#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1it8 n MET 7 N 0.00 1.78 -3.68 1.97 0.00 -1.26 -4.90 117.12 111.02 1it8 n MET 7 Ca 0.00 -1.75 -0.13 0.00 0.00 0.00 0.00 57.70 55.82 1it8 n MET 7 Cb 0.00 -1.35 -0.13 0.00 0.00 0.00 0.00 33.22 31.74 1it8 n MET 7 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 175.97 174.80 1it8 s LEU 8 N -1.30 -0.10 0.07 3.17 2.96 -1.26 -4.14 118.68 118.08 1it8 s LEU 8 Ca 0.24 0.62 0.02 0.00 -0.22 0.00 0.00 54.13 54.79 1it8 s LEU 8 Cb 0.15 0.80 -0.04 0.00 0.50 0.00 0.00 46.19 47.60 1it8 s LEU 8 CO 0.22 -0.21 0.11 -0.54 -1.32 0.00 0.00 176.35 174.61 1it8 s LYS 9 N 2.02 3.04 -0.13 1.98 1.02 -0.29 -4.99 119.74 122.38 1it8 s LYS 9 Ca -0.03 -0.61 -0.05 0.00 0.02 0.00 0.00 55.97 55.30 1it8 s LYS 9 Cb -0.11 -2.82 0.06 0.00 -0.52 0.00 0.00 37.83 34.44 1it8 s LYS 9 CO -0.09 0.59 0.28 0.12 -0.92 0.00 0.00 175.35 175.33 1it8 s PHE 10 N -1.40 -0.46 0.03 3.18 5.36 -1.26 -1.98 117.98 121.46 1it8 s PHE 10 Ca 0.30 1.02 0.04 0.00 -0.96 0.00 0.00 56.93 57.33 1it8 s PHE 10 Cb -0.12 0.02 -0.02 0.00 -0.34 0.00 0.00 43.02 42.56 1it8 s PHE 10 CO 0.23 -0.35 -0.11 -2.00 -1.46 0.00 0.00 175.22 171.52 1it8 s GLU 11 N 2.23 0.76 -0.49 10.12 2.12 -0.42 -4.76 118.70 128.27 1it8 s GLU 11 Ca -0.01 -0.64 -0.23 0.00 0.36 0.00 0.00 54.97 54.45 1it8 s GLU 11 Cb -0.12 -0.72 0.03 0.00 0.26 0.00 0.00 34.13 33.59 1it8 s GLU 11 CO -0.09 0.18 0.82 0.42 -0.54 0.00 0.00 175.26 176.04 1it8 s ILE 12 N -0.79 4.59 0.04 -3.70 1.01 -1.26 -0.56 121.20 120.53 1it8 s ILE 12 Ca -0.01 0.27 -0.12 0.00 0.00 0.00 0.00 60.65 60.80 1it8 s ILE 12 Cb -0.07 -4.39 -0.33 0.00 0.01 0.00 0.00 42.46 37.68 1it8 s ILE 12 CO 0.01 -0.86 1.02 0.11 0.00 0.00 0.00 174.94 175.23 1it8 h LYS 13 N 9.09 0.46 -3.36 2.79 1.57 -1.23 -3.49 116.57 122.40 1it8 h LYS 13 Ca -0.25 -0.78 -0.00 0.00 -1.87 0.00 0.00 60.65 57.74 1it8 h LYS 13 Cb 1.08 0.29 -0.08 0.00 0.08 0.00 0.00 32.23 33.61 1it8 h LYS 13 CO 1.00 1.37 0.03 0.00 -0.57 0.00 0.00 179.45 181.28 1it8 s ALA 14 N -2.62 -0.70 0.17 3.86 0.00 -0.96 -4.98 121.76 116.53 1it8 s ALA 14 Ca -0.08 -0.58 -0.24 0.00 0.00 0.00 0.00 51.96 51.06 1it8 s ALA 14 Cb 0.05 0.96 0.06 0.00 0.00 0.00 0.00 23.12 24.19 1it8 s ALA 14 CO 0.92 -0.92 0.77 -0.98 0.00 0.00 0.00 175.76 175.56 1it8 s ARG 15 N -3.96 1.34 -0.23 0.00 1.70 -1.26 -0.50 118.95 116.04 1it8 s ARG 15 Ca 0.16 -0.65 -0.27 0.00 -0.47 0.00 0.00 55.73 54.51 1it8 s ARG 15 Cb -0.03 0.52 0.11 0.00 -0.57 0.00 0.00 34.95 34.98 1it8 s ARG 15 CO 0.07 -0.60 0.96 0.34 -1.08 0.00 0.00 175.30 174.99 1it8 s ASP 16 N -2.80 -0.47 0.68 -2.89 2.15 -0.91 -4.85 116.67 107.57 1it8 s ASP 16 Ca 0.07 0.78 0.00 0.00 0.43 0.00 0.00 52.55 53.83 1it8 s ASP 16 Cb -0.03 0.74 0.00 0.00 -0.30 0.00 0.00 42.92 43.34 1it8 s ASP 16 CO -0.02 -0.25 0.00 0.61 -0.17 0.00 0.00 175.17 175.33 1it8 n GLY 17 N 1.72 1.86 0.84 2.66 0.00 -1.26 -0.32 105.19 110.69 1it8 n GLY 17 Ca -0.12 -0.44 0.09 0.00 0.00 0.00 0.00 46.02 45.55 1it8 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1it8 n ALA 18 N 6.38 2.45 -2.00 4.61 0.00 -1.08 -4.17 120.51 126.70 1it8 n ALA 18 Ca 0.00 -0.78 -0.23 0.00 0.00 0.00 0.00 53.44 52.44 1it8 n ALA 18 Cb 0.00 -0.98 0.04 0.00 0.00 0.00 0.00 19.45 18.51 1it8 n ALA 18 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1it8 s GLY 19 N -1.25 1.76 -0.25 0.00 0.00 0.57 -2.98 107.32 105.17 1it8 s GLY 19 Ca 0.33 -1.17 -0.26 0.00 0.00 0.00 0.00 44.72 43.62 1it8 s GLY 19 CO 0.25 -0.87 0.95 1.09 0.00 0.00 0.00 173.10 174.52 1it8 s ARG 20 N -4.88 0.61 -0.12 2.90 1.70 -1.26 -2.14 118.95 115.75 1it8 s ARG 20 Ca 0.57 0.57 -0.19 0.00 -0.47 0.00 0.00 55.73 56.22 1it8 s ARG 20 Cb -0.10 0.29 -0.04 0.00 -0.57 0.00 0.00 34.95 34.53 1it8 s ARG 20 CO 0.40 -0.10 0.50 0.42 -1.08 0.00 0.00 175.30 175.44 1it8 s ILE 21 N -0.05 5.17 0.18 4.99 1.01 0.34 -4.07 121.20 128.77 1it8 s ILE 21 Ca 0.01 1.00 0.03 0.00 0.00 0.00 0.00 60.65 61.68 1it8 s ILE 21 Cb -0.04 -3.84 -0.05 0.00 0.01 0.00 0.00 42.46 38.54 1it8 s ILE 21 CO -0.03 0.30 -0.02 -0.83 0.00 0.00 0.00 174.94 174.37 1it8 s GLY 22 N 0.70 1.27 -0.26 6.18 0.00 0.47 -0.65 107.32 115.03 1it8 s GLY 22 Ca 0.27 -1.61 -0.07 0.00 0.00 0.00 0.00 44.72 43.30 1it8 s GLY 22 CO 0.11 -1.57 0.07 1.25 0.00 0.00 0.00 173.10 172.96 1it8 s LYS 23 N -3.88 3.58 -0.22 2.90 2.20 0.28 -0.01 119.74 124.60 1it8 s LYS 23 Ca 0.24 -0.53 0.02 0.00 -0.36 0.00 0.00 55.97 55.33 1it8 s LYS 23 Cb 0.05 -3.34 0.04 0.00 -1.51 0.00 0.00 37.83 33.08 1it8 s LYS 23 CO 0.04 -0.23 -0.14 -1.17 -0.36 0.00 0.00 175.35 173.49 1it8 s LEU 24 N 1.60 2.68 -0.17 5.43 0.20 -0.67 -1.30 118.68 126.46 1it8 s LEU 24 Ca 0.06 -1.00 -0.01 0.00 0.69 0.00 0.00 54.13 53.87 1it8 s LEU 24 Cb -0.15 -1.45 -0.01 0.00 -0.43 0.00 0.00 46.19 44.15 1it8 s LEU 24 CO 0.03 -0.11 -0.11 -0.70 -0.29 0.00 0.00 176.35 175.18 1it8 s GLU 25 N 1.24 3.33 -0.06 1.98 2.12 -0.84 -1.85 118.70 124.63 1it8 s GLU 25 Ca -0.02 -0.68 -0.03 0.00 0.36 0.00 0.00 54.97 54.60 1it8 s GLU 25 Cb -0.16 -2.75 0.03 0.00 0.26 0.00 0.00 34.13 31.51 1it8 s GLU 25 CO -0.09 0.03 0.13 0.08 -0.54 0.00 0.00 175.26 174.86 1it8 s VAL 26 N 0.83 -0.04 -1.58 3.70 1.01 0.56 -1.14 120.40 123.74 1it8 s VAL 26 Ca -0.04 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1it8 s VAL 26 Cb -0.15 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 36.02 1it8 s VAL 26 CO 0.00 0.06 0.00 0.59 0.00 0.00 0.00 175.10 175.76 1it8 n ASN 27 N 4.02 -5.22 0.00 3.32 4.13 -1.26 0.11 115.26 120.35 1it8 n ASN 27 Ca -0.24 0.09 0.00 0.00 1.68 0.00 0.00 54.58 56.10 1it8 n ASN 27 Cb 0.53 -4.40 0.00 0.00 -1.54 0.00 0.00 39.78 34.37 1it8 n ASN 27 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1it8 n GLY 28 N -0.90 0.55 3.80 7.41 0.00 -1.26 -5.01 105.19 109.79 1it8 n GLY 28 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 1it8 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1it8 s LYS 29 N -0.21 3.42 0.03 1.61 1.02 0.12 -5.10 119.74 120.62 1it8 s LYS 29 Ca 0.00 -0.22 0.06 0.00 0.02 0.00 0.00 55.97 55.83 1it8 s LYS 29 Cb 0.00 -3.11 -0.03 0.00 -0.52 0.00 0.00 37.83 34.17 1it8 s LYS 29 CO 0.00 0.69 -0.17 0.15 -0.92 0.00 0.00 175.35 175.10 1it8 s LYS 30 N -0.79 2.16 0.02 1.68 1.02 -1.26 -0.32 119.74 122.25 1it8 s LYS 30 Ca 0.13 -0.93 -0.09 0.00 0.02 0.00 0.00 55.97 55.10 1it8 s LYS 30 Cb -0.12 -2.23 0.00 0.00 -0.52 0.00 0.00 37.83 34.96 1it8 s LYS 30 CO 0.03 0.55 0.19 -1.50 -0.92 0.00 0.00 175.35 173.70 1it8 s ILE 31 N -0.91 0.09 0.17 2.17 1.10 -0.77 -5.02 121.20 118.03 1it8 s ILE 31 Ca 0.15 -0.78 0.04 0.00 -0.51 0.00 0.00 60.65 59.54 1it8 s ILE 31 Cb -0.11 -0.72 -0.04 0.00 0.15 0.00 0.00 42.46 41.75 1it8 s ILE 31 CO 0.05 -0.43 0.25 -0.70 -2.11 0.00 0.00 174.94 172.00 1it8 s GLU 32 N -2.03 3.27 0.16 3.50 2.12 -1.26 -1.67 118.70 122.80 1it8 s GLU 32 Ca -0.09 -0.70 0.07 0.00 0.36 0.00 0.00 54.97 54.60 1it8 s GLU 32 Cb -0.04 -2.86 -0.04 0.00 0.26 0.00 0.00 34.13 31.45 1it8 s GLU 32 CO -0.01 0.50 -0.14 0.95 -0.54 0.00 0.00 175.26 176.02 1it8 s THR 33 N -1.78 1.49 0.45 -1.70 -4.23 0.99 -4.17 115.64 106.69 1it8 s THR 33 Ca 0.33 -1.96 -0.25 0.00 -1.18 0.00 0.00 61.69 58.63 1it8 s THR 33 Cb -0.10 -1.79 -0.09 0.00 1.34 0.00 0.00 72.50 71.86 1it8 s THR 33 CO 0.27 -0.52 1.41 -2.65 -0.54 0.00 0.00 174.62 172.59 1it8 n PRO 34 N 0.08 2.20 -3.94 3.99 -0.02 -1.26 -0.39 135.00 135.67 1it8 n PRO 34 Ca -0.12 0.79 -0.10 0.00 -2.02 0.00 0.00 63.50 62.04 1it8 n PRO 34 Cb 0.59 -2.60 -0.12 0.00 -0.02 0.00 0.00 33.50 31.35 1it8 n PRO 34 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1it8 s ALA 35 N -1.19 0.08 -0.21 3.55 0.00 -1.02 -5.01 121.76 117.95 1it8 s ALA 35 Ca 0.61 -0.33 -0.01 0.00 0.00 0.00 0.00 51.96 52.23 1it8 s ALA 35 Cb -0.46 0.08 0.01 0.00 0.00 0.00 0.00 23.12 22.76 1it8 s ALA 35 CO 0.57 -0.08 -0.11 -1.50 0.00 0.00 0.00 175.76 174.64 1it8 s ILE 36 N -0.80 2.69 -0.33 0.00 1.10 -1.26 -1.24 121.20 121.37 1it8 s ILE 36 Ca -0.09 -0.84 -0.18 0.00 -0.51 0.00 0.00 60.65 59.03 1it8 s ILE 36 Cb -0.05 -2.25 -0.01 0.00 0.15 0.00 0.00 42.46 40.30 1it8 s ILE 36 CO -0.01 0.39 0.50 0.00 -2.11 0.00 0.00 174.94 173.72 1it8 s MET 37 N 1.35 3.70 0.23 3.50 0.23 0.20 -4.90 119.30 123.61 1it8 s MET 37 Ca 0.03 -0.09 -0.31 0.00 -1.03 0.00 0.00 55.69 54.30 1it8 s MET 37 Cb -0.15 -3.78 -0.11 0.00 -1.53 0.00 0.00 34.83 29.27 1it8 s MET 37 CO -0.07 -0.58 1.61 -2.14 -2.03 0.00 0.00 175.02 171.80 1it8 s PRO 38 N 2.36 4.17 0.01 3.16 0.02 -1.25 -2.38 135.00 141.09 1it8 s PRO 38 Ca 0.19 2.49 -0.30 0.00 0.02 0.00 0.00 61.00 63.40 1it8 s PRO 38 Cb -0.15 -3.09 -0.04 0.00 0.02 0.00 0.00 34.50 31.24 1it8 s PRO 38 CO 0.12 -0.64 1.15 0.08 -0.33 0.00 0.00 177.00 177.39 1it8 s VAL 39 N 0.68 4.28 -0.24 3.83 1.01 0.29 -2.44 120.40 127.82 1it8 s VAL 39 Ca 0.68 1.63 -0.02 0.00 0.00 0.00 0.00 61.98 64.26 1it8 s VAL 39 Cb -0.47 -4.04 0.02 0.00 0.00 0.00 0.00 36.38 31.89 1it8 s VAL 39 CO 0.38 0.09 -0.05 -0.69 0.00 0.00 0.00 175.10 174.82 1it8 s VAL 40 N 1.40 3.04 -0.28 2.92 1.01 0.59 -4.81 120.40 124.27 1it8 s VAL 40 Ca 0.56 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 1it8 s VAL 40 Cb -0.26 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.65 1it8 s VAL 40 CO 0.27 0.27 1.10 0.21 0.00 0.00 0.00 175.10 176.94 1it8 s ASN 41 N 1.38 6.96 0.31 3.32 3.04 -1.26 -4.21 114.94 124.48 1it8 s ASN 41 Ca 0.02 1.21 0.07 0.00 0.04 0.00 0.00 52.86 54.20 1it8 s ASN 41 Cb -0.16 -2.54 0.84 0.00 -1.54 0.00 0.00 41.25 37.85 1it8 s ASN 41 CO -0.04 -0.82 1.69 -0.65 -3.04 0.00 0.00 177.10 174.24 1it8 h PRO 42 N 7.99 0.40 0.00 0.43 0.11 -1.97 -3.34 132.00 135.63 1it8 h PRO 42 Ca -0.21 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1it8 h PRO 42 Cb 1.07 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1it8 h PRO 42 CO 1.01 0.27 0.00 1.63 -0.21 0.00 0.00 178.00 180.70 1it8 n LYS 43 N -5.02 0.00 -2.35 1.05 5.02 -1.26 -4.88 118.16 110.71 1it8 n LYS 43 Ca 0.25 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 56.13 1it8 n LYS 43 Cb 0.74 -0.05 -0.03 0.00 -0.02 0.00 0.00 35.03 35.67 1it8 n LYS 43 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1it8 s GLN 44 N -0.00 4.49 -0.37 1.97 0.74 -1.25 -5.02 119.66 120.21 1it8 s GLN 44 Ca 0.00 1.91 0.01 0.00 0.05 0.00 0.00 55.36 57.32 1it8 s GLN 44 Cb 0.00 -3.22 0.14 0.00 1.10 0.00 0.00 33.01 31.03 1it8 s GLN 44 CO 0.00 -0.08 0.23 -1.64 -0.55 0.00 0.00 175.29 173.25 1it8 s MET 45 N -0.45 0.72 0.23 1.67 -1.94 -1.26 -4.22 119.30 114.06 1it8 s MET 45 Ca 0.52 -1.53 -0.06 0.00 -1.71 0.00 0.00 55.69 52.91 1it8 s MET 45 Cb -0.33 -1.51 0.40 0.00 2.01 0.00 0.00 34.83 35.41 1it8 s MET 45 CO 0.38 -1.22 1.70 0.28 -0.01 0.00 0.00 175.02 176.15 1it8 h VAL 46 N 5.02 0.58 -3.28 -6.03 2.07 -1.95 -3.37 116.25 109.30 1it8 h VAL 46 Ca 0.07 -0.10 -0.51 0.00 0.82 0.00 0.00 66.70 66.98 1it8 h VAL 46 Cb 0.96 0.26 -0.38 0.00 -1.52 0.00 0.00 31.29 30.60 1it8 h VAL 46 CO 0.31 0.05 -0.78 0.54 0.02 0.00 0.00 177.57 177.72 1it8 s VAL 47 N -6.06 0.72 0.32 2.57 0.11 -1.26 -4.89 120.40 111.91 1it8 s VAL 47 Ca -0.13 -0.37 -0.28 0.00 -2.93 0.00 0.00 61.98 58.27 1it8 s VAL 47 Cb 0.20 -0.98 -0.13 0.00 -1.53 0.00 0.00 36.38 33.94 1it8 s VAL 47 CO 0.75 0.08 1.22 -0.62 -3.33 0.00 0.00 175.10 173.20 1it8 n GLU 48 N 5.01 1.91 -0.26 1.54 -0.58 -1.26 -4.75 120.64 122.25 1it8 n GLU 48 Ca -0.10 0.67 0.05 0.00 -0.42 0.00 0.00 57.16 57.36 1it8 n GLU 48 Cb 0.48 -2.20 0.18 0.00 -0.57 0.00 0.00 31.44 29.34 1it8 n GLU 48 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1it8 h PRO 49 N 2.45 0.47 -0.39 3.49 0.11 -1.91 0.22 132.00 136.44 1it8 h PRO 49 Ca -0.44 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.72 1it8 h PRO 49 Cb 1.30 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 1it8 h PRO 49 CO 0.62 0.31 0.27 1.57 -0.21 0.00 0.00 178.00 180.56 1it8 h LYS 50 N 0.48 0.18 0.06 1.05 2.10 -1.72 0.22 116.57 118.94 1it8 h LYS 50 Ca 0.41 -0.01 -0.00 0.00 -2.00 0.00 0.00 60.65 59.05 1it8 h LYS 50 Cb 0.59 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.88 1it8 h LYS 50 CO -0.38 0.12 -0.03 1.49 -2.00 0.00 0.00 179.45 178.65 1it8 h GLU 51 N 0.19 -0.08 -0.94 0.07 4.81 -1.01 -2.95 114.58 114.67 1it8 h GLU 51 Ca 0.18 0.01 0.19 0.00 -0.13 0.00 0.00 59.36 59.61 1it8 h GLU 51 Cb 0.46 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.78 1it8 h GLU 51 CO -0.03 0.50 0.61 -0.07 -0.73 0.00 0.00 179.01 179.29 1it8 h LEU 52 N -0.75 0.57 -0.37 1.64 3.38 0.20 -1.10 115.31 118.88 1it8 h LEU 52 Ca -0.01 0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 1it8 h LEU 52 Cb 0.61 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1it8 h LEU 52 CO 0.01 0.23 -0.21 -0.08 0.09 0.00 0.00 178.44 178.48 1it8 h GLU 53 N 0.57 0.79 -0.73 1.13 4.81 -0.61 -1.36 114.58 119.18 1it8 h GLU 53 Ca 0.51 -0.36 -0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1it8 h GLU 53 Cb 1.03 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 1it8 h GLU 53 CO -0.25 0.99 0.34 0.87 -0.73 0.00 0.00 179.01 180.23 1it8 h LYS 54 N 0.59 1.06 -0.09 1.92 1.57 -1.06 -1.67 116.57 118.88 1it8 h LYS 54 Ca 0.08 -0.16 0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1it8 h LYS 54 Cb 0.77 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.89 1it8 h LYS 54 CO 0.06 0.84 0.07 0.52 -0.57 0.00 0.00 179.45 180.37 1it8 h MET 55 N 1.03 0.00 0.00 3.15 2.86 -1.20 -3.45 114.93 117.31 1it8 h MET 55 Ca 0.25 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 1it8 h MET 55 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1it8 h MET 55 CO -0.03 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.35 1it8 n GLY 56 N -1.51 0.08 3.55 8.32 0.00 -0.63 -5.09 105.19 109.91 1it8 n GLY 56 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1it8 n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1it8 s PHE 57 N -0.97 2.52 -1.22 1.61 0.40 -0.55 -4.83 117.98 114.94 1it8 s PHE 57 Ca 0.00 0.14 0.28 0.00 -0.60 0.00 0.00 56.93 56.75 1it8 s PHE 57 Cb 0.00 -4.49 1.14 0.00 0.51 0.00 0.00 43.02 40.18 1it8 s PHE 57 CO 0.00 -1.73 1.83 0.39 0.70 0.00 0.00 175.22 176.41 1it8 n GLU 58 N 8.61 0.23 -3.99 0.44 -0.58 -1.26 -4.17 120.64 119.91 1it8 n GLU 58 Ca 0.05 -0.06 -0.13 0.00 -0.42 0.00 0.00 57.16 56.60 1it8 n GLU 58 Cb 0.49 -1.50 -0.14 0.00 -0.57 0.00 0.00 31.44 29.72 1it8 n GLU 58 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1it8 s ILE 59 N -2.81 0.18 0.14 -3.67 2.07 -1.26 -0.87 121.20 114.98 1it8 s ILE 59 Ca 0.19 -0.18 -0.06 0.00 -1.41 0.00 0.00 60.65 59.19 1it8 s ILE 59 Cb 0.19 -0.17 -0.02 0.00 0.13 0.00 0.00 42.46 42.59 1it8 s ILE 59 CO 0.54 -0.00 0.18 0.27 -1.91 0.00 0.00 174.94 174.02 1it8 s ILE 60 N -0.19 0.09 0.01 2.00 -4.36 -0.74 -3.93 121.20 114.08 1it8 s ILE 60 Ca -0.01 -1.58 0.03 0.00 -0.26 0.00 0.00 60.65 58.84 1it8 s ILE 60 Cb -0.02 -1.86 -0.01 0.00 1.25 0.00 0.00 42.46 41.82 1it8 s ILE 60 CO -0.00 -0.41 -0.10 -0.51 0.24 0.00 0.00 174.94 174.16 1it8 s ILE 61 N -3.99 0.75 0.43 8.37 2.07 -1.02 -0.59 121.20 127.23 1it8 s ILE 61 Ca 0.18 -0.64 0.03 0.00 -1.41 0.00 0.00 60.65 58.81 1it8 s ILE 61 Cb 0.05 -0.68 -0.02 0.00 0.13 0.00 0.00 42.46 41.94 1it8 s ILE 61 CO -0.01 0.04 0.10 -0.89 -1.91 0.00 0.00 174.94 172.28 1it8 s THR 62 N -0.56 0.73 -0.72 4.00 2.01 -1.01 -0.30 115.64 119.79 1it8 s THR 62 Ca 0.01 -2.00 -0.08 0.00 0.31 0.00 0.00 61.69 59.92 1it8 s THR 62 Cb -0.06 -2.31 0.19 0.00 0.01 0.00 0.00 72.50 70.34 1it8 s THR 62 CO 0.00 0.00 0.60 0.21 -0.69 0.00 0.00 174.62 174.74 1it8 s ASN 63 N -3.67 5.96 0.25 3.53 3.84 -1.26 -0.10 114.94 123.49 1it8 s ASN 63 Ca 0.20 -2.78 -0.03 0.00 0.21 0.00 0.00 52.86 50.46 1it8 s ASN 63 Cb 0.02 -2.02 0.49 0.00 -0.55 0.00 0.00 41.25 39.19 1it8 s ASN 63 CO 0.12 -0.47 1.74 0.77 -2.79 0.00 0.00 177.10 176.47 1it8 h SER 64 N 7.38 0.36 -0.89 -4.21 4.64 -1.75 -0.99 113.55 118.09 1it8 h SER 64 Ca 0.04 0.10 0.11 0.00 -0.47 0.00 0.00 61.79 61.58 1it8 h SER 64 Cb 0.99 0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 63.08 1it8 h SER 64 CO 0.73 0.14 0.58 0.22 -0.87 0.00 0.00 176.83 177.63 1it8 h TYR 65 N 0.50 0.92 -0.12 4.77 3.20 -1.69 0.45 116.97 124.99 1it8 h TYR 65 Ca 0.43 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 62.17 1it8 h TYR 65 Cb 0.65 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 1it8 h TYR 65 CO -0.14 0.39 -0.59 0.82 -1.64 0.00 0.00 178.16 177.00 1it8 h ILE 66 N 0.83 1.35 -0.10 1.81 2.04 -1.55 -0.71 117.51 121.18 1it8 h ILE 66 Ca 0.43 -1.91 -0.11 0.00 1.00 0.00 0.00 64.86 64.27 1it8 h ILE 66 Cb 0.51 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 1it8 h ILE 66 CO -0.19 0.58 -0.44 0.40 0.00 0.00 0.00 178.15 178.49 1it8 h ILE 67 N 0.31 1.32 0.12 -0.67 2.04 -0.51 -3.21 117.51 116.92 1it8 h ILE 67 Ca -0.00 -1.59 -0.01 0.00 1.00 0.00 0.00 64.86 64.26 1it8 h ILE 67 Cb 1.12 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.94 1it8 h ILE 67 CO 0.10 0.47 -0.06 0.22 0.00 0.00 0.00 178.15 178.89 1it8 h TYR 68 N 0.19 -0.15 0.00 1.37 3.20 0.21 -2.33 116.97 119.46 1it8 h TYR 68 Ca 0.01 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1it8 h TYR 68 Cb 0.86 0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.18 1it8 h TYR 68 CO 0.01 0.27 0.00 1.63 -1.64 0.00 0.00 178.16 178.44 1it8 n LYS 69 N -4.95 0.63 -3.76 1.82 4.76 -0.31 -4.64 118.16 111.72 1it8 n LYS 69 Ca -0.09 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.11 1it8 n LYS 69 Cb 0.25 -1.31 -0.17 0.00 -1.84 0.00 0.00 35.03 31.96 1it8 n LYS 69 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1it8 s ASP 70 N -0.39 1.98 0.15 4.39 -1.08 -1.21 -5.04 116.67 115.48 1it8 s ASP 70 Ca 0.00 -0.30 -0.23 0.00 -0.52 0.00 0.00 52.55 51.49 1it8 s ASP 70 Cb 0.00 -0.48 0.03 0.00 -1.46 0.00 0.00 42.92 41.00 1it8 s ASP 70 CO 0.00 -0.23 1.62 -0.33 0.52 0.00 0.00 175.17 176.75 1it8 h GLU 71 N 8.31 -0.27 0.01 4.34 5.08 -1.85 0.47 114.58 130.66 1it8 h GLU 71 Ca -0.19 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1it8 h GLU 71 Cb 1.12 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 1it8 h GLU 71 CO 0.28 -0.18 -0.39 0.93 -1.00 0.00 0.00 179.01 178.66 1it8 h GLU 72 N -0.28 -0.48 -0.05 2.33 4.39 -1.96 -1.47 114.58 117.06 1it8 h GLU 72 Ca 0.14 0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.87 1it8 h GLU 72 Cb 0.50 0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1it8 h GLU 72 CO -0.41 -0.32 0.03 -0.07 -1.16 0.00 0.00 179.01 177.08 1it8 h LEU 73 N -0.49 0.07 -0.76 1.33 4.07 -1.77 -2.61 115.31 115.14 1it8 h LEU 73 Ca 0.01 -0.10 0.18 0.00 0.08 0.00 0.00 57.88 58.04 1it8 h LEU 73 Cb 0.52 -0.02 -0.13 0.00 1.08 0.00 0.00 40.66 42.12 1it8 h LEU 73 CO -0.25 0.15 0.06 -0.09 -1.08 0.00 0.00 178.44 177.23 1it8 h ARG 74 N -0.02 0.14 0.05 1.13 2.43 0.52 0.21 114.38 118.84 1it8 h ARG 74 Ca 0.02 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1it8 h ARG 74 Cb 0.10 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1it8 h ARG 74 CO -0.00 0.09 -0.03 -0.09 -1.51 0.00 0.00 179.97 178.43 1it8 h ARG 75 N 0.14 -0.08 -0.72 0.20 2.43 -1.08 -1.77 114.38 113.50 1it8 h ARG 75 Ca 0.43 0.01 0.21 0.00 -0.81 0.00 0.00 59.98 59.81 1it8 h ARG 75 Cb 0.77 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.31 1it8 h ARG 75 CO -0.64 -0.05 0.56 0.87 -1.51 0.00 0.00 179.97 179.20 1it8 h LYS 76 N -0.08 0.00 0.18 0.20 1.57 -1.07 0.12 116.57 117.49 1it8 h LYS 76 Ca -0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1it8 h LYS 76 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1it8 h LYS 76 CO 0.01 0.00 -0.08 0.00 -0.57 0.00 0.00 179.45 178.80 1it8 h ALA 77 N 1.56 -0.24 -0.50 3.86 0.00 -0.41 -1.54 119.26 122.00 1it8 h ALA 77 Ca 0.34 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1it8 h ALA 77 Cb 1.46 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 1it8 h ALA 77 CO -0.00 -0.39 -0.01 -0.07 0.00 0.00 0.00 179.25 178.78 1it8 h LEU 78 N -0.72 0.80 0.21 0.00 3.38 -0.50 1.24 115.31 119.73 1it8 h LEU 78 Ca -0.02 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 1it8 h LEU 78 Cb 0.50 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1it8 h LEU 78 CO 0.04 0.87 -0.10 -0.08 0.09 0.00 0.00 178.44 179.26 1it8 h GLU 79 N 0.77 -0.27 -0.00 1.13 4.57 -1.04 -3.37 114.58 116.37 1it8 h GLU 79 Ca 0.15 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1it8 h GLU 79 Cb 0.48 