10 -1.35 114.58 117.62 1ag8 h GLU 320 Ca 0.02 -0.09 -0.11 0.00 0.07 0.00 0.00 59.36 59.25 1ag8 h GLU 320 Cb 0.40 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1ag8 h GLU 320 CO -0.09 0.56 -0.13 0.00 0.07 0.00 0.00 179.01 179.42 1ag8 h ARG 321 N 0.69 0.96 -0.17 1.06 2.47 -0.86 -2.18 114.38 116.35 1ag8 h ARG 321 Ca 0.17 -0.37 -0.01 0.00 -1.26 0.00 0.00 59.98 58.51 1ag8 h ARG 321 Cb 0.11 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.37 1ag8 h ARG 321 CO -0.02 1.04 0.06 0.77 0.56 0.00 0.00 179.97 182.38 1ag8 h SER 322 N 0.82 0.23 -0.53 7.04 0.02 -0.39 -1.93 113.55 118.81 1ag8 h SER 322 Ca 0.12 -0.17 0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1ag8 h SER 322 Cb 0.69 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 1ag8 h SER 322 CO 0.05 0.35 0.32 0.58 -1.14 0.00 0.00 176.83 176.99 1ag8 h VAL 323 N 0.11 1.06 -0.20 2.27 2.07 -1.19 0.43 116.25 120.80 1ag8 h VAL 323 Ca 0.06 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.36 1ag8 h VAL 323 Cb 0.19 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1ag8 h VAL 323 CO -0.00 0.12 0.11 0.00 0.02 0.00 0.00 177.57 177.82 1ag8 h ALA 324 N 1.23 0.25 -0.93 1.67 0.00 -1.31 0.12 119.26 120.29 1ag8 h ALA 324 Ca 0.21 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1ag8 h ALA 324 Cb 0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 1ag8 h ALA 324 CO -0.09 -0.30 0.62 -0.09 0.00 0.00 0.00 179.25 179.39 1ag8 h ARG 325 N 0.24 1.22 -0.03 0.00 9.65 -0.87 -0.97 114.38 123.63 1ag8 h ARG 325 Ca 0.08 -0.07 -0.11 0.00 -1.10 0.00 0.00 59.98 58.77 1ag8 h ARG 325 Cb 0.00 -0.28 -0.01 0.00 -1.39 0.00 0.00 29.97 28.29 1ag8 h ARG 325 CO -0.04 0.81 -0.51 0.00 2.80 0.00 0.00 179.97 183.03 1ag8 h ALA 326 N 1.42 1.10 0.00 2.80 0.00 -0.38 -2.56 119.26 121.65 1ag8 h ALA 326 Ca 0.34 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1ag8 h ALA 326 Cb -0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1ag8 h ALA 326 CO -0.08 0.65 -0.21 0.87 0.00 0.00 0.00 179.25 180.48 1ag8 h LYS 327 N 0.06 0.00 0.00 0.00 1.57 0.52 -3.09 116.57 115.62 1ag8 h LYS 327 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ag8 h LYS 327 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1ag8 h LYS 327 CO 0.07 0.21 -0.93 -1.13 -0.57 0.00 0.00 179.45 177.11 1ag8 n SER 328 N -3.30 0.78 -4.63 0.86 3.41 -0.67 -4.92 113.62 105.16 1ag8 n SER 328 Ca 0.01 -0.66 -0.43 0.00 -0.26 0.00 0.00 58.87 57.53 1ag8 n SER 328 Cb 0.47 0.83 -0.03 0.00 -0.26 0.00 0.00 64.21 65.22 1ag8 n SER 328 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1ag8 s ARG 329 N -3.05 3.57 -0.21 4.33 3.52 -0.98 -4.92 118.95 121.20 1ag8 s ARG 329 Ca 0.07 2.24 -0.29 0.00 -0.13 0.00 0.00 55.73 57.62 1ag8 s ARG 329 Cb 0.16 -4.27 -0.01 0.00 -1.56 0.00 0.00 34.95 29.26 1ag8 s ARG 329 CO 0.82 -1.61 1.37 0.08 -0.81 0.00 0.00 175.30 175.15 1ag8 s VAL 330 N 6.62 4.07 -0.14 7.11 1.01 -1.26 -4.93 120.40 132.88 1ag8 s VAL 330 Ca 0.94 1.25 -0.03 0.00 0.00 0.00 0.00 61.98 64.14 1ag8 s VAL 330 Cb -0.36 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 1ag8 s VAL 330 CO 0.37 -0.28 -0.03 -0.69 0.00 0.00 0.00 175.10 174.48 1ag8 s VAL 331 N 4.15 4.02 -1.96 2.92 1.01 -1.26 -0.58 120.40 128.69 1ag8 s VAL 331 Ca 0.60 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.25 1ag8 s VAL 331 Cb -0.21 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.42 1ag8 s VAL 331 CO 0.21 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.44 1ag8 n GLY 332 N 3.24 -0.54 3.57 4.51 0.00 0.02 -4.95 105.19 111.03 1ag8 n GLY 332 Ca -0.17 -0.80 -0.49 0.00 0.00 0.00 0.00 46.02 44.55 1ag8 n GLY 332 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ag8 n ASN 333 N 0.02 2.80 -0.20 1.61 5.15 -1.26 -4.35 115.26 119.03 1ag8 n ASN 333 Ca 0.00 0.62 0.30 0.00 -0.60 0.00 0.00 54.58 54.90 1ag8 n ASN 333 Cb 0.00 -1.34 0.73 0.00 -0.53 0.00 0.00 39.78 38.64 1ag8 n ASN 333 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1ag8 h PRO 334 N 11.35 0.00 -0.00 1.20 0.11 -1.89 0.26 132.00 143.03 1ag8 h PRO 334 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1ag8 h PRO 334 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1ag8 h PRO 334 CO 0.98 0.00 -0.07 1.19 -0.21 0.00 0.00 178.00 179.89 1ag8 n PHE 335 N -4.15 0.00 -3.03 0.65 3.72 -1.26 -1.11 117.46 112.29 1ag8 n PHE 335 Ca 0.20 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.20 1ag8 n PHE 335 Cb 1.04 -0.18 -0.05 0.00 -0.94 0.00 0.00 39.48 39.35 1ag8 n PHE 335 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1ag8 s ASP 336 N -2.43 6.94 0.59 4.37 -1.08 0.91 -4.94 116.67 121.04 1ag8 s ASP 336 Ca 0.31 1.14 0.29 0.00 -0.52 0.00 0.00 52.55 53.77 1ag8 s ASP 336 Cb 0.20 -2.41 1.53 0.00 -1.46 0.00 0.00 42.92 40.79 1ag8 s ASP 336 CO 0.46 -0.19 1.95 0.77 0.52 0.00 0.00 175.17 178.68 1ag8 h SER 337 N 6.95 0.00 0.36 -0.34 4.64 -1.87 -0.53 113.55 122.77 1ag8 h SER 337 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1ag8 h SER 337 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1ag8 h SER 337 CO 0.77 0.00 -0.35 0.54 -0.87 0.00 0.00 176.83 176.92 1ag8 n ARG 338 N -3.69 0.47 -2.47 4.77 1.74 -1.26 -4.89 116.66 111.33 1ag8 n ARG 338 Ca 0.06 -0.27 -0.43 0.00 -0.77 0.00 0.00 57.85 56.44 1ag8 n ARG 338 Cb 0.56 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.48 1ag8 n ARG 338 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1ag8 s THR 339 N -2.71 4.35 -0.15 0.55 2.01 -0.21 -4.72 115.64 114.76 1ag8 s THR 339 Ca 0.19 1.63 0.03 0.00 0.31 0.00 0.00 61.69 63.85 1ag8 s THR 339 Cb 0.19 -4.05 -0.23 0.00 0.01 0.00 0.00 72.50 68.41 1ag8 s THR 339 CO 0.59 -0.13 0.25 -0.62 -0.69 0.00 0.00 174.62 174.02 1ag8 n GLU 340 N 6.40 0.70 -4.76 4.92 1.02 0.25 -4.86 120.64 124.31 1ag8 n GLU 340 Ca 0.13 0.21 -0.28 0.00 -0.02 0.00 0.00 57.16 57.19 1ag8 n GLU 340 Cb 0.45 -1.66 -0.17 0.00 -0.02 0.00 0.00 31.44 30.05 1ag8 n GLU 340 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1ag8 s GLN 341 N -2.55 2.34 0.00 3.49 0.74 -0.09 -4.80 119.66 118.79 1ag8 s GLN 341 Ca -0.20 -0.63 0.00 0.00 0.05 0.00 0.00 55.36 54.59 1ag8 s GLN 341 Cb 0.07 -1.88 0.00 0.00 1.10 0.00 0.00 33.01 32.31 1ag8 s GLN 341 CO 0.75 0.05 0.00 0.41 -0.55 0.00 0.00 175.29 175.95 1ag8 n GLY 342 N 3.84 1.31 3.95 2.59 0.00 -1.26 -0.80 105.19 114.81 1ag8 n GLY 342 Ca -0.20 -1.93 -0.25 0.00 0.00 0.00 0.00 46.02 43.63 1ag8 n GLY 342 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ag8 s PRO 343 N 2.35 2.01 0.47 1.61 0.04 -1.25 -4.76 135.00 135.47 1ag8 s PRO 343 Ca 0.00 -0.51 -0.18 0.00 0.04 0.00 0.00 61.00 60.35 1ag8 s PRO 343 Cb 0.00 -2.22 -0.09 0.00 0.04 0.00 0.00 34.50 32.23 1ag8 s PRO 343 CO 0.00 -1.30 0.96 -0.65 0.04 0.00 0.00 177.00 176.05 1ag8 s GLN 344 N -5.21 4.07 0.33 4.56 -1.52 0.84 -4.71 119.66 118.02 1ag8 s GLN 344 Ca 0.62 1.01 0.12 0.00 -1.95 0.00 0.00 55.36 55.16 1ag8 s GLN 344 Cb -0.09 -2.17 0.97 0.00 -0.22 0.00 0.00 33.01 31.51 1ag8 s GLN 344 CO 0.44 -0.15 1.70 -0.24 -0.25 0.00 0.00 175.29 176.79 1ag8 h VAL 345 N 1.38 0.44 -3.11 1.09 3.04 -1.89 -3.42 116.25 113.77 1ag8 h VAL 345 Ca -0.48 -0.16 0.03 0.00 -1.01 0.00 0.00 66.70 65.08 1ag8 h VAL 345 Cb 1.18 -0.08 -0.07 0.00 -2.01 0.00 0.00 31.29 30.32 1ag8 h VAL 345 CO 0.61 0.09 0.16 1.51 -1.01 0.00 0.00 177.57 178.93 1ag8 s ASP 346 N -5.07 -0.28 0.26 3.17 1.47 -1.26 -4.37 116.67 110.59 1ag8 s ASP 346 Ca -0.10 -0.57 -0.02 0.00 1.18 0.00 0.00 52.55 53.04 1ag8 s ASP 346 Cb 0.28 0.68 0.45 0.00 -0.34 0.00 0.00 42.92 43.99 1ag8 s ASP 346 CO 0.79 -1.25 1.83 -0.08 0.68 0.00 0.00 175.17 177.15 1ag8 h GLU 347 N 2.05 0.91 -0.42 2.11 4.81 -1.96 0.12 114.58 122.19 1ag8 h GLU 347 Ca -0.23 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 58.98 1ag8 h GLU 347 Cb 1.26 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.40 1ag8 h GLU 347 CO 0.28 0.60 0.22 1.15 -0.73 0.00 0.00 179.01 180.53 1ag8 h THR 348 N 0.94 0.99 -0.24 0.32 2.02 -1.99 0.21 112.91 115.17 1ag8 h THR 348 Ca 0.44 -0.15 -0.14 0.00 0.77 0.00 0.00 66.41 67.32 1ag8 h THR 348 Cb 0.36 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 1ag8 h THR 348 CO -0.24 0.08 -0.45 -0.61 0.37 0.00 0.00 175.52 174.68 1ag8 h GLN 349 N 0.45 0.60 -0.33 6.66 5.75 -1.82 -0.71 115.11 125.71 1ag8 h GLN 349 Ca 0.18 -0.33 0.06 0.00 -0.15 0.00 0.00 58.65 58.41 1ag8 h GLN 349 Cb 0.07 0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.58 1ag8 h GLN 349 CO -0.11 0.93 0.01 0.35 -2.65 0.00 0.00 178.83 177.36 1ag8 h PHE 350 N 0.48 0.00 -0.39 3.99 3.57 0.12 -0.65 116.94 124.07 1ag8 h PHE 350 Ca 0.03 0.02 -0.15 0.00 3.53 0.00 0.00 57.97 61.40 1ag8 h PHE 350 Cb 0.97 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.75 1ag8 h PHE 350 CO 0.04 -0.05 -0.35 0.87 -2.23 0.00 0.00 178.31 176.59 1ag8 h LYS 351 N 0.11 0.92 0.12 1.11 1.57 -0.35 -2.46 116.57 117.59 1ag8 h LYS 351 Ca 0.16 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 1ag8 h LYS 351 Cb 0.21 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1ag8 h LYS 351 CO -0.26 1.12 -0.12 0.87 -0.57 0.00 0.00 179.45 180.49 1ag8 h LYS 352 N 0.76 -0.25 -0.47 3.15 1.57 -0.55 0.10 116.57 120.88 1ag8 h LYS 352 Ca 0.07 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.89 1ag8 h LYS 352 Cb 0.94 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.27 1ag8 h LYS 352 CO 0.09 -0.17 0.27 0.28 -0.57 0.00 0.00 179.45 179.35 1ag8 h VAL 353 N -0.26 1.03 -0.65 0.50 2.07 -1.13 -1.30 116.25 116.50 1ag8 h VAL 353 Ca 0.00 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 1ag8 h VAL 353 Cb 0.25 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1ag8 h VAL 353 CO -0.03 0.10 0.39 -0.07 0.02 0.00 0.00 177.57 177.98 1ag8 h LEU 354 N 0.54 0.77 -1.29 2.57 3.38 -1.17 -1.18 115.31 118.92 1ag8 h LEU 354 Ca 0.19 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1ag8 h LEU 354 Cb 0.03 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1ag8 h LEU 354 CO -0.10 0.59 0.03 1.23 0.09 0.00 0.00 178.44 180.29 1ag8 h GLY 355 N 0.92 0.55 1.48 0.83 0.00 0.30 -1.33 103.07 105.82 1ag8 h GLY 355 Ca 0.23 -0.30 -0.18 0.00 0.00 0.00 0.00 47.33 47.08 1ag8 h GLY 355 CO -0.04 0.29 -0.65 -0.97 0.00 0.00 0.00 176.54 175.16 1ag8 h TYR 356 N 0.50 0.69 -0.64 5.60 0.05 -0.37 -1.19 116.97 121.61 1ag8 h TYR 356 Ca 0.11 -0.27 -0.09 0.00 0.05 0.00 0.00 58.73 58.53 1ag8 h TYR 356 Cb 0.27 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 37.87 1ag8 h TYR 356 CO 0.01 1.03 0.05 0.82 -1.05 0.00 0.00 178.16 179.02 1ag8 h ILE 357 N 0.38 1.27 -0.27 -2.88 2.04 -0.86 0.16 117.51 117.35 1ag8 h ILE 357 Ca -0.01 -1.10 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 1ag8 h ILE 357 Cb 1.22 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 38.00 1ag8 h ILE 357 CO 0.12 0.41 0.14 0.50 0.00 0.00 0.00 178.15 179.32 1ag8 h LYS 358 N 1.00 0.38 -0.02 2.37 3.64 -1.13 -1.48 116.57 121.33 1ag8 h LYS 358 Ca 0.19 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.55 1ag8 h LYS 358 Cb 0.51 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.22 1ag8 h LYS 358 CO 0.02 0.35 -0.17 1.03 -2.27 0.00 0.00 179.45 178.41 1ag8 h SER 359 N 0.31 -0.51 -0.51 4.20 0.87 -0.86 -0.67 113.55 116.38 1ag8 h SER 359 Ca 0.09 0.08 0.08 0.00 -1.23 0.00 0.00 61.79 60.81 1ag8 h SER 359 Cb 0.09 0.22 -0.07 0.00 -0.44 0.00 0.00 62.40 62.20 1ag8 h SER 359 CO -0.01 -0.23 0.14 1.23 -0.53 0.00 0.00 176.83 177.43 1ag8 h GLY 360 N -0.27 0.66 0.86 5.77 0.00 -0.66 0.73 103.07 110.16 1ag8 h GLY 360 Ca 0.06 -0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.36 1ag8 h GLY 360 CO -0.18 -0.04 0.29 0.50 0.00 0.00 0.00 176.54 177.11 1ag8 h LYS 361 N 0.30 0.56 -0.06 4.80 1.57 -0.89 -0.83 116.57 122.01 1ag8 h LYS 361 Ca 0.26 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.87 1ag8 h LYS 361 Cb 0.32 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1ag8 h LYS 361 CO -0.30 0.37 -0.57 0.93 -0.57 0.00 0.00 179.45 179.32 1ag8 h GLU 362 N 0.58 0.20 0.00 3.15 5.08 0.16 -2.64 114.58 121.10 1ag8 h GLU 362 Ca 0.20 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1ag8 h GLU 362 Cb 0.03 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1ag8 h GLU 362 CO -0.10 0.71 0.00 0.93 -1.00 0.00 0.00 179.01 179.55 1ag8 h GLU 363 N 0.15 0.00 0.00 2.33 4.39 0.77 -3.46 114.58 118.76 1ag8 h GLU 363 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1ag8 h GLU 363 Cb 1.