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 1it8 h GLU 79 CO 0.02 -0.07 -0.36 1.28 -1.18 0.00 0.00 179.01 178.70 1it8 n LEU 80 N -5.15 0.59 -0.75 1.64 4.77 -0.58 -5.09 117.00 112.43 1it8 n LEU 80 Ca -0.09 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.33 1it8 n LEU 80 Cb 0.19 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1it8 n LEU 80 CO 0.34 0.13 -0.18 0.61 -1.33 0.00 0.00 177.39 176.96 1it8 n GLY 81 N 1.12 -4.02 0.42 -0.72 0.00 0.43 -3.94 105.19 98.47 1it8 n GLY 81 Ca 0.02 -0.74 0.26 0.00 0.00 0.00 0.00 46.02 45.56 1it8 n GLY 81 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1it8 n ILE 82 N -0.00 0.00 -0.30 -0.61 -6.64 0.26 -1.03 119.36 111.04 1it8 n ILE 82 Ca 0.00 0.94 -0.06 0.00 -1.77 0.00 0.00 62.75 61.86 1it8 n ILE 82 Cb 0.00 -1.63 0.07 0.00 -1.44 0.00 0.00 39.64 36.64 1it8 n ILE 82 CO 0.00 0.00 0.00 0.45 -1.77 0.00 0.00 176.55 175.23 1it8 h HIS 83 N 0.00 1.22 0.01 4.28 3.86 -1.80 -2.09 115.15 120.63 1it8 h HIS 83 Ca 0.46 -0.09 -0.29 0.00 -1.16 0.00 0.00 60.37 59.29 1it8 h HIS 83 Cb 2.27 -0.37 -0.05 0.00 1.06 0.00 0.00 27.41 30.32 1it8 h HIS 83 CO 0.00 0.91 -1.65 0.00 0.86 0.00 0.00 177.93 178.05 1it8 h ARG 84 N 1.18 0.02 0.00 2.45 2.47 -1.20 -2.17 114.38 117.13 1it8 h ARG 84 Ca 0.27 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 1it8 h ARG 84 Cb 0.20 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.53 1it8 h ARG 84 CO -0.03 0.60 0.00 -0.12 0.56 0.00 0.00 179.97 180.99 1it8 n MET 85 N -3.11 0.11 0.00 0.04 1.56 -1.17 -2.33 117.12 112.22 1it8 n MET 85 Ca -0.16 0.19 0.00 0.00 -0.27 0.00 0.00 57.70 57.46 1it8 n MET 85 Cb 1.04 -1.50 0.00 0.00 2.15 0.00 0.00 33.22 34.91 1it8 n MET 85 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 1it8 n LEU 86 N -1.39 0.20 -3.81 -0.89 4.32 -0.79 -5.00 117.00 109.63 1it8 n LEU 86 Ca 0.06 -0.50 -0.26 0.00 -0.02 0.00 0.00 56.01 55.28 1it8 n LEU 86 Cb 0.15 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 41.98 1it8 n LEU 86 CO 0.13 0.05 0.05 -0.67 -1.22 0.00 0.00 177.39 175.72 1it8 n ASP 87 N -0.59 -3.45 -3.98 -1.43 2.03 -0.94 -4.17 116.55 104.03 1it8 n ASP 87 Ca 0.00 -0.78 -0.26 0.00 0.52 0.00 0.00 54.79 54.27 1it8 n ASP 87 Cb 0.01 -4.01 -0.17 0.00 -0.72 0.00 0.00 41.12 36.23 1it8 n ASP 87 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1it8 s TYR 88 N -3.45 1.49 -0.21 -0.67 5.04 -0.86 -3.69 117.35 115.00 1it8 s TYR 88 Ca 0.40 -0.64 0.15 0.00 -2.44 0.00 0.00 57.07 54.54 1it8 s TYR 88 Cb -0.20 -1.15 0.69 0.00 0.35 0.00 0.00 41.96 41.65 1it8 s TYR 88 CO 0.82 -0.39 1.61 0.09 -1.34 0.00 0.00 175.55 176.34 1it8 n ASN 89 N 4.29 4.89 -0.73 4.32 3.02 -1.26 -4.69 115.26 125.10 1it8 n ASN 89 Ca -0.19 -2.99 0.00 0.00 -0.03 0.00 0.00 54.58 51.37 1it8 n ASN 89 Cb 0.51 -0.63 0.00 0.00 -0.61 0.00 0.00 39.78 39.05 1it8 n ASN 89 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1it8 n GLY 90 N 0.08 2.02 3.63 7.41 0.00 -1.26 -5.04 105.19 112.03 1it8 n GLY 90 Ca 0.25 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.77 1it8 n GLY 90 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1it8 s ILE 91 N 1.61 4.47 -0.32 -0.61 1.01 -0.05 -4.99 121.20 122.32 1it8 s ILE 91 Ca 0.00 1.58 -0.12 0.00 0.00 0.00 0.00 60.65 62.12 1it8 s ILE 91 Cb 0.00 -4.44 -0.02 0.00 0.01 0.00 0.00 42.46 38.01 1it8 s ILE 91 CO 0.00 -0.58 0.21 -0.63 0.00 0.00 0.00 174.94 173.94 1it8 s ILE 92 N 3.77 5.11 0.38 2.92 1.01 -1.26 -1.79 121.20 131.35 1it8 s ILE 92 Ca 0.45 -0.19 0.02 0.00 0.00 0.00 0.00 60.65 60.93 1it8 s ILE 92 Cb -0.11 -3.58 -0.01 0.00 0.01 0.00 0.00 42.46 38.76 1it8 s ILE 92 CO 0.19 0.06 0.57 -0.70 0.00 0.00 0.00 174.94 175.06 1it8 s GLU 93 N 1.70 3.20 -0.09 2.79 2.12 0.24 -1.51 118.70 127.15 1it8 s GLU 93 Ca 0.06 -0.60 -0.10 0.00 0.36 0.00 0.00 54.97 54.69 1it8 s GLU 93 Cb -0.17 -2.67 0.03 0.00 0.26 0.00 0.00 34.13 31.58 1it8 s GLU 93 CO 0.09 -0.05 0.28 0.54 -0.54 0.00 0.00 175.26 175.59 1it8 s VAL 94 N -2.37 0.01 0.08 3.70 0.11 -0.33 -2.41 120.40 119.19 1it8 s VAL 94 Ca 0.45 -0.07 0.01 0.00 -2.93 0.00 0.00 61.98 59.43 1it8 s VAL 94 Cb -0.10 -0.42 -0.04 0.00 -1.53 0.00 0.00 36.38 34.29 1it8 s VAL 94 CO 0.35 -0.04 0.23 -0.62 -3.33 0.00 0.00 175.10 171.69 1it8 s ASP 95 N -0.04 6.35 0.32 3.54 -1.08 0.86 -3.29 116.67 123.33 1it8 s ASP 95 Ca -0.02 0.25 0.06 0.00 -0.52 0.00 0.00 52.55 52.31 1it8 s ASP 95 Cb -0.02 -1.95 0.53 0.00 -1.46 0.00 0.00 42.92 40.02 1it8 s ASP 95 CO 0.01 0.14 1.77 0.77 0.52 0.00 0.00 175.17 178.38 1it8 h SER 96 N 2.85 0.34 0.00 -0.34 4.64 -1.82 -2.44 113.55 116.79 1it8 h SER 96 Ca -0.46 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 60.75 1it8 h SER 96 Cb 1.17 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1it8 h SER 96 CO 0.74 0.60 0.00 0.61 -0.87 0.00 0.00 176.83 177.91 1it8 n GLY 97 N -0.47 0.89 0.28 -0.77 0.00 -1.26 -3.99 105.19 99.85 1it8 n GLY 97 Ca -0.01 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.20 1it8 n GLY 97 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1it8 h SER 98 N 0.00 0.00 0.30 1.61 4.64 -1.88 0.24 113.55 118.46 1it8 h SER 98 Ca 0.00 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 1it8 h SER 98 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1it8 h SER 98 CO 0.00 0.00 -0.91 0.15 -0.87 0.00 0.00 176.83 175.20 1it8 h PHE 99 N 0.00 0.63 -0.16 4.77 3.57 -1.92 -1.94 116.94 121.89 1it8 h PHE 99 Ca 0.00 -0.33 -0.06 0.00 3.53 0.00 0.00 57.97 61.11 1it8 h PHE 99 Cb 0.04 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1it8 h PHE 99 CO 0.00 1.14 -0.17 1.96 -2.23 0.00 0.00 178.31 179.01 1it8 h GLN 100 N 0.25 0.26 0.00 1.11 7.50 -0.98 -0.40 115.11 122.86 1it8 h GLN 100 Ca -0.07 -0.07 -0.02 0.00 0.50 0.00 0.00 58.65 58.99 1it8 h GLN 100 Cb 1.53 -0.03 -0.00 0.00 0.05 0.00 0.00 27.48 29.03 1it8 h GLN 100 CO 0.16 0.43 -0.10 1.25 -1.50 0.00 0.00 178.83 179.07 1it8 h LEU 101 N 0.24 0.00 0.21 1.46 5.85 -0.69 -1.86 115.31 120.54 1it8 h LEU 101 Ca 0.05 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.46 1it8 h LEU 101 Cb 0.45 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.51 1it8 h LEU 101 CO 0.03 0.10 -1.42 -0.03 -0.34 0.00 0.00 178.44 176.78 1it8 h MET 102 N 0.00 0.45 0.00 1.25 4.05 -0.34 -1.93 114.93 118.41 1it8 h MET 102 Ca -0.00 -0.78 0.00 0.00 -0.28 0.00 0.00 59.70 58.64 1it8 h MET 102 Cb 0.27 0.29 0.00 0.00 -0.80 0.00 0.00 31.60 31.36 1it8 h MET 102 CO 0.01 1.37 0.00 0.87 0.23 0.00 0.00 176.91 179.39 1it8 h LYS 103 N 0.02 0.00 0.00 0.39 1.57 -1.03 -3.39 116.57 114.13 1it8 h LYS 103 Ca -0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1it8 h LYS 103 Cb 2.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.35 1it8 h LYS 103 CO 0.22 0.00 -0.59 0.66 -0.57 0.00 0.00 179.45 179.17 1it8 n TYR 104 N -2.69 0.00 0.00 -1.35 0.53 -0.73 -5.05 117.16 107.87 1it8 n TYR 104 Ca 0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.91 1it8 n TYR 104 Cb 0.38 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.69 1it8 n TYR 104 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1it8 n GLY 105 N 1.83 0.54 0.00 2.72 0.00 -0.73 -5.04 105.19 104.51 1it8 n GLY 105 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1it8 n GLY 105 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1it8 n SER 106 N 0.00 0.00 -4.64 1.61 3.41 -1.25 -5.03 113.62 107.73 1it8 n SER 106 Ca 0.00 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.36 1it8 n SER 106 Cb 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.06 1it8 n SER 106 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1it8 s ILE 107 N 0.00 2.17 -0.65 -1.33 -4.36 -1.26 -4.93 121.20 110.84 1it8 s ILE 107 Ca 0.00 -0.47 0.03 0.00 -0.26 0.00 0.00 60.65 59.95 1it8 s ILE 107 Cb 0.00 -2.70 0.36 0.00 1.25 0.00 0.00 42.46 41.37 1it8 s ILE 107 CO 0.00 0.00 1.25 -0.62 0.24 0.00 0.00 174.94 175.81 1it8 n GLU 108 N -2.96 3.64 -3.60 0.37 4.71 -1.26 -5.00 120.64 116.55 1it8 n GLU 108 Ca 0.14 -4.62 -0.16 0.00 -0.01 0.00 0.00 57.16 52.51 1it8 n GLU 108 Cb 0.60 -2.29 -0.07 0.00 -1.01 0.00 0.00 31.44 28.68 1it8 n GLU 108 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1it8 s VAL 109 N -4.77 0.02 0.25 2.62 0.11 -1.26 -5.08 120.40 112.29 1it8 s VAL 109 Ca 0.47 -0.18 -0.09 0.00 -2.93 0.00 0.00 61.98 59.26 1it8 s VAL 109 Cb 0.31 -0.87 -0.07 0.00 -1.53 0.00 0.00 36.38 34.22 1it8 s VAL 109 CO -0.18 -0.10 0.56 -0.94 -3.33 0.00 0.00 175.10 171.12 1it8 s SER 110 N -1.30 6.59 0.38 3.54 1.04 -1.26 -4.95 113.70 117.74 1it8 s SER 110 Ca -0.11 0.89 0.15 0.00 0.48 0.00 0.00 55.95 57.36 1it8 s SER 110 Cb -0.02 -2.22 1.00 0.00 0.10 0.00 0.00 66.02 64.89 1it8 s SER 110 CO 0.07 -0.11 1.81 -1.13 0.98 0.00 0.00 173.24 174.87 1it8 h ASN 111 N 2.34 0.52 -0.09 7.02 -0.00 -1.99 -0.07 115.58 123.31 1it8 h ASN 111 Ca -0.47 0.07 -0.04 0.00 -0.00 0.00 0.00 56.30 55.86 1it8 h ASN 111 Cb 1.17 -0.03 -0.00 0.00 -0.00 0.00 0.00 38.32 39.47 1it8 h ASN 111 CO 0.68 0.18 -0.10 -0.09 -0.00 0.00 0.00 177.43 178.10 1it8 h ARG 112 N 0.50 0.23 0.06 6.67 2.43 -1.97 -3.11 114.38 119.19 1it8 h ARG 112 Ca 0.53 -0.12 0.02 0.00 -0.81 0.00 0.00 59.98 59.59 1it8 h ARG 112 Cb 1.19 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.69 1it8 h ARG 112 CO -0.26 0.66 -0.54 0.93 -1.51 0.00 0.00 179.97 179.26 1it8 h GLU 113 N -0.20 -0.69 -0.34 0.20 5.08 -1.39 -1.81 114.58 115.43 1it8 h GLU 113 Ca 0.01 0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 1it8 h GLU 113 Cb 0.63 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.02 1it8 h GLU 113 CO 0.02 -0.46 -0.06 -0.84 -1.00 0.00 0.00 179.01 176.67 1it8 h ILE 114 N -0.72 1.22 -0.61 3.13 -0.00 -1.59 -1.13 117.51 117.81 1it8 h ILE 114 Ca 0.00 -0.93 0.03 0.00 -0.00 0.00 0.00 64.86 63.97 1it8 h ILE 114 Cb 0.75 1.03 -0.04 0.00 -0.00 0.00 0.00 36.82 38.56 1it8 h ILE 114 CO -0.32 0.31 0.37 0.40 -0.00 0.00 0.00 178.15 178.90 1it8 h ILE 115 N 0.52 1.06 -0.46 0.16 2.04 -1.42 0.54 117.51 119.94 1it8 h ILE 115 Ca 0.10 -0.25 -0.11 0.00 1.00 0.00 0.00 64.86 65.61 1it8 h ILE 115 Cb 0.43 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1it8 h ILE 115 CO 0.02 0.13 -0.13 -0.33 0.00 0.00 0.00 178.15 177.84 1it8 h GLU 116 N 0.72 0.91 -0.84 2.37 5.08 -0.99 -2.22 114.58 119.61 1it8 h GLU 116 Ca 0.25 -0.36 0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1it8 h GLU 116 Cb 0.04 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.20 1it8 h GLU 116 CO -0.11 1.01 0.55 0.35 -1.00 0.00 0.00 179.01 179.80 1it8 h PHE 117 N 0.75 1.03 -0.31 4.33 3.57 -0.70 -0.17 116.94 125.45 1it8 h PHE 117 Ca 0.12 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.65 1it8 h PHE 117 Cb 0.68 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 1it8 h PHE 117 CO 0.05 0.63 0.17 1.96 -2.23 0.00 0.00 178.31 178.90 1it8 h GLN 118 N 1.10 0.35 -0.68 1.11 4.20 -0.71 -0.97 115.11 119.50 1it8 h GLN 118 Ca 0.32 -0.02 0.07 0.00 0.06 0.00 0.00 58.65 59.07 1it8 h GLN 118 Cb -0.08 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 27.56 1it8 h GLN 118 CO -0.08 0.23 0.37 0.45 -0.67 0.00 0.00 178.83 179.13 1it8 h HIS 119 N 0.36 0.67 0.00 2.96 3.86 -0.66 -2.49 115.15 119.85 1it8 h HIS 119 Ca 0.12 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.35 1it8 h HIS 119 Cb 0.01 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.27 1it8 h HIS 119 CO -0.08 0.30 -0.05 0.00 0.86 0.00 0.00 177.93 178.96 1it8 h ARG 120 N 0.67 0.00 -0.59 2.45 3.08 -0.46 -3.24 114.38 116.29 1it8 h ARG 120 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1it8 h ARG 120 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1it8 h ARG 120 CO -0.21 0.05 0.00 0.44 -1.07 0.00 0.00 179.97 179.18 1it8 n ILE 121 N -3.14 0.78 -0.84 2.04 -5.35 -0.43 -4.80 119.36 107.64 1it8 n ILE 121 Ca 0.02 -0.84 0.00 0.00 -0.27 0.00 0.00 62.75 61.66 1it8 n ILE 121 Cb 0.40 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 38.85 1it8 n ILE 121 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1it8 n GLY 122 N 1.53 0.63 3.53 3.28 0.00 -1.19 -0.57 105.19 112.39 1it8 n GLY 122 Ca 0.21 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.77 1it8 n GLY 122 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1it8 n VAL 123 N -2.72 1.82 0.06 1.61 0.31 -1.18 -4.86 118.33 113.36 1it8 n VAL 123 Ca 0.00 -0.45 -0.14 0.00 -0.01 0.00 0.00 64.34 63.74 1it8 n VAL 123 Cb 0.00 -0.65 -0.14 0.00 -0.91 0.00 0.00 33.84 32.14 1it8 n VAL 123 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1it8 h ASP 124 N 1.88 0.27 -3.16 4.52 3.32 -1.64 -3.46 116.42 118.16 1it8 h ASP 124 Ca -0.37 -0.36 -0.25 0.00 0.02 0.00 0.00 57.03 56.07 1it8 h ASP 124 Cb 1.37 -0.09 -0.33 0.00 0.22 0.00 0.00 39.33 40.50 1it8 h ASP 124 CO 0.61 1.30 -0.59 -0.63 -1.72 0.00 0.00 179.24 178.21 1it8 s ILE 125 N -2.64 -0.21 0.44 0.35 1.01 -1.10 -4.16 121.20 114.90 1it8 s ILE 125 Ca -0.06 0.27 0.05 0.00 0.00 0.00 0.00 60.65 60.91 1it8 s ILE 125 Cb 0.08 -0.32 0.05 0.00 0.01 0.00 0.00 42.46 42.27 1it8 s ILE 125 CO 0.85 0.11 0.40 0.61 0.00 0.00 0.00 174.94 176.91 1it8 n GLY 126 N 4.90 2.61 3.10 6.18 0.00 -0.10 -1.19 105.19 120.69 1it8 n GLY 126 Ca -0.13 -2.26 -0.12 0.00 0.00 0.00 0.00 46.02 43.51 1it8 n GLY 126 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1it8 s THR 127 N -2.09 0.04 0.48 2.61 2.01 -1.21 -0.00 115.64 117.48 1it8 s THR 127 Ca 0.30 -0.29 0.08 0.00 0.31 0.00 0.00 61.69 62.09 1it8 s THR 127 Cb -0.02 -0.36 0.04 0.00 0.01 0.00 0.00 72.50 72.16 1it8 s THR 127 CO 0.19 -0.16 0.66 0.72 -0.69 0.00 0.00 174.62 175.34 1it8 s PHE 128 N -0.56 2.32 -1.05 4.92 -0.12 -1.26 -4.10 117.98 118.12 1it8 s PHE 128 Ca -0.07 -0.49 -0.14 0.00 -0.05 0.00 0.00 56.93 56.19 1it8 s PHE 128 Cb -0.04 -2.35 -0.08 0.00 -0.63 0.00 0.00 43.02 39.92 1it8 s PHE 128 CO 0.01 -0.71 2.18 1.28 -0.05 0.00 0.00 175.22 177.93 1it8 n LEU 129 N -2.02 5.48 -4.78 -1.99 4.77 -1.26 -4.63 117.00 112.57 1it8 n LEU 129 Ca 0.11 -3.30 -0.37 0.00 -0.03 0.00 0.00 56.01 52.41 1it8 n LEU 129 Cb 0.60 -1.26 -0.03 0.00 -2.33 0.00 0.00 43.42 40.40 1it8 n LEU 129 CO 0.40 0.55 0.77 1.51 -1.33 0.00 0.00 177.39 179.28 1it8 s ASP 130 N 3.78 6.60 -0.37 -1.43 1.47 -1.26 -4.84 116.67 120.62 1it8 s ASP 130 Ca 0.51 2.14 -0.18 0.00 1.18 0.00 0.00 52.55 56.21 1it8 s ASP 130 Cb 0.13 -2.59 0.00 0.00 -0.34 0.00 0.00 42.92 40.12 1it8 s ASP 130 CO 0.01 -0.61 0.51 -0.63 0.68 0.00 0.00 175.17 175.13 1it8 s ILE 131 N -1.59 5.02 -0.93 2.11 1.01 -1.26 -4.70 121.20 120.86 1it8 s ILE 131 Ca 0.59 0.21 -0.24 0.00 0.00 0.00 0.00 60.65 61.20 1it8 s ILE 131 Cb -0.25 -3.99 0.04 0.00 0.01 0.00 0.00 42.46 38.27 1it8 s ILE 131 CO 0.31 -0.27 1.43 -2.84 0.00 0.00 0.00 174.94 173.57 1it8 s PRO 132 N 2.38 3.41 0.26 2.79 0.02 -1.26 -4.88 135.00 137.71 1it8 s PRO 132 Ca 0.18 -0.80 -0.30 0.00 0.02 0.00 0.00 61.00 60.10 1it8 s PRO 132 Cb -0.16 -5.00 -0.10 0.00 0.02 0.00 0.00 34.50 29.27 1it8 s PRO 132 CO 0.14 -2.26 1.33 0.99 -0.33 0.00 0.00 177.00 176.87 1it8 s THR 133 N 5.51 2.94 1.04 0.99 2.01 -1.26 -4.83 115.64 122.03 1it8 s THR 133 Ca 0.44 0.83 -0.12 0.00 0.31 0.00 0.00 61.69 63.16 1it8 s THR 133 Cb -0.03 -3.53 0.21 0.00 0.01 0.00 0.00 72.50 69.16 1it8 s THR 133 CO -0.02 0.16 1.07 -2.84 -0.69 0.00 0.00 174.62 172.30 1it8 s PRO 134 N -0.79 0.10 0.00 4.92 0.02 -1.26 -4.65 135.00 133.34 1it8 s PRO 134 Ca 0.54 0.93 0.00 0.00 0.02 0.00 0.00 61.00 62.49 1it8 s PRO 134 Cb -0.39 -1.67 0.00 0.00 0.02 0.00 0.00 34.50 32.47 1it8 s PRO 134 CO 0.44 -3.06 0.78 -2.30 -0.33 0.00 0.00 177.00 172.53 1it8 n PRO 135 N -4.47 0.00 -2.22 5.54 -0.02 -1.26 -3.54 135.00 129.03 1it8 n PRO 135 Ca 0.06 0.66 -0.39 0.00 -2.02 0.00 0.00 63.50 61.81 1it8 n PRO 135 Cb 0.54 -1.28 0.01 0.00 -0.02 0.00 0.00 33.50 32.75 1it8 n PRO 135 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1it8 n ASP 136 N -1.94 7.49 -4.89 2.55 8.00 -1.26 -2.65 116.55 123.85 1it8 n ASP 136 Ca 0.00 -3.51 -0.30 0.00 0.71 0.00 0.00 54.79 51.69 1it8 n ASP 136 Cb 0.00 -1.21 0.03 0.00 -0.02 0.00 0.00 41.12 39.91 1it8 n ASP 136 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1it8 s ALA 137 N -3.15 3.09 0.23 2.24 0.00 -1.23 -5.01 121.76 117.92 1it8 s ALA 137 Ca 0.47 -0.33 -0.30 0.00 0.00 0.00 0.00 51.96 51.80 1it8 s ALA 137 Cb 0.25 -2.93 -0.09 0.00 0.00 0.00 0.00 23.12 20.35 1it8 s ALA 137 CO -0.18 -0.84 1.32 -2.14 0.00 0.00 0.00 175.76 173.92 1it8 s PRO 138 N -5.17 4.38 0.33 0.00 0.02 -1.26 -4.82 135.00 128.48 1it8 s PRO 138 Ca 0.55 2.09 0.12 0.00 0.02 0.00 0.00 61.00 63.78 1it8 s PRO 138 Cb -0.11 -3.17 0.99 0.00 0.02 0.00 0.00 34.50 32.24 1it8 s PRO 138 CO 0.51 -0.24 1.68 -0.09 -0.33 0.00 0.00 177.00 178.53 1it8 h ARG 139 N 5.00 0.38 -0.45 5.54 2.43 -1.99 0.20 114.38 125.50 1it8 h ARG 139 Ca -0.45 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 58.75 1it8 h ARG 139 Cb 1.22 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.63 1it8 h ARG 139 CO 0.75 0.25 0.14 1.49 -1.51 0.00 0.00 179.97 181.10 1it8 h GLU 140 N 0.40 0.29 -0.40 0.20 4.81 -1.99 0.11 114.58 117.99 1it8 h GLU 140 Ca 0.69 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.86 1it8 h GLU 140 Cb 1.49 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.79 1it8 h GLU 140 CO -0.57 0.19 0.09 0.37 -0.73 0.00 0.00 179.01 178.36 1it8 h GLN 141 N 0.30 0.65 -0.95 1.92 4.15 -1.00 0.32 115.11 120.51 1it8 h GLN 141 Ca 0.21 -0.16 0.04 0.00 0.77 0.00 0.00 58.65 59.51 1it8 h GLN 141 Cb 0.23 -0.08 -0.06 0.00 0.21 0.00 0.00 27.48 27.78 1it8 h GLN 141 CO -0.24 0.68 0.61 0.00 -1.93 0.00 0.00 178.83 177.96 1it8 h ALA 142 N 0.95 1.26 -0.01 3.38 0.00 -0.78 -0.56 119.26 123.49 1it8 h ALA 142 Ca 0.13 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 1it8 h ALA 142 Cb 0.32 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.80 1it8 h ALA 142 CO 0.00 0.48 -0.53 0.28 0.00 0.00 0.00 179.25 179.49 1it8 h VAL 143 N 1.18 1.44 0.18 0.00 2.07 -0.54 -1.90 116.25 118.67 1it8 h VAL 143 Ca 0.38 -2.03 0.00 0.00 0.82 0.00 0.00 66.70 65.87 1it8 h VAL 143 Cb 0.02 2.59 -0.03 0.00 -1.52 0.00 0.00 31.29 32.35 1it8 h VAL 143 CO -0.13 0.59 -0.41 0.50 0.02 0.00 0.00 177.57 178.14 1it8 h LYS 144 N -0.16 -0.62 -0.98 1.57 3.64 -0.09 -2.15 116.57 117.79 1it8 h LYS 144 Ca -0.06 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.46 1it8 h LYS 144 Cb 1.24 0.14 -0.08 0.00 -0.41 0.00 0.00 32.23 33.12 1it8 h LYS 144 CO 0.10 -0.41 0.61 0.93 -2.27 0.00 0.00 179.45 178.41 1it8 h GLU 145 N -0.64 0.98 -0.65 1.90 5.08 -1.21 -2.21 114.58 117.83 1it8 h GLU 145 Ca -0.02 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1it8 h GLU 145 Cb 0.62 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 1it8 h GLU 145 CO -0.18 0.65 0.40 1.25 -1.00 0.00 0.00 179.01 180.13 1it8 h LEU 146 N 1.01 0.64 -0.73 1.33 5.85 -0.97 0.20 115.31 122.64 1it8 h LEU 146 Ca 0.47 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 59.15 1it8 h LEU 146 Cb 0.39 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1it8 h LEU 146 CO -0.24 0.44 0.27 -0.33 -0.34 0.00 0.00 178.44 178.24 1it8 h GLU 147 N 0.77 1.10 -0.64 1.25 4.39 -0.79 0.54 114.58 121.21 1it8 h GLU 147 Ca 0.27 -0.21 -0.03 0.00 0.34 0.00 0.00 59.36 59.73 1it8 h GLU 147 Cb 0.05 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.50 1it8 h GLU 147 CO -0.12 0.92 0.30 0.82 -1.16 0.00 0.00 179.01 179.77 1it8 h ILE 148 N 1.06 1.22 -0.21 3.13 2.04 -1.01 0.15 117.51 123.89 1it8 h ILE 148 Ca 0.24 -0.64 0.03 0.00 1.00 0.00 0.00 64.86 65.49 1it8 h ILE 148 Cb 0.24 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 1it8 h ILE 148 CO -0.02 0.26 0.05 0.74 0.00 0.00 0.00 178.15 179.18 1it8 h THR 149 N 0.89 0.91 -0.40 -0.27 2.02 -0.05 -1.87 112.91 114.14 1it8 h THR 149 Ca 0.22 -0.05 -0.04 0.00 0.77 0.00 0.00 66.41 67.32 1it8 h THR 149 Cb 0.13 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 1it8 h THR 149 CO -0.03 0.03 0.10 -0.07 0.37 0.00 0.00 175.52 175.92 1it8 h LEU 150 N 0.14 0.55 -0.41 2.58 3.38 -0.10 0.13 115.31 121.58 1it8 h LEU 150 Ca 0.10 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1it8 h LEU 150 Cb 0.09 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1it8 h LEU 150 CO -0.12 0.55 -0.10 0.77 0.09 0.00 0.00 178.44 179.63 1it8 h SER 151 N 0.58 0.80 0.36 -0.43 4.64 -0.28 -1.02 113.55 118.21 1it8 h SER 151 Ca 0.14 -0.36 -0.04 0.00 -0.47 0.00 0.00 61.79 61.05 1it8 h SER 