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 1ag8 h GLU 363 CO 0.09 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.35 1ag8 n GLY 364 N -0.15 1.22 3.91 -3.84 0.00 -1.00 -5.07 105.19 100.27 1ag8 n GLY 364 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1ag8 n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ag8 s LEU 365 N 0.00 4.32 -0.80 0.99 1.43 -0.35 -5.03 118.68 119.25 1ag8 s LEU 365 Ca 0.00 0.38 -0.25 0.00 -1.03 0.00 0.00 54.13 53.23 1ag8 s LEU 365 Cb 0.00 -3.08 0.05 0.00 0.03 0.00 0.00 46.19 43.18 1ag8 s LEU 365 CO 0.00 0.12 1.25 -0.75 0.23 0.00 0.00 176.35 177.20 1ag8 s LYS 366 N -2.60 3.29 -0.30 1.70 2.20 -1.02 -4.63 119.74 118.38 1ag8 s LYS 366 Ca 0.37 -0.63 -0.29 0.00 -0.36 0.00 0.00 55.97 55.06 1ag8 s LYS 366 Cb -0.13 -4.49 -0.01 0.00 -1.51 0.00 0.00 37.83 31.69 1ag8 s LYS 366 CO 0.27 -2.08 1.58 -1.17 -0.36 0.00 0.00 175.35 173.59 1ag8 s LEU 367 N 5.09 3.72 -0.17 5.43 2.96 -1.26 -0.57 118.68 133.88 1ag8 s LEU 367 Ca 0.35 1.32 0.18 0.00 -0.22 0.00 0.00 54.13 55.76 1ag8 s LEU 367 Cb -0.08 -3.53 -0.25 0.00 0.50 0.00 0.00 46.19 42.83 1ag8 s LEU 367 CO 0.07 -1.39 0.15 0.18 -1.32 0.00 0.00 176.35 174.04 1ag8 n LEU 368 N 8.91 0.06 -4.14 -0.68 4.77 0.03 -4.93 117.00 121.01 1ag8 n LEU 368 Ca 0.19 0.03 -0.26 0.00 -0.03 0.00 0.00 56.01 55.94 1ag8 n LEU 368 Cb 0.46 0.44 -0.16 0.00 -2.33 0.00 0.00 43.42 41.83 1ag8 n LEU 368 CO 0.67 0.45 -0.50 0.00 -1.33 0.00 0.00 177.39 176.67 1ag8 n GLY 370 N 3.13 0.13 3.05 0.00 0.00 -1.26 -3.79 105.19 106.44 1ag8 n GLY 370 Ca -0.18 0.89 -0.38 0.00 0.00 0.00 0.00 46.02 46.36 1ag8 n GLY 370 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ag8 n GLY 371 N 3.39 4.40 3.37 -0.02 0.00 -1.26 -4.09 105.19 110.99 1ag8 n GLY 371 Ca 0.27 -2.63 -0.09 0.00 0.00 0.00 0.00 46.02 43.57 1ag8 n GLY 371 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ag8 n GLY 372 N 2.01 1.25 3.76 -0.02 0.00 -1.26 -4.91 105.19 106.01 1ag8 n GLY 372 Ca 0.24 -1.29 -0.39 0.00 0.00 0.00 0.00 46.02 44.58 1ag8 n GLY 372 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ag8 s ALA 373 N -2.09 3.00 -1.47 4.61 0.00 -1.26 -0.17 121.76 124.38 1ag8 s ALA 373 Ca 0.16 1.28 0.22 0.00 0.00 0.00 0.00 51.96 53.63 1ag8 s ALA 373 Cb -0.04 -3.53 -0.01 0.00 0.00 0.00 0.00 23.12 19.54 1ag8 s ALA 373 CO 0.12 -1.13 1.06 0.00 0.00 0.00 0.00 175.76 175.81 1ag8 n ALA 374 N -0.59 4.08 -3.83 0.00 0.00 0.26 -4.61 120.51 115.82 1ag8 n ALA 374 Ca 0.08 -0.59 -0.06 0.00 0.00 0.00 0.00 53.44 52.87 1ag8 n ALA 374 Cb 0.45 -0.83 -0.01 0.00 0.00 0.00 0.00 19.45 19.05 1ag8 n ALA 374 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ag8 s ALA 375 N -2.76 -1.28 -0.41 0.00 0.00 -1.26 -4.99 121.76 111.06 1ag8 s ALA 375 Ca 0.14 -0.26 0.12 0.00 0.00 0.00 0.00 51.96 51.96 1ag8 s ALA 375 Cb 0.17 0.77 0.34 0.00 0.00 0.00 0.00 23.12 24.40 1ag8 s ALA 375 CO 0.71 -1.04 1.26 -0.40 0.00 0.00 0.00 175.76 176.30 1ag8 n ASP 376 N -0.63 3.06 0.00 0.00 5.68 -1.26 -4.76 116.55 118.64 1ag8 n ASP 376 Ca -0.05 -2.53 0.00 0.00 -0.50 0.00 0.00 54.79 51.71 1ag8 n ASP 376 Cb 0.60 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 40.24 1ag8 n ASP 376 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1ag8 n ARG 377 N -0.28 0.00 -0.36 0.11 1.85 -1.26 -5.08 116.66 111.63 1ag8 n ARG 377 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.99 1ag8 n ARG 377 Cb 0.60 -0.24 0.00 0.00 -1.05 0.00 0.00 32.46 31.77 1ag8 n ARG 377 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ag8 n GLY 378 N 2.51 0.12 2.61 2.89 0.00 -1.09 -4.46 105.19 107.76 1ag8 n GLY 378 Ca 0.00 -1.85 -0.38 0.00 0.00 0.00 0.00 46.02 43.79 1ag8 n GLY 378 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ag8 n TYR 379 N -1.44 2.55 -3.24 1.61 4.01 -0.72 -4.83 117.16 115.10 1ag8 n TYR 379 Ca 0.00 -2.51 -0.39 0.00 -0.16 0.00 0.00 57.90 54.84 1ag8 n TYR 379 Cb 0.00 -1.44 -0.06 0.00 -0.31 0.00 0.00 39.34 37.53 1ag8 n TYR 379 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1ag8 s PHE 380 N -2.81 3.66 0.04 -0.72 0.08 -1.26 -0.11 117.98 116.86 1ag8 s PHE 380 Ca 0.49 1.14 0.07 0.00 0.12 0.00 0.00 56.93 58.75 1ag8 s PHE 380 Cb 0.26 -2.57 -0.02 0.00 -0.57 0.00 0.00 43.02 40.11 1ag8 s PHE 380 CO -0.18 0.35 -0.20 0.42 -0.10 0.00 0.00 175.22 175.51 1ag8 s ILE 381 N -0.15 1.64 0.18 0.64 1.01 -1.26 -0.58 121.20 122.69 1ag8 s ILE 381 Ca 0.30 -1.17 -0.30 0.00 0.00 0.00 0.00 60.65 59.48 1ag8 s ILE 381 Cb -0.18 -1.42 -0.08 0.00 0.01 0.00 0.00 42.46 40.79 1ag8 s ILE 381 CO 0.16 0.21 1.07 -1.10 0.00 0.00 0.00 174.94 175.28 1ag8 s GLN 382 N -1.13 4.63 -0.38 2.79 -0.21 0.77 -4.63 119.66 121.49 1ag8 s GLN 382 Ca 0.07 1.68 -0.27 0.00 0.02 0.00 0.00 55.36 56.86 1ag8 s GLN 382 Cb -0.09 -3.28 -0.06 0.00 1.00 0.00 0.00 33.01 30.58 1ag8 s GLN 382 CO 0.02 0.13 2.32 -1.25 -2.12 0.00 0.00 175.29 174.38 1ag8 s PRO 383 N -0.45 2.52 0.11 2.91 0.04 -1.26 -4.58 135.00 134.30 1ag8 s PRO 383 Ca 0.48 1.64 -0.12 0.00 0.04 0.00 0.00 61.00 63.04 1ag8 s PRO 383 Cb -0.29 -4.49 -0.06 0.00 0.04 0.00 0.00 34.50 29.70 1ag8 s PRO 383 CO 0.34 -2.80 0.47 0.99 0.04 0.00 0.00 177.00 176.05 1ag8 s THR 384 N 10.57 4.98 -0.06 1.26 2.01 -0.05 -4.51 115.64 129.85 1ag8 s THR 384 Ca 0.98 0.62 -0.00 0.00 0.31 0.00 0.00 61.69 63.61 1ag8 s THR 384 Cb -0.23 -3.69 0.02 0.00 0.01 0.00 0.00 72.50 68.62 1ag8 s THR 384 CO 0.30 0.26 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.77 1ag8 s VAL 385 N -1.44 0.47 -0.20 3.82 1.01 -1.25 -0.21 120.40 122.59 1ag8 s VAL 385 Ca 0.36 -0.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.29 1ag8 s VAL 385 Cb -0.14 -0.55 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 1ag8 s VAL 385 CO 0.19 0.24 -0.05 -0.36 0.00 0.00 0.00 175.10 175.11 1ag8 s PHE 386 N 1.37 2.95 0.36 5.22 0.08 0.71 -0.79 117.98 127.88 1ag8 s PHE 386 Ca -0.04 -0.83 0.07 0.00 0.12 0.00 0.00 56.93 56.25 1ag8 s PHE 386 Cb -0.13 -2.06 -0.01 0.00 -0.57 0.00 0.00 43.02 40.25 1ag8 s PHE 386 CO -0.03 -0.45 0.42 0.20 -0.10 0.00 0.00 175.22 175.26 1ag8 s GLY 387 N 1.22 1.81 -1.24 4.36 0.00 0.26 -1.02 107.32 112.71 1ag8 s GLY 387 Ca 0.03 -1.63 -0.00 0.00 0.00 0.00 0.00 44.72 43.11 1ag8 s GLY 387 CO -0.01 -1.51 0.86 1.22 0.00 0.00 0.00 173.10 173.65 1ag8 n ASP 388 N -1.58 -1.75 -4.90 1.64 9.92 -1.13 -2.42 116.55 116.33 1ag8 n ASP 388 Ca 0.02 -0.72 -0.29 0.00 -0.53 0.00 0.00 54.79 53.27 1ag8 n ASP 388 Cb 0.59 -4.62 -0.02 0.00 -0.64 0.00 0.00 41.12 36.43 1ag8 n ASP 388 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1ag8 s LEU 389 N -6.48 3.88 -0.04 0.64 1.43 -1.14 -4.62 118.68 112.35 1ag8 s LEU 389 Ca 0.01 0.89 0.07 0.00 -1.03 0.00 0.00 54.13 54.08 1ag8 s LEU 389 Cb -0.00 -3.77 -0.02 0.00 0.03 0.00 0.00 46.19 42.44 1ag8 s LEU 389 CO 0.77 -0.36 -0.25 -1.10 0.23 0.00 0.00 176.35 175.64 1ag8 s GLN 390 N -3.97 2.31 0.57 1.70 -1.52 -1.26 -4.65 119.66 112.84 1ag8 s GLN 390 Ca 0.47 -0.92 0.34 0.00 -1.95 0.00 0.00 55.36 53.30 1ag8 s GLN 390 Cb -0.10 -2.09 1.44 0.00 -0.22 0.00 0.00 33.01 32.04 1ag8 s GLN 390 CO 0.34 0.47 1.74 -0.44 -0.25 0.00 0.00 175.29 177.15 1ag8 h ASP 391 N 5.76 0.00 0.12 5.90 3.32 -1.98 0.15 116.42 129.69 1ag8 h ASP 391 Ca -0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.67 1ag8 h ASP 391 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 1ag8 h ASP 391 CO 0.47 0.00 -0.06 0.61 -1.72 0.00 0.00 179.24 178.54 1ag8 n GLY 392 N -1.69 -0.55 3.75 2.75 0.00 -1.26 -4.56 105.19 103.62 1ag8 n GLY 392 Ca 0.21 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 1ag8 n GLY 392 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ag8 s MET 393 N -2.18 4.74 0.17 1.61 -1.94 0.53 -4.94 119.30 117.28 1ag8 s MET 393 Ca 0.36 1.60 -0.20 0.00 -1.71 0.00 0.00 55.69 55.75 1ag8 s MET 393 Cb 0.21 -3.27 0.09 0.00 2.01 0.00 0.00 34.83 33.87 1ag8 s MET 393 CO 0.40 0.33 1.63 1.79 -0.01 0.00 0.00 175.02 179.16 1ag8 h THR 394 N 3.36 0.39 0.00 2.05 1.35 -1.90 0.25 112.91 118.42 1ag8 h THR 394 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1ag8 h THR 394 Cb 1.21 0.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.02 1ag8 h THR 394 CO 0.69 0.00 0.06 0.16 -0.25 0.00 0.00 175.52 176.18 1ag8 h ILE 395 N -0.15 0.00 -0.03 6.82 3.07 -1.89 0.56 117.51 125.90 1ag8 h ILE 395 Ca 0.19 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.60 1ag8 h ILE 395 Cb 0.44 0.46 0.00 0.00 -0.27 0.00 0.00 36.82 37.45 1ag8 h ILE 395 CO -0.48 0.00 -0.05 0.00 -1.05 0.00 0.00 178.15 176.57 1ag8 n ALA 396 N -1.75 2.57 -0.02 0.16 0.00 0.83 -4.54 120.51 117.76 1ag8 n ALA 396 Ca -0.01 -0.68 -0.03 0.00 0.00 0.00 0.00 53.44 52.72 1ag8 n ALA 396 Cb 0.09 -0.78 -0.01 0.00 0.00 0.00 0.00 19.45 18.75 1ag8 n ALA 396 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ag8 n LYS 397 N 1.16 0.08 -3.62 0.00 5.02 0.15 -4.92 118.16 116.03 1ag8 n LYS 397 Ca 0.13 0.03 -0.38 0.00 -2.02 0.00 0.00 58.31 56.07 1ag8 n LYS 397 Cb 0.56 -0.86 -0.06 0.00 -0.02 0.00 0.00 35.03 34.65 1ag8 n LYS 397 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ag8 s GLU 398 N -2.07 3.79 -0.08 1.97 2.02 0.11 -4.95 118.70 119.51 1ag8 s GLU 398 Ca -0.05 0.22 -0.29 0.00 0.02 0.00 0.00 54.97 54.87 1ag8 s GLU 398 Cb 0.01 -3.23 -0.06 0.00 0.10 0.00 0.00 34.13 30.95 1ag8 s GLU 398 CO 0.07 0.68 1.87 -2.00 0.02 0.00 0.00 175.26 175.91 1ag8 s GLU 399 N -0.94 3.91 0.01 1.61 2.12 -1.26 -4.72 118.70 119.44 1ag8 s GLU 399 Ca 0.20 2.24 0.02 0.00 0.36 0.00 0.00 54.97 57.80 1ag8 s GLU 399 Cb -0.15 -4.13 -0.25 0.00 0.26 0.00 0.00 34.13 29.85 1ag8 s GLU 399 CO 0.10 -1.19 0.89 0.82 -0.54 0.00 0.00 175.26 175.33 1ag8 h ILE 400 N 5.98 1.18 -4.53 -3.70 2.04 -1.90 -3.49 117.51 113.10 1ag8 h ILE 400 Ca -0.43 -2.89 -0.39 0.00 1.00 0.00 0.00 64.86 62.15 1ag8 h ILE 400 Cb 1.21 2.69 0.01 0.00 -0.74 0.00 0.00 36.82 39.99 1ag8 h ILE 400 CO 0.96 0.78 -0.57 0.33 0.00 0.00 0.00 178.15 179.65 1ag8 n PHE 401 N -3.34 -1.79 -4.13 1.37 7.35 -1.26 -4.60 117.46 111.06 1ag8 n PHE 401 Ca -0.14 0.42 -0.15 0.00 -0.76 0.00 0.00 57.45 56.82 1ag8 n PHE 401 Cb 1.02 -3.94 -0.05 0.00 0.35 0.00 0.00 39.48 36.87 1ag8 n PHE 401 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1ag8 s GLY 402 N -2.59 1.63 -1.11 7.13 0.00 -1.12 -3.93 107.32 107.34 1ag8 s GLY 402 Ca 0.27 -1.62 -0.08 0.00 0.00 0.00 0.00 44.72 43.30 1ag8 s GLY 402 CO 0.34 -1.10 2.67 -1.55 0.00 0.00 0.00 173.10 173.46 1ag8 n PRO 403 N -0.56 2.78 -4.00 2.90 -0.04 -1.19 -4.36 135.00 130.54 1ag8 n PRO 403 Ca 0.02 -1.71 -0.31 0.00 -0.04 0.00 0.00 63.50 61.47 1ag8 n PRO 403 Cb 0.62 -2.53 -0.15 0.00 -0.04 0.00 0.00 33.50 31.40 1ag8 n PRO 403 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ag8 s VAL 404 N 2.49 1.85 0.15 0.52 1.01 -1.26 -0.87 120.40 124.29 1ag8 s VAL 404 Ca 0.56 -1.45 -0.12 0.00 0.00 0.00 0.00 61.98 60.98 1ag8 s VAL 404 Cb 0.16 -2.05 -0.07 0.00 0.00 0.00 0.00 36.38 34.43 1ag8 s VAL 404 CO -0.04 -0.08 0.51 -0.32 0.00 0.00 0.00 175.10 175.16 1ag8 s MET 405 N 1.24 3.87 -0.12 2.72 1.75 0.70 -4.98 119.30 124.48 1ag8 s MET 405 Ca -0.07 0.35 0.02 0.00 -1.25 0.00 0.00 55.69 54.73 1ag8 s MET 405 Cb -0.19 -2.88 0.02 0.00 2.84 0.00 0.00 34.83 34.61 1ag8 s MET 405 CO -0.06 0.46 -0.16 -0.65 -0.65 0.00 0.00 175.02 173.96 1ag8 s GLN 406 N -2.17 2.39 -0.23 4.11 1.11 -1.26 -0.21 119.66 123.40 1ag8 s GLN 406 Ca 0.39 -0.62 0.01 0.00 0.01 0.00 0.00 55.36 55.16 1ag8 s GLN 406 Cb -0.14 -2.03 0.04 0.00 -1.01 0.00 0.00 33.01 29.87 1ag8 s GLN 406 CO 0.20 -0.09 -0.13 0.42 0.01 0.00 0.00 175.29 175.70 1ag8 s ILE 407 N 1.04 2.30 0.23 1.08 1.01 -0.19 -1.55 121.20 125.13 1ag8 s ILE 407 Ca -0.05 -1.29 0.06 0.00 0.00 0.00 0.00 60.65 59.38 1ag8 s ILE 407 Cb -0.15 -2.20 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 1ag8 s ILE 407 CO -0.03 0.20 0.26 -0.76 0.00 0.00 0.00 174.94 174.60 1ag8 s LEU 408 N 1.21 4.03 -0.02 2.97 1.43 0.77 -2.84 118.68 126.23 1ag8 s LEU 408 Ca -0.03 -0.10 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 1ag8 s LEU 408 Cb -0.17 -2.58 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 1ag8 s LEU 408 CO -0.07 -0.04 -0.19 -0.75 0.23 0.00 0.00 176.35 175.53 1ag8 s LYS 409 N -3.80 2.26 0.11 1.70 2.20 -1.26 -0.55 119.74 120.41 1ag8 s LYS 409 Ca 0.33 -0.85 -0.02 0.00 -0.36 0.00 0.00 55.97 55.07 1ag8 s LYS 409 Cb -0.09 -2.22 -0.03 0.00 -1.51 0.00 0.00 37.83 33.98 1ag8 s LYS 409 CO 0.27 0.58 0.07 -0.59 -0.36 0.00 0.00 175.35 175.32 1ag8 s PHE 410 N -0.75 0.69 -0.01 4.03 -0.71 -0.71 -4.86 117.98 115.67 1ag8 s PHE 410 Ca 0.12 -1.10 -0.05 0.00 -1.04 0.00 0.00 56.93 54.85 1ag8 s PHE 410 Cb -0.10 -0.38 -0.02 