151 Cb 0.22 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.09 1it8 h SER 151 CO -0.00 0.98 -0.21 0.03 -0.87 0.00 0.00 176.83 176.75 1it8 h ARG 152 N 0.61 0.00 -0.28 4.77 3.08 -0.87 -1.91 114.38 119.78 1it8 h ARG 152 Ca 0.10 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 1it8 h ARG 152 Cb 0.63 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 1it8 h ARG 152 CO 0.04 0.21 0.02 0.00 -1.07 0.00 0.00 179.97 179.17 1it8 h ALA 153 N 1.79 0.37 -0.83 0.04 0.00 0.05 -1.15 119.26 119.53 1it8 h ALA 153 Ca -0.00 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.71 1it8 h ALA 153 Cb 0.45 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1it8 h ALA 153 CO 0.03 0.09 0.54 0.00 0.00 0.00 0.00 179.25 179.91 1it8 h ARG 154 N 0.27 1.07 -0.63 0.00 3.08 -0.48 -0.40 114.38 117.29 1it8 h ARG 154 Ca 0.08 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 1it8 h ARG 154 Cb 0.39 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 1it8 h ARG 154 CO 0.01 0.71 0.15 1.49 -1.07 0.00 0.00 179.97 181.26 1it8 h GLU 155 N 1.10 1.02 -0.66 0.04 4.81 -1.22 -2.25 114.58 117.41 1it8 h GLU 155 Ca 0.31 -0.25 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1it8 h GLU 155 Cb -0.09 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.13 1it8 h GLU 155 CO -0.08 0.92 0.33 0.00 -0.73 0.00 0.00 179.01 179.45 1it8 h ALA 156 N 1.05 0.85 -0.93 2.92 0.00 -0.62 -1.61 119.26 120.93 1it8 h ALA 156 Ca 0.20 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1it8 h ALA 156 Cb 0.36 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 1it8 h ALA 156 CO 0.00 0.41 0.61 1.49 0.00 0.00 0.00 179.25 181.76 1it8 h GLU 157 N 0.91 1.11 0.00 0.00 4.81 -0.72 0.11 114.58 120.80 1it8 h GLU 157 Ca 0.23 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1it8 h GLU 157 Cb 0.10 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.23 1it8 h GLU 157 CO -0.03 0.73 0.00 0.39 -0.73 0.00 0.00 179.01 179.37 1it8 n GLU 158 N -4.46 0.00 0.00 1.92 1.02 -0.88 -3.89 120.64 114.35 1it8 n GLU 158 Ca 0.13 0.34 0.03 0.00 -0.02 0.00 0.00 57.16 57.64 1it8 n GLU 158 Cb 0.13 -1.11 0.19 0.00 -0.02 0.00 0.00 31.44 30.62 1it8 n GLU 158 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1it8 n ILE 159 N -1.53 0.00 -2.07 -3.67 -5.35 -0.66 -4.84 119.36 101.25 1it8 n ILE 159 Ca 0.00 0.00 -0.40 0.00 -0.27 0.00 0.00 62.75 62.08 1it8 n ILE 159 Cb 0.00 -0.45 -0.01 0.00 -1.74 0.00 0.00 39.64 37.44 1it8 n ILE 159 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1it8 s LYS 160 N -2.00 4.19 0.00 6.28 2.20 0.37 -4.89 119.74 125.89 1it8 s LYS 160 Ca 0.10 2.22 0.00 0.00 -0.36 0.00 0.00 55.97 57.92 1it8 s LYS 160 Cb 0.04 -2.94 0.00 0.00 -1.51 0.00 0.00 37.83 33.43 1it8 s LYS 160 CO 0.07 -0.33 0.01 0.39 -0.36 0.00 0.00 175.35 175.13 1it8 n GLU 161 N 0.51 0.41 -4.27 4.03 -0.58 -1.26 -5.03 120.64 114.44 1it8 n GLU 161 Ca 0.01 -0.01 -0.15 0.00 -0.42 0.00 0.00 57.16 56.60 1it8 n GLU 161 Cb 0.42 -0.15 -0.10 0.00 -0.57 0.00 0.00 31.44 31.04 1it8 n GLU 161 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1it8 s ILE 162 N -0.06 0.76 0.55 -3.67 1.10 -1.26 -5.13 121.20 113.49 1it8 s ILE 162 Ca 0.00 -2.00 -0.21 0.00 -0.51 0.00 0.00 60.65 57.93 1it8 s ILE 162 Cb 0.00 -2.24 -0.05 0.00 0.15 0.00 0.00 42.46 40.32 1it8 s ILE 162 CO 0.00 -0.38 1.25 -2.84 -2.11 0.00 0.00 174.94 170.87 1it8 s PRO 163 N -3.92 3.19 0.04 3.50 0.02 -1.26 -4.86 135.00 131.72 1it8 s PRO 163 Ca 0.27 1.97 -0.01 0.00 0.02 0.00 0.00 61.00 63.24 1it8 s PRO 163 Cb 0.06 -2.15 -0.03 0.00 0.02 0.00 0.00 34.50 32.40 1it8 s PRO 163 CO 0.06 -1.07 -0.01 -1.64 -0.33 0.00 0.00 177.00 174.01 1it8 s MET 164 N -3.04 0.54 -0.03 5.54 -1.94 -1.26 -0.93 119.30 118.18 1it8 s MET 164 Ca 0.72 -1.01 -0.20 0.00 -1.71 0.00 0.00 55.69 53.49 1it8 s MET 164 Cb -0.34 0.19 -0.05 0.00 2.01 0.00 0.00 34.83 36.64 1it8 s MET 164 CO 0.39 -0.10 0.59 -0.80 -0.01 0.00 0.00 175.02 175.08 1it8 s ASN 165 N -2.46 6.92 -0.44 3.03 0.02 1.00 -3.18 114.94 119.83 1it8 s ASN 165 Ca -0.00 1.10 0.03 0.00 -1.02 0.00 0.00 52.86 52.97 1it8 s ASN 165 Cb 0.02 -2.36 0.12 0.00 0.02 0.00 0.00 41.25 39.06 1it8 s ASN 165 CO -0.07 0.05 0.19 0.00 0.02 0.00 0.00 177.10 177.29 1it8 s ALA 166 N 0.09 2.75 -0.22 0.60 0.00 -0.36 -4.06 121.76 120.57 1it8 s ALA 166 Ca 0.31 -2.78 -0.29 0.00 0.00 0.00 0.00 51.96 49.20 1it8 s ALA 166 Cb -0.18 -2.00 -0.02 0.00 0.00 0.00 0.00 23.12 20.93 1it8 s ALA 166 CO 0.16 -1.92 1.47 0.99 0.00 0.00 0.00 175.76 176.46 1it8 s THR 167 N 0.33 3.91 0.24 0.00 2.01 -1.26 -3.53 115.64 117.34 1it8 s THR 167 Ca 0.15 1.05 -0.30 0.00 0.31 0.00 0.00 61.69 62.89 1it8 s THR 167 Cb -0.23 -3.86 -0.10 0.00 0.01 0.00 0.00 72.50 68.31 1it8 s THR 167 CO -0.04 -0.30 1.48 -0.63 -0.69 0.00 0.00 174.62 174.43 1it8 s ILE 168 N 4.58 2.58 -0.38 1.82 1.09 0.14 -4.81 121.20 126.22 1it8 s ILE 168 Ca 0.64 0.48 0.12 0.00 -1.10 0.00 0.00 60.65 60.79 1it8 s ILE 168 Cb -0.23 -3.30 0.39 0.00 -1.06 0.00 0.00 42.46 38.26 1it8 s ILE 168 CO 0.25 0.07 1.00 1.67 -0.10 0.00 0.00 174.94 177.83 1it8 n GLN 169 N 2.57 1.08 -0.50 2.79 -0.06 -1.26 -1.40 117.38 120.59 1it8 n GLN 169 Ca 0.08 -2.74 0.02 0.00 -2.00 0.00 0.00 57.00 52.36 1it8 n GLN 169 Cb 0.40 -1.09 0.21 0.00 -4.06 0.00 0.00 30.24 25.69 1it8 n GLN 169 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1it8 n GLY 170 N 0.01 2.41 7.00 1.69 0.00 -1.26 -4.73 105.19 110.30 1it8 n GLY 170 Ca 0.11 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1it8 n GLY 170 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1it8 n SER 171 N 0.26 0.00 -2.10 1.61 2.88 -1.26 -2.80 113.62 112.21 1it8 n SER 171 Ca 0.17 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.59 1it8 n SER 171 Cb 0.80 0.00 0.27 0.00 -0.75 0.00 0.00 64.21 64.53 1it8 n SER 171 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1it8 n THR 172 N 0.00 3.03 -3.49 2.46 -2.24 -1.09 -4.85 114.28 108.11 1it8 n THR 172 Ca 0.00 -1.71 -0.42 0.00 -2.27 0.00 0.00 64.05 59.64 1it8 n THR 172 Cb 0.00 -0.40 -0.09 0.00 -2.10 0.00 0.00 70.33 67.75 1it8 n THR 172 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1it8 s TYR 173 N -3.08 3.30 0.22 4.78 1.51 -1.12 -4.96 117.35 117.99 1it8 s TYR 173 Ca 0.56 -1.27 -0.10 0.00 -1.01 0.00 0.00 57.07 55.26 1it8 s TYR 173 Cb 0.45 -3.11 0.34 0.00 -0.11 0.00 0.00 41.96 39.53 1it8 s TYR 173 CO 0.13 -0.84 1.65 1.79 -1.11 0.00 0.00 175.55 177.17 1it8 h THR 174 N 5.93 0.43 -0.58 -0.71 1.35 -1.88 0.33 112.91 117.77 1it8 h THR 174 Ca -0.26 -0.03 0.07 0.00 -0.55 0.00 0.00 66.41 65.64 1it8 h THR 174 Cb 1.10 0.32 -0.03 0.00 -1.73 0.00 0.00 68.15 67.80 1it8 h THR 174 CO 0.83 0.02 0.39 -2.24 -0.25 0.00 0.00 175.52 174.26 1it8 h ASP 175 N 0.10 0.47 0.16 5.36 2.03 -1.95 -0.70 116.42 121.89 1it8 h ASP 175 Ca 0.35 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.44 1it8 h ASP 175 Cb 0.58 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 38.99 1it8 h ASP 175 CO -0.59 0.30 -0.85 -0.07 -1.03 0.00 0.00 179.24 177.00 1it8 h LEU 176 N 0.53 0.65 -0.42 0.15 3.38 -0.70 -2.20 115.31 116.70 1it8 h LEU 176 Ca 0.25 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1it8 h LEU 176 Cb 0.32 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1it8 h LEU 176 CO -0.07 1.25 0.21 0.03 0.09 0.00 0.00 178.44 179.94 1it8 h ARG 177 N 0.33 0.61 -0.25 1.13 2.47 -0.34 -0.49 114.38 117.84 1it8 h ARG 177 Ca -0.06 -0.09 0.03 0.00 -1.26 0.00 0.00 59.98 58.60 1it8 h ARG 177 Cb 1.46 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 29.64 1it8 h ARG 177 CO 0.16 0.52 0.06 -0.09 0.56 0.00 0.00 179.97 181.18 1it8 h ARG 178 N 0.54 0.16 0.36 0.04 2.43 -1.14 0.45 114.38 117.22 1it8 h ARG 178 Ca 0.15 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 1it8 h ARG 178 Cb 0.11 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1it8 h ARG 178 CO -0.02 0.11 -0.18 -0.92 -1.51 0.00 0.00 179.97 177.44 1it8 h TYR 179 N 0.17 -0.48 0.10 2.20 3.20 -1.15 -0.69 116.97 120.32 1it8 h TYR 179 Ca 0.11 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.99 1it8 h TYR 179 Cb 0.10 0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.49 1it8 h TYR 179 CO -0.15 -0.30 -0.31 0.00 -1.64 0.00 0.00 178.16 175.77 1it8 h ALA 180 N 0.14 -0.52 -0.22 1.82 0.00 -0.86 0.10 119.26 119.71 1it8 h ALA 180 Ca -0.05 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.87 1it8 h ALA 180 Cb 0.39 0.52 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 1it8 h ALA 180 CO 0.07 -0.85 -0.13 0.00 0.00 0.00 0.00 179.25 178.34 1it8 h ALA 181 N 0.15 0.05 -0.39 0.00 0.00 -0.87 -0.58 119.26 117.62 1it8 h ALA 181 Ca 0.03 0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1it8 h ALA 181 Cb 0.56 0.30 -0.09 0.00 0.00 0.00 0.00 17.79 18.56 1it8 h ALA 181 CO -0.19 -0.55 -0.43 -0.09 0.00 0.00 0.00 179.25 177.99 1it8 h ARG 182 N -0.11 -0.33 -0.16 0.00 2.43 -0.59 0.47 114.38 116.08 1it8 h ARG 182 Ca 0.12 0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.25 1it8 h ARG 182 Cb 0.30 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 1it8 h ARG 182 CO -0.29 -0.22 -0.20 0.00 -1.51 0.00 0.00 179.97 177.75 1it8 h ARG 183 N -0.34 0.28 0.00 0.20 2.47 -0.36 -2.69 114.38 113.94 1it8 h ARG 183 Ca 0.13 -0.08 -0.03 0.00 -1.26 0.00 0.00 59.98 58.74 1it8 h ARG 183 Cb 0.59 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.87 1it8 h ARG 183 CO -0.56 0.48 -0.12 -0.07 0.56 0.00 0.00 179.97 180.26 1it8 h LEU 184 N 0.26 0.00 -0.16 3.04 -0.00 -0.42 -3.21 115.31 114.81 1it8 h LEU 184 Ca 0.05 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.76 1it8 h LEU 184 Cb 0.52 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.18 1it8 h LEU 184 CO 0.03 0.12 -0.54 0.28 -0.00 0.00 0.00 178.44 178.34 1it8 h SER 185 N 0.00 0.75 0.43 -0.43 0.02 -0.60 -2.88 113.55 110.83 1it8 h SER 185 Ca -0.00 -0.60 0.00 0.00 -0.84 0.00 0.00 61.79 60.35 1it8 h SER 185 Cb 1.04 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1it8 h SER 185 CO 0.02 1.22 0.00 -1.54 -1.14 0.00 0.00 176.83 175.39 1it8 n SER 186 N -4.15 0.00 -4.97 3.07 3.41 -1.12 -4.69 113.62 105.16 1it8 n SER 186 Ca -0.07 0.48 -0.21 0.00 -0.26 0.00 0.00 58.87 58.81 1it8 n SER 186 Cb 0.62 -0.49 0.01 0.00 -0.26 0.00 0.00 64.21 64.08 1it8 n SER 186 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1it8 s MET 187 N -2.98 3.00 -0.92 4.33 1.00 -1.09 -5.04 119.30 117.60 1it8 s MET 187 Ca 0.06 -0.74 -0.19 0.00 0.00 0.00 0.00 55.69 54.82 1it8 s MET 187 Cb 0.08 -2.64 0.13 0.00 0.00 0.00 0.00 34.83 32.39 1it8 s MET 187 CO 0.23 -0.22 1.13 1.21 0.00 0.00 0.00 175.02 177.37 1it8 s ASN 188 N -4.24 6.61 0.04 3.03 3.84 -1.26 -4.96 114.94 117.99 1it8 s ASN 188 Ca 0.49 -1.98 -0.01 0.00 0.21 0.00 0.00 52.86 51.57 1it8 s ASN 188 Cb -0.10 -2.41 -0.03 0.00 -0.55 0.00 0.00 41.25 38.17 1it8 s ASN 188 CO 0.35 -1.09 -0.03 -0.36 -2.79 0.00 0.00 177.10 173.18 1it8 s PHE 189 N 2.82 0.39 -0.20 0.43 0.40 -1.26 -4.87 117.98 115.69 1it8 s PHE 189 Ca 0.33 -0.80 0.17 0.00 -0.60 0.00 0.00 56.93 56.02 1it8 s PHE 189 Cb -0.05 -0.29 -0.24 0.00 0.51 0.00 0.00 43.02 42.95 1it8 s PHE 189 CO -0.09 -0.29 0.06 -0.85 0.70 0.00 0.00 175.22 174.75 1it8 n GLU 190 N 0.83 0.75 -4.59 0.44 0.00 -1.22 -4.98 120.64 111.86 1it8 n GLU 190 Ca -0.19 -0.00 -0.22 0.00 0.00 0.00 0.00 57.16 56.75 1it8 n GLU 190 Cb 0.58 -1.51 -0.15 0.00 0.00 0.00 0.00 31.44 30.36 1it8 n GLU 190 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1it8 s ILE 191 N -2.48 1.05 -0.39 3.84 1.01 -1.19 -3.84 121.20 119.19 1it8 s ILE 191 Ca -0.11 -0.54 -0.00 0.00 0.00 0.00 0.00 60.65 59.99 1it8 s ILE 191 Cb 0.06 -0.89 0.11 0.00 0.01 0.00 0.00 42.46 41.75 1it8 s ILE 191 CO 0.81 0.30 0.16 -1.00 0.00 0.00 0.00 174.94 175.21 1it8 s HIS 192 N -0.14 3.64 0.63 3.97 3.76 0.29 -1.22 115.29 126.22 1it8 s HIS 192 Ca 0.02 -2.64 -0.13 0.00 -0.15 0.00 0.00 55.06 52.16 1it8 s HIS 192 Cb -0.07 -3.12 -0.02 0.00 1.11 0.00 0.00 32.58 30.48 1it8 s HIS 192 CO 0.00 -0.96 1.04 -2.14 -0.85 0.00 0.00 174.74 171.84 1it8 s PRO 193 N 0.99 3.30 -0.25 8.40 0.02 -1.23 -2.40 135.00 143.84 1it8 s PRO 193 Ca 0.10 0.97 -0.03 0.00 0.02 0.00 0.00 61.00 62.06 1it8 s PRO 193 Cb -0.21 -2.04 0.02 0.00 0.02 0.00 0.00 34.50 32.28 1it8 s PRO 193 CO -0.05 -0.81 -0.04 0.42 -0.33 0.00 0.00 177.00 176.19 1it8 s ILE 194 N -2.87 3.10 0.55 2.83 1.01 0.89 0.23 121.20 126.95 1it8 s ILE 194 Ca 0.59 -0.87 0.05 0.00 0.00 0.00 0.00 60.65 60.42 1it8 s ILE 194 Cb -0.13 -2.54 0.04 0.00 0.01 0.00 0.00 42.46 39.84 1it8 s ILE 194 CO 0.47 0.24 0.40 -0.83 0.00 0.00 0.00 174.94 175.22 1it8 s GLY 195 N 1.38 2.40 -0.64 6.18 0.00 -0.50 -2.92 107.32 113.22 1it8 s GLY 195 Ca 0.02 -1.18 0.00 0.00 0.00 0.00 0.00 44.72 43.56 1it8 s GLY 195 CO -0.04 -1.96 0.00 0.61 0.00 0.00 0.00 173.10 171.72 1it8 n GLY 196 N -1.78 0.80 1.08 0.20 0.00 -1.26 -4.82 105.19 99.40 1it8 n GLY 196 Ca -0.02 -0.33 0.11 0.00 0.00 0.00 0.00 46.02 45.77 1it8 n GLY 196 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1it8 n VAL 197 N -2.62 0.51 0.14 1.61 0.24 -1.26 -4.31 118.33 112.63 1it8 n VAL 197 Ca -0.06 -0.75 -0.13 0.00 -2.04 0.00 0.00 64.34 61.35 1it8 n VAL 197 Cb 0.30 0.97 -0.07 0.00 -1.47 0.00 0.00 33.84 33.58 1it8 n VAL 197 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 1it8 h VAL 198 N 4.19 0.62 -0.98 3.34 2.07 -1.91 -0.76 116.25 122.84 1it8 h VAL 198 Ca 0.00 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.68 1it8 h VAL 198 Cb 0.94 0.62 -0.09 0.00 -1.52 0.00 0.00 31.29 31.25 1it8 h VAL 198 CO 0.00 0.00 0.61 -0.65 0.02 0.00 0.00 177.57 177.55 1it8 h PRO 199 N -0.38 0.76 0.71 1.57 0.11 -2.00 -0.02 132.00 132.76 1it8 h PRO 199 Ca -0.00 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 1it8 h PRO 199 Cb 0.36 -0.17 0.01 0.00 0.11 0.00 0.00 31.00 31.30 1it8 h PRO 199 CO -0.03 0.50 -0.34 -0.07 -0.21 0.00 0.00 178.00 177.85 1it8 h LEU 200 N 0.78 -0.81 0.15 2.35 3.38 -1.59 -1.98 115.31 117.58 1it8 h LEU 200 Ca 0.52 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.53 1it8 h LEU 200 Cb 0.78 0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 1it8 h LEU 200 CO -0.30 -0.56 -0.45 -0.07 0.09 0.00 0.00 178.44 177.16 1it8 h LEU 201 N -1.00 -1.33 -1.03 1.67 3.38 -0.39 -0.58 115.31 116.04 1it8 h LEU 201 Ca -0.10 0.14 0.31 0.00 0.09 0.00 0.00 57.88 58.33 1it8 h LEU 201 Cb 0.75 0.49 -0.14 0.00 0.09 0.00 0.00 40.66 41.85 1it8 h LEU 201 CO 0.16 -0.52 0.59 -0.33 0.09 0.00 0.00 178.44 178.43 1it8 h GLU 202 N -0.70 0.35 -0.65 1.13 5.08 -1.02 0.78 114.58 119.55 1it8 h GLU 202 Ca 0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1it8 h GLU 202 Cb 0.71 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1it8 h GLU 202 CO -0.24 0.23 0.00 0.43 -1.00 0.00 0.00 179.01 178.43 1it8 n SER 203 N -5.00 1.58 -2.08 1.42 7.64 -0.35 -4.87 113.62 111.97 1it8 n SER 203 Ca 0.31 -2.13 -0.11 0.00 1.01 0.00 0.00 58.87 57.96 1it8 n SER 203 Cb 0.96 -0.39 -0.02 0.00 -1.01 0.00 0.00 64.21 63.75 1it8 n SER 203 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1it8 n TYR 204 N 0.07 -1.16 -2.21 1.43 4.01 0.27 -4.82 117.16 114.74 1it8 n TYR 204 Ca 0.06 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.38 1it8 n TYR 204 Cb 0.34 -2.46 0.00 0.00 -0.31 0.00 0.00 39.34 36.91 1it8 n TYR 204 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1it8 n ARG 205 N -2.43 3.81 0.20 -0.72 1.74 -0.47 -4.72 116.66 114.06 1it8 n ARG 205 Ca -0.12 -3.45 0.08 0.00 -0.77 0.00 0.00 57.85 53.59 1it8 n ARG 205 Cb 0.52 -2.87 0.37 0.00 -1.02 0.00 0.00 32.46 29.46 1it8 n ARG 205 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 1it8 h PHE 206 N 5.48 0.00 -0.52 -1.55 -1.00 -1.82 -2.88 116.94 114.65 1it8 h PHE 206 Ca 0.48 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 61.17 1it8 h PHE 206 Cb 0.55 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.09 1it8 h PHE 206 CO 1.35 0.30 -0.01 -0.09 -1.61 0.00 0.00 178.31 178.25 1it8 h ARG 207 N 0.00 0.92 -0.44 1.51 2.43 -1.85 -1.56 114.38 115.39 1it8 h ARG 207 Ca -0.00 -0.30 -0.03 0.00 -0.81 0.00 0.00 59.98 58.84 1it8 h ARG 207 Cb 0.87 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.32 1it8 h ARG 207 CO 0.04 0.94 0.15 -0.44 -1.51 0.00 0.00 179.97 179.15 1it8 h ASP 208 N 0.78 0.63 -0.30 -3.80 3.32 -1.93 -2.53 116.42 112.59 1it8 h ASP 208 Ca 0.15 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1it8 h ASP 208 Cb 0.54 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 1it8 h ASP 208 CO 0.03 0.66 0.17 0.58 -1.72 0.00 0.00 179.24 178.95 1it8 h VAL 209 N 0.56 1.11 -0.01 -1.35 2.07 -1.36 -2.08 116.25 115.19 1it8 h VAL 209 Ca 0.14 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 1it8 h VAL 209 Cb 0.25 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1it8 h VAL 209 CO -0.01 0.13 0.00 0.58 0.02 0.00 0.00 177.57 178.29 1it8 h VAL 210 N 0.46 1.15 -0.38 2.57 2.07 -0.87 -0.83 116.25 120.43 1it8 h VAL 210 Ca 0.12 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 67.22 1it8 h VAL 210 Cb 0.04 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1it8 h VAL 210 CO -0.02 0.12 0.18 0.44 0.02 0.00 0.00 177.57 178.31 1it8 h ASP 211 N -0.17 0.25 -0.06 0.57 3.32 -1.17 -0.01 116.42 119.15 1it8 h ASP 211 Ca 0.00 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.09 1it8 h ASP 211 Cb 0.19 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1it8 h ASP 211 CO -0.00 0.18 -0.02 0.40 -1.72 0.00 0.00 179.24 178.09 1it8 h ILE 212 N 0.36 0.94 -0.73 0.35 2.04 -1.28 -0.69 117.51 118.50 1it8 h ILE 212 Ca 0.16 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.03 1it8 h ILE 212 Cb 0.09 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1it8 h ILE 212 CO -0.13 0.00 0.47 0.58 0.00 0.00 0.00 178.15 179.07 1it8 h VAL 213 N -0.00 1.19 0.15 1.67 2.07 -0.72 -1.81 116.25 118.80 1it8 h VAL 213 Ca 0.03 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 1it8 h VAL 213 Cb 0.05 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 29.96 1it8 h VAL 213 CO -0.07 0.19 -0.07 0.40 0.02 0.00 0.00 177.57 178.05 1it8 h ILE 214 N 0.99 0.99 -0.16 4.57 1.08 -0.82 0.12 117.51 124.29 1it8 h ILE 214 Ca 0.26 -0.68 0.05 0.00 -0.39 0.00 0.00 64.86 64.10 1it8 h ILE 214 Cb -0.09 1.40 -0.01 0.00 -3.07 0.00 0.00 36.82 35.06 1it8 h ILE 214 CO -0.05 0.16 0.20 0.77 -0.69 0.00 0.00 178.15 178.53 1it8 h SER 215 N -0.53 0.00 0.02 1.72 4.64 -1.05 -0.56 113.55 117.79 1it8 h SER 215 Ca -0.02 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.26 1it8 h SER 215 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1it8 h SER 215 CO 0.03 0.00 -0.17 0.28 -0.87 0.00 0.00 176.83 176.10 1it8 h SER 216 N 0.00 0.05 0.13 4.97 0.02 -0.93 -3.31 113.55 114.48 1it8 h SER 216 Ca 0.08 -0.96 0.00 0.00 -0.84 0.00 0.00 61.79 60.06 1it8 h SER 216 Cb 0.47 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1it8 h SER 216 CO -0.00 1.08 0.00 0.11 -1.14 0.00 0.00 176.83 176.88 1it8 h LYS 217 N -0.93 0.00 0.00 3.45 1.57 0.70 -0.77 116.57 120.60 1it8 h LYS 217 Ca -0.04 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.60 1it8 h LYS 217 Cb 1.09 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 1it8 h LYS 217 CO 0.00 0.00 -0.69 0.52 -0.57 0.00 0.00 179.45 178.72 1it8 h MET 218 N 0.00 0.00 0.00 3.15 2.86 -1.28 -3.30 114.93 116.37 1it8 h MET 218 Ca 0.00 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 1it8 h MET 218 Cb 0.07 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 1it8 h MET 218 CO 0.00 0.69 -1.65 0.00 1.06 0.00 0.00 176.91 177.01 1it8 n ALA 219 N -2.37 2.47 -1.66 6.32 0.00 -0.38 -4.97 120.51 119.93 1it8 n ALA 219 Ca -0.00 -0.51 -0.32 0.00 0.00 0.00 0.00 53.44 52.60 1it8 n ALA 219 Cb 0.70 -0.83 0.01 0.00 0.00 0.00 0.00 19.45 19.33 1it8 n ALA 219 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1it8 s LEU 220 N -5.05 3.46 -0.12 0.00 1.43 -0.71 -4.11 118.68 113.58 1it8 s LEU 220 Ca -0.05 1.78 -0.29 0.00 -1.03 0.00 0.00 54.13 54.54 1it8 s LEU 220 Cb 0.11 -4.53 -0.01 0.00 0.03 0.00 0.00 46.19 41.79 1it8 s LEU 220 CO 0.85 -1.17 0.97 0.00 0.23 0.00 0.00 176.35 177.23 1it8 s ARG 221 N -4.18 4.39 0.54 1.70 1.70 -1.26 -4.92 118.95 116.92 1it8 s ARG 221 Ca 0.63 1.30 0.19 0.00 -0.47 0.00 0.00 55.73 57.38 1it8 s ARG 221 Cb -0.15 -3.55 1.04 0.00 -0.57 0.00 0.00 34.95 31.72 1it8 s ARG 221 CO 0.39 -0.32 1.54 -1.35 -1.08 0.00 