0.00 -1.21 0.00 0.00 43.02 41.30 1ag8 s PHE 410 CO 0.01 -0.52 -0.11 1.17 -1.34 0.00 0.00 175.22 174.44 1ag8 n LYS 411 N -0.06 0.17 -3.75 1.99 4.81 -1.26 -0.92 118.16 119.14 1ag8 n LYS 411 Ca -0.08 0.07 -0.21 0.00 -0.87 0.00 0.00 58.31 57.21 1ag8 n LYS 411 Cb 0.63 -0.80 -0.04 0.00 0.02 0.00 0.00 35.03 34.84 1ag8 n LYS 411 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1ag8 s SER 412 N -5.94 5.08 0.01 3.14 1.04 -1.26 -4.87 113.70 110.90 1ag8 s SER 412 Ca -0.10 -0.66 -0.22 0.00 0.48 0.00 0.00 55.95 55.45 1ag8 s SER 412 Cb 0.02 -0.75 -0.17 0.00 0.10 0.00 0.00 66.02 65.22 1ag8 s SER 412 CO 0.14 -0.49 1.29 -0.03 0.98 0.00 0.00 173.24 175.14 1ag8 h MET 413 N 1.19 0.23 -0.79 4.02 4.05 -1.98 -1.02 114.93 120.63 1ag8 h MET 413 Ca -0.43 -0.13 0.13 0.00 -0.28 0.00 0.00 59.70 58.99 1ag8 h MET 413 Cb 1.26 0.01 -0.09 0.00 -0.80 0.00 0.00 31.60 31.98 1ag8 h MET 413 CO 0.59 0.68 0.38 1.49 0.23 0.00 0.00 176.91 180.27 1ag8 h GLU 414 N -0.20 0.55 0.30 0.39 4.22 -2.00 0.30 114.58 118.14 1ag8 h GLU 414 Ca 0.01 -0.03 -0.01 0.00 0.08 0.00 0.00 59.36 59.40 1ag8 h GLU 414 Cb 0.64 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1ag8 h GLU 414 CO 0.03 0.36 -0.14 1.49 -2.18 0.00 0.00 179.01 178.56 1ag8 h GLU 415 N 0.56 -0.39 -0.15 1.92 4.81 -1.95 -2.87 114.58 116.52 1ag8 h GLU 415 Ca 0.42 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.65 1ag8 h GLU 415 Cb 0.58 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 1ag8 h GLU 415 CO -0.35 -0.10 -0.03 -0.24 -0.73 0.00 0.00 179.01 177.55 1ag8 h VAL 416 N -0.67 1.12 0.12 0.32 3.04 -0.66 -1.24 116.25 118.29 1ag8 h VAL 416 Ca -0.04 -0.48 -0.01 0.00 -1.01 0.00 0.00 66.70 65.16 1ag8 h VAL 416 Cb 0.47 1.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.80 1ag8 h VAL 416 CO 0.07 0.16 -0.06 0.58 -1.01 0.00 0.00 177.57 177.31 1ag8 h VAL 417 N 0.21 1.02 -0.56 1.51 2.07 -0.96 0.39 116.25 119.93 1ag8 h VAL 417 Ca 0.05 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1ag8 h VAL 417 Cb 0.20 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1ag8 h VAL 417 CO 0.01 0.15 0.35 1.23 0.02 0.00 0.00 177.57 179.32 1ag8 h GLY 418 N -0.45 0.81 0.77 2.17 0.00 -1.26 0.96 103.07 106.07 1ag8 h GLY 418 Ca -0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 1ag8 h GLY 418 CO 0.03 0.32 -0.09 3.21 0.00 0.00 0.00 176.54 180.01 1ag8 h ARG 419 N 0.76 -0.25 -0.99 4.80 3.08 -1.20 -0.19 114.38 120.39 1ag8 h ARG 419 Ca 0.20 0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.31 1ag8 h ARG 419 Cb -0.03 0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.02 1ag8 h ARG 419 CO -0.04 0.01 0.65 0.00 -1.07 0.00 0.00 179.97 179.52 1ag8 h ALA 420 N 0.26 1.31 0.00 0.04 0.00 -0.82 -1.39 119.26 118.67 1ag8 h ALA 420 Ca -0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ag8 h ALA 420 Cb 0.37 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ag8 h ALA 420 CO 0.04 0.55 0.00 -0.91 0.00 0.00 0.00 179.25 178.93 1ag8 h ASN 421 N 1.26 0.00 -0.34 0.00 2.35 -0.73 -3.40 115.58 114.72 1ag8 h ASN 421 Ca 0.39 0.00 -0.65 0.00 -0.55 0.00 0.00 56.30 55.49 1ag8 h ASN 421 Cb -0.00 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 1ag8 h ASN 421 CO -0.12 0.00 2.48 -3.20 -1.65 0.00 0.00 177.43 174.93 1ag8 n ASN 422 N -2.91 3.94 -3.53 5.81 4.05 -0.09 -4.81 115.26 117.71 1ag8 n ASN 422 Ca 0.03 -2.83 -0.16 0.00 0.45 0.00 0.00 54.58 52.07 1ag8 n ASN 422 Cb 0.41 -1.62 -0.05 0.00 1.23 0.00 0.00 39.78 39.75 1ag8 n ASN 422 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 1ag8 s SER 423 N 4.17 -0.59 0.09 1.20 0.15 -1.26 -4.99 113.70 112.47 1ag8 s SER 423 Ca 0.53 0.50 0.27 0.00 0.70 0.00 0.00 55.95 57.95 1ag8 s SER 423 Cb 0.09 0.53 1.03 0.00 -1.71 0.00 0.00 66.02 65.96 1ag8 s SER 423 CO 0.02 -0.67 1.83 0.29 1.20 0.00 0.00 173.24 175.91 1ag8 n LYS 424 N 0.67 0.10 -3.19 5.44 4.76 -1.26 -4.81 118.16 119.86 1ag8 n LYS 424 Ca -0.19 0.12 -0.20 0.00 -2.87 0.00 0.00 58.31 55.17 1ag8 n LYS 424 Cb 0.59 -1.63 0.01 0.00 -1.84 0.00 0.00 35.03 32.15 1ag8 n LYS 424 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1ag8 s TYR 425 N -3.05 3.06 -0.29 2.13 2.02 -1.26 -0.64 117.35 119.32 1ag8 s TYR 425 Ca 0.12 -0.13 0.05 0.00 -0.37 0.00 0.00 57.07 56.74 1ag8 s TYR 425 Cb 0.15 -2.21 0.20 0.00 -0.40 0.00 0.00 41.96 39.70 1ag8 s TYR 425 CO 0.53 -0.25 1.12 0.41 -1.57 0.00 0.00 175.55 175.79 1ag8 n GLY 426 N -1.85 0.25 0.07 0.71 0.00 -1.26 -4.73 105.19 98.37 1ag8 n GLY 426 Ca 0.03 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 1ag8 n GLY 426 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ag8 h LEU 427 N 1.14 -0.02 -8.25 0.99 5.85 -1.83 0.10 115.31 113.30 1ag8 h LEU 427 Ca -0.38 -0.76 -0.09 0.00 0.84 0.00 0.00 57.88 57.50 1ag8 h LEU 427 Cb 1.22 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.19 1ag8 h LEU 427 CO -0.13 0.78 -0.05 0.00 -0.34 0.00 0.00 178.44 178.70 1ag8 s ALA 428 N -2.96 -0.17 0.12 1.25 0.00 -1.26 -2.35 121.76 116.38 1ag8 s ALA 428 Ca -0.17 -0.95 -0.25 0.00 0.00 0.00 0.00 51.96 50.58 1ag8 s ALA 428 Cb -0.01 1.01 0.07 0.00 0.00 0.00 0.00 23.12 24.19 1ag8 s ALA 428 CO 0.64 -0.88 0.81 0.00 0.00 0.00 0.00 175.76 176.34 1ag8 s ALA 429 N -3.54 -1.64 0.00 0.00 0.00 0.28 -4.14 121.76 112.73 1ag8 s ALA 429 Ca 0.22 0.47 -0.08 0.00 0.00 0.00 0.00 51.96 52.57 1ag8 s ALA 429 Cb -0.02 0.65 0.00 0.00 0.00 0.00 0.00 23.12 23.76 1ag8 s ALA 429 CO 0.12 -0.85 0.15 0.00 0.00 0.00 0.00 175.76 175.18 1ag8 s ALA 430 N -3.43 -0.35 -0.05 0.00 0.00 -0.80 -0.50 121.76 116.62 1ag8 s ALA 430 Ca 0.07 -0.11 -0.00 0.00 0.00 0.00 0.00 51.96 51.91 1ag8 s ALA 430 Cb -0.02 0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.24 1ag8 s ALA 430 CO -0.05 -0.21 -0.01 0.08 0.00 0.00 0.00 175.76 175.57 1ag8 s VAL 431 N -1.40 0.37 -0.28 0.00 1.01 0.55 -1.11 120.40 119.54 1ag8 s VAL 431 Ca -0.15 0.