0.00 175.30 174.48 1it8 h PRO 222 N 7.14 0.00 -0.25 3.89 0.11 -1.94 -2.82 132.00 138.13 1it8 h PRO 222 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1it8 h PRO 222 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1it8 h PRO 222 CO 0.85 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.24 1it8 n ASP 223 N -2.52 1.61 -4.46 -2.05 5.75 -1.26 -4.88 116.55 108.73 1it8 n ASP 223 Ca -0.01 -1.87 -0.30 0.00 -0.01 0.00 0.00 54.79 52.59 1it8 n ASP 223 Cb 0.47 -0.17 -0.12 0.00 -1.03 0.00 0.00 41.12 40.27 1it8 n ASP 223 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1it8 s ARG 224 N -1.67 1.89 0.23 0.11 0.52 -1.07 -4.77 118.95 114.20 1it8 s ARG 224 Ca 0.25 -1.10 -0.30 0.00 -0.52 0.00 0.00 55.73 54.06 1it8 s ARG 224 Cb 0.13 -2.13 -0.10 0.00 0.52 0.00 0.00 34.95 33.37 1it8 s ARG 224 CO 0.19 0.51 1.46 -2.14 0.02 0.00 0.00 175.30 175.33 1it8 s PRO 225 N -1.79 4.26 -0.21 3.54 0.02 -1.25 -4.84 135.00 134.72 1it8 s PRO 225 Ca 0.16 2.30 -0.06 0.00 0.02 0.00 0.00 61.00 63.42 1it8 s PRO 225 Cb -0.10 -3.12 -0.03 0.00 0.02 0.00 0.00 34.50 31.27 1it8 s PRO 225 CO 0.07 -0.45 0.03 0.08 -0.33 0.00 0.00 177.00 176.41 1it8 s VAL 226 N 0.19 4.18 -0.21 3.83 1.01 -1.26 -0.54 120.40 127.60 1it8 s VAL 226 Ca 0.61 -0.23 -0.04 0.00 0.00 0.00 0.00 61.98 62.32 1it8 s VAL 226 Cb -0.42 -2.91 -0.01 0.00 0.00 0.00 0.00 36.38 33.03 1it8 s VAL 226 CO 0.41 0.40 -0.03 -2.28 0.00 0.00 0.00 175.10 173.60 1it8 s HIS 227 N 1.13 2.97 -1.00 5.22 2.46 -1.01 0.13 115.29 125.18 1it8 s HIS 227 Ca 0.03 -0.75 -0.15 0.00 0.47 0.00 0.00 55.06 54.66 1it8 s HIS 227 Cb -0.14 -2.08 0.19 0.00 -0.13 0.00 0.00 32.58 30.42 1it8 s HIS 227 CO 0.02 -0.42 1.11 -1.17 -2.47 0.00 0.00 174.74 171.81 1it8 s LEU 228 N 1.24 5.71 0.05 8.88 2.96 0.35 -0.08 118.68 137.79 1it8 s LEU 228 Ca 0.03 -2.70 -0.38 0.00 -0.22 0.00 0.00 54.13 50.86 1it8 s LEU 228 Cb -0.14 -2.32 -0.19 0.00 0.50 0.00 0.00 46.19 44.04 1it8 s LEU 228 CO -0.01 -0.73 1.09 0.49 -1.32 0.00 0.00 176.35 175.88 1it8 n PHE 229 N 5.02 0.79 -0.94 5.38 0.99 -1.15 -2.58 117.46 124.97 1it8 n PHE 229 Ca 0.24 0.93 0.00 0.00 -0.00 0.00 0.00 57.45 58.63 1it8 n PHE 229 Cb 0.45 -2.15 0.00 0.00 -1.00 0.00 0.00 39.48 36.79 1it8 n PHE 229 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1it8 n GLY 230 N 1.80 0.50 3.37 1.37 0.00 -1.26 -4.61 105.19 106.36 1it8 n GLY 230 Ca 0.19 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.75 1it8 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1it8 s ALA 231 N -2.29 3.73 -0.20 4.61 0.00 -1.07 -4.84 121.76 121.71 1it8 s ALA 231 Ca 0.00 -2.91 0.15 0.00 0.00 0.00 0.00 51.96 49.20 1it8 s ALA 231 Cb 0.00 -3.65 0.48 0.00 0.00 0.00 0.00 23.12 19.95 1it8 s ALA 231 CO 0.00 -2.47 1.38 0.41 0.00 0.00 0.00 175.76 175.08 1it8 n GLY 232 N 4.72 4.41 3.38 0.00 0.00 -1.06 -3.56 105.19 113.09 1it8 n GLY 232 Ca 0.10 -1.11 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 1it8 n GLY 232 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1it8 s HIS 233 N -2.94 2.98 0.64 1.61 5.04 -1.26 -4.59 115.29 116.77 1it8 s HIS 233 Ca 0.41 -0.68 0.14 0.00 -1.54 0.00 0.00 55.06 53.39 1it8 s HIS 233 Cb 0.35 -2.08 0.62 0.00 0.04 0.00 0.00 32.58 31.51 1it8 s HIS 233 CO 0.05 -0.37 1.30 -1.35 -2.34 0.00 0.00 174.74 172.03 1it8 h PRO 234 N 7.71 0.00 0.00 2.88 0.11 -1.93 -2.39 132.00 138.38 1it8 h PRO 234 Ca -0.37 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.70 1it8 h PRO 234 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1it8 h PRO 234 CO 0.60 0.00 -0.18 0.97 -0.21 0.00 0.00 178.00 179.18 1it8 h ILE 235 N 0.00 1.10 0.00 4.15 2.10 -1.78 -3.04 117.51 120.04 1it8 h ILE 235 Ca 0.14 -0.62 0.00 0.00 1.08 0.00 0.00 64.86 65.46 1it8 h ILE 235 Cb 1.93 1.34 0.00 0.00 -1.09 0.00 0.00 36.82 39.00 1it8 h ILE 235 CO -0.00 0.18 -1.32 1.33 -1.08 0.00 0.00 178.15 177.25 1it8 n VAL 236 N -4.29 0.08 -0.02 2.19 0.24 -0.90 -4.66 118.33 110.97 1it8 n VAL 236 Ca -0.02 -0.26 -0.01 0.00 -2.04 0.00 0.00 64.34 62.01 1it8 n VAL 236 Cb 0.24 0.36 -0.01 0.00 -1.47 0.00 0.00 33.84 32.97 1it8 n VAL 236 CO 0.00 0.00 0.00 -0.26 -2.14 0.00 0.00 176.83 174.43 1it8 h PHE 237 N 0.00 -0.10 -0.37 6.34 0.05 -1.68 0.66 116.94 121.85 1it8 h PHE 237 Ca 0.00 0.01 0.04 0.00 3.82 0.00 0.00 57.97 61.84 1it8 h PHE 237 Cb 0.75 0.05 -0.08 0.00 2.00 0.00 0.00 35.95 38.68 1it8 h PHE 237 CO 0.00 -0.02 -0.52 0.00 -0.18 0.00 0.00 178.31 177.59 1it8 h ALA 238 N -0.93 -0.76 -0.08 2.45 0.00 -1.83 0.30 119.26 118.41 1it8 h ALA 238 Ca 0.01 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1it8 h ALA 238 Cb 0.02 1.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 1it8 h ALA 238 CO -0.05 -1.01 -0.46 1.25 0.00 0.00 0.00 179.25 178.98 1it8 h LEU 239 N -0.38 -1.42 -0.24 0.00 5.85 -1.70 -0.51 115.31 116.90 1it8 h LEU 239 Ca 0.07 0.18 0.04 0.00 0.84 0.00 0.00 57.88 59.01 1it8 h LEU 239 Cb 0.56 0.56 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 1it8 h LEU 239 CO -0.55 -0.46 -0.03 0.00 -0.34 0.00 0.00 178.44 177.06 1it8 h ALA 240 N -0.06 0.18 -0.74 1.25 0.00 0.10 -1.08 119.26 118.91 1it8 h ALA 240 Ca 0.05 0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1it8 h ALA 240 Cb 0.66 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 1it8 h ALA 240 CO -0.38 -0.45 0.48 0.28 0.00 0.00 0.00 179.25 179.19 1it8 h VAL 241 N 0.03 1.03 0.00 0.00 2.07 -0.06 0.58 116.25 119.91 1it8 h VAL 241 Ca 0.11 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.36 1it8 h VAL 241 Cb 0.16 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1it8 h VAL 241 CO -0.22 0.14 0.00 0.00 0.02 0.00 0.00 177.57 177.51 1it8 h ALA 242 N 1.60 1.00 -0.21 1.67 0.00 0.23 0.20 119.26 123.75 1it8 h ALA 242 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1it8 h ALA 242 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1it8 h ALA 242 CO -0.10 0.00 0.00 -1.33 0.00 0.00 0.00 179.25 177.82 1it8 n MET 243 N -3.05 2.21 -0.47 0.00 2.81 0.17 -2.64 117.12 116.14 1it8 n MET 243 Ca -0.02 -1.80 0.00 0.00 -1.81 0.00 0.00 57.70 54.07 1it8 n MET 243 Cb 0.12 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 1it8 n MET 243 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1it8 n GLY 244 N 1.35 0.86 3.75 3.03 0.00 0.70 -4.87 105.19 110.02 1it8 n GLY 244 Ca 0.17 -0.42 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 1it8 n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1it8 s VAL 245 N -2.00 4.18 -0.03 1.61 1.01 -1.04 -4.69 120.40 119.45 1it8 s VAL 245 Ca 0.00 2.01 0.10 0.00 0.00 0.00 0.00 61.98 64.09 1it8 s VAL 245 Cb 0.00 -4.29 -0.15 0.00 0.00 0.00 0.00 36.38 31.94 1it8 s VAL 245 CO 0.00 0.48 0.18 0.47 0.00 0.00 0.00 175.10 176.23 1it8 n ASP 246 N 1.68 2.66 -4.01 3.32 8.00 0.12 -4.42 116.55 123.90 1it8 n ASP 246 Ca -0.02 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.31 1it8 n ASP 246 Cb 0.48 1.30 -0.14 0.00 -0.02 0.00 0.00 41.12 42.74 1it8 n ASP 246 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1it8 s LEU 247 N -3.94 2.06 0.15 0.64 1.43 0.23 -2.43 118.68 116.84 1it8 s LEU 247 Ca -0.04 -0.21 0.05 0.00 -1.03 0.00 0.00 54.13 52.90 1it8 s LEU 247 Cb 0.06 -0.35 -0.04 0.00 0.03 0.00 0.00 46.19 45.88 1it8 s LEU 247 CO 0.42 0.04 -0.11 -0.36 0.23 0.00 0.00 176.35 176.56 1it8 s PHE 248 N -0.39 1.36 -0.06 0.29 0.40 -0.37 -0.50 117.98 118.71 1it8 s PHE 248 Ca 0.01 -0.69 -0.03 0.00 -0.60 0.00 0.00 56.93 55.62 1it8 s PHE 248 Cb -0.04 -0.68 0.03 0.00 0.51 0.00 0.00 43.02 42.84 1it8 s PHE 248 CO -0.00 0.14 0.13 0.16 0.70 0.00 0.00 175.22 176.35 1it8 s ASP 249 N -3.08 -0.10 -0.02 1.36 1.47 -1.23 0.59 116.67 115.65 1it8 s ASP 249 Ca 0.16 0.27 0.08 0.00 1.18 0.00 0.00 52.55 54.24 1it8 s ASP 249 Cb 0.01 0.18 -0.02 0.00 -0.34 0.00 0.00 42.92 42.75 1it8 s ASP 249 CO 0.02 -0.12 -0.26 -0.55 0.68 0.00 0.00 175.17 174.94 1it8 s SER 250 N 0.92 3.03 0.00 2.11 0.15 -1.00 -2.56 113.70 116.34 1it8 s SER 250 Ca -0.07 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.11 1it8 s SER 250 Cb -0.09 -0.37 0.00 0.00 -1.71 0.00 0.00 66.02 63.85 1it8 s SER 250 CO -0.04 0.31 0.00 0.00 1.20 0.00 0.00 173.24 174.71 1it8 n ALA 251 N 2.47 1.80 -0.14 5.45 0.00 -1.26 0.11 120.51 128.95 1it8 n ALA 251 Ca -0.16 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.30 1it8 n ALA 251 Cb 0.51 0.03 0.32 0.00 0.00 0.00 0.00 19.45 20.31 1it8 n ALA 251 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1it8 h SER 252 N 0.00 0.71 -1.02 0.00 0.02 -1.91 -1.06 113.55 110.29 1it8 h SER 252 Ca 0.00 -0.02 0.25 0.00 -0.84 0.00 0.00 61.79 61.18 1it8 h SER 252 Cb 0.13 -0.17 -0.11 0.00 0.14 0.00 0.00 62.40 62.39 1it8 h SER 252 CO 0.00 0.51 0.63 0.10 -1.14 0.00 0.00 176.83 176.93 1it8 h TYR 253 N 0.83 0.84 0.05 3.45 -0.00 -1.84 0.57 116.97 120.88 1it8 h TYR 253 Ca 0.23 0.03 -0.37 0.00 0.00 0.00 0.00 58.73 58.63 1it8 h TYR 253 Cb -0.07 -0.24 -0.04 0.00 0.00 0.00 0.00 36.73 36.37 1it8 h TYR 253 CO -0.00 0.09 -2.11 0.00 -0.00 0.00 0.00 178.16 176.14 1it8 n ALA 254 N -2.40 1.08 -0.22 0.10 0.00 -0.92 -3.53 120.51 114.63 1it8 n ALA 254 Ca 0.25 -0.80 0.12 0.00 0.00 0.00 0.00 53.44 53.01 1it8 n ALA 254 Cb 0.78 -0.37 0.41 0.00 0.00 0.00 0.00 19.45 20.27 1it8 n ALA 254 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1it8 h LEU 255 N -0.27 0.58 -0.26 0.00 3.38 -0.87 -0.88 115.31 116.99 1it8 h LEU 255 Ca -0.50 0.03 -0.19 0.00 0.09 0.00 0.00 57.88 57.30 1it8 h LEU 255 Cb 1.82 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.48 1it8 h LEU 255 CO -0.09 0.32 -0.60 1.88 0.09 0.00 0.00 178.44 180.04 1it8 h TYR 256 N 0.63 1.10 0.00 1.13 0.99 -1.07 -3.07 116.97 116.68 1it8 h TYR 256 Ca 0.40 -0.41 -0.00 0.00 2.00 0.00 0.00 58.73 60.71 1it8 h TYR 256 Cb 0.65 -0.20 -0.00 0.00 1.00 0.00 0.00 36.73 38.18 1it8 h TYR 256 CO -0.00 1.25 -0.02 0.00 -0.00 0.00 0.00 178.16 179.38 1it8 h ALA 257 N 0.65 1.15 0.00 3.88 0.00 -1.22 0.23 119.26 123.94 1it8 h ALA 257 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1it8 h ALA 257 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1it8 h ALA 257 CO 0.13 0.03 -0.06 1.63 0.00 0.00 0.00 179.25 180.98 1it8 n LYS 258 N -3.33 0.16 -0.55 0.00 5.02 -0.91 -3.12 118.16 115.43 1it8 n LYS 258 Ca -0.02 0.12 0.06 0.00 -2.02 0.00 0.00 58.31 56.45 1it8 n LYS 258 Cb 0.14 -1.67 0.20 0.00 -0.02 0.00 0.00 35.03 33.68 1it8 n LYS 258 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1it8 n ASP 259 N -1.94 1.81 -3.48 4.39 8.00 -0.39 -4.96 116.55 119.98 1it8 n ASP 259 Ca 0.06 -3.82 -0.25 0.00 0.71 0.00 0.00 54.79 51.49 1it8 n ASP 259 Cb 0.39 -0.52 -0.01 0.00 -0.02 0.00 0.00 41.12 40.96 1it8 n ASP 259 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1it8 n ASP 260 N -1.15 -3.69 -4.75 -2.24 8.00 -1.08 -4.86 116.55 106.78 1it8 n ASP 260 Ca 0.19 -0.47 -0.36 0.00 0.71 0.00 0.00 54.79 54.86 1it8 n ASP 260 Cb 0.70 -3.05 -0.07 0.00 -0.02 0.00 0.00 41.12 38.68 1it8 n ASP 260 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1it8 s ARG 261 N -6.14 4.12 -0.16 -1.24 0.52 0.66 -1.50 118.95 115.21 1it8 s ARG 261 Ca 0.45 -0.06 -0.05 0.00 -0.52 0.00 0.00 55.73 55.54 1it8 s ARG 261 Cb -0.24 -3.39 -0.03 0.00 0.52 0.00 0.00 34.95 31.81 1it8 s ARG 261 CO 0.55 0.34 0.00 -0.47 0.02 0.00 0.00 175.30 175.75 1it8 s TYR 262 N 0.20 3.12 0.25 -0.53 5.04 0.11 -3.86 117.35 121.69 1it8 s TYR 262 Ca 0.13 -0.13 -0.12 0.00 -2.44 0.00 0.00 57.07 54.51 1it8 s TYR 262 Cb -0.12 -2.00 -0.08 0.00 0.35 0.00 0.00 41.96 40.11 1it8 s TYR 262 CO 0.01 0.06 0.61 -1.64 -1.34 0.00 0.00 175.55 173.25 1it8 s MET 263 N 0.31 3.88 0.01 4.97 -1.94 -1.26 -0.35 119.30 124.92 1it8 s MET 263 Ca -0.01 0.42 -0.04 0.00 -1.71 0.00 0.00 55.69 54.35 1it8 s MET 263 Cb -0.13 -2.60 -0.01 0.00 2.01 0.00 0.00 34.83 34.10 1it8 s MET 263 CO 0.02 0.28 0.06 0.99 -0.01 0.00 0.00 175.02 176.36 1it8 s THR 264 N -1.85 0.10 -0.80 2.05 2.01 0.87 -4.91 115.64 113.12 1it8 s THR 264 Ca 0.49 -0.80 0.08 0.00 0.31 0.00 0.00 61.69 61.76 1it8 s THR 264 Cb -0.11 -0.38 0.07 0.00 0.01 0.00 0.00 72.50 72.10 1it8 s THR 264 CO 0.20 -0.44 1.24 -2.65 -0.69 0.00 0.00 174.62 172.27 1it8 n PRO 265 N 1.48 0.04 -0.12 4.92 -0.02 -1.26 -1.48 135.00 138.56 1it8 n PRO 265 Ca -0.23 0.50 0.04 0.00 -2.02 0.00 0.00 63.50 61.78 1it8 n PRO 265 Cb 0.55 -1.62 0.10 0.00 -0.02 0.00 0.00 33.50 32.51 1it8 n PRO 265 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1it8 n GLU 266 N -1.70 2.78 -0.90 -0.52 4.71 -1.26 -4.20 120.64 119.55 1it8 n GLU 266 Ca 0.00 -1.94 0.00 0.00 -0.01 0.00 0.00 57.16 55.21 1it8 n GLU 266 Cb 0.04 -1.23 0.00 0.00 -1.01 0.00 0.00 31.44 29.24 1it8 n GLU 266 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1it8 n GLY 267 N -0.19 0.50 3.19 0.62 0.00 -0.55 -4.72 105.19 104.03 1it8 n GLY 267 Ca 0.08 -1.58 -0.20 0.00 0.00 0.00 0.00 46.02 44.32 1it8 n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1it8 s THR 268 N -3.25 1.26 0.07 2.61 2.01 -1.26 -0.09 115.64 116.99 1it8 s THR 268 Ca 0.00 -1.23 0.03 0.00 0.31 0.00 0.00 61.69 60.80 1it8 s THR 268 Cb 0.00 -1.16 -0.03 0.00 0.01 0.00 0.00 72.50 71.32 1it8 s THR 268 CO 0.00 -0.08 -0.09 -0.54 -0.69 0.00 0.00 174.62 173.22 1it8 s LYS 269 N -1.51 0.72 -0.03 4.92 1.02 0.53 -4.97 119.74 120.42 1it8 s LYS 269 Ca 0.01 -1.02 -0.21 0.00 0.02 0.00 0.00 55.97 54.77 1it8 s LYS 269 Cb -0.09 -0.39 -0.05 0.00 -0.52 0.00 0.00 37.83 36.79 1it8 s LYS 269 CO 0.02 0.05 0.62 1.03 -0.92 0.00 0.00 175.35 176.16 1it8 s ARG 270 N -2.47 4.37 0.25 1.68 0.52 -1.26 0.08 118.95 122.11 1it8 s ARG 270 Ca 0.00 0.77 -0.04 0.00 -0.52 0.00 0.00 55.73 55.94 1it8 s ARG 270 Cb -0.04 -3.38 0.38 0.00 0.52 0.00 0.00 34.95 32.42 1it8 s ARG 270 CO -0.01 0.25 1.83 1.25 0.02 0.00 0.00 175.30 178.65 1it8 h LEU 271 N 6.07 0.78 0.00 2.53 5.85 -1.60 -0.03 115.31 128.91 1it8 h LEU 271 Ca -0.43 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.32 1it8 h LEU 271 Cb 1.20 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1it8 h LEU 271 CO 0.72 0.47 0.00 -0.90 -0.34 0.00 0.00 178.44 178.39 1it8 n ASP 272 N -4.67 0.00 -0.03 1.25 5.75 -1.26 -1.54 116.55 116.04 1it8 n ASP 272 Ca 0.13 -1.20 0.01 0.00 -0.01 0.00 0.00 54.79 53.73 1it8 n ASP 272 Cb 0.23 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.34 1it8 n ASP 272 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1it8 n GLU 273 N -0.56 1.91 -3.83 0.11 2.13 -0.04 -5.02 120.64 115.35 1it8 n GLU 273 Ca 0.02 -1.35 -0.36 0.00 0.66 0.00 0.00 57.16 56.12 1it8 n GLU 273 Cb 0.01 -0.91 -0.13 0.00 0.27 0.00 0.00 31.44 30.68 1it8 n GLU 273 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1it8 s LEU 274 N -0.92 3.52 -0.02 4.31 1.43 -0.59 -4.90 118.68 121.51 1it8 s LEU 274 Ca 0.04 -0.66 0.04 0.00 -1.03 0.00 0.00 54.13 52.52 1it8 s LEU 274 Cb 0.03 -1.81 -0.25 0.00 0.03 0.00 0.00 46.19 44.19 1it8 s LEU 274 CO 0.00 -0.14 0.75 0.44 0.23 0.00 0.00 176.35 177.63 1it8 h ASP 275 N 8.16 0.18 -4.29 2.29 5.19 -1.95 -3.43 116.42 122.57 1it8 h ASP 275 Ca -0.34 -0.31 -0.34 0.00 -0.62 0.00 0.00 57.03 55.43 1it8 h ASP 275 Cb 1.13 -0.06 -0.18 0.00 0.18 0.00 0.00 39.33 40.41 1it8 h ASP 275 CO 0.59 1.27 -0.74 -0.31 -3.12 0.00 0.00 179.24 176.94 1it8 s TYR 276 N -2.61 1.14 -0.44 4.55 1.51 -1.26 -4.58 117.35 115.66 1it8 s TYR 276 Ca -0.08 -0.65 -0.15 0.00 -1.01 0.00 0.00 57.07 55.18 1it8 s TYR 276 Cb 0.08 -0.61 0.04 0.00 -0.11 0.00 0.00 41.96 41.36 1it8 s TYR 276 CO 0.82 0.03 0.35 -0.06 -1.11 0.00 0.00 175.55 175.59 1it8 s PHE 277 N -2.45 3.23 -0.79 2.71 0.08 -1.26 -4.93 117.98 114.58 1it8 s PHE 277 Ca 0.07 -0.71 -0.07 0.00 0.12 0.00 0.00 56.93 56.33 1it8 s PHE 277 Cb -0.03 -2.86 -0.16 0.00 -0.57 0.00 0.00 43.02 39.41 1it8 s PHE 277 CO 0.01 -0.69 3.03 -0.35 -0.10 0.00 0.00 175.22 177.12 1it8 n PRO 278 N 5.22 2.63 -3.44 0.24 -0.04 -1.26 -4.79 135.00 133.56 1it8 n PRO 278 Ca -0.11 -1.51 -0.11 0.00 -0.04 0.00 0.00 63.50 61.73 1it8 n PRO 278 Cb 0.46 -2.36 -0.02 0.00 -0.04 0.00 0.00 33.50 31.53 1it8 n PRO 278 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1it8 n SER 280 N -0.34 1.87 -4.66 0.00 7.64 -1.26 -4.43 113.62 112.44 1it8 n SER 280 Ca -0.15 -2.98 -0.30 0.00 1.01 0.00 0.00 58.87 56.45 1it8 n SER 280 Cb 0.64 -0.40 0.17 0.00 -1.01 0.00 0.00 64.21 63.61 1it8 n SER 280 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1it8 h PRO 282 N -1.84 0.00 0.00 0.00 0.11 -1.97 0.93 132.00 129.22 1it8 h PRO 282 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1it8 h PRO 282 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1it8 h PRO 282 CO 0.49 0.00 -0.41 0.28 -0.21 0.00 0.00 178.00 178.15 1it8 n VAL 283 N -3.12 1.14 0.24 3.15 0.31 -1.26 -4.11 118.33 114.67 1it8 n VAL 283 Ca 0.08 0.27 0.10 0.00 -0.01 0.00 0.00 64.34 64.79 1it8 n VAL 283 Cb 0.91 -2.22 0.49 0.00 -0.91 0.00 0.00 33.84 32.11 1it8 n VAL 283 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1it8 h SER 285 N 0.00 0.00 0.00 0.00 0.87 0.69 -3.37 113.55 111.74 1it8 h SER 285 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1it8 h SER 285 Cb 0.13 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1it8 h SER 285 CO 0.00 0.67 0.00 2.29 -0.53 0.00 0.00 176.83 179.26 1it8 n LYS 286 N -3.52 1.86 -4.37 2.24 2.85 -0.40 -5.05 118.16 111.77 1it8 n LYS 286 Ca -0.00 -0.27 -0.24 0.00 -1.05 0.00 0.00 58.31 56.75 1it8 n LYS 286 Cb 0.71 -0.74 -0.12 0.00 -0.65 0.00 0.00 35.03 34.24 1it8 n LYS 286 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1it8 s TYR 287 N -0.34 2.04 0.25 5.58 1.51 -0.61 -5.12 117.35 120.66 1it8 s TYR 287 Ca 0.00 -0.41 0.08 0.00 -1.01 0.00 0.00 57.07 55.72 1it8 s TYR 287 Cb 0.00 -1.02 -0.04 0.00 -0.11 0.00 0.00 41.96 40.80 1it8 s TYR 287 CO 0.00 0.40 0.15 0.95 -1.11 0.00 0.00 175.55 175.94 1it8 s THR 288 N -1.82 4.23 0.25 -0.71 -4.23 -1.26 -4.64 115.64 107.45 1it8 s THR 288 Ca 0.17 -1.51 -0.03 0.00 -1.18 0.00 0.00 61.69 59.14 1it8 s THR 288 Cb -0.07 -3.28 0.23 0.00 1.34 0.00 0.00 72.50 70.72 1it8 s THR 288 CO 0.08 -0.35 1.72 -0.65 -0.54 0.00 0.00 174.62 174.88 1it8 h PRO 289 N 1.59 0.42 -0.58 3.99 0.11 -1.83 -0.13 132.00 135.55 1it8 h PRO 289 Ca -0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1it8 h PRO 289 Cb 1.24 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 1it8 h PRO 289 CO 0.61 0.27 0.23 -0.56 -0.21 0.00 0.00 178.00 178.34 1it8 h GLN 290 N 0.43 0.87 -0.92 1.05 -0.00 -1.88 -1.79 115.11 112.88 1it8 h GLN 290 Ca 0.43 -0.16 0.03 0.00 -0.00 0.00 0.00 58.65 58.95 1it8 h GLN 290 Cb 0.68 -0.14 -0.05 0.00 -0.00 0.00 0.00 27.48 27.97 1it8 h GLN 290 CO -0.43 0.76 0.60 0.93 -0.00 0.00 0.00 178.83 180.69 1it8 h GLU 291 N 0.80 1.13 -0.05 0.06 5.08 -1.58 -1.90 114.58 118.13 1it8 h GLU 291 Ca 0.19 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1it8 h GLU 291 Cb 0.21 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1it8 h GLU 291 CO -0.01 0.75 -0.33 1.25 -1.00 0.00 0.00 179.01 179.66 1it8 h LEU 292 N 1.16 0.09 -0.71 1.33 7.12 -0.65 -2.83 115.31 120.82 1it8 h LEU 292 Ca 0.36 -0.03 -0.04 0.00 0.13 0.00 0.00 57.88 58.30 1it8 h LEU 292 Cb -0.01 -0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 40.09 1it8 h LEU 292 CO -0.12 0.42 -0.21 0.03 -0.13 0.00 0.00 178.44 178.44 1it8 h ARG 293 N 0.08 0.00 -0.11 1.25 3.08 -0.53 -3.24 114.38 114.92 1it8 h ARG 293 Ca 0.01 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.84 1it8 h ARG 293 Cb 0.63 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.69 1it8 h ARG 293 CO 0.05 0.21 -0.78 0.93 -1.07 0.00 0.00 179.97 179.30 1it8 h GLU 294 N 0.00 0.72 -6.86 0.04 3.07 -1.23 -3.46 114.58 106.86 1it8 h GLU 294 Ca -0.00 -0.63 -0.56 0.00 -0.50 0.00 0.00 59.36 57.67 1it8 h GLU 294 Cb 0.90 0.14 0.18 0.00 -0.84 0.00 0.00 28.75 29.13 1it8 h GLU 294 CO 0.03 1.24 -0.02 -1.33 -1.40 0.00 0.00 179.01 177.52 1it8 n MET 295 N -3.98 0.51 -1.56 2.33 2.81 -1.20 -4.93 117.12 111.10 1it8 n MET 295 Ca -0.08 0.22 -0.36 0.00 -1.81 0.00 0.00 57.70 55.67 1it8 n MET 295 Cb 0.75 -2.11 0.08 0.00 -0.71 0.00 0.00 33.22 31.22 1it8 n MET 295 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 1it8 n PRO 296 N -1.46 0.85 -0.27 0.03 -0.02 -1.26 -4.67 135.00 128.19 1it8 n PRO 296 Ca 0.12 0.35 0.33 0.00 -2.02 0.00 0.00 63.50 62.29 1it8 n PRO 296 Cb 0.49 -2.43 0.74 0.00 -0.02 0.00 0.00 33.50 32.28 1it8 n PRO 296 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1it8 