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.83 1ag8 s VAL 431 Cb -0.07 -0.47 0.03 0.00 0.00 0.00 0.00 36.38 35.86 1ag8 s VAL 431 CO 0.02 0.22 0.01 -0.36 0.00 0.00 0.00 175.10 174.98 1ag8 s PHE 432 N 1.37 3.14 -0.08 5.22 0.40 -0.11 -0.23 117.98 127.68 1ag8 s PHE 432 Ca -0.04 -1.43 -0.30 0.00 -0.60 0.00 0.00 56.93 54.56 1ag8 s PHE 432 Cb -0.13 -2.15 0.11 0.00 0.51 0.00 0.00 43.02 41.36 1ag8 s PHE 432 CO -0.02 -0.70 0.89 -0.08 0.70 0.00 0.00 175.22 176.00 1ag8 s THR 433 N 1.37 0.00 -0.75 0.64 -1.32 -1.26 -1.66 115.64 112.65 1ag8 s THR 433 Ca -0.00 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.70 1ag8 s THR 433 Cb -0.18 -1.00 -0.13 0.00 -1.51 0.00 0.00 72.50 69.68 1ag8 s THR 433 CO -0.01 0.00 1.04 0.29 -2.21 0.00 0.00 174.62 173.73 1ag8 n LYS 434 N 0.43 0.18 -2.79 7.08 5.02 -1.26 -4.85 118.16 121.96 1ag8 n LYS 434 Ca -0.12 -0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.74 1ag8 n LYS 434 Cb 0.59 -1.55 -0.03 0.00 -0.02 0.00 0.00 35.03 34.02 1ag8 n LYS 434 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ag8 s ASP 435 N -3.55 7.09 0.10 4.39 2.15 -1.26 -4.98 116.67 120.62 1ag8 s ASP 435 Ca 0.06 1.34 -0.23 0.00 0.43 0.00 0.00 52.55 54.15 1ag8 s ASP 435 Cb 0.15 -2.50 -0.10 0.00 -0.30 0.00 0.00 42.92 40.17 1ag8 s ASP 435 CO 0.80 -0.44 1.71 0.25 -0.17 0.00 0.00 175.17 177.33 1ag8 h LEU 436 N 8.25 -0.18 -0.87 -1.34 5.85 -2.00 -1.79 115.31 123.24 1ag8 h LEU 436 Ca -0.29 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.43 1ag8 h LEU 436 Cb 1.13 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.20 1ag8 h LEU 436 CO 0.86 -0.09 0.43 0.44 -0.34 0.00 0.00 178.44 179.74 1ag8 h ASP 437 N -0.10 1.12 -0.28 1.25 3.32 -1.99 -1.12 116.42 118.62 1ag8 h ASP 437 Ca 0.03 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 56.91 1ag8 h ASP 437 Cb 0.14 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1ag8 h ASP 437 CO -0.07 0.93 0.01 0.11 -1.72 0.00 0.00 179.24 178.49 1ag8 h LYS 438 N 1.23 0.48 0.40 3.56 1.57 -1.94 0.70 116.57 122.56 1ag8 h LYS 438 Ca 0.30 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1ag8 h LYS 438 Cb 0.09 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 1ag8 h LYS 438 CO -0.04 0.63 -0.44 0.00 -0.57 0.00 0.00 179.45 179.03 1ag8 h ALA 439 N 0.83 -0.94 -0.66 3.86 0.00 -1.06 0.44 119.26 121.73 1ag8 h ALA 439 Ca 0.08 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.88 1ag8 h ALA 439 Cb 0.41 0.64 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 1ag8 h ALA 439 CO 0.01 -1.07 0.39 -0.91 0.00 0.00 0.00 179.25 177.67 1ag8 h ASN 440 N -0.86 0.61 0.53 0.00 2.35 -1.18 -1.02 115.58 116.02 1ag8 h ASN 440 Ca -0.04 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.70 1ag8 h ASN 440 Cb 0.77 -0.11 0.01 0.00 0.05 0.00 0.00 38.32 39.03 1ag8 h ASN 440 CO -0.09 0.41 -0.26 0.22 -1.65 0.00 0.00 177.43 176.07 1ag8 h TYR 441 N 0.75 -0.66 -0.58 1.19 3.20 -0.65 -3.01 116.97 117.20 1ag8 h TYR 441 Ca 0.28 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.16 1ag8 h TYR 441 Cb 0.10 0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.55 1ag8 h TYR 441 CO -0.06 -0.36 0.36 -0.07 -1.64 0.00 0.00 178.16 176.38 1ag8 h LEU 442 N -0.85 0.59 -1.27 2.82 3.38 -0.81 -1.26 115.31 117.90 1ag8 h LEU 442 Ca -0.07 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.99 1ag8 h LEU 442 Cb 0.60 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 1ag8 h LEU 442 CO 0.12 0.41 0.54 0.77 0.09 0.00 0.00 178.44 180.38 1ag8 h SER 443 N 0.71 0.73 0.18 -0.43 4.64 -1.22 0.21 113.55 118.37 1ag8 h SER 443 Ca 0.23 0.02 -0.27 0.00 -0.47 0.00 0.00 61.79 61.30 1ag8 h SER 443 Cb 0.01 -0.14 0.02 0.00 -0.31 0.00 0.00 62.40 61.98 1ag8 h SER 443 CO -0.09 0.44 -1.11 -0.61 -0.87 0.00 0.00 176.83 174.58 1ag8 h GLN 444 N 0.82 0.57 -0.14 4.77 4.15 -1.34 -3.34 115.11 120.60 1ag8 h GLN 444 Ca 0.38 -0.69 -0.15 0.00 0.77 0.00 0.00 58.65 58.96 1ag8 h GLN 444 Cb 0.40 0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.30 1ag8 h GLN 444 CO -0.15 1.29 -0.56 0.00 -1.93 0.00 0.00 178.83 177.47 1ag8 h ALA 445 N 0.46 0.77 -2.29 3.38 0.00 -0.17 -3.44 119.26 117.97 1ag8 h ALA 445 Ca -0.14 -0.52 -0.55 0.00 0.00 0.00 0.00 54.91 53.70 1ag8 h ALA 445 Cb 1.78 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 1ag8 h ALA 445 CO 0.21 0.70 0.93 -0.51 0.00 0.00 0.00 179.25 180.57 1ag8 s LEU 446 N -8.20 4.29 -1.34 0.00 1.43 -0.04 -4.93 118.68 109.88 1ag8 s LEU 446 Ca -0.06 2.06 -0.14 0.00 -1.03 0.00 0.00 54.13 54.95 1ag8 s LEU 446 Cb 0.12 -3.55 0.09 0.00 0.03 0.00 0.00 46.19 42.88 1ag8 s LEU 446 CO 0.82 -0.80 1.89 0.00 0.23 0.00 0.00 176.35 178.50 1ag8 n GLN 447 N 6.22 3.19 -4.08 1.70 6.02 -1.26 -4.90 117.38 124.26 1ag8 n GLN 447 Ca 0.15 -3.18 -0.13 0.00 -0.01 0.00 0.00 57.00 53.82 1ag8 n GLN 447 Cb 0.44 -3.25 -0.11 0.00 1.02 0.00 0.00 30.24 28.34 1ag8 n GLN 447 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ag8 s ALA 448 N 2.72 0.64 0.37 -1.58 0.00 -1.26 -4.53 121.76 118.13 1ag8 s ALA 448 Ca 0.47 -0.81 0.12 0.00 0.00 0.00 0.00 51.96 51.74 1ag8 s ALA 448 Cb 0.07 0.03 0.72 0.00 0.00 0.00 0.00 23.12 23.95 1ag8 s ALA 448 CO -0.01 -0.01 1.83 0.78 0.00 0.00 0.00 175.76 178.36 1ag8 h GLY 449 N 4.42 0.05 -6.17 0.00 0.00 -0.87 -3.43 103.07 97.07 1ag8 h GLY 449 Ca -0.36 -0.04 -0.27 0.00 0.00 0.00 0.00 47.33 46.66 1ag8 h GLY 449 CO 0.41 0.03 -0.70 -1.59 0.00 0.00 0.00 176.54 174.70 1ag8 s THR 450 N -4.27 -0.04 -0.18 4.70 2.01 -1.11 -4.69 115.64 112.06 1ag8 s THR 450 Ca -0.03 0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.12 1ag8 s THR 450 Cb 0.14 -0.10 0.04 0.00 0.01 0.00 0.00 72.50 72.59 1ag8 s THR 450 CO 0.73 0.06 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.91 1ag8 s VAL 451 N 0.77 1.63 -0.05 3.82 1.01 -1.26 -0.56 120.40 125.76 1ag8 s VAL 451 Ca -0.06 -0.89 -0.14 0.00 0.00 0.00 0.00 61.98 60.89 1ag8 s VAL 451 Cb -0.09 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 1ag8 s VAL 451 CO -0.03 0.27 0.38 0.26 0.00 0.00 0.00 175.10 175.98 1ag8 s TRP 452 N 1.42 3.65 -0.24 5.22 0.51 0.34 -4.96 118.94 124.88 1ag8 s TRP 452 Ca 0.01 0.88 -0.01 0.00 -2.12 0.00 0.00 56.10 54.86 1ag8 s TRP 452 Cb -0.15 -2.30 0.02 0.00 -0.81 0.00 0.00 33.47 30.23 1ag8 s TRP 452 CO -0.09 0.53 -0.07 0.08 -0.51 0.00 0.00 176.95 176.89 1ag8 s VAL 453 N -0.63 2.83 -1.43 4.03 1.01 -1.26 -0.33 120.40 124.62 1ag8 s VAL 453 Ca 0.22 -1.