h LYS 297 N 0.18 0.00 0.01 -0.52 3.11 -1.95 -1.22 116.57 116.18 1it8 h LYS 297 Ca -0.49 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.35 1it8 h LYS 297 Cb 1.34 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.57 1it8 h LYS 297 CO 0.51 0.00 -0.01 1.49 -2.81 0.00 0.00 179.45 178.63 1it8 h GLU 298 N 0.00 -0.02 -0.36 1.90 4.81 -2.00 -2.53 114.58 116.38 1it8 h GLU 298 Ca 0.52 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.75 1it8 h GLU 298 Cb 2.15 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.51 1it8 h GLU 298 CO -0.01 0.77 0.24 1.49 -0.73 0.00 0.00 179.01 180.77 1it8 h GLU 299 N -0.88 0.48 -0.53 1.92 4.81 -1.74 -1.42 114.58 117.22 1it8 h GLU 299 Ca -0.00 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 1it8 h GLU 299 Cb 0.79 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.04 1it8 h GLU 299 CO 0.00 0.32 0.17 -0.09 -0.73 0.00 0.00 179.01 178.68 1it8 h ARG 300 N 0.49 0.82 -0.21 1.92 2.43 -1.30 -1.83 114.38 116.70 1it8 h ARG 300 Ca 0.13 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1it8 h ARG 300 Cb -0.06 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.37 1it8 h ARG 300 CO -0.03 0.75 0.04 1.15 -1.51 0.00 0.00 179.97 180.37 1it8 h THR 301 N 0.72 1.22 0.10 0.20 2.02 -0.84 -2.29 112.91 114.04 1it8 h THR 301 Ca 0.17 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.65 1it8 h THR 301 Cb 0.27 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 1it8 h THR 301 CO -0.01 0.22 -0.25 0.03 0.37 0.00 0.00 175.52 175.89 1it8 h ARG 302 N 0.15 -0.37 -0.97 6.66 2.47 -1.17 0.31 114.38 121.46 1it8 h ARG 302 Ca 0.06 0.03 0.20 0.00 -1.26 0.00 0.00 59.98 59.01 1it8 h ARG 302 Cb 0.29 0.08 -0.09 0.00 -1.65 0.00 0.00 29.97 28.61 1it8 h ARG 302 CO 0.00 -0.25 0.62 -0.07 0.56 0.00 0.00 179.97 180.83 1it8 h LEU 303 N -0.38 0.60 -0.15 3.04 3.38 -1.37 0.78 115.31 121.22 1it8 h LEU 303 Ca -0.01 0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1it8 h LEU 303 Cb 0.37 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1it8 h LEU 303 CO -0.11 0.22 -0.16 -0.07 0.09 0.00 0.00 178.44 178.41 1it8 h LEU 304 N 0.59 0.40 -0.42 1.67 3.38 -1.10 -1.55 115.31 118.28 1it8 h LEU 304 Ca 0.54 -0.49 0.06 0.00 0.09 0.00 0.00 57.88 58.07 1it8 h LEU 304 Cb 1.06 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 1it8 h LEU 304 CO -0.29 0.81 0.12 0.00 0.09 0.00 0.00 178.44 179.17 1it8 h ALA 305 N 0.60 0.48 -0.52 1.53 0.00 0.51 0.18 119.26 122.05 1it8 h ALA 305 Ca 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1it8 h ALA 305 Cb 0.70 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1it8 h ALA 305 CO 0.04 -0.28 0.30 -0.07 0.00 0.00 0.00 179.25 179.24 1it8 h LEU 306 N 0.27 0.63 0.13 0.00 3.38 -0.85 -0.93 115.31 117.93 1it8 h LEU 306 Ca 0.20 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1it8 h LEU 306 Cb 0.22 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1it8 h LEU 306 CO -0.23 0.50 -0.06 -0.74 0.09 0.00 0.00 178.44 177.99 1it8 h HIS 307 N 0.72 -0.16 -0.98 1.13 -0.00 -0.08 -1.84 115.15 113.94 1it8 h HIS 307 Ca 0.19 -0.00 0.14 0.00 -0.00 0.00 0.00 60.37 60.70 1it8 h HIS 307 Cb -0.00 0.05 -0.09 0.00 -0.00 0.00 0.00 27.41 27.37 1it8 h HIS 307 CO 0.00 0.13 0.60 -0.91 -0.00 0.00 0.00 177.93 177.76 1it8 h ASN 308 N -0.44 0.84 -0.42 3.26 2.35 -0.12 0.44 115.58 121.48 1it8 h ASN 308 Ca -0.02 0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.70 1it8 h ASN 308 Cb 0.36 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 1it8 h ASN 308 CO 0.03 0.39 -0.12 -0.07 -1.65 0.00 0.00 177.43 176.01 1it8 h LEU 309 N 0.88 0.89 -1.07 1.61 3.38 -1.06 0.06 115.31 120.00 1it8 h LEU 309 Ca 0.52 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 58.12 1it8 h LEU 309 Cb 0.63 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1it8 h LEU 309 CO -0.31 1.02 -0.24 -0.50 0.09 0.00 0.00 178.44 178.50 1it8 h TRP 310 N 0.79 0.41 -0.22 1.13 4.06 -0.13 0.11 115.95 122.10 1it8 h TRP 310 Ca 0.13 -0.08 -0.07 0.00 2.06 0.00 0.00 58.89 60.93 1it8 h TRP 310 Cb 0.65 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.70 1it8 h TRP 310 CO 0.04 0.58 -0.12 0.28 -3.56 0.00 0.00 178.44 175.66 1it8 h VAL 311 N 0.33 1.31 0.64 1.49 2.07 -0.58 -0.89 116.25 120.62 1it8 h VAL 311 Ca 0.05 -1.20 -0.03 0.00 0.82 0.00 0.00 66.70 66.34 1it8 h VAL 311 Cb 0.60 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 1it8 h VAL 311 CO 0.04 0.37 -0.34 0.40 0.02 0.00 0.00 177.57 178.06 1it8 h ILE 312 N 0.17 0.31 -0.95 4.57 2.04 -0.65 0.16 117.51 123.16 1it8 h ILE 312 Ca 0.05 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.06 1it8 h ILE 312 Cb 0.62 0.31 -0.09 0.00 -0.74 0.00 0.00 36.82 36.91 1it8 h ILE 312 CO 0.03 0.00 0.56 0.50 0.00 0.00 0.00 178.15 179.24 1it8 h LYS 313 N -0.90 0.77 -0.31 2.37 3.64 -0.80 -2.28 116.57 119.07 1it8 h LYS 313 Ca -0.08 -0.05 -0.18 0.00 -1.27 0.00 0.00 60.65 59.07 1it8 h LYS 313 Cb 0.71 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1it8 h LYS 313 CO 0.12 0.51 -0.51 1.49 -2.27 0.00 0.00 179.45 178.78 1it8 h GLU 314 N 0.79 0.89 -0.88 1.90 4.81 -0.85 -2.29 114.58 118.95 1it8 h GLU 314 Ca 0.51 -0.55 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1it8 h GLU 314 Cb 0.67 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.07 1it8 h GLU 314 CO -0.33 1.19 0.49 0.93 -0.73 0.00 0.00 179.01 180.55 1it8 h GLU 315 N 0.68 1.22 0.13 1.92 4.39 -0.44 -1.49 114.58 120.99 1it8 h GLU 315 Ca 0.02 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 1it8 h GLU 315 Cb 1.12 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 29.53 1it8 h GLU 315 CO 0.12 0.88 -0.06 0.82 -1.16 0.00 0.00 179.01 179.61 1it8 h ILE 316 N 1.22 0.88 -0.96 3.13 1.08 -1.30 0.69 117.51 122.26 1it8 h ILE 316 Ca 0.31 -0.04 0.08 0.00 -0.39 0.00 0.00 64.86 64.82 1it8 h ILE 316 Cb 0.02 0.91 -0.07 0.00 -3.07 0.00 0.00 36.82 34.60 1it8 h ILE 316 CO -0.05 0.01 0.62 0.11 -0.69 0.00 0.00 178.15 178.15 1it8 h LYS 317 N -0.20 1.02 -0.37 2.37 1.57 -1.14 0.50 116.57 120.33 1it8 h LYS 317 Ca -0.02 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 1it8 h LYS 317 Cb 0.15 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1it8 h LYS 317 CO 0.03 0.68 0.11 -0.09 -0.57 0.00 0.00 179.45 179.61 1it8 h ARG 318 N 1.05 0.58 -0.43 3.15 2.43 -0.64 0.14 114.38 120.67 1it8 h ARG 318 Ca 0.43 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 59.45 1it8 h ARG 318 Cb 0.28 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 1it8 h ARG 318 CO -0.18 0.60 0.18 0.28 -1.51 0.00 0.00 179.97 179.34 1it8 h VAL 319 N 0.45 1.20 -0.55 0.20 2.07 -0.19 0.27 116.25 119.70 1it8 h VAL 319 Ca 0.12 -0.59 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 1it8 h VAL 319 Cb 0.27 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1it8 h VAL 319 CO -0.00 0.22 0.22 0.11 0.02 0.00 0.00 177.57 178.14 1it8 h LYS 320 N 0.55 0.81 0.00 1.57 1.57 -0.72 0.75 116.57 121.10 1it8 h LYS 320 Ca 0.14 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1it8 h LYS 320 Cb 0.18 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1it8 h LYS 320 CO -0.01 0.71 -0.20 0.37 -0.57 0.00 0.00 179.45 179.74 1it8 h GLN 321 N 0.74 0.00 -0.21 3.15 5.75 -0.48 -0.72 115.11 123.34 1it8 h GLN 321 Ca 0.18 0.00 -0.13 0.00 -0.15 0.00 0.00 58.65 58.56 1it8 h GLN 321 Cb 0.19 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.74 1it8 h GLN 321 CO -0.02 0.20 -0.36 0.00 -2.65 0.00 0.00 178.83 176.00 1it8 h ALA 322 N 1.80 0.33 0.06 3.38 0.00 0.08 -2.84 119.26 122.06 1it8 h ALA 322 Ca -0.00 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1it8 h ALA 322 Cb 0.37 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1it8 h ALA 322 CO 0.03 0.39 -0.03 0.82 0.00 0.00 0.00 179.25 180.46 1it8 h ILE 323 N 0.30 0.98 -1.04 0.00 2.04 -0.26 -0.09 117.51 119.43 1it8 h ILE 323 Ca 0.01 -0.11 0.26 0.00 1.00 0.00 0.00 64.86 66.03 1it8 h ILE 323 Cb 0.95 1.05 -0.10 0.00 -0.74 0.00 0.00 36.82 37.98 1it8 h ILE 323 CO 0.08 0.03 0.66 0.50 0.00 0.00 0.00 178.15 179.42 1it8 h LYS 324 N -0.13 0.40 -0.54 2.37 1.63 -1.12 -0.10 116.57 119.07 1it8 h LYS 324 Ca -0.01 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1it8 h LYS 324 Cb 0.11 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 1it8 h LYS 324 CO 0.01 0.26 0.00 -0.85 -3.45 0.00 0.00 179.45 175.43 1it8 n GLU 325 N -4.65 2.60 -2.25 1.90 0.28 -1.08 -4.96 120.64 112.48 1it8 n GLU 325 Ca 0.26 -2.43 -0.13 0.00 -0.16 0.00 0.00 57.16 54.69 1it8 n GLU 325 Cb 0.87 -1.52 -0.01 0.00 1.43 0.00 0.00 31.44 32.21 1it8 n GLU 325 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1it8 n GLY 326 N 1.48 -0.18 0.72 -1.84 0.00 -0.05 -3.83 105.19 101.50 1it8 n GLY 326 Ca 0.21 -0.32 0.08 0.00 0.00 0.00 0.00 46.02 45.99 1it8 n GLY 326 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1it8 n GLU 327 N -2.29 2.66 0.07 1.61 -0.58 -0.13 -4.73 120.64 117.25 1it8 n GLU 327 Ca -0.16 -2.71 0.09 0.00 -0.42 0.00 0.00 57.16 53.95 1it8 n GLU 327 Cb 0.62 -1.73 0.54 0.00 -0.57 0.00 0.00 31.44 30.30 1it8 n GLU 327 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1it8 h LEU 328 N 1.50 0.24 -0.42 -4.62 7.12 -1.85 -1.79 115.31 115.48 1it8 h LEU 328 Ca 0.00 -0.00 -0.18 0.00 0.13 0.00 0.00 57.88 57.83 1it8 h LEU 328 Cb 1.30 -0.05 -0.00 0.00 -0.53 0.00 0.00 40.66 41.37 1it8 h LEU 328 CO 0.17 0.16 -0.68 -0.50 -0.13 0.00 0.00 178.44 177.46 1it8 h TRP 329 N 0.28 0.64 0.03 1.25 4.06 -1.92 -2.27 115.95 118.01 1it8 h TRP 329 Ca 0.13 -0.26 0.01 0.00 2.06 0.00 0.00 58.89 60.83 1it8 h TRP 329 Cb 0.19 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 28.23 1it8 h TRP 329 CO -0.00 1.02 -0.11 -0.09 -3.56 0.00 0.00 178.44 175.70 1it8 h ARG 330 N 0.34 -0.19 -0.51 0.49 2.43 -1.70 0.15 114.38 115.38 1it8 h ARG 330 Ca -0.02 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.24 1it8 h ARG 330 Cb 1.25 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.78 1it8 h ARG 330 CO 0.12 -0.13 0.15 1.25 -1.51 0.00 0.00 179.97 179.85 1it8 h LEU 331 N -0.20 0.10 -0.54 3.80 5.85 -1.38 0.12 115.31 123.07 1it8 h LEU 331 Ca 0.03 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.86 1it8 h LEU 331 Cb 0.23 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 1it8 h LEU 331 CO -0.09 0.08 0.32 0.58 -0.34 0.00 0.00 178.44 178.99 1it8 h VAL 332 N 0.30 1.04 -0.53 1.05 2.07 -0.86 -0.09 116.25 119.22 1it8 h VAL 332 Ca 0.25 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.58 1it8 h VAL 332 Cb 0.31 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 1it8 h VAL 332 CO -0.29 0.11 0.33 -0.78 0.02 0.00 0.00 177.57 176.97 1it8 h ASP 333 N 0.62 0.56 -0.17 0.57 1.82 0.78 0.12 116.42 120.73 1it8 h ASP 333 Ca 0.22 -0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.85 1it8 h ASP 333 Cb 0.04 -0.13 -0.01 0.00 0.68 0.00 0.00 39.33 39.92 1it8 h ASP 333 CO -0.11 0.40 0.10 -0.08 -1.61 0.00 0.00 179.24 177.94 1it8 h GLU 334 N 0.67 0.23 0.00 0.28 4.81 -0.28 -2.48 114.58 117.82 1it8 h GLU 334 Ca 0.21 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1it8 h GLU 334 Cb -0.02 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.31 1it8 h GLU 334 CO -0.07 0.21 0.00 0.00 -0.73 0.00 0.00 179.01 178.42 1it8 h ARG 335 N 0.18 0.00 0.00 1.92 2.47 -0.69 -2.72 114.38 115.53 1it8 h ARG 335 Ca 0.06 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.78 1it8 h ARG 335 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.37 1it8 h ARG 335 CO -0.01 0.00 0.00 0.00 0.56 0.00 0.00 179.97 180.52 1it8 h ALA 336 N 2.14 1.00 -0.30 0.04 0.00 -0.28 -2.31 119.26 119.55 1it8 h ALA 336 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1it8 h ALA 336 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1it8 h ALA 336 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.79 1it8 n ARG 337 N -2.98 2.49 0.05 0.00 5.12 -1.03 -2.82 116.66 117.50 1it8 n ARG 337 Ca -0.00 -1.41 -0.06 0.00 -1.93 0.00 0.00 57.85 54.45 1it8 n ARG 337 Cb 0.24 -1.66 -0.11 0.00 -1.16 0.00 0.00 32.46 29.77 1it8 n ARG 337 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 1it8 h SER 338 N 1.94 0.00 -4.97 0.55 0.02 -1.62 -3.48 113.55 106.00 1it8 h SER 338 Ca 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 1it8 h SER 338 Cb 0.95 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 63.30 1it8 h SER 338 CO 0.15 0.95 0.20 -2.28 -1.14 0.00 0.00 176.83 174.71 1it8 s HIS 339 N -2.71 -0.66 0.24 3.45 5.65 -1.26 -4.89 115.29 115.11 1it8 s HIS 339 Ca 0.00 1.13 -0.05 0.00 0.25 0.00 0.00 55.06 56.39 1it8 s HIS 339 Cb 0.09 0.41 0.39 0.00 -1.18 0.00 0.00 32.58 32.30 1it8 s HIS 339 CO 0.81 -0.60 1.77 -1.35 -0.65 0.00 0.00 174.74 174.73 1it8 h PRO 340 N 3.02 0.60 0.00 2.88 0.11 -1.92 -0.40 132.00 136.28 1it8 h PRO 340 Ca -0.27 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.72 1it8 h PRO 340 Cb 1.14 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1it8 h PRO 340 CO 0.38 0.40 -0.41 0.87 -0.21 0.00 0.00 178.00 179.03 1it8 h LYS 341 N 0.62 0.00 0.02 1.05 6.56 -1.94 -0.96 116.57 121.92 1it8 h LYS 341 Ca 0.38 0.00 -0.21 0.00 -1.06 0.00 0.00 60.65 59.77 1it8 h LYS 341 Cb 0.45 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.09 1it8 h LYS 341 CO -0.30 0.41 -0.96 1.25 -2.06 0.00 0.00 179.45 177.80 1it8 h LEU 342 N 0.00 0.19 -0.78 2.94 6.46 -1.61 -2.23 115.31 120.28 1it8 h LEU 342 Ca -0.00 -0.17 -0.11 0.00 -0.12 0.00 0.00 57.88 57.48 1it8 h LEU 342 Cb 0.88 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.73 1it8 h LEU 342 CO 0.05 1.03 -0.21 0.22 -0.62 0.00 0.00 178.44 178.92 1it8 h TYR 343 N 0.06 0.78 -0.07 1.25 3.20 -0.73 -2.10 116.97 119.37 1it8 h TYR 343 Ca -0.05 -0.17 -0.01 0.00 3.14 0.00 0.00 58.73 61.65 1it8 h TYR 343 Cb 1.63 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 39.71 1it8 h TYR 343 CO 0.02 0.85 0.02 1.03 -1.64 0.00 0.00 178.16 178.44 1it8 h SER 344 N 0.61 0.10 -0.21 -2.11 0.87 -1.02 -2.46 113.55 109.32 1it8 h SER 344 Ca 0.09 -0.20 0.05 0.00 -1.23 0.00 0.00 61.79 60.49 1it8 h SER 344 Cb 0.69 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.58 1it8 h SER 344 CO 0.05 0.28 -0.07 0.00 -0.53 0.00 0.00 176.83 176.56 1it8 h ALA 345 N 0.82 0.12 -0.23 6.23 0.00 -1.27 -1.55 119.26 123.37 1it8 h ALA 345 Ca 0.02 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.07 1it8 h ALA 345 Cb 0.21 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.12 1it8 h ALA 345 CO -0.00 -0.49 -0.40 -0.92 0.00 0.00 0.00 179.25 177.44 1it8 h TYR 346 N -0.03 -1.13 -0.51 0.00 3.20 -1.29 0.76 116.97 117.97 1it8 h TYR 346 Ca 0.11 0.05 0.10 0.00 3.14 0.00 0.00 58.73 62.13 1it8 h TYR 346 Cb 0.19 0.53 -0.08 0.00 1.54 0.00 0.00 36.73 38.91 1it8 h TYR 346 CO -0.24 -0.44 0.02 0.87 -1.64 0.00 0.00 178.16 176.72 1it8 h LYS 347 N -0.41 0.13 -0.90 1.82 1.57 -1.12 -0.31 116.57 117.36 1it8 h LYS 347 Ca 0.11 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1it8 h LYS 347 Cb 0.59 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.83 1it8 h LYS 347 CO -0.45 0.09 0.49 -0.09 -0.57 0.00 0.00 179.45 178.91 1it8 h ARG 348 N 0.13 1.26 -0.18 3.15 9.65 -0.13 -2.02 114.38 126.23 1it8 h ARG 348 Ca 0.26 -0.15 -0.01 0.00 -1.10 0.00 0.00 59.98 58.98 1it8 h ARG 348 Cb 0.38 -0.25 -0.01 0.00 -1.39 0.00 0.00 29.97 28.71 1it8 h ARG 348 CO -0.41 0.92 0.07 1.25 2.80 0.00 0.00 179.97 184.60 1it8 h LEU 349 N 1.26 0.22 -0.24 3.80 5.85 0.21 -0.92 115.31 125.50 1it8 h LEU 349 Ca 0.32 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.02 1it8 h LEU 349 Cb 0.03 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.00 1it8 h LEU 349 CO -0.05 0.20 0.00 0.18 -0.34 0.00 0.00 178.44 178.43 1it8 n LEU 350 N -4.46 0.79 0.23 2.25 4.77 -0.59 -2.95 117.00 117.04 1it8 n LEU 350 Ca -0.00 0.61 0.12 0.00 -0.03 0.00 0.00 56.01 56.70 1it8 n LEU 350 Cb 0.11 -0.40 0.48 0.00 -2.33 0.00 0.00 43.42 41.29 1it8 n LEU 350 CO 0.35 -0.31 0.84 -0.33 -1.33 0.00 0.00 177.39 176.61 1it8 h GLU 351 N 0.00 0.00 -2.31 3.23 5.08 -0.99 -3.29 114.58 116.30 1it8 h GLU 351 Ca 0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 1it8 h GLU 351 Cb 0.62 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.75 1it8 h GLU 351 CO 0.00 0.16 1.30 0.72 -1.00 0.00 0.00 179.01 180.19 1it8 n HIS 352 N -3.29 1.75 -0.02 4.33 8.25 -1.15 -4.71 115.22 120.37 1it8 n HIS 352 Ca 0.01 -2.28 -0.09 0.00 -0.26 0.00 0.00 57.72 55.10 1it8 n HIS 352 Cb 0.42 -1.69 -0.02 0.00 1.12 0.00 0.00 29.99 29.82 1it8 n HIS 352 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1it8 h TYR 353 N 3.74 -0.36 -0.59 4.41 3.20 -1.83 -1.99 116.97 123.55 1it8 h TYR 353 Ca 0.51 0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.53 1it8 h TYR 353 Cb 0.67 0.19 -0.11 0.00 1.54 0.00 0.00 36.73 39.01 1it8 h TYR 353 CO 1.61 -0.21 -0.18 1.15 -1.64 0.00 0.00 178.16 178.89 1it8 h THR 354 N -0.15 0.36 0.63 1.81 2.02 -1.94 0.60 112.91 116.23 1it8 h THR 354 Ca 0.11 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 1it8 h THR 354 Cb 0.32 0.36 0.01 0.00 -1.74 0.00 0.00 68.15 67.09 1it8 h THR 354 CO -0.27 0.00 -0.30 0.15 0.37 0.00 0.00 175.52 175.47 1it8 h PHE 355 N -0.03 -0.78 -0.63 3.16 3.57 -1.91 -3.09 116.94 117.23 1it8 h PHE 355 Ca 0.28 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.86 1it8 h PHE 355 Cb 0.46 0.26 -0.08 0.00 2.79 0.00 0.00 35.95 39.38 1it8 h PHE 355 CO -0.51 -0.44 0.23 -0.07 -2.23 0.00 0.00 178.31 175.29 1it8 h LEU 356 N -1.03 0.22 -1.42 0.59 3.38 -0.78 -2.24 115.31 114.03 1it8 h LEU 356 Ca -0.09 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1it8 h LEU 356 Cb 0.69 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1it8 h LEU 356 CO 0.14 0.12 0.33 -0.08 0.09 0.00 0.00 178.44 179.04 1it8 h GLU 357 N 0.40 0.72 0.00 1.13 4.22 0.12 -2.21 114.58 118.97 1it8 h GLU 357 Ca 0.32 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.71 1it8 h GLU 357 Cb 0.41 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1it8 h GLU 357 CO -0.33 0.50 0.25 1.49 -2.18 0.00 0.00 179.01 178.75 1it8 h GLU 358 N 0.73 0.00 0.00 1.92 4.81 -1.31 -2.54 114.58 118.19 1it8 h GLU 358 Ca 0.19 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1it8 h GLU 358 Cb -0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1it8 h GLU 358 CO -0.04 0.00 -0.33 1.19 -0.73 0.00 0.00 179.01 179.11 1it8 n PHE 359 N -2.64 0.00 -1.79 0.92 3.01 -0.87 -4.85 117.46 111.23 1it8 n PHE 359 Ca -0.02 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.02 1it8 n PHE 359 Cb 0.29 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.74 1it8 n PHE 359 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1it8 s GLU 360 N -1.19 4.16 1.10 -1.08 2.56 -0.96 -4.72 118.70 118.57 1it8 s GLU 360 Ca 0.00 2.48 -0.16 0.00 0.00 0.00 0.00 54.97 57.30 1it8 s GLU 360 Cb 0.00 -3.83 0.15 0.00 2.00 0.00 0.00 34.13 32.45 1it8 s GLU 360 CO 0.00 -0.85 0.42 -2.30 -0.56 0.00 0.00 175.26 171.97 1it8 n PRO 361 N 6.44 -1.58 0.01 4.30 -0.02 -1.26 -4.64 135.00 138.25 1it8 n PRO 361 Ca 0.18 -0.43 0.11 0.00 -2.02 0.00 0.00 63.50 61.33 1it8 n PRO 361 Cb 0.40 -1.90 -0.05 0.00 -0.02 0.00 0.00 33.50 31.94 1it8 n PRO 361 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1it8 n ILE 362 N -4.45 0.09 -3.72 4.25 3.06 -1.06 -4.90 119.36 112.63 1it8 n ILE 362 Ca 0.03 -0.23 -0.12 0.00 -2.50 0.00 0.00 62.75 59.93 1it8 n ILE 362 Cb 0.58 0.38 -0.13 0.00 0.54 0.00 0.00 39.64 41.01 1it8 n ILE 362 CO 0.00 0.00 0.00 0.28 -2.50 0.00 0.00 176.55 174.33 1it8 s THR 363 N -3.20 -0.06 0.22 9.51 -1.32 -1.26 -4.88 115.64 114.64 1it8 s THR 363 Ca 0.03 0.15 0.11 0.00 -1.21 0.00 0.00 61.69 60.77 1it8 s THR 363 Cb 0.15 -0.41 -0.05 0.00 -1.51 0.00 0.00 72.50 70.68 1it8 s THR 363 CO 0.84 0.06 -0.20 -0.54 -2.21 0.00 0.00 174.62 172.57 1it8 s LYS 364 N 1.35 1.65 0.15 7.08 1.02 -1.26 -5.02 119.74 124.72 1it8 s LYS 364 Ca -0.09 -1.57 -0.09 0.00 0.02 0.00 0.00 55.97 54.24 1it8 s LYS 364 Cb -0.10 -1.86 -0.01 0.00 -0.52 0.00 0.00 37.83 35.34 1it8 s LYS 364 CO -0.09 0.38 1.48 1.57 -0.92 0.00 0.00 175.35 177.77 1it8 h LYS 365 N 2.83 0.87 -7.48 1.68 2.10 -1.93 -3.45 116.57 111.18 1it8 h LYS 365 Ca -0.44 -0.47 -0.42 0.00 -2.00 0.00 0.00 60.65 57.31 1it8 h LYS 365 Cb 1.23 0.02 0.19 0.00 -0.90 0.00 0.00 32.23 32.77 1it8 h LYS 365 CO 0.53 1.12 0.19 -1.54 -2.00 0.00 0.00 179.45 177.74 1it8 s SER 366 N -6.86 1.34 0.11 7.07 1.04 -1.25 -5.08 113.70 110.07 1it8 s SER 366 Ca -0.10 0.56 0.06 0.00 0.48 0.00 0.00 55.95 56.95 1it8 s SER 366 Cb 0.11 -0.76 -0.04 0.00 0.10 0.00 0.00 66.02 65.43 1it8 s SER 366 CO 0.87 -3.86 -0.03 0.00 0.98 0.00 0.00 173.24 171.21 1it8 s ALA 367 N -3.18 3.17 -0.20 5.32 0.00 -1.26 -5.05 121.76 120.55 1it8 s ALA 367 Ca 0.71 -1.21 -0.29 0.00 0.00 0.00 0.00 51.96 51.17 1it8 s ALA 367 Cb -0.08 -1.05 -0.01 0.00 0.00 0.00 0.00 23.12 21.97 1it8 s ALA 367 CO 0.55 0.64 1.35 -1.17 0.00 0.00 0.00 175.76 177.14 1it8 s LEU 368 N -2.41 4.07 -0.20 0.00 0.20 -0.38 -4.96 118.68 115.00 1it8 s LEU 368 Ca 0.25 1.59 -0.10 0.00 0.69 0.00 0.00 54.13 56.56 1it8 s LEU 368 Cb -0.11 -3.54 -0.05 0.00 -0.43 0.00 0.00 46.19 42.06 1it8 s LEU 368 CO 0.17 -0.93 0.15 -0.36 -0.29 0.00 0.00 176.35 175.08 1it8 s PHE 369 N 4.02 3.41 -0.62 5.38 2.99 -1.26 -1.64 117.98 130.26 1it8 s PHE 369 Ca 0.59 0.35 -0.17 0.00 0.00 0.00 0.00 56.93 57.69 1it8 s PHE 369 Cb -0.22 -2.18 0.13 0.00 0.00 0.00 0.00 43.02 40.74 1it8 s PHE 369 CO 0.20 0.27 0.66 0.21 -0.00 0.00 0.00 175.22 176.57 1it8 s LYS 370 N 0.41 3.11 0.00 0.44 2.36 -0.36 -4.81 119.74 120.89 1it8 s LYS 370 Ca 0.09 -1.59 0.00 0.00 -2.55 0.00 0.00 55.97 51.92 1it8 s LYS 370 Cb -0.11 -4.32 0.00 0.00 -1.05 0.00 0.00 37.83 32.34 1it8 s LYS 370 CO -0.01 -1.46 0.74 0.44 1.55 0.00 0.00 175.35 176.61 1it8 n ILE 371 N 5.29 0.50 -3.70 5.43 -5.35 -1.26 -4.63 119.36 115.64 1it8 n ILE 371 Ca -0.07 -0.73 0.01 0.00 -0.27 0.00 0.00 62.75 61.70 1it8 n ILE 371 Cb 0.42 0.77 -0.00 0.00 -1.74 0.00 0.00 39.64 39.09 1it8 n ILE 371 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1it8 s SER 372 N -0.50 -0.05 0.14 7.28 1.04 -1.26 -4.98 113.70 115.36 1it8 s SER 372 Ca 0.00 -0.19 -0.14 0.00 0.48 0.00 0.00 55.95 56.10 1it8 s SER 372 Cb 0.00 0.20 0.01 0.00 0.10 0.00 0.00 66.02 66.33 1it8 s SER 372 CO 0.00 -0.37 1.65 0.78 0.98 0.00 0.00 173.24 176.28 1it8 h ASN 373 N 2.00 0.69 -0.50 7.02 4.21 -2.02 -2.98 115.58 123.99 1it8 h ASN 373 Ca -0.29 -0.22 0.08 0.00 1.21 0.00 0.00 56.30 57.08 1it8 h ASN 373 Cb 1.20 -0.18 -0.03 0.00 -1.12 0.00 0.00 38.32 38.19 1it8 h ASN 373 CO 0.29 0.73 0.34 -0.33 -1.29 0.00 0.00 177.43 177.17 1it8 h GLU 374 N 0.61 0.33 0.00 0.81 3.07 -2.01 -2.43 114.58 114.97 1it8 h GLU 374 Ca 0.15 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 1it8 h GLU 374 Cb 0.30 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1it8 h GLU 374 CO -0.00 0.22 0.00 0.66 -1.40 0.00 0.00 179.01 178.49 1it8 h SER 375 N 0.34 0.00 0.70 1.42 4.64 -1.89 -1.64 113.55 117.11 1it8 h SER 375 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1it8 h SER 375 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1it8 h SER 375 CO -0.05 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.09 1it8 n LEU 376 N -2.66 0.00 -0.91 5.97 4.77 -0.91 -2.41 117.00 120.85 1it8 n LEU 376 Ca 0.01 0.50 0.07 0.00 -0.03 0.00 0.00 56.01 56.56 1it8 n LEU 376 Cb 0.24 -0.50 0.23 0.00 -2.33 0.00 0.00 43.42 41.06 1it8 n LEU 376 CO 0.22 -0.15 0.69 0.54 -1.33 0.00 0.00 177.39 177.37 1it8 n ARG 377 N -1.50 3.03 -1.97 3.23 1.74 -0.62 -4.52 116.66 116.06 1it8 n ARG 377 Ca 0.05 -2.44 -0.35 0.00 -0.77 0.00 0.00 57.85 54.34 1it8 n ARG 377 Cb 0.24 -1.54 0.04 0.00 -1.02 0.00 0.00 32.46 30.17 1it8 n ARG 377 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1it8 s TRP 378 N -1.62 2.43 0.09 -1.55 0.51 -1.01 -4.75 118.94 113.03 1it8 s TRP 378 Ca 0.34 1.53 -0.24 0.00 -2.12 0.00 0.00 56.10 55.62 1it8 s TRP 378 Cb 0.22 -3.41 -0.09 0.00 -0.81 0.00 0.00 33.47 29.38 1it8 s TRP 378 CO 0.16 -2.08 1.39 -1.35 -0.51 0.00 0.00 176.95 174.56 1it8 h PRO 379 N 0.73 -0.37 -1.39 4.98 0.11 -1.93 -1.07 132.00 133.06 1it8 h PRO 379 Ca -0.50 0.03 0.42 0.00 0.11 0.00 0.00 66.00 66.05 1it8 h PRO 379 Cb 1.29 0.08 -0.09 0.00 0.11 0.00 0.00 31.00 32.39 1it8 h PRO 379 CO 0.55 -0.25 0.95 0.28 -0.21 0.00 0.00 178.00 179.32 1it8 h VAL 380 N -0.38 0.23 0.16 3.15 2.07 -1.92 -0.06 116.25 119.50 1it8 h VAL 380 Ca 0.03 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1it8 h VAL 380 Cb 0.47 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1it8 h VAL 380 CO -0.34 0.02 -0.08 0.58 0.02 0.00 0.00 177.57 177.77 1it8 h VAL 381 N 0.10 0.29 -0.70 2.57 2.07 -1.57 -2.72 116.25 116.28 1it8 h VAL 381 Ca 0.75 -0.99 0.15 0.00 0.82 0.00 0.00 66.70 67.42 1it8 h VAL 381 Cb 2.59 0.51 -0.13 0.00 -1.52 0.00 0.00 31.29 32.74 1it8 h VAL 381 CO -0.21 0.09 -0.12 0.03 0.02 0.00 0.00 177.57 177.37 1it8 h ARG 382 N -1.03 0.03 0.59 1.57 2.47 -0.22 -0.18 114.38 117.61 1it8 h ARG 382 Ca -0.02 -0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.67 1it8 h ARG 382 Cb 0.31 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.61 1it8 h ARG 382 CO 0.04 0.02 -0.45 -0.09 0.56 0.00 0.00 179.97 180.05 1it8 h ARG 383 N 0.03 -0.96 -0.97 0.04 2.43 -1.18 -2.28 114.38 111.48 1it8 h ARG 383 Ca 0.35 0.07 0.23 0.00 -0.81 0.00 0.00 59.98 59.81 1it8 h ARG 383 Cb 0.56 0.22 -0.12 0.00 -0.42 0.00 0.00 29.97 30.21 1it8 h ARG 383 CO -0.69 -0.64 0.54 0.00 -1.51 0.00 0.00 179.97 177.66 1it8 h ALA 384 N -1.13 1.66 -0.29 2.80 0.00 -1.01 -0.56 119.26 120.72 1it8 h ALA 384 Ca -0.08 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1it8 h ALA 384 Cb 0.83 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1it8 h ALA 384 CO 0.02 -0.25 0.17 -0.22 0.00 0.00 0.00 179.25 178.97 1it8 h LYS 385 N 0.56 0.40 0.33 0.00 3.64 -0.79 -2.19 116.57 118.52 1it8 h LYS 385 Ca 0.61 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.93 1it8 h LYS 385 Cb 1.11 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1it8 h LYS 385 CO -0.47 0.32 -0.16 0.93 -2.27 0.00 0.00 179.45 177.80 1it8 h GLU 386 N 0.36 -0.43 -0.62 1.90 5.08 -0.57 -2.95 114.58 117.35 1it8 h GLU 386 Ca 0.10 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.63 1it8 h GLU 386 Cb 0.03 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1it8 h GLU 386 CO -0.02 -0.13 0.42 0.00 -1.00 0.00 0.00 179.01 178.28 1it8 h ARG 387 N -0.73 0.25 0.00 2.33 3.08 -1.25 -2.31 114.38 115.75 1it8 h ARG 387 Ca -0.05 -0.02 -0.19 0.00 0.07 0.00 0.00 59.98 59.80 1it8 h ARG 387 Cb 0.50 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 1it8 h ARG 387 CO 0.08 0.17 -0.89 0.00 -1.07 0.00 0.00 179.97 178.26 1it8 h ALA 388 N 1.70 0.50 -0.98 0.04 0.00 -1.38 -3.33 119.26 115.80 1it8 h ALA 388 Ca 0.30 -0.81 0.30 0.00 0.00 0.00 0.00 54.91 54.70 1it8 h ALA 388 Cb 0.80 -0.14 -0.18 0.00 0.00 0.00 0.00 17.79 18.27 1it8 h ALA 388 CO -0.06 1.11 0.18 -0.22 0.00 0.00 0.00 179.25 180.25 1it8 h LYS 389 N 0.00 0.03 -0.19 0.00 3.64 -1.23 0.76 116.57 119.58 1it8 h LYS 389 Ca -0.01 -0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.21 1it8 h LYS 389 Cb 1.61 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.41 1it8 h LYS 389 CO 0.12 0.02 -0.52 0.66 -2.27 0.00 0.00 179.45 177.45 1it8 h SER 390 N 0.03 0.60 -0.35 4.20 4.64 -1.73 -2.69 113.55 118.25 1it8 h SER 390 Ca 0.65 -0.31 -0.16 0.00 -0.47 0.00 0.00 61.79 61.50 1it8 h SER 390 Cb 1.46 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1it8 h SER 390 CO -0.85 1.01 -0.42 0.40 -0.87 0.00 0.00 176.83 176.10 1it8 h ILE 391 N 0.43 1.27 0.01 0.95 5.03 0.27 -2.89 117.51 122.58 1it8 h ILE 391 Ca 0.01 -1.60 -0.00 0.00 -0.12 0.00 0.00 64.86 63.16 1it8 h ILE 391 Cb 1.06 1.46 0.00 0.00 -3.03 0.00 0.00 36.82 36.31 1it8 h ILE 391 CO 0.10 0.53 -0.00 0.78 -0.68 0.00 0.00 178.15 178.88 1it8 h ASN 392 N 0.72 -0.01 -0.34 1.72 2.35 -1.00 0.54 115.58 119.56 1it8 h ASN 392 Ca 0.05 -0.23 0.10 0.00 -0.55 0.00 0.00 56.30 55.67 1it8 h ASN 392 Cb 1.02 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.38 1it8 h ASN 392 CO 0.10 0.22 0.43 -0.08 -1.65 0.00 0.00 177.43 176.45 1it8 h GLU 393 N -0.24 0.00 0.00 0.81 4.57 -1.46 0.12 114.58 118.38 1it8 h GLU 393 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1it8 h GLU 393 Cb 0.23 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1it8 h GLU 393 CO 0.00 0.00 -0.27 -2.13 -1.18 0.00 0.00 179.01 175.43 1it8 n ARG 394 N -3.58 0.14 0.26 1.92 0.63 -1.03 -4.72 116.66 110.29 1it8 n ARG 394 Ca 0.06 0.06 0.12 0.00 -0.92 0.00 0.00 57.85 57.16 1it8 n ARG 394 Cb 0.58 -0.71 0.71 0.00 0.45 0.00 0.00 32.46 33.49 1it8 n ARG 394 CO 0.00 0.00 0.00 0.74 -2.51 0.00 0.00 177.63 175.86 1it8 h PHE 395 N -0.27 0.00 0.00 -0.14 -1.00 -0.94 -3.48 116.94 111.11 1it8 h PHE 395 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1it8 h PHE 395 Cb 0.27 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.83 1it8 h PHE 395 CO -0.12 0.12 0.00 0.41 -1.61 0.00 0.00 178.31 177.12 1it8 n GLY 396 N -0.73 2.19 3.40 -1.45 0.00 0.42 -4.89 105.19 104.13 1it8 n GLY 396 Ca -0.02 -0.41 -0.21 0.00 0.00 0.00 0.00 46.02 45.39 1it8 n GLY 396 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1it8 n GLU 397 N 10.44 -7.09 -1.63 1.61 -0.58 -1.26 -4.06 120.64 118.07 1it8 n GLU 397 Ca 0.00 0.78 -0.35 0.00 -0.42 0.00 0.00 57.16 57.16 1it8 n GLU 397 Cb 0.00 -5.64 0.07 0.00 -0.57 0.00 0.00 31.44 25.30 1it8 n GLU 397 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1it8 s LEU 398 N -6.65 3.45 0.02 -4.62 1.43 -1.26 0.51 118.68 111.55 1it8 s LEU 398 Ca 0.40 2.42 -0.05 0.00 -1.03 0.00 0.00 54.13 55.87 1it8 s LEU 398 Cb -0.18 -4.60 -0.01 0.00 0.03 0.00 0.00 46.19 41.44 1it8 s LEU 398 CO 0.68 -2.05 0.08 0.54 0.23 0.00 0.00 176.35 175.82 1it8 s VAL 399 N -1.77 0.10 -0.15 -1.59 0.11 -0.82 -4.75 120.40 111.53 1it8 s VAL 399 Ca 0.77 -0.85 -0.29 0.00 -2.93 0.00 0.00 61.98 58.67 1it8 s VAL 399 Cb -0.31 -0.49 -0.01 0.00 -1.53 0.00 0.00 36.38 34.04 1it8 s VAL 399 CO 0.41 -0.47 1.17 -1.61 -3.33 0.00 0.00 175.10 171.27 1it8 s GLU 400 N -1.69 4.29 -0.07 1.54 2.02 -1.26 -1.99 118.70 121.54 1it8 s GLU 400 Ca -0.13 1.56 0.04 0.00 0.02 0.00 0.00 54.97 56.46 1it8 s GLU 400 Cb -0.07 -3.66 -0.02 0.00 0.10 0.00 0.00 34.13 30.48 1it8 s GLU 400 CO -0.01 -0.58 -0.20 -1.58 0.02 0.00 0.00 175.26 172.92 1it8 s HIS 401 N 2.96 2.60 0.33 1.61 2.46 0.19 -4.95 115.29 120.48 1it8 s HIS 401 Ca 0.52 -0.57 0.09 0.00 0.47 0.00 0.00 55.06 55.56 1it8 s HIS 401 Cb -0.20 -1.67 0.82 0.00 -0.13 0.00 0.00 32.58 31.40 1it8 s HIS 401 CO 0.15 -0.12 1.78 -1.35 -2.47 0.00 0.00 174.74 172.72 1it8 h PRO 402 N 6.05 0.66 0.01 2.88 0.11 -1.91 0.17 132.00 139.97 1it8 h PRO 402 Ca -0.34 -0.04 -0.39 0.00 0.11 0.00 0.00 66.00 65.35 1it8 h PRO 402 Cb 1.18 -0.15 -0.07 0.00 0.11 0.00 0.00 31.00 32.08 1it8 h PRO 402 CO 0.50 0.44 -2.43 -0.89 -0.21 0.00 0.00 178.00 175.40 1it8 n ILE 403 N -4.74 1.51 1.02 4.15 5.41 -1.26 -4.56 119.36 120.90 1it8 n ILE 403 Ca 0.23 -0.59 0.11 0.00 1.00 0.00 0.00 62.75 63.51 1it8 n ILE 403 Cb 0.63 -1.42 0.05 0.00 -0.71 0.00 0.00 39.64 38.19 1it8 n ILE 403 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1it8 n PHE 404 N -3.26 0.00 0.00 1.39 3.01 -1.24 -5.01 117.46 112.35 1it8 n PHE 404 Ca -0.44 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.02 1it8 n PHE 404 Cb 1.00 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.46 1it8 n PHE 404 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1it8 n GLY 405 N 1.40 2.29 3.20 1.37 0.00 0.58 -4.77 105.19 109.26 1it8 n GLY 405 Ca 0.11 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1it8 n GLY 405 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1it8 s ARG 406 N 0.00 2.12 -0.22 1.61 3.03 -1.26 0.53 118.95 124.76 1it8 s ARG 406 Ca 0.00 -0.75 -0.12 0.00 2.03 0.00 0.00 55.73 56.88 1it8 s ARG 406 Cb 0.00 -1.83 0.07 0.00 -1.03 0.00 0.00 34.95 32.16 1it8 s ARG 406 CO 0.00 0.32 0.53 0.54 -1.13 0.00 0.00 175.30 175.56 1it8 s VAL 407 N -0.09 -0.01 -0.01 4.99 0.11 -0.84 -4.91 120.40 119.64 1it8 s VAL 407 Ca -0.03 0.05 -0.36 0.00 -2.93 0.00 0.00 61.98 58.71 1it8 s VAL 407 Cb -0.12 -0.78 -0.15 0.00 -1.53 0.00 0.00 36.38 33.80 1it8 s VAL 407 CO 0.03 0.02 1.59 -0.24 -3.33 0.00 0.00 175.10 173.17 1it8 n SER 408 N 4.23 2.51 0.28 3.54 2.88 -1.26 -1.94 113.62 123.86 1it8 n SER 408 Ca -0.22 1.07 0.08 0.00 -1.33 0.00 0.00 58.87 58.48 1it8 n SER 408 Cb 0.57 -1.27 0.44 0.00 -0.75 0.00 0.00 64.21 63.20 1it8 n SER 408 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 1it8 h ARG 409 N 6.36 0.00 0.00 -1.46 0.11 -0.09 0.15 114.38 119.45 1it8 h ARG 409 Ca -0.47 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 59.56 1it8 h ARG 409 Cb 1.30 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.37 1it8 h ARG 409 CO 0.88 0.00 -0.26 1.88 0.10 0.00 0.00 179.97 182.56 1it8 h TYR 410 N 0.00 0.00 0.00 4.08 -1.99 -1.85 -2.92 116.97 114.29 1it8 h TYR 410 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1it8 h TYR 410 Cb 1.03 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.76 1it8 h TYR 410 CO 0.00 0.26 -1.24 1.28 -0.00 0.00 0.00 178.16 178.47 1it8 n LEU 411 N -3.28 0.57 0.25 3.88 4.77 0.50 -4.35 117.00 119.34 1it8 n LEU 411 Ca 0.01 0.14 0.09 0.00 -0.03 0.00 0.00 56.01 56.23 1it8 n LEU 411 Cb 0.53 -0.06 0.34 0.00 -2.33 0.00 0.00 43.42 41.90 1it8 n LEU 411 CO 0.35 -0.07 1.08 0.77 -1.33 0.00 0.00 177.39 178.19 1it8 h SER 412 N 0.00 0.00 -0.01 -1.43 4.64 -1.38 1.38 113.55 116.75 1it8 h SER 412 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1it8 h SER 412 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1it8 h SER 412 CO 0.00 0.00 -0.52 0.18 -0.87 0.00 0.00 176.83 175.62 1it8 n LEU 413 N -2.78 1.92 -4.73 5.97 4.77 -1.26 -3.23 117.00 117.66 1it8 n LEU 413 Ca 0.03 -0.72 -0.33 0.00 -0.03 0.00 0.00 56.01 54.96 1it8 n LEU 413 Cb 0.86 -0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.87 1it8 n LEU 413 CO 0.08 0.36 -0.29 -0.89 -1.33 0.00 0.00 177.39 175.33 1it8 s THR 414 N -2.53 4.43 0.39 -5.08 2.01 0.47 -3.64 115.64 111.70 1it8 s THR 414 Ca 0.18 -0.50 -0.27 0.00 0.31 0.00 0.00 61.69 61.41 1it8 s THR 414 Cb 0.18 -3.00 -0.11 0.00 0.01 0.00 0.00 72.50 69.59 1it8 s THR 414 CO 0.60 0.37 1.45 0.00 -0.69 0.00 0.00 174.62 176.35 1it8 n TYR 415 N 1.33 2.82 -1.44 4.92 9.36 0.20 -0.73 117.16 133.61 1it8 n TYR 415 Ca -0.14 0.46 -0.28 0.00 3.32 0.00 0.00 57.90 61.26 1it8 n TYR 415 Cb 0.53 -2.50 0.10 0.00 -0.63 0.00 0.00 39.34 36.84 1it8 n TYR 415 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1it8 n PRO 416 N 0.30 2.68 -0.07 2.98 -0.04 -1.26 -4.94 135.00 134.65 1it8 n PRO 416 Ca 0.03 -3.38 -0.04 0.00 -0.04 0.00 0.00 63.50 60.07 1it8 n PRO 416 Cb 0.39 -2.22 -0.02 0.00 -0.04 0.00 0.00 33.50 31.62 1it8 n PRO 416 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1it8 h PHE 417 N 1.74 0.00 -0.42 0.54 -1.00 -1.22 -3.40 116.94 113.17 1it8 h PHE 417 Ca 0.53 0.00 0.05 0.00 2.81 0.00 0.00 57.97 61.36 1it8 h PHE 417 Cb 1.40 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.91 1it8 h PHE 417 CO 1.33 0.06 0.17 0.00 -1.61 0.00 0.00 178.31 178.26 1it8 h ALA 418 N -0.97 0.52 -0.96 2.45 0.00 -1.49 -3.23 119.26 115.56 1it8 h ALA 418 Ca -0.01 0.04 -0.76 0.00 0.00 0.00 0.00 54.91 54.17 1it8 h ALA 418 Cb 0.41 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.03 1it8 h ALA 418 CO -0.01 -0.21 1.92 1.04 0.00 0.00 0.00 179.25 182.00 1it8 n GLN 419 N -4.97 4.35 -4.51 0.00 3.00 -1.26 -4.93 117.38 109.06 1it8 n GLN 419 Ca 0.03 -3.76 -0.24 0.00 -0.01 0.00 0.00 57.00 53.01 1it8 n GLN 419 Cb 0.14 -2.70 -0.09 0.00 0.00 0.00 0.00 30.24 27.59 1it8 n GLN 419 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 1it8 s SER 420 N 0.05 2.72 -0.29 1.08 0.01 -1.22 -1.25 113.70 114.79 1it8 s SER 420 Ca 0.44 -1.52 -0.14 0.00 1.31 0.00 0.00 55.95 56.04 1it8 s SER 420 Cb 0.14 0.20 0.14 0.00 0.21 0.00 0.00 66.02 66.71 1it8 s SER 420 CO -0.04 -0.76 0.84 -0.70 0.41 0.00 0.00 173.24 172.99 1it8 s GLU 421 N -3.82 0.47 0.00 12.44 2.12 -0.65 -4.76 118.70 124.50 1it8 s GLU 421 Ca 0.29 1.01 0.00 0.00 0.36 0.00 0.00 54.97 56.63 1it8 s GLU 421 Cb 0.06 0.43 0.00 0.00 0.26 0.00 0.00 34.13 34.88 1it8 s GLU 421 CO 0.14 -0.13 0.00 0.00 -0.54 0.00 0.00 175.26 174.73 1it8 n ALA 422 N 4.71 0.00 0.14 6.30 0.00 -1.26 -1.22 120.51 129.18 1it8 n ALA 422 Ca -0.14 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.49 1it8 n ALA 422 Cb 0.54 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.74 1it8 n ALA 422 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1it8 h GLU 423 N 0.00 0.00 -5.10 0.00 3.07 -1.97 -3.41 114.58 107.18 1it8 h GLU 423 Ca 0.00 0.00 -0.36 0.00 -0.50 0.00 0.00 59.36 58.50 1it8 h GLU 423 Cb 0.00 0.00 -0.14 0.00 -0.84 0.00 0.00 28.75 27.77 1it8 h GLU 423 CO 0.00 0.00 -0.69 -0.51 -1.40 0.00 0.00 179.01 176.41 1it8 s ASP 424 N -5.12 1.84 0.56 1.42 1.01 -1.26 -5.16 116.67 109.95 1it8 s ASP 424 Ca -0.04 -1.11 -0.07 0.00 0.71 0.00 0.00 52.55 52.04 1it8 s ASP 424 Cb 0.14 -0.01 -0.02 0.00 1.01 0.00 0.00 42.92 44.05 1it8 s ASP 424 CO 0.50 -0.41 0.89 -1.81 0.21 0.00 0.00 175.17 174.54 1it8 s ASP 425 N -3.24 5.98 -0.24 0.27 1.01 -1.26 -4.80 116.67 114.39 1it8 s ASP 425 Ca 0.22 0.95 0.02 0.00 0.71 0.00 0.00 52.55 54.46 1it8 s ASP 425 Cb 0.04 -2.08 0.05 0.00 1.01 0.00 0.00 42.92 41.94 1it8 s ASP 425 CO 0.04 -0.84 -0.13 0.12 0.21 0.00 0.00 175.17 174.58 1it8 s PHE 426 N -2.94 3.08 0.11 4.23 5.36 -1.26 -4.91 117.98 121.65 1it8 s PHE 426 Ca 0.52 -2.12 -0.31 0.00 -0.96 0.00 0.00 56.93 54.06 1it8 s PHE 426 Cb -0.11 -1.90 -0.08 0.00 -0.34 0.00 0.00 43.02 40.60 1it8 s PHE 426 CO 0.47 -0.85 1.34 0.15 -1.46 0.00 0.00 175.22 174.87 1it8 s LYS 427 N 1.17 4.35 -0.20 10.12 1.02 -1.26 -4.98 119.74 129.96 1it8 s LYS 427 Ca -0.05 2.01 -0.28 0.00 0.02 0.00 0.00 55.97 57.67 1it8 s LYS 427 Cb -0.18 -3.26 0.00 0.00 -0.52 0.00 0.00 37.83 33.87 1it8 s LYS 427 CO -0.07 -0.38 0.98 0.42 -0.92 0.00 0.00 175.35 175.38 1it8 s ILE 428 N 1.01 4.74 -0.60 2.17 1.09 -1.26 -5.01 121.20 123.34 1it8 s ILE 428 Ca 0.63 1.92 -0.26 0.00 -1.10 0.00 0.00 60.65 61.84 1it8 s ILE 428 Cb -0.35 -4.26 0.04 0.00 -1.06 0.00 0.00 42.46 36.82 1it8 s ILE 428 CO 0.31 -0.11 1.07 -1.61 -0.10 0.00 0.00 174.94 174.49 1it8 s GLU 429 N 2.82 3.34 0.75 2.79 8.01 -1.26 -5.04 118.70 130.12 1it8 s GLU 429 Ca 0.43 -0.17 -0.11 0.00 0.01 0.00 0.00 54.97 55.13 1it8 s GLU 429 Cb -0.16 -4.08 0.04 0.00 -4.31 0.00 0.00 34.13 25.62 1it8 s GLU 429 CO 0.09 -1.67 1.08 0.15 0.01 0.00 0.00 175.26 174.91 1it8 s LYS 430 N 4.51 2.50 0.35 1.61 1.02 -1.26 -4.77 119.74 123.70 1it8 s LYS 430 Ca 0.34 1.05 -0.02 0.00 0.02 0.00 0.00 55.97 57.36 1it8 s LYS 430 Cb -0.11 -1.93 -0.04 0.00 -0.52 0.00 0.00 37.83 35.23 1it8 s LYS 430 CO 0.19 -1.44 0.58 -2.14 -0.92 0.00 0.00 175.35 171.63 1it8 s PRO 431 N -4.97 3.54 0.00 -1.68 0.02 -1.26 -5.09 135.00 125.55 1it8 s PRO 431 Ca 0.60 -0.15 0.00 0.00 0.02 0.00 0.00 61.00 61.46 1it8 s PRO 431 Cb -0.16 -2.62 0.00 0.00 0.02 0.00 0.00 34.50 31.74 1it8 s PRO 431 CO 0.56 0.12 0.00 0.25 -0.33 0.00 0.00 177.00 177.60 1it8 n THR 432 N -1.58 0.00 -0.01 0.99 -2.24 -1.26 -4.93 114.28 105.25 1it8 n THR 432 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1it8 n THR 432 Cb 0.55 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1it8 n THR 432 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1it8 n LYS 433 N 0.00 2.16 -0.06 -0.78 5.02 -1.26 -4.57 118.16 118.67 1it8 n LYS 433 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.07 1it8 n LYS 433 Cb 0.00 -0.18 -0.13 0.00 -0.02 0.00 0.00 35.03 34.70 1it8 n LYS 433 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1it8 n GLU 434 N 0.00 0.68 -0.37 1.97 4.71 -1.26 -4.00 120.64 122.37 1it8 n GLU 434 Ca 0.00 0.32 0.03 0.00 -0.01 0.00 0.00 57.16 57.50 1it8 n GLU 434 Cb 0.00 -1.66 0.18 0.00 -1.01 0.00 0.00 31.44 28.95 1it8 n GLU 434 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 1it8 h ASP 435 N -0.31 1.02 0.00 1.62 3.32 -1.95 -3.26 116.42 116.85 1it8 h ASP 435 Ca -0.47 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1it8 h ASP 435 Cb 1.79 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 41.14 1it8 h ASP 435 CO -0.07 0.63 0.00 0.00 -1.72 0.00 0.00 179.24 178.08 1it8 n ALA 436 N -2.36 0.00 -0.04 3.45 0.00 -1.26 0.16 120.51 120.47 1it8 n ALA 436 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.47 1it8 n ALA 436 Cb 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.58 1it8 n ALA 436 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1it8 h ILE 437 N 0.00 1.31 0.00 0.00 6.09 -1.84 -3.05 117.51 120.02 1it8 h ILE 437 