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.16 1ag8 s VAL 453 Cb -0.16 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.81 1ag8 s VAL 453 CO 0.11 0.23 0.57 0.59 0.00 0.00 0.00 175.10 176.60 1ag8 n ASN 454 N 4.67 -5.78 -3.65 3.32 3.02 0.68 -4.96 115.26 112.56 1ag8 n ASN 454 Ca -0.17 -0.27 -0.00 0.00 -0.03 0.00 0.00 54.58 54.11 1ag8 n ASN 454 Cb 0.47 -4.60 -0.00 0.00 -0.61 0.00 0.00 39.78 35.04 1ag8 n ASN 454 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ag8 s TYR 456 N -2.62 -0.24 -1.31 0.00 5.04 -1.26 -4.69 117.35 112.27 1ag8 s TYR 456 Ca 0.15 0.24 -0.07 0.00 -2.44 0.00 0.00 57.07 54.95 1ag8 s TYR 456 Cb 0.02 0.18 0.05 0.00 0.35 0.00 0.00 41.96 42.57 1ag8 s TYR 456 CO -0.01 -0.53 0.46 -0.25 -1.34 0.00 0.00 175.55 173.88 1ag8 n ASP 457 N 0.69 -4.18 -4.52 4.32 8.00 -1.26 -4.91 116.55 114.70 1ag8 n ASP 457 Ca -0.19 -0.31 -0.43 0.00 0.71 0.00 0.00 54.79 54.57 1ag8 n ASP 457 Cb 0.59 -3.44 -0.06 0.00 -0.02 0.00 0.00 41.12 38.18 1ag8 n ASP 457 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ag8 s VAL 458 N -2.94 4.77 -0.06 2.53 1.01 -1.26 -5.03 120.40 119.42 1ag8 s VAL 458 Ca 0.34 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.49 1ag8 s VAL 458 Cb -0.17 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 31.92 1ag8 s VAL 458 CO 0.42 -0.66 -0.08 -0.36 0.00 0.00 0.00 175.10 174.41 1ag8 s PHE 459 N 2.97 2.90 -0.03 5.22 0.40 -1.26 -5.10 117.98 123.08 1ag8 s PHE 459 Ca 0.24 -0.01 0.02 0.00 -0.60 0.00 0.00 56.93 56.58 1ag8 s PHE 459 Cb -0.14 -1.69 0.01 0.00 0.51 0.00 0.00 43.02 41.71 1ag8 s PHE 459 CO 0.19 0.32 -0.07 0.20 0.70 0.00 0.00 175.22 176.57 1ag8 s GLY 460 N -0.87 0.47 0.65 4.36 0.00 -1.26 -4.99 107.32 105.68 1ag8 s GLY 460 Ca 0.13 -0.19 0.40 0.00 0.00 0.00 0.00 44.72 45.07 1ag8 s GLY 460 CO 0.02 0.16 2.32 0.00 0.00 0.00 0.00 173.10 175.60 1ag8 h ALA 461 N 6.74 1.16 0.00 3.20 0.00 -1.95 -1.55 119.26 126.87 1ag8 h ALA 461 Ca -0.35 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ag8 h ALA 461 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ag8 h ALA 461 CO 0.48 -0.03 -0.37 0.00 0.00 0.00 0.00 179.25 179.33 1ag8 n GLN 462 N -3.27 0.09 -4.95 0.00 0.00 -1.26 -1.01 117.38 106.98 1ag8 n GLN 462 Ca -0.03 0.04 -0.32 0.00 0.00 0.00 0.00 57.00 56.68 1ag8 n GLN 462 Cb 0.10 -1.57 -0.15 0.00 0.00 0.00 0.00 30.24 28.62 1ag8 n GLN 462 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 1ag8 s SER 463 N -3.41 3.70 0.80 2.61 0.01 -0.58 -4.22 113.70 112.59 1ag8 s SER 463 Ca 0.11 -0.38 -0.13 0.00 1.31 0.00 0.00 55.95 56.85 1ag8 s SER 463 Cb 0.16 -1.35 0.08 0.00 0.21 0.00 0.00 66.02 65.12 1ag8 s SER 463 CO 0.66 0.20 1.19 -2.16 0.41 0.00 0.00 173.24 173.54 1ag8 s PRO 464 N 0.12 1.74 -0.03 12.44 0.04 -1.24 -4.28 135.00 143.79 1ag8 s PRO 464 Ca -0.08 1.69 -0.02 0.00 0.04 0.00 0.00 61.00 62.63 1ag8 s PRO 464 Cb -0.15 -1.79 0.02 0.00 0.04 0.00 0.00 34.50 32.61 1ag8 s PRO 464 CO 0.05 -2.12 0.07 0.12 0.04 0.00 0.00 177.00 175.16 1ag8 s PHE 465 N -2.22 -0.06 0.00 0.56 5.36 -1.26 -4.80 117.98 115.55 1ag8 s PHE 465 Ca 0.72 0.20 0.00 0.00 -0.96 0.00 0.00 56.93 56.89 1ag8 s PHE 465 Cb -0.27 -0.04 0.00 0.00 -0.34 0.00 0.00 43.02 42.37 1ag8 s PHE 465 CO 0.50 -0.06 0.00 0.41 -1.46 0.00 0.00 175.22 174.61 1ag8 n GLY 466 N 3.44 -0.99 3.72 13.12 0.00 -1.26 -0.44 105.19 122.77 1ag8 n GLY 466 Ca -0.17 -1.00 -0.28 0.00 0.00 0.00 0.00 46.02 44.57 1ag8 n GLY 466 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ag8 s GLY 467 N 0.00 1.84 0.07 -0.02 0.00 -1.25 -3.71 107.32 104.25 1ag8 s GLY 467 Ca 0.00 -1.19 0.17 0.00 0.00 0.00 0.00 44.72 43.70 1ag8 s GLY 467 CO 0.00 -1.18 0.86 -0.97 0.00 0.00 0.00 173.10 171.80 1ag8 h TYR 468 N 2.98 0.00 0.00 1.90 -1.99 -1.13 -3.37 116.97 115.36 1ag8 h TYR 468 Ca -0.47 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.26 1ag8 h TYR 468 Cb 1.18 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.91 1ag8 h TYR 468 CO 0.60 0.55 0.00 1.63 -0.00 0.00 0.00 178.16 180.95 1ag8 n LYS 469 N -2.89 0.00 -0.07 4.88 5.02 -1.26 -4.92 118.16 118.92 1ag8 n LYS 469 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1ag8 n LYS 469 Cb 0.82 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.86 1ag8 n LYS 469 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ag8 n LEU 470 N 0.00 1.58 -0.42 -0.35 4.77 0.19 -3.05 117.00 119.73 1ag8 n LEU 470 Ca 0.00 -0.80 0.04 0.00 -0.03 0.00 0.00 56.01 55.23 1ag8 n LEU 470 Cb 0.00 -0.52 0.07 0.00 -2.33 0.00 0.00 43.42 40.65 1ag8 n LEU 470 CO 0.00 0.31 0.47 -1.54 -1.33 0.00 0.00 177.39 175.30 1ag8 n SER 471 N 0.09 2.13 0.00 -1.43 3.41 -1.26 -4.40 113.62 112.16 1ag8 n SER 471 Ca 0.02 -1.61 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 1ag8 n SER 471 Cb 0.35 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1ag8 n SER 471 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ag8 n GLY 472 N 0.43 -2.48 3.37 5.00 0.00 -1.17 -1.33 105.19 109.02 1ag8 n GLY 472 Ca 0.07 -1.26 0.02 0.00 0.00 0.00 0.00 46.02 44.85 1ag8 n GLY 472 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ag8 s SER 473 N -0.57 -0.81 0.00 1.61 0.15 0.12 -4.55 113.70 109.66 1ag8 s SER 473 Ca 0.00 0.88 0.00 0.00 0.70 0.00 0.00 55.95 57.53 1ag8 s SER 473 Cb 0.00 1.83 0.00 0.00 -1.71 0.00 0.00 66.02 66.14 1ag8 s SER 473 CO 0.00 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 174.90 1ag8 n GLY 474 N 5.24 -0.21 3.61 9.45 0.00 -1.26 -1.64 105.19 120.38 1ag8 n GLY 474 Ca -0.08 -1.69 -0.29 0.00 0.00 0.00 0.00 46.02 43.96 1ag8 n GLY 474 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ag8 s ARG 475 N -2.76 2.24 -0.02 1.61 1.81 -1.26 -4.38 118.95 116.19 1ag8 s ARG 475 Ca 0.00 -1.02 0.17 0.00 -1.72 0.00 0.00 55.73 53.16 1ag8 s ARG 475 Cb 0.00 -2.35 -0.24 0.00 -0.45 0.00 0.00 34.95 31.91 1ag8 s ARG 475 CO 0.00 0.50 0.49 0.39 -0.68 0.00 0.00 175.30 176.00 1ag8 n GLU 476 N 0.49 0.83 -4.68 3.54 1.02 0.41 -4.08 120.64 118.17 1ag8 n GLU 476 Ca -0.12 -0.11 -0.30 0.00 -0.02 0.00 0.00 57.16 56.61 1ag8 n GLU 476 Cb 0.53 -1.37 -0.09 0.00 -0.02 0.00 0.00 31.44 30.49 1ag8 n GLU 476 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1ag8 s LEU 477 N -3.74 2.39 0.00 -4.62 1.43 -1.26 -4.52 118.68 108.36 1ag8 s LEU 477 Ca -0.02 -1.57 0.00 0.00 -1.03 0.00 0.00 54.13 51.50 1ag8 s LEU 477 Cb 0.12 -0.68 0.00 0.00 0.03 0.00 0.00 46.19 45.66 1ag8 s LEU 477 CO 0.71 -0.75 0.00 0.61 0.23 0.00 0.00 176.35 177.15 1ag8 n GLY 478 