Ca 0.00 -1.04 0.00 0.00 -1.37 0.00 0.00 64.86 62.45 1it8 h ILE 437 Cb 0.00 1.79 0.00 0.00 0.47 0.00 0.00 36.82 39.08 1it8 h ILE 437 CO 0.00 0.30 0.30 0.11 -3.07 0.00 0.00 178.15 175.79 1it8 h LYS 438 N -0.14 0.00 0.13 2.19 1.57 0.14 0.41 116.57 120.87 1it8 h LYS 438 Ca 0.02 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.60 1it8 h LYS 438 Cb 0.49 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.81 1it8 h LYS 438 CO 0.01 0.00 -0.96 1.88 -0.57 0.00 0.00 179.45 179.81 1it8 h TYR 439 N 0.00 0.51 -0.48 -1.35 -1.99 -1.29 -2.32 116.97 110.04 1it8 h TYR 439 Ca 0.00 -0.37 -0.06 0.00 2.00 0.00 0.00 58.73 60.30 1it8 h TYR 439 Cb 0.61 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 39.29 1it8 h TYR 439 CO 0.00 1.37 0.06 0.28 -0.00 0.00 0.00 178.16 179.87 1it8 h VAL 440 N -0.37 1.22 -0.01 -2.88 2.07 -0.38 0.49 116.25 116.39 1it8 h VAL 440 Ca -0.18 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.47 1it8 h VAL 440 Cb 1.66 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1it8 h VAL 440 CO 0.12 0.31 -0.00 0.24 0.02 0.00 0.00 177.57 178.26 1it8 h MET 441 N 0.72 0.03 -0.43 1.57 2.86 -0.56 -0.56 114.93 118.55 1it8 h MET 441 Ca 0.15 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.81 1it8 h MET 441 Cb 0.35 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.98 1it8 h MET 441 CO 0.01 0.38 0.24 0.00 1.06 0.00 0.00 176.91 178.59 1it8 h ALA 442 N 0.65 0.54 0.01 6.32 0.00 -1.17 0.12 119.26 125.72 1it8 h ALA 442 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1it8 h ALA 442 Cb 0.37 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1it8 h ALA 442 CO 0.00 -0.10 -0.03 0.82 0.00 0.00 0.00 179.25 179.94 1it8 h ILE 443 N 0.48 0.91 -0.62 0.00 2.04 -0.88 0.11 117.51 119.56 1it8 h ILE 443 Ca 0.17 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.10 1it8 h ILE 443 Cb 0.04 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 1it8 h ILE 443 CO -0.10 0.00 0.31 0.00 0.00 0.00 0.00 178.15 178.37 1it8 h ALA 444 N 0.92 0.81 0.00 1.87 0.00 -0.63 1.97 119.26 124.21 1it8 h ALA 444 Ca 0.01 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1it8 h ALA 444 Cb 0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1it8 h ALA 444 CO -0.03 -0.04 -0.23 1.49 0.00 0.00 0.00 179.25 180.45 1it8 h GLU 445 N 0.58 0.00 0.00 0.00 4.57 -0.51 -0.42 114.58 118.80 1it8 h GLU 445 Ca 0.28 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.38 1it8 h GLU 445 Cb 0.22 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 1it8 h GLU 445 CO -0.20 0.23 -0.52 -0.92 -1.18 0.00 0.00 179.01 176.41 1it8 h TYR 446 N 0.00 0.00 -0.15 0.92 3.20 0.13 -2.92 116.97 118.16 1it8 h TYR 446 Ca -0.00 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 1it8 h TYR 446 Cb 0.47 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.74 1it8 h TYR 446 CO 0.00 0.82 -0.16 0.37 -1.64 0.00 0.00 178.16 177.55 1it8 h GLN 447 N -1.00 0.37 0.00 1.82 4.15 0.30 -3.31 115.11 117.44 1it8 h GLN 447 Ca -0.12 -0.20 0.00 0.00 0.77 0.00 0.00 58.65 59.10 1it8 h GLN 447 Cb 0.85 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.55 1it8 h GLN 447 CO -0.07 0.77 -0.79 1.19 -1.93 0.00 0.00 178.83 177.99 1it8 n PHE 448 N -4.53 0.00 0.00 3.99 0.99 -0.18 -4.95 117.46 112.78 1it8 n PHE 448 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.39 1it8 n PHE 448 Cb 0.38 -0.11 0.00 0.00 -1.00 0.00 0.00 39.48 38.75 1it8 n PHE 448 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1it8 n GLY 449 N 1.50 -0.37 0.63 1.37 0.00 -1.10 -4.81 105.19 102.40 1it8 n GLY 449 Ca 0.05 -1.82 -0.09 0.00 0.00 0.00 0.00 46.02 44.16 1it8 n GLY 449 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1it8 n GLU 450 N -0.42 0.00 -0.04 1.61 4.07 -1.25 -1.52 120.64 123.10 1it8 n GLU 450 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1it8 n GLU 450 Cb 0.00 -0.20 0.00 0.00 -0.06 0.00 0.00 31.44 31.18 1it8 n GLU 450 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1it8 n GLY 451 N 0.35 0.00 0.43 8.31 0.00 -1.26 -4.71 105.19 108.31 1it8 n GLY 451 Ca 0.03 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.28 1it8 n GLY 451 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1it8 h ALA 452 N 0.00 2.33 -0.06 4.61 0.00 -1.53 0.77 119.26 125.39 1it8 h ALA 452 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1it8 h ALA 452 Cb 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1it8 h ALA 452 CO 0.00 -0.94 -0.05 0.66 0.00 0.00 0.00 179.25 178.92 1it8 h SER 453 N 0.00 0.07 0.00 0.00 4.64 -1.79 -2.09 113.55 114.37 1it8 h SER 453 Ca 0.27 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1it8 h SER 453 Cb 1.55 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.63 1it8 h SER 453 CO -0.00 0.14 0.05 0.54 -0.87 0.00 0.00 176.83 176.68 1it8 n ARG 454 N -4.43 0.08 0.00 4.77 1.74 0.26 0.37 116.66 119.46 1it8 n ARG 454 Ca -0.02 0.56 0.13 0.00 -0.77 0.00 0.00 57.85 57.76 1it8 n ARG 454 Cb 0.16 -1.81 0.47 0.00 -1.02 0.00 0.00 32.46 30.26 1it8 n ARG 454 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1it8 n ALA 455 N -1.64 2.97 -2.52 7.54 0.00 -0.79 -4.12 120.51 121.95 1it8 n ALA 455 Ca -0.01 -0.30 -0.13 0.00 0.00 0.00 0.00 53.44 53.00 1it8 n ALA 455 Cb 0.07 -1.25 0.03 0.00 0.00 0.00 0.00 19.45 18.29 1it8 n ALA 455 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1it8 n PHE 456 N -1.08 2.02 -0.02 0.00 3.01 0.16 -4.88 117.46 116.67 1it8 n PHE 456 Ca 0.11 -2.52 -0.01 0.00 1.01 0.00 0.00 57.45 56.05 1it8 n PHE 456 Cb 0.32 -0.26 -0.00 0.00 -0.01 0.00 0.00 39.48 39.52 1it8 n PHE 456 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1it8 h ASP 457 N 2.60 0.00 0.00 4.37 3.32 -1.71 -3.37 116.42 121.62 1it8 h ASP 457 Ca 0.08 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1it8 h ASP 457 Cb 1.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 1it8 h ASP 457 CO 0.53 0.23 0.02 -0.90 -1.72 0.00 0.00 179.24 177.40 1it8 n ASP 458 N -3.09 2.55 -4.52 6.45 5.68 -1.26 -4.80 116.55 117.57 1it8 n ASP 458 Ca -0.01 -1.76 -0.24 0.00 -0.50 0.00 0.00 54.79 52.27 1it8 n ASP 458 Cb 0.04 -0.58 -0.09 0.00 -1.14 0.00 0.00 41.12 39.34 1it8 n ASP 458 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1it8 s ALA 459 N 1.33 2.85 -0.09 2.12 0.00 -1.26 -4.69 121.76 122.02 1it8 s ALA 459 Ca 0.09 -1.78 0.03 0.00 0.00 0.00 0.00 51.96 50.30 1it8 s ALA 459 Cb 0.05 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.75 1it8 s ALA 459 CO 0.00 0.30 -0.18 0.15 0.00 0.00 0.00 175.76 176.03 1it8 s LYS 460 N -3.45 2.37 -0.27 0.00 1.02 0.06 -4.93 119.74 114.55 1it8 s LYS 460 Ca 0.29 -0.64 -0.09 0.00 0.02 0.00 0.00 55.97 55.56 1it8 s LYS 460 Cb -0.06 -1.89 -0.03 0.00 -0.52 0.00 0.00 37.83 35.34 1it8 s LYS 460 CO 0.16 0.07 0.12 0.08 -0.92 0.00 0.00 175.35 174.85 1it8 s VAL 461 N 0.61 4.61 0.01 3.17 1.01 -1.26 -1.72 120.40 126.84 1it8 s VAL 461 Ca -0.14 -0.16 -0.20 0.00 0.00 0.00 0.00 61.98 61.48 1it8 s VAL 461 Cb -0.16 -3.22 -0.06 0.00 0.00 0.00 0.00 36.38 32.94 1it8 s VAL 461 CO 0.04 0.25 0.58 -1.83 0.00 0.00 0.00 175.10 174.14 1it8 s GLU 462 N 1.65 4.27 -0.22 2.72 -1.05 -0.84 -4.92 118.70 120.30 1it8 s GLU 462 Ca 0.06 0.71 -0.10 0.00 -0.15 0.00 0.00 54.97 55.50 1it8 s GLU 462 Cb -0.16 -3.31 -0.05 0.00 -0.44 0.00 0.00 34.13 30.18 1it8 s GLU 462 CO 0.06 0.45 0.13 -0.51 0.95 0.00 0.00 175.26 176.34 1it8 s LEU 463 N -0.47 4.01 0.00 1.83 1.43 -1.26 -2.03 118.68 122.19 1it8 s LEU 463 Ca 0.30 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.49 1it8 s LEU 463 Cb -0.18 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 43.98 1it8 s LEU 463 CO 0.17 0.09 0.00 -1.54 0.23 0.00 0.00 176.35 175.31 1it8 n SER 464 N 4.10 -0.27 0.00 2.29 3.41 -0.68 -4.91 113.62 117.56 1it8 n SER 464 Ca -0.16 -0.39 0.00 0.00 -0.26 0.00 0.00 58.87 58.07 1it8 n SER 464 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1it8 n SER 464 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1it8 n LYS 465 N -0.66 0.00 -2.01 4.33 2.85 -1.26 -4.15 118.16 117.26 1it8 n LYS 465 Ca 0.00 0.81 -0.41 0.00 -1.05 0.00 0.00 58.31 57.66 1it8 n LYS 465 Cb 0.00 -1.46 -0.01 0.00 -0.65 0.00 0.00 35.03 32.91 1it8 n LYS 465 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1it8 s THR 466 N -2.83 2.50 0.00 0.58 -4.23 -1.26 -4.75 115.64 105.64 1it8 s THR 466 Ca 0.00 0.49 0.00 0.00 -1.18 0.00 0.00 61.69 61.00 1it8 s THR 466 Cb 0.00 -3.31 0.00 0.00 1.34 0.00 0.00 72.50 70.53 1it8 s THR 466 CO 0.00 0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 1it8 n GLY 467 N 0.68 0.42 3.83 3.99 0.00 -1.26 -4.76 105.19 108.09 1it8 n GLY 467 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1it8 n GLY 467 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1it8 s MET 468 N 1.77 3.76 -0.05 1.61 -1.94 -1.26 -4.07 119.30 119.12 1it8 s MET 468 Ca 0.00 -0.00 -0.30 0.00 -1.71 0.00 0.00 55.69 53.68 1it8 s MET 468 Cb 0.00 -3.26 -0.03 0.00 2.01 0.00 0.00 34.83 33.55 1it8 s MET 468 CO 0.00 0.61 1.16 -2.14 -0.01 0.00 0.00 175.02 174.64 1it8 s PRO 469 N -0.62 4.38 0.02 2.03 0.02 -1.26 -1.69 135.00 137.88 1it8 s PRO 469 Ca 0.16 1.62 -0.04 0.00 0.02 0.00 0.00 61.00 62.76 1it8 s PRO 469 Cb -0.13 -3.53 -0.01 0.00 0.02 0.00 0.00 34.50 30.84 1it8 s PRO 469 CO 0.05 -0.39 -0.08 0.54 -0.33 0.00 0.00 177.00 176.79 1it8 n ARG 470 N 5.01 0.12 -4.49 5.54 5.12 -0.86 -4.53 116.66 122.57 1it8 n ARG 470 Ca 0.10 0.05 -0.32 0.00 -1.93 0.00 0.00 57.85 55.75 1it8 n ARG 470 Cb 0.47 -0.65 -0.11 0.00 -1.16 0.00 0.00 32.46 31.01 1it8 n ARG 470 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1it8 s GLN 471 N -2.04 2.57 -0.11 5.56 0.74 -1.25 0.14 119.66 125.27 1it8 s GLN 471 Ca -0.07 -0.70 0.01 0.00 0.05 0.00 0.00 55.36 54.65 1it8 s GLN 471 Cb 0.01 -2.51 -0.01 0.00 1.10 0.00 0.00 33.01 31.60 1it8 s GLN 471 CO 0.10 0.61 -0.15 0.08 -0.55 0.00 0.00 175.29 175.38 1it8 s VAL 472 N -0.96 2.86 0.07 1.34 1.01 0.40 -2.00 120.40 123.13 1it8 s VAL 472 Ca 0.16 -0.74 -0.01 0.00 0.00 0.00 0.00 61.98 61.40 1it8 s VAL 472 Cb -0.11 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 1it8 s VAL 472 CO 0.06 0.54 -0.01 -0.54 0.00 0.00 0.00 175.10 175.15 1it8 s LYS 473 N 0.20 0.70 -0.12 2.72 1.02 -0.70 -0.90 119.74 122.68 1it8 s LYS 473 Ca -0.09 -1.28 -0.15 0.00 0.02 0.00 0.00 55.97 54.46 1it8 s LYS 473 Cb -0.16 0.18 0.04 0.00 -0.52 0.00 0.00 37.83 37.37 1it8 s LYS 473 CO 0.06 -0.14 0.40 0.08 -0.92 0.00 0.00 175.35 174.83 1it8 s VAL 474 N -3.92 0.01 0.00 3.17 1.01 -0.09 -0.76 120.40 119.81 1it8 s VAL 474 Ca 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1it8 s VAL 474 Cb 0.08 -0.60 0.00 0.00 0.00 0.00 0.00 36.38 35.86 1it8 s VAL 474 CO -0.07 -0.06 0.00 0.59 0.00 0.00 0.00 175.10 175.56 1it8 n ASN 475 N 2.40 -2.54 0.00 3.32 3.02 -1.26 -0.39 115.26 119.80 1it8 n ASN 475 Ca -0.15 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.40 1it8 n ASN 475 Cb 0.57 -2.49 0.00 0.00 -0.61 0.00 0.00 39.78 37.25 1it8 n ASN 475 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1it8 n GLY 476 N -0.25 3.10 3.76 7.41 0.00 -1.26 -5.07 105.19 112.87 1it8 n GLY 476 Ca 0.00 -0.97 -0.37 0.00 0.00 0.00 0.00 46.02 44.68 1it8 n GLY 476 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1it8 s LYS 477 N 0.00 3.35 -0.09 1.61 -2.85 0.47 -4.89 119.74 117.35 1it8 s LYS 477 Ca 0.00 1.91 -0.30 0.00 -1.00 0.00 0.00 55.97 56.59 1it8 s LYS 477 Cb 0.00 -2.22 -0.02 0.00 -2.06 0.00 0.00 37.83 33.53 1it8 s LYS 477 CO 0.00 -0.92 1.18 0.50 0.10 0.00 0.00 175.35 176.20 1it8 s ARG 478 N -2.95 4.34 0.00 1.78 3.00 -1.26 -0.92 118.95 122.94 1it8 s ARG 478 Ca 0.70 1.62 0.00 0.00 -1.00 0.00 0.00 55.73 57.05 1it8 s ARG 478 Cb -0.32 -3.59 0.00 0.00 0.00 0.00 0.00 34.95 31.04 1it8 s ARG 478 CO 0.38 -0.48 0.00 1.28 0.00 0.00 0.00 175.30 176.48 1it8 n LEU 479 N 5.44 0.41 -4.26 -0.88 4.77 -0.07 -4.28 117.00 118.13 1it8 n LEU 479 Ca 0.11 0.23 -0.17 0.00 -0.03 0.00 0.00 56.01 56.15 1it8 n LEU 479 Cb 0.46 -0.39 -0.09 0.00 -2.33 0.00 0.00 43.42 41.08 1it8 n LEU 479 CO 0.55 -0.39 -0.16 0.00 -1.33 0.00 0.00 177.39 176.06 1it8 s ALA 480 N -3.32 1.65 -0.07 -1.18 0.00 -1.22 0.64 121.76 118.25 1it8 s ALA 480 Ca 0.00 -1.92 -0.03 0.00 0.00 0.00 0.00 51.96 50.01 1it8 s ALA 480 Cb 0.00 1.42 0.04 0.00 0.00 0.00 0.00 23.12 24.59 1it8 s ALA 480 CO 0.00 -0.63 0.14 0.99 0.00 0.00 0.00 175.76 176.26 1it8 s THR 481 N -3.69 -0.22 -0.19 0.00 2.01 0.52 -0.45 115.64 113.61 1it8 s THR 481 Ca 0.40 0.36 -0.29 0.00 0.31 0.00 0.00 61.69 62.47 1it8 s THR 481 Cb 0.04 -0.26 -0.05 0.00 0.01 0.00 0.00 72.50 72.24 1it8 s THR 481 CO 0.22 0.15 2.00 -0.69 -0.69 0.00 0.00 174.62 175.61 1it8 s VAL 482 N 2.21 3.20 0.18 3.82 1.01 0.37 -0.85 120.40 130.34 1it8 s VAL 482 Ca 0.03 0.22 -0.31 0.00 0.00 0.00 0.00 61.98 61.92 1it8 s VAL 482 Cb -0.12 -3.24 -0.10 0.00 0.00 0.00 0.00 36.38 32.93 1it8 s VAL 482 CO -0.05 -0.12 1.52 -0.13 0.00 0.00 0.00 175.10 176.32 1it8 s ARG 483 N 5.64 4.23 0.17 2.72 0.52 -0.15 -4.61 118.95 127.47 1it8 s ARG 483 Ca 0.90 2.33 -0.10 0.00 -0.52 0.00 0.00 55.73 58.34 1it8 s ARG 483 Cb -0.31 -3.15 0.04 0.00 0.52 0.00 0.00 34.95 32.05 1it8 s ARG 483 CO 0.35 -0.55 1.61 0.00 0.02 0.00 0.00 175.30 176.73 1it8 h ALA 484 N 6.36 0.77 0.00 2.13 0.00 -1.91 0.18 119.26 126.79 1it8 h ALA 484 Ca -0.43 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.15 1it8 h ALA 484 Cb 1.21 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1it8 h ALA 484 CO 0.88 0.65 0.00 -0.40 0.00 0.00 0.00 179.25 180.37 1it8 n ASP 485 N -4.18 0.12 0.00 0.00 3.85 -1.26 -4.03 116.55 111.04 1it8 n ASP 485 Ca 0.02 -1.90 0.00 0.00 -0.71 0.00 0.00 54.79 52.20 1it8 n ASP 485 Cb 0.37 -0.06 0.00 0.00 -1.35 0.00 0.00 41.12 40.09 1it8 n ASP 485 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1it8 n ASP 486 N -0.44 0.00 -1.74 -1.12 3.85 -1.21 -4.96 116.55 110.94 1it8 n ASP 486 Ca 0.00 -0.34 -0.17 0.00 -0.71 0.00 0.00 54.79 53.57 1it8 n ASP 486 Cb 0.03 0.00 -0.03 0.00 -1.35 0.00 0.00 41.12 39.77 1it8 n ASP 486 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1it8 n GLY 487 N 0.00 0.39 3.51 6.12 0.00 0.61 0.62 105.19 116.45 1it8 n GLY 487 Ca 0.00 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 1it8 n GLY 487 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1it8 s LEU 488 N -4.59 3.19 0.21 0.99 1.43 -1.24 -4.54 118.68 114.12 1it8 s LEU 488 Ca 0.00 -0.11 -0.31 0.00 -1.03 0.00 0.00 54.13 52.68 1it8 s LEU 488 Cb 0.00 -1.74 -0.10 0.00 0.03 0.00 0.00 46.19 44.38 1it8 s LEU 488 CO 0.00 0.23 1.46 -0.76 0.23 0.00 0.00 176.35 177.51 1it8 s LEU 489 N 0.01 4.38 -0.28 1.79 1.43 -1.26 -0.98 118.68 123.77 1it8 s LEU 489 Ca -0.00 2.60 -0.06 0.00 -1.03 0.00 0.00 54.13 55.64 1it8 s LEU 489 Cb -0.13 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.48 1it8 s LEU 489 CO 0.03 -0.72 0.06 -0.89 0.23 0.00 0.00 176.35 175.06 1it8 s THR 490 N 0.45 3.90 0.56 5.49 2.01 -0.03 -4.89 115.64 123.13 1it8 s THR 490 Ca 0.63 -0.65 -0.18 0.00 0.31 0.00 0.00 61.69 61.80 1it8 s THR 490 Cb -0.42 -2.98 -0.05 0.00 0.01 0.00 0.00 72.50 69.07 1it8 s THR 490 CO 0.38 0.13 1.07 -0.76 -0.69 0.00 0.00 174.62 174.76 1it8 s LEU 491 N 1.50 3.65 0.00 4.42 1.43 -1.26 -0.36 118.68 128.07 1it8 s LEU 491 Ca 0.03 1.96 0.07 0.00 -1.03 0.00 0.00 54.13 55.16 1it8 s LEU 491 Cb -0.17 -4.55 -0.02 0.00 0.03 0.00 0.00 46.19 41.48 1it8 s LEU 491 CO 0.02 -1.12 -0.22 -0.83 0.23 0.00 0.00 176.35 174.43 1it8 s GLY 492 N -2.27 1.10 0.02 -3.19 0.00 0.21 -4.91 107.32 98.27 1it8 s GLY 492 Ca 0.67 -0.99 0.01 0.00 0.00 0.00 0.00 44.72 44.41 1it8 s GLY 492 CO 0.30 -0.86 0.08 1.39 0.00 0.00 0.00 173.10 174.00 1it8 n ILE 493 N 2.30 -0.02 -0.06 0.90 2.08 -1.26 0.26 119.36 123.56 1it8 n ILE 493 Ca -0.16 0.10 -0.14 0.00 0.56 0.00 0.00 62.75 63.11 1it8 n ILE 493 Cb 0.53 -0.16 -0.07 0.00 -0.75 0.00 0.00 39.64 39.19 1it8 n ILE 493 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 1it8 h GLU 494 N 0.00 0.48 -0.68 0.38 4.57 -1.81 -1.70 114.58 115.83 1it8 h GLU 494 Ca 0.03 -0.29 0.07 0.00 -1.18 0.00 0.00 59.36 58.00 1it8 h GLU 494 Cb 0.08 0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 28.64 1it8 h GLU 494 CO -0.04 0.89 0.35 0.78 -1.18 0.00 0.00 179.01 179.81 1it8 h GLY 495 N 0.12 1.00 0.95 1.92 0.00 0.37 -1.88 103.07 105.54 1it8 h GLY 495 Ca 0.01 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 1it8 h GLY 495 CO 0.06 0.10 0.02 0.00 0.00 0.00 0.00 176.54 176.73 1it8 h ALA 496 N 1.38 0.05 -0.96 3.60 0.00 -1.41 -1.11 119.26 120.82 1it8 h ALA 496 Ca 0.32 -0.03 0.20 0.00 0.00 0.00 0.00 54.91 55.40 1it8 h ALA 496 Cb 0.27 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.96 1it8 h ALA 496 CO -0.22 -0.42 0.61 0.87 0.00 0.00 0.00 179.25 180.08 1it8 h LYS 497 N -0.00 0.54 0.06 0.00 1.57 -0.66 0.37 116.57 118.45 1it8 h LYS 497 Ca 0.01 -0.03 -0.27 0.00 -1.87 0.00 0.00 60.65 58.49 1it8 h LYS 497 Cb 0.05 -0.12 0.02 0.00 0.08 0.00 0.00 32.23 32.26 1it8 h LYS 497 CO -0.00 0.36 -1.12 0.00 -0.57 0.00 0.00 179.45 178.11 1it8 h ARG 498 N 0.56 0.57 -0.42 3.15 3.08 -0.90 -2.95 114.38 117.46 1it8 h ARG 498 Ca 0.52 -0.70 -0.11 0.00 0.07 0.00 0.00 59.98 59.77 1it8 h ARG 498 Cb 1.08 0.22 -0.02 0.00 0.08 0.00 0.00 29.97 31.33 1it8 h ARG 498 CO -0.26 1.29 -0.17 -0.07 -1.07 0.00 0.00 179.97 179.69 1it8 h LEU 499 N 0.28 0.81 -0.97 3.04 -0.00 0.08 -2.06 115.31 116.50 1it8 h LEU 499 Ca -0.14 -0.27 0.10 0.00 -0.00 0.00 0.00 57.88 57.56 1it8 h LEU 499 Cb 1.78 -0.22 -0.08 0.00 -0.00 0.00 0.00 40.66 42.15 1it8 h LEU 499 CO 0.21 0.98 0.61 -0.74 -0.00 0.00 0.00 178.44 179.49 1it8 h HIS 500 N 0.71 1.11 0.10 1.13 2.76 -0.30 0.15 115.15 120.80 1it8 h HIS 500 Ca 0.11 0.03 -0.32 0.00 -2.20 0.00 0.00 60.37 57.99 1it8 h HIS 500 Cb 0.68 -0.35 -0.02 0.00 1.55 0.00 0.00 27.41 29.27 1it8 h HIS 500 CO 0.04 0.48 -1.66 0.07 -1.30 0.00 0.00 177.93 175.55 1it8 h ARG 501 N 1.01 0.20 -0.17 5.26 0.11 -1.41 -3.37 114.38 116.01 1it8 h ARG 501 Ca 0.46 -0.34 -0.18 0.00 0.10 0.00 0.00 59.98 60.01 1it8 h ARG 501 Cb 0.37 0.13 -0.00 0.00 1.11 0.00 0.00 29.97 31.58 1it8 h ARG 501 CO -0.23 1.01 -0.63 0.28 0.10 0.00 0.00 179.97 180.50 1it8 h VAL 502 N 0.06 1.32 -3.10 0.08 2.07 -1.18 -3.43 116.25 112.06 1it8 h VAL 502 Ca -0.29 -1.90 -0.61 0.00 0.82 0.00 0.00 66.70 64.73 1it8 h VAL 502 Cb 2.02 1.86 -0.08 0.00 -1.52 0.00 0.00 31.29 33.57 1it8 h VAL 502 CO 0.13 0.59 -0.33 -0.76 0.02 0.00 0.00 177.57 177.22 1it8 s LEU 503 N -8.31 4.32 0.28 2.57 1.43 0.50 -5.01 118.68 114.46 1it8 s LEU 503 Ca -0.08 0.59 -0.29 0.00 -1.03 0.00 0.00 54.13 53.32 1it8 s LEU 503 Cb 0.10 -2.36 -0.10 0.00 0.03 0.00 0.00 46.19 43.87 1it8 s LEU 503 CO 0.86 0.21 1.20 -2.84 0.23 0.00 0.00 176.35 176.01 1it8 s PRO 504 N -0.17 4.50 0.53 1.29 0.02 -1.26 -4.73 135.00 135.19 1it8 s PRO 504 Ca 0.18 1.98 -0.21 0.00 0.02 0.00 0.00 61.00 62.97 1it8 s PRO 504 Cb -0.14 -3.16 -0.07 0.00 0.02 0.00 0.00 34.50 31.16 1it8 s PRO 504 CO 0.06 -0.01 0.99 0.98 -0.33 0.00 0.00 177.00 178.69 1it8 n TYR 505 N 1.36 0.99 0.31 6.54 9.36 -1.26 -1.65 117.16 132.81 1it8 n TYR 505 Ca 0.01 0.47 0.06 0.00 3.32 0.00 0.00 57.90 61.76 1it8 n TYR 505 Cb 0.44 -2.18 0.22 0.00 -0.63 0.00 0.00 39.34 37.18 1it8 n TYR 505 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1it8 n PRO 506 N -0.56 2.50 -1.44 2.98 -0.04 -1.26 -5.11 135.00 132.06 1it8 n PRO 506 Ca 0.12 -1.75 -0.60 0.00 -0.04 0.00 0.00 63.50 61.22 1it8 n PRO 506 Cb 0.44 -1.55 -0.10 0.00 -0.04 0.00 0.00 33.50 32.25 1it8 n PRO 506 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1it8 n ARG 507 N 0.71 0.30 -0.59 0.54 5.12 -0.66 -0.62 116.66 121.46 1it8 n ARG 507 Ca 0.16 0.09 0.00 0.00 -1.93 0.00 0.00 57.85 56.17 1it8 n ARG 507 Cb 0.53 -1.72 0.00 0.00 -1.16 0.00 0.00 32.46 30.11 1it8 n ARG 507 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 1it8 n MET 508 N 6.60 0.00 -2.62 5.56 2.81 -1.26 -4.91 117.12 123.30 1it8 n MET 508 Ca 0.44 0.00 -0.38 0.00 -1.81 0.00 0.00 57.70 55.95 1it8 n MET 508 Cb 0.02 -2.86 -0.05 0.00 -0.71 0.00 0.00 33.22 29.62 1it8 n MET 508 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1it8 s ARG 509 N -0.21 4.49 -0.34 0.03 3.00 0.20 -0.04 118.95 126.07 1it8 s ARG 509 Ca 0.00 1.53 0.00 0.00 0.00 0.00 0.00 55.73 57.26 1it8 s ARG 509 Cb 0.00 -2.87 0.11 0.00 0.00 0.00 0.00 34.95 32.19 1it8 s ARG 509 CO 0.00 0.15 0.12 0.08 0.00 