N -1.12 0.08 0.27 -3.19 0.00 -0.18 -2.14 105.19 98.92 1ag8 n GLY 478 Ca -0.13 -0.99 0.01 0.00 0.00 0.00 0.00 46.02 44.91 1ag8 n GLY 478 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ag8 h GLU 479 N 0.00 0.50 -0.68 1.61 4.81 -1.89 -2.47 114.58 116.46 1ag8 h GLU 479 Ca 0.00 -0.09 0.06 0.00 -0.13 0.00 0.00 59.36 59.20 1ag8 h GLU 479 Cb 0.00 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.26 1ag8 h GLU 479 CO 0.00 0.50 0.45 1.88 -0.73 0.00 0.00 179.01 181.10 1ag8 h TYR 480 N 0.48 0.71 0.00 0.92 0.05 -1.93 -0.65 116.97 116.56 1ag8 h TYR 480 Ca 0.11 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.91 1ag8 h TYR 480 Cb 0.26 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.76 1ag8 h TYR 480 CO 0.01 0.39 0.00 0.78 -1.05 0.00 0.00 178.16 178.28 1ag8 h GLY 481 N 0.71 0.00 1.43 3.88 0.00 -0.93 -1.27 103.07 106.90 1ag8 h GLY 481 Ca 0.29 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.42 1ag8 h GLY 481 CO -0.09 0.00 -1.22 1.41 0.00 0.00 0.00 176.54 176.63 1ag8 h LEU 482 N 0.00 0.00 -0.35 3.11 3.38 -1.25 -3.39 115.31 116.81 1ag8 h LEU 482 Ca 0.00 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 1ag8 h LEU 482 Cb 0.06 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 1ag8 h LEU 482 CO 0.00 0.80 -0.21 1.56 0.09 0.00 0.00 178.44 180.67 1ag8 h GLN 483 N 0.00 -0.16 0.00 1.13 4.20 -1.28 -1.51 115.11 117.49 1ag8 h GLN 483 Ca -0.13 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1ag8 h GLN 483 Cb 1.72 0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.54 1ag8 h GLN 483 CO 0.08 -0.11 0.00 0.00 -0.67 0.00 0.00 178.83 178.14 1ag8 n ALA 484 N -2.85 1.51 -0.65 3.87 0.00 -1.26 -1.97 120.51 119.15 1ag8 n ALA 484 Ca 0.01 0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.62 1ag8 n ALA 484 Cb 0.29 -1.33 0.31 0.00 0.00 0.00 0.00 19.45 18.72 1ag8 n ALA 484 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ag8 n TYR 485 N -2.08 1.27 -5.06 0.00 4.01 -0.58 -4.91 117.16 109.81 1ag8 n TYR 485 Ca 0.02 -0.66 -0.28 0.00 -0.16 0.00 0.00 57.90 56.82 1ag8 n TYR 485 Cb 0.17 -0.25 -0.16 0.00 -0.31 0.00 0.00 39.34 38.80 1ag8 n TYR 485 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1ag8 s THR 486 N -1.99 1.70 -0.14 -0.72 2.01 -0.83 -2.79 115.64 112.87 1ag8 s THR 486 Ca 0.45 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.55 1ag8 s THR 486 Cb 0.31 -1.41 -0.00 0.00 0.01 0.00 0.00 72.50 71.40 1ag8 s THR 486 CO 0.19 0.48 -0.17 -0.70 -0.69 0.00 0.00 174.62 173.73 1ag8 s GLU 487 N -0.45 3.19 -0.18 4.92 2.56 0.59 -4.75 118.70 124.58 1ag8 s GLU 487 Ca 0.07 -0.77 -0.15 0.00 0.00 0.00 0.00 54.97 54.12 1ag8 s GLU 487 Cb -0.09 -2.55 -0.04 0.00 2.00 0.00 0.00 34.13 33.45 1ag8 s GLU 487 CO -0.00 0.07 0.34 0.08 -0.56 0.00 0.00 175.26 175.18 1ag8 s VAL 488 N 0.67 5.26 -0.10 3.70 1.01 -1.26 -0.68 120.40 129.00 1ag8 s VAL 488 Ca -0.09 0.61 0.04 0.00 0.00 0.00 0.00 61.98 62.55 1ag8 s VAL 488 Cb -0.16 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1ag8 s VAL 488 CO 0.02 0.33 -0.23 -0.75 0.00 0.00 0.00 175.10 174.47 1ag8 s LYS 489 N 0.81 2.94 -0.20 2.72 2.20 -0.40 -4.94 119.74 122.86 1ag8 s LYS 489 Ca 0.18 -0.84 -0.09 0.00 -0.36 0.00 0.00 55.97 54.85 1ag8 s LYS 489 Cb -0.14 -2.23 -0.05 0.00 -1.51 0.00 0.00 37.83 33.90 1ag8 s LYS 489 CO 0.06 0.16 0.11 0.99 -0.36 0.00 0.00 175.35 176.31 1ag8 s THR 490 N 0.39 5.20 -0.24 3.43 2.01 -1.26 -0.19 115.64 124.98 1ag8 s THR 490 Ca -0.18 0.12 0.01 0.00 0.31 0.00 0.00 61.69 61.94 1ag8 s THR 490 Cb -0.18 -3.38 0.04 0.00 0.01 0.00 0.00 72.50 68.99 1ag8 s THR 490 CO 0.08 0.43 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.64 1ag8 s VAL 491 N 0.52 2.44 -0.31 3.82 1.01 0.29 -4.98 120.40 123.20 1ag8 s VAL 491 Ca 0.06 -1.21 -0.04 0.00 0.00 0.00 0.00 61.98 60.79 1ag8 s VAL 491 Cb -0.12 -2.26 0.04 0.00 0.00 0.00 0.00 36.38 34.04 1ag8 s VAL 491 CO -0.00 0.20 0.04 -0.89 0.00 0.00 0.00 175.10 174.45 1ag8 s THR 492 N 1.24 3.38 -0.15 3.92 2.01 -1.26 -1.93 115.64 122.85 1ag8 s THR 492 Ca -0.02 -1.19 -0.07 0.00 0.31 0.00 0.00 61.69 60.72 1ag8 s THR 492 Cb -0.17 -2.89 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 1ag8 s THR 492 CO -0.07 -0.09 0.09 -0.69 -0.69 0.00 0.00 174.62 173.17 1ag8 s VAL 493 N 1.34 5.07 -0.03 3.82 1.01 -0.03 -4.92 120.40 126.66 1ag8 s VAL 493 Ca -0.03 0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.71 1ag8 s VAL 493 Cb -0.19 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 1ag8 s VAL 493 CO 0.01 0.53 1.04 -0.60 0.00 0.00 0.00 175.10 176.08 1ag8 s ARG 494 N -0.30 4.47 0.08 2.72 3.52 -1.26 -0.31 118.95 127.87 1ag8 s ARG 494 Ca 0.10 1.48 0.07 0.00 -0.13 0.00 0.00 55.73 57.25 1ag8 s ARG 494 Cb -0.12 -3.49 -0.04 0.00 -1.56 0.00 0.00 34.95 29.75 1ag8 s ARG 494 CO 0.01 -0.21 -0.14 0.54 -0.81 0.00 0.00 175.30 174.69 1ag8 s VAL 495 N 1.50 3.13 0.17 7.11 0.11 -0.47 -4.91 120.40 127.03 1ag8 s VAL 495 Ca 0.52 -1.27 -0.16 0.00 -2.93 0.00 0.00 61.98 58.14 1ag8 s VAL 495 Cb -0.22 -2.42 0.09 0.00 -1.53 0.00 0.00 36.38 32.31 1ag8 s VAL 495 CO 0.24 0.18 1.68 -0.65 -3.33 0.00 0.00 175.10 173.22 1ag8 h PRO 496 N 3.92 0.06 -1.44 1.54 0.11 -1.96 -3.42 132.00 130.81 1ag8 h PRO 496 Ca -0.49 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1ag8 h PRO 496 Cb 1.16 -0.01 -0.25 0.00 0.11 0.00 0.00 31.00 32.02 1ag8 h PRO 496 CO 0.50 0.04 -0.35 -1.14 -0.21 0.00 0.00 178.00 176.83 1ag8 s GLN 497 N -6.19 0.48 0.20 1.05 0.74 -1.26 -5.03 119.66 109.64 1ag8 s GLN 497 Ca -0.14 0.84 -0.30 0.00 0.05 0.00 0.00 55.36 55.82 1ag8 s GLN 497 Cb 0.14 0.16 -0.08 0.00 1.10 0.00 0.00 33.01 34.33 1ag8 s GLN 497 CO 0.71 -0.60 1.12 0.21 -0.55 0.00 0.00 175.29 176.18 1ag8 s LYS 498 N 2.73 4.59 0.04 1.67 2.36 -1.26 -5.05 119.74 124.82 1ag8 s LYS 498 Ca 0.16 1.77 0.01 0.00 -2.55 0.00 0.00 55.97 55.35 1ag8 s LYS 498 Cb -0.15 -3.25 -0.03 0.00 -1.05 0.00 0.00 37.83 33.35 1ag8 s LYS 498 CO -0.19 0.08 -0.05 -0.80 1.55 0.00 0.00 175.35 175.95 1ag8 s ASN 499 N -0.25 0.54 0.00 1.43 0.01 -1.26 -5.00 114.94 110.41 1ag8 s ASN 499 Ca 0.49 -0.65 0.03 0.00 -0.71 0.00 0.00 52.86 52.02 1ag8 s ASN 499 Cb -0.31 0.10 0.20 0.00 0.41 0.00 0.00 41.25 41.65 1ag8 s ASN 499 CO 0.37 -0.34 0.68 -1.54 -1.51 0.00 0.00 177.10 174.75