0.00 0.00 175.30 175.65 1it8 s VAL 510 N -1.46 1.15 -0.23 3.52 1.01 -0.73 -1.09 120.40 122.57 1it8 s VAL 510 Ca 0.50 -1.77 -0.29 0.00 0.00 0.00 0.00 61.98 60.42 1it8 s VAL 510 Cb -0.24 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.30 1it8 s VAL 510 CO 0.30 -0.72 1.08 -0.69 0.00 0.00 0.00 175.10 175.07 1it8 s VAL 511 N 1.25 4.60 0.29 2.92 1.01 0.17 -1.85 120.40 128.78 1it8 s VAL 511 Ca 0.12 1.92 0.07 0.00 0.00 0.00 0.00 61.98 64.08 1it8 s VAL 511 Cb -0.19 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 31.88 1it8 s VAL 511 CO -0.17 -0.22 0.27 0.68 0.00 0.00 0.00 175.10 175.66 1it8 s VAL 512 N 3.32 4.16 1.03 2.92 -7.23 0.15 -1.30 120.40 123.45 1it8 s VAL 512 Ca 0.46 -1.32 -0.14 0.00 -1.81 0.00 0.00 61.98 59.17 1it8 s VAL 512 Cb -0.16 -3.37 0.11 0.00 0.56 0.00 0.00 36.38 33.53 1it8 s VAL 512 CO 0.09 -0.27 0.48 -3.20 -0.31 0.00 0.00 175.10 171.88 1it8 n ASN 513 N -1.31 -1.78 0.10 4.85 5.15 0.26 -4.35 115.26 118.18 1it8 n ASN 513 Ca -0.05 0.13 -0.05 0.00 -0.60 0.00 0.00 54.58 54.01 1it8 n ASN 513 Cb 0.58 -1.18 0.08 0.00 -0.53 0.00 0.00 39.78 38.74 1it8 n ASN 513 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1it8 h LYS 514 N -1.94 0.12 -0.27 1.20 6.56 -2.00 -2.65 116.57 117.59 1it8 h LYS 514 Ca -0.49 -0.10 -0.19 0.00 -1.06 0.00 0.00 60.65 58.81 1it8 h LYS 514 Cb 1.31 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 33.00 1it8 h LYS 514 CO 0.39 0.78 -0.58 1.49 -2.06 0.00 0.00 179.45 179.47 1it8 h GLU 515 N 0.08 0.86 0.00 3.15 4.81 -1.96 -3.26 114.58 118.25 1it8 h GLU 515 Ca -0.02 -0.56 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 1it8 h GLU 515 Cb 1.26 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.72 1it8 h GLU 515 CO 0.10 1.19 0.00 0.00 -0.73 0.00 0.00 179.01 179.58 1it8 h ALA 516 N 0.68 1.00 -0.75 2.92 0.00 -1.89 -3.37 119.26 117.85 1it8 h ALA 516 Ca 0.01 0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.08 1it8 h ALA 516 Cb 1.19 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.85 1it8 h ALA 516 CO 0.13 0.00 0.00 1.49 0.00 0.00 0.00 179.25 180.87 1it8 h GLU 517 N 0.00 0.10 0.16 0.00 4.81 -1.52 -2.46 114.58 115.67 1it8 h GLU 517 Ca 0.00 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1it8 h GLU 517 Cb 0.89 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.23 1it8 h GLU 517 CO 0.00 0.06 -0.23 -1.35 -0.73 0.00 0.00 179.01 176.76 1it8 h PRO 518 N 0.10 -0.44 -0.11 0.92 0.11 -1.81 -2.05 132.00 128.72 1it8 h PRO 518 Ca 0.41 0.03 0.04 0.00 0.11 0.00 0.00 66.00 66.59 1it8 h PRO 518 Cb 0.71 0.10 -0.05 0.00 0.11 0.00 0.00 31.00 31.88 1it8 h PRO 518 CO -0.66 -0.29 -0.17 0.74 -0.21 0.00 0.00 178.00 177.41 1it8 h PHE 519 N -0.45 -0.43 -0.04 0.65 -1.00 -1.72 -0.69 116.94 113.25 1it8 h PHE 519 Ca 0.02 0.02 0.01 0.00 2.81 0.00 0.00 57.97 60.83 1it8 h PHE 519 Cb 0.45 0.21 -0.00 0.00 3.61 0.00 0.00 35.95 40.22 1it8 h PHE 519 CO -0.19 -0.24 0.04 0.00 -1.61 0.00 0.00 178.31 176.31 1it8 h ALA 520 N 0.81 1.80 -0.80 2.45 0.00 -1.42 -0.32 119.26 121.79 1it8 h ALA 520 Ca 0.09 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1it8 h ALA 520 Cb 0.35 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1it8 h ALA 520 CO -0.24 -0.06 0.42 0.00 0.00 0.00 0.00 179.25 179.37 1it8 h ARG 521 N 0.00 1.12 0.00 0.00 2.47 -0.38 -3.30 114.38 114.29 1it8 h ARG 521 Ca 0.02 -0.14 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 1it8 h ARG 521 Cb 0.10 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 28.21 1it8 h ARG 521 CO -0.00 0.84 0.00 1.63 0.56 0.00 0.00 179.97 183.00 1it8 n LYS 522 N -4.40 0.00 0.00 0.04 4.01 -0.25 -1.18 118.16 116.38 1it8 n LYS 522 Ca 0.08 0.33 0.00 0.00 -0.51 0.00 0.00 58.31 58.20 1it8 n LYS 522 Cb 0.11 -0.95 0.00 0.00 -0.51 0.00 0.00 35.03 33.67 1it8 n LYS 522 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1it8 n GLY 523 N 1.42 0.00 3.59 0.72 0.00 -0.49 -1.35 105.19 109.08 1it8 n GLY 523 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1it8 n GLY 523 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1it8 n LYS 524 N 0.00 0.66 -2.42 1.61 4.76 -0.94 -4.51 118.16 117.32 1it8 n LYS 524 Ca 0.00 0.27 -0.35 0.00 -2.87 0.00 0.00 58.31 55.36 1it8 n LYS 524 Cb 0.00 -2.12 -0.02 0.00 -1.84 0.00 0.00 35.03 31.05 1it8 n LYS 524 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1it8 s ASP 525 N -1.42 6.07 -0.15 4.39 1.01 -1.26 -4.27 116.67 121.05 1it8 s ASP 525 Ca 0.74 2.04 -0.21 0.00 0.71 0.00 0.00 52.55 55.83 1it8 s ASP 525 Cb -0.38 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 40.95 1it8 s ASP 525 CO 0.49 -0.97 0.63 -0.69 0.21 0.00 0.00 175.17 174.84 1it8 s VAL 526 N -1.88 5.06 -0.18 -1.27 1.01 -0.65 -4.91 120.40 117.58 1it8 s VAL 526 Ca 0.70 1.23 -0.13 0.00 0.00 0.00 0.00 61.98 63.77 1it8 s VAL 526 Cb -0.20 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 1it8 s VAL 526 CO 0.23 0.19 0.28 -0.36 0.00 0.00 0.00 175.10 175.44 1it8 s PHE 527 N 1.36 3.42 0.33 5.22 0.40 -1.26 0.42 117.98 127.87 1it8 s PHE 527 Ca 0.31 0.53 0.23 0.00 -0.60 0.00 0.00 56.93 57.40 1it8 s PHE 527 Cb -0.16 -2.35 1.13 0.00 0.51 0.00 0.00 43.02 42.15 1it8 s PHE 527 CO 0.12 0.18 1.21 0.00 0.70 0.00 0.00 175.22 177.43 1it8 n ALA 528 N 3.81 0.99 0.36 5.36 0.00 -0.47 0.86 120.51 131.43 1it8 n ALA 528 Ca -0.12 0.70 0.14 0.00 0.00 0.00 0.00 53.44 54.16 1it8 n ALA 528 Cb 0.52 -0.81 0.56 0.00 0.00 0.00 0.00 19.45 19.71 1it8 n ALA 528 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1it8 h LYS 529 N 0.00 0.00 -0.03 0.00 2.10 -1.72 -2.42 116.57 114.51 1it8 h LYS 529 Ca 0.68 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.33 1it8 h LYS 529 Cb 2.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.42 1it8 h LYS 529 CO -0.42 0.00 0.00 1.19 -2.00 0.00 0.00 179.45 178.22 1it8 n PHE 530 N -2.53 0.00 -3.14 0.07 0.99 0.25 -4.86 117.46 108.25 1it8 n PHE 530 Ca 0.02 -0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 57.06 1it8 n PHE 530 Cb 0.26 0.00 -0.07 0.00 -1.00 0.00 0.00 39.48 38.67 1it8 n PHE 530 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1it8 s VAL 531 N -2.00 5.00 -0.05 -4.37 1.01 -0.91 0.92 120.40 120.00 1it8 s VAL 531 Ca 0.32 1.06 0.13 0.00 0.00 0.00 0.00 61.98 63.49 1it8 s VAL 531 Cb 0.20 -3.92 -0.20 0.00 0.00 0.00 0.00 36.38 32.47 1it8 s VAL 531 CO 0.31 0.03 0.76 0.16 0.00 0.00 0.00 175.10 176.36 1it8 h ILE 532 N 5.42 0.83 -1.59 2.22 3.07 -1.51 -3.43 117.51 122.52 1it8 h ILE 532 Ca -0.27 -2.58 0.06 0.00 1.55 0.00 0.00 64.86 63.62 1it8 h ILE 532 Cb 1.13 2.36 -0.25 0.00 -0.27 0.00 0.00 36.82 39.79 1it8 h ILE 532 CO 0.76 0.47 0.48 0.12 -1.05 0.00 0.00 178.15 178.93 1it8 s PHE 533 N -2.69 -0.44 0.04 0.16 5.36 -1.12 -4.95 117.98 114.34 1it8 s PHE 533 Ca -0.04 0.99 -0.05 0.00 -0.96 0.00 0.00 56.93 56.87 1it8 s PHE 533 Cb 0.08 0.39 -0.01 0.00 -0.34 0.00 0.00 43.02 43.14 1it8 s PHE 533 CO 0.82 -0.27 0.08 0.00 -1.46 0.00 0.00 175.22 174.39 1it8 s ALA 534 N -0.22 -0.04 -0.17 11.12 0.00 -1.26 0.42 121.76 131.61 1it8 s ALA 534 Ca 0.01 -0.56 -0.36 0.00 0.00 0.00 0.00 51.96 51.06 1it8 s ALA 534 Cb -0.03 0.24 -0.13 0.00 0.00 0.00 0.00 23.12 23.20 1it8 s ALA 534 CO -0.03 -0.30 1.89 -3.47 0.00 0.00 0.00 175.76 173.84 1it8 n ASP 535 N 0.83 3.05 0.28 0.00 2.03 -0.25 -4.66 116.55 117.84 1it8 n ASP 535 Ca -0.19 0.93 0.16 0.00 0.52 0.00 0.00 54.79 56.21 1it8 n ASP 535 Cb 0.58 -1.30 0.92 0.00 -0.72 0.00 0.00 41.12 40.60 1it8 n ASP 535 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1it8 h PRO 536 N 9.16 0.00 0.00 -0.67 0.11 -1.92 -0.61 132.00 138.07 1it8 h PRO 536 Ca -0.46 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1it8 h PRO 536 Cb 1.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 1it8 h PRO 536 CO 0.96 0.00 -0.09 0.78 -0.21 0.00 0.00 178.00 179.44 1it8 h GLY 537 N 0.00 0.00 -4.27 -0.55 0.00 -1.97 -3.41 103.07 92.87 1it8 h GLY 537 Ca 0.02 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.79 1it8 h GLY 537 CO -0.00 0.00 0.69 1.39 0.00 0.00 0.00 176.54 178.62 1it8 n ILE 538 N -3.18 1.51 -4.32 2.60 5.41 -0.24 -4.89 119.36 116.25 1it8 n ILE 538 Ca 0.01 -0.38 -0.19 0.00 1.00 0.00 0.00 62.75 63.20 1it8 n ILE 538 Cb 0.42 -1.75 -0.10 0.00 -0.71 0.00 0.00 39.64 37.50 1it8 n ILE 538 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1it8 s ARG 539 N -1.23 1.26 0.11 0.38 1.81 -1.26 -1.48 118.95 118.54 1it8 s ARG 539 Ca 0.60 -1.50 -0.36 0.00 -1.72 0.00 0.00 55.73 52.75 1it8 s ARG 539 Cb -0.55 -1.11 -0.16 0.00 -0.45 0.00 0.00 34.95 32.69 1it8 s ARG 539 CO 0.56 0.20 1.37 -2.30 -0.68 0.00 0.00 175.30 174.45 1it8 n PRO 540 N -0.11 1.37 -0.93 3.54 -0.02 -1.25 -1.42 135.00 136.18 1it8 n PRO 540 Ca -0.10 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1it8 n PRO 540 Cb 0.59 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1it8 n PRO 540 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1it8 n TYR 541 N 2.58 0.00 -1.19 6.00 4.02 0.24 -2.56 117.16 126.24 1it8 n TYR 541 Ca 0.18 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.76 1it8 n TYR 541 Cb 0.22 -0.57 0.12 0.00 -0.02 0.00 0.00 39.34 39.08 1it8 n TYR 541 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1it8 s ASP 542 N -2.30 3.91 0.08 7.72 1.01 -0.50 -4.64 116.67 121.94 1it8 s ASP 542 Ca 0.00 1.69 -0.28 0.00 0.71 0.00 0.00 52.55 54.67 1it8 s ASP 542 Cb 0.00 -2.37 -0.06 0.00 1.01 0.00 0.00 42.92 41.51 1it8 s ASP 542 CO 0.00 -2.39 0.90 -1.61 0.21 0.00 0.00 175.17 172.27 1it8 s GLU 543 N -4.90 4.63 0.08 8.23 0.41 -1.26 -2.03 118.70 123.85 1it8 s GLU 543 Ca 0.63 1.32 0.05 0.00 -0.41 0.00 0.00 54.97 56.56 1it8 s GLU 543 Cb -0.18 -3.38 -0.03 0.00 -1.78 0.00 0.00 34.13 28.76 1it8 s GLU 543 CO 0.57 0.22 -0.15 0.54 -0.49 0.00 0.00 175.26 175.95 1it8 s VAL 544 N 0.03 1.18 -0.43 2.63 0.11 -0.44 -4.92 120.40 118.56 1it8 s VAL 544 Ca 0.44 -1.39 -0.13 0.00 -2.93 0.00 0.00 61.98 57.98 1it8 s VAL 544 Cb -0.22 -1.18 0.05 0.00 -1.53 0.00 0.00 36.38 33.51 1it8 s VAL 544 CO 0.27 -0.24 0.30 -0.76 -3.33 0.00 0.00 175.10 171.35 1it8 s LEU 545 N -1.86 5.22 0.17 2.54 1.43 0.94 -1.88 118.68 125.24 1it8 s LEU 545 Ca 0.00 -1.22 -0.30 0.00 -1.03 0.00 0.00 54.13 51.58 1it8 s LEU 545 Cb -0.09 -2.10 -0.08 0.00 0.03 0.00 0.00 46.19 43.95 1it8 s LEU 545 CO 0.02 -0.53 1.15 -0.69 0.23 0.00 0.00 176.35 176.53 1it8 s VAL 546 N 1.58 3.75 0.17 -1.59 1.01 0.12 -1.77 120.40 123.67 1it8 s VAL 546 Ca 0.03 1.48 -0.21 0.00 0.00 0.00 0.00 61.98 63.28 1it8 s VAL 546 Cb -0.22 -3.94 0.05 0.00 0.00 0.00 0.00 36.38 32.27 1it8 s VAL 546 CO 0.06 0.24 0.56 0.54 0.00 0.00 0.00 175.10 176.50 1it8 s VAL 547 N -0.07 0.02 0.73 2.92 0.11 -0.77 -0.72 120.40 122.62 1it8 s VAL 547 Ca 0.51 -0.30 0.00 0.00 -2.93 0.00 0.00 61.98 59.27 1it8 s VAL 547 Cb -0.31 -1.19 0.14 0.00 -1.53 0.00 0.00 36.38 33.50 1it8 s VAL 547 CO 0.35 -0.08 1.00 -0.46 -3.33 0.00 0.00 175.10 172.58 1it8 n ASN 548 N -0.35 1.37 0.33 3.54 0.23 -1.13 -0.67 115.26 118.58 1it8 n ASN 548 Ca -0.15 -2.15 0.23 0.00 -0.53 0.00 0.00 54.58 51.97 1it8 n ASN 548 Cb 0.64 -0.64 1.20 0.00 -2.08 0.00 0.00 39.78 38.90 1it8 n ASN 548 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1it8 h GLU 549 N 0.00 0.00 -0.00 -3.83 5.08 -1.94 0.16 114.58 114.04 1it8 h GLU 549 Ca -0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1it8 h GLU 549 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1it8 h GLU 549 CO 0.36 0.00 -0.24 0.09 -1.00 0.00 0.00 179.01 178.21 1it8 n ASN 550 N -3.06 0.72 -1.58 1.42 3.02 -1.26 -4.93 115.26 109.59 1it8 n ASN 550 Ca -0.03 -0.62 -0.07 0.00 -0.03 0.00 0.00 54.58 53.83 1it8 n ASN 550 Cb 0.07 0.06 0.03 0.00 -0.61 0.00 0.00 39.78 39.33 1it8 n ASN 550 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1it8 n ASP 551 N -0.93 -3.11 -4.58 6.41 4.64 0.55 -5.03 116.55 114.51 1it8 n ASP 551 Ca 0.11 -0.18 -0.37 0.00 -1.38 0.00 0.00 54.79 52.97 1it8 n ASP 551 Cb 0.32 -1.99 -0.11 0.00 -1.04 0.00 0.00 41.12 38.30 1it8 n ASP 551 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 1it8 s GLU 552 N -5.20 3.91 -0.06 -0.67 2.02 -1.26 -4.89 118.70 112.55 1it8 s GLU 552 Ca 0.15 -0.35 -0.34 0.00 0.02 0.00 0.00 54.97 54.44 1it8 s GLU 552 Cb -0.07 -3.48 -0.12 0.00 0.10 0.00 0.00 34.13 30.56 1it8 s GLU 552 CO 0.24 -0.05 1.84 -0.11 0.02 0.00 0.00 175.26 177.19 1it8 n LEU 553 N 4.61 3.36 -0.10 1.80 7.94 -1.26 -2.86 117.00 130.49 1it8 n LEU 553 Ca -0.15 0.99 -0.12 0.00 -1.11 0.00 0.00 56.01 55.62 1it8 n LEU 553 Cb 0.52 -1.37 -0.12 0.00 0.53 0.00 0.00 43.42 42.98 1it8 n LEU 553 CO 0.33 -0.10 -1.14 0.18 -1.11 0.00 0.00 177.39 175.56 1it8 n LEU 554 N 6.16 1.39 0.00 -1.96 4.77 0.10 -4.81 117.00 122.67 1it8 n LEU 554 Ca 0.22 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1it8 n LEU 554 Cb 0.29 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1it8 n LEU 554 CO 0.72 0.63 0.00 0.00 -1.33 0.00 0.00 177.39 177.42 1it8 n ALA 555 N -2.87 0.00 -2.57 -1.18 0.00 -1.18 -1.13 120.51 111.58 1it8 n ALA 555 Ca -0.33 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.80 1it8 n ALA 555 Cb 0.99 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.34 1it8 n ALA 555 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1it8 s THR 556 N -2.00 3.43 0.00 0.00 2.01 -0.67 0.13 115.64 118.54 1it8 s THR 556 Ca 0.00 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 60.98 1it8 s THR 556 Cb 0.00 -2.53 0.00 0.00 0.01 0.00 0.00 72.50 69.98 1it8 s THR 556 CO 0.00 0.28 0.00 0.61 -0.69 0.00 0.00 174.62 174.82 1it8 n GLY 557 N 1.22 2.98 3.10 4.40 0.00 -0.79 0.75 105.19 116.85 1it8 n GLY 557 Ca -0.15 -0.77 -0.26 0.00 0.00 0.00 0.00 46.02 44.84 1it8 n GLY 557 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1it8 s GLN 558 N 0.86 1.86 0.34 1.61 0.74 -0.63 -1.33 119.66 123.11 1it8 s GLN 558 Ca 0.00 -0.56 -0.27 0.00 0.05 0.00 0.00 55.36 54.58 1it8 s GLN 558 Cb 0.00 -1.56 -0.09 0.00 1.10 0.00 0.00 33.01 32.46 1it8 s GLN 558 CO 0.00 0.16 1.08 0.00 -0.55 0.00 0.00 175.29 175.98 1it8 s ALA 559 N 0.29 3.24 -1.02 1.58 0.00 -0.86 -0.63 121.76 124.35 1it8 s ALA 559 Ca -0.09 0.82 0.08 0.00 0.00 0.00 0.00 51.96 52.77 1it8 s ALA 559 Cb -0.14 -3.31 0.08 0.00 0.00 0.00 0.00 23.12 19.76 1it8 s ALA 559 CO 0.03 -0.22 0.81 1.28 0.00 0.00 0.00 175.76 177.66 1it8 n LEU 560 N 0.52 1.80 -4.16 0.00 4.77 -0.18 0.81 117.00 120.56 1it8 n LEU 560 Ca 0.02 -1.10 -0.11 0.00 -0.03 0.00 0.00 56.01 54.79 1it8 n LEU 560 Cb 0.47 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 1it8 n LEU 560 CO 0.50 0.37 -0.23 -0.76 -1.33 0.00 0.00 177.39 175.93 1it8 s LEU 561 N -0.73 1.35 0.44 2.23 1.43 -1.25 -4.84 118.68 117.30 1it8 s LEU 561 Ca 0.11 -1.28 -0.09 0.00 -1.03 0.00 0.00 54.13 51.85 1it8 s LEU 561 Cb 0.07 0.45 -0.05 0.00 0.03 0.00 0.00 46.19 46.68 1it8 s LEU 561 CO 0.11 -0.81 0.78 -0.94 0.23 0.00 0.00 176.35 175.72 1it8 s SER 562 N -3.10 6.41 0.07 2.29 1.04 -1.26 -3.82 113.70 115.32 1it8 s SER 562 Ca 0.32 1.06 -0.13 0.00 0.48 0.00 0.00 55.95 57.68 1it8 s SER 562 Cb 0.07 -2.30 -0.03 0.00 0.10 0.00 0.00 66.02 63.86 1it8 s SER 562 CO 0.07 -0.48 1.21 0.61 0.98 0.00 0.00 173.24 175.63 1it8 n GLY 563 N -1.70 -2.83 0.32 7.32 0.00 -0.55 -0.50 105.19 107.25 1it8 n GLY 563 Ca 0.02 0.83 0.20 0.00 0.00 0.00 0.00 46.02 47.07 1it8 n GLY 563 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1it8 h ARG 564 N 0.00 0.17 -0.31 1.61 2.43 -1.81 -0.89 114.38 115.58 1it8 h ARG 564 Ca 0.07 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.12 1it8 h ARG 564 Cb 0.18 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1it8 h ARG 564 CO -0.41 0.11 -0.25 0.93 -1.51 0.00 0.00 179.97 178.85 1it8 h GLU 565 N 0.17 0.71 -1.00 0.20 5.08 -1.16 -3.09 114.58 115.50 1it8 h GLU 565 Ca 0.67 -0.35 0.21 0.00 -1.00 0.00 0.00 59.36 58.88 1it8 h GLU 565 Cb 1.51 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.65 1it8 h GLU 565 CO -0.71 0.97 0.61 0.52 -1.00 0.00 0.00 179.01 179.40 1it8 h MET 566 N 0.47 0.67 0.70 2.33 2.86 -0.01 -0.71 114.93 121.24 1it8 h MET 566 Ca 0.06 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 1it8 h MET 566 Cb 0.81 -0.15 0.01 0.00 0.06 0.00 0.00 31.60 32.32 1it8 h MET 566 CO 0.06 0.44 -0.34 0.82 1.06 0.00 0.00 176.91 178.96 1it8 h ILE 567 N 0.69 0.00 -0.18 -1.22 2.04 -1.45 -3.32 117.51 114.06 1it8 h ILE 567 Ca 0.59 -0.25 -0.06 0.00 1.00 0.00 0.00 64.86 66.14 1it8 h ILE 567 Cb 1.02 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1it8 h ILE 567 CO -0.39 0.00 -0.15 -0.37 0.00 0.00 0.00 178.15 177.25 1it8 h VAL 568 N -1.20 1.20 -3.38 1.67 -1.51 -1.41 -3.45 116.25 108.17 1it8 h VAL 568 Ca -0.10 -0.89 -0.53 0.00 -1.23 0.00 0.00 66.70 63.95 1it8 h VAL 568 Cb 0.73 1.23 0.05 0.00 -2.13 0.00 0.00 31.29 31.16 1it8 h VAL 568 CO 0.16 0.28 0.74 -0.36 -1.23 0.00 0.00 177.57 177.16 1it8 s PHE 569 N -4.69 3.07 -0.52 5.19 0.40 -0.31 -4.90 117.98 116.23 1it8 s PHE 569 Ca -0.06 1.07 0.10 0.00 -0.60 0.00 0.00 56.93 57.43 1it8 s PHE 569 Cb 0.15 -3.77 -0.09 0.00 0.51 0.00 0.00 43.02 39.82 1it8 s PHE 569 CO 0.75 -2.50 0.44 1.04 0.70 0.00 0.00 175.22 175.64 1it8 n GLN 570 N 2.41 3.60 -4.89 0.44 1.13 -1.26 -2.97 117.38 115.84 1it8 n GLN 570 Ca 0.07 -0.09 -0.26 0.00 -1.94 0.00 0.00 57.00 54.78 1it8 n GLN 570 Cb 0.41 -0.97 -0.16 0.00 0.11 0.00 0.00 30.24 29.63 1it8 n GLN 570 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 1it8 s TYR 571 N -1.82 1.69 0.00 1.08 1.51 -1.26 -4.28 117.35 114.27 1it8 s TYR 571 Ca 0.04 -0.36 0.00 0.00 -1.01 0.00 0.00 57.07 55.74 1it8 s TYR 571 Cb 0.07 -1.10 0.00 0.00 -0.11 0.00 0.00 41.96 40.82 1it8 s TYR 571 CO 0.37 -0.06 0.00 0.41 -1.11 0.00 0.00 175.55 175.16 1it8 n GLY 572 N 2.75 0.87 3.81 0.71 0.00 -1.26 -4.80 105.19 107.27 1it8 n GLY 572 Ca -0.16 -1.88 -0.33 0.00 0.00 0.00 0.00 46.02 43.66 1it8 n GLY 572 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1it8 s ARG 573 N -2.29 3.73 -0.03 1.61 0.52 -1.26 -1.36 118.95 119.87 1it8 s ARG 573 Ca 0.00 1.17 0.01 0.00 -0.52 0.00 0.00 55.73 56.39 1it8 s ARG 573 Cb 0.00 -2.10 -0.03 0.00 0.52 0.00 0.00 34.95 33.35 1it8 s ARG 573 CO 0.00 -0.46 -0.01 0.00 0.02 0.00 0.00 175.30 174.84 1it8 n ALA 574 N -1.44 1.93 -3.70 2.13 0.00 0.17 -4.46 120.51 115.14 1it8 n ALA 574 Ca 0.08 -0.16 -0.17 0.00 0.00 0.00 0.00 53.44 53.19 1it8 n ALA 574 Cb 0.53 0.33 -0.17 0.00 0.00 0.00 0.00 19.45 20.14 1it8 n ALA 574 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1it8 s VAL 575 N -2.07 -0.14 -0.77 0.00 1.01 -0.96 -1.01 120.40 116.47 1it8 s VAL 575 Ca -0.03 0.34 -0.24 0.00 0.00 0.00 0.00 61.98 62.05 1it8 s VAL 575 Cb 0.01 -0.19 0.06 0.00 0.00 0.00 0.00 36.38 36.26 1it8 s VAL 575 CO 0.09 0.14 1.18 -0.75 0.00 0.00 0.00 175.10 175.76 1it8 s LYS 576 N 1.90 3.26 0.00 2.72 2.20 0.19 -1.64 119.74 128.37 1it8 s LYS 576 Ca 0.00 -0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 54.60 1it8 s LYS 576 Cb -0.12 -4.43 -0.07 0.00 -1.51 0.00 0.00 37.83 31.70 1it8 s LYS 576 CO -0.04 -2.01 1.69 0.08 -0.36 0.00 0.00 175.35 174.71 1it8 s VAL 577 N 4.77 3.33 0.00 4.02 1.01 -1.26 -1.61 120.40 130.65 1it8 s VAL 577 Ca 0.32 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.85 1it8 s VAL 577 Cb -0.10 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.93 1it8 s VAL 577 CO 0.08 -0.03 0.53 0.54 0.00 0.00 0.00 175.10 176.22 1it8 n ARG 578 N 6.61 0.00 -3.83 2.72 1.74 0.23 -4.83 116.66 119.30 1it8 n ARG 578 Ca 0.17 0.44 -0.11 0.00 -0.77 0.00 0.00 57.85 57.59 1it8 n ARG 578 Cb 0.42 -1.23 -0.08 0.00 -1.02 0.00 0.00 32.46 30.55 1it8 n ARG 578 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1it8 s LYS 579 N -1.95 0.68 0.81 5.56 2.20 -1.06 -4.98 119.74 120.98 1it8 s LYS 579 Ca 0.00 -0.56 -0.06 0.00 -0.36 0.00 0.00 55.97 54.99 1it8 s LYS 579 Cb 0.00 0.28 0.16 0.00 -1.51 0.00 0.00 37.83 36.76 1it8 s LYS 579 CO 0.00 -0.19 1.11 0.20 -0.36 0.00 0.00 175.35 176.11 1it8 s GLY 580 N -1.94 1.77 0.04 5.54 0.00 -0.46 -1.66 107.32 110.61 1it8 s GLY 580 Ca -0.07 -1.58 0.20 0.00 0.00 0.00 0.00 44.72 43.27 1it8 s GLY 580 CO -0.03 -0.93 0.71 -0.62 0.00 0.00 0.00 173.10 172.23 1it8 n VAL 581 N -3.16 0.80 1.92 1.40 0.31 -0.28 -4.86 118.33 114.46 1it8 n VAL 581 Ca 0.15 -0.63 0.15 0.00 -0.01 0.00 0.00 64.34 64.01 1it8 n VAL 581 Cb 0.60 -0.43 0.91 0.00 -0.91 0.00 0.00 33.84 34.01 1it8 n VAL 581 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72