#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 0.46 -4.34 -1.58 2.81 -1.26 -4.86 117.12 108.35 1it8 n MET 7 Ca 0.00 -0.34 -0.31 0.00 -1.81 0.00 0.00 57.70 55.23 1it8 n MET 7 Cb 0.00 -1.49 -0.16 0.00 -0.71 0.00 0.00 33.22 30.85 1it8 n MET 7 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 1it8 s LEU 8 N -2.78 1.93 0.10 4.03 1.98 -1.26 -1.92 118.68 120.77 1it8 s LEU 8 Ca 0.14 -0.55 0.05 0.00 -2.89 0.00 0.00 54.13 50.88 1it8 s LEU 8 Cb 0.17 -1.32 -0.04 0.00 0.66 0.00 0.00 46.19 45.67 1it8 s LEU 8 CO 0.69 0.01 -0.00 -0.54 -1.89 0.00 0.00 176.35 174.63 1it8 s LYS 9 N 1.13 2.52 -0.29 1.98 1.02 -0.04 -4.97 119.74 121.08 1it8 s LYS 9 Ca -0.01 -0.88 -0.10 0.00 0.02 0.00 0.00 55.97 54.99 1it8 s LYS 9 Cb -0.14 -2.51 0.12 0.00 -0.52 0.00 0.00 37.83 34.78 1it8 s LYS 9 CO -0.07 0.53 0.64 0.12 -0.92 0.00 0.00 175.35 175.65 1it8 s PHE 10 N -1.37 -1.29 0.06 3.18 5.36 -1.26 -1.09 117.98 121.57 1it8 s PHE 10 Ca 0.26 2.27 0.02 0.00 -0.96 0.00 0.00 56.93 58.52 1it8 s PHE 10 Cb -0.11 0.76 -0.03 0.00 -0.34 0.00 0.00 43.02 43.30 1it8 s PHE 10 CO 0.18 -0.65 -0.07 -1.83 -1.46 0.00 0.00 175.22 171.40 1it8 s GLU 11 N 2.77 0.61 -0.01 10.12 -1.05 -0.70 -4.69 118.70 125.75 1it8 s GLU 11 Ca -0.06 -0.94 -0.24 0.00 -0.15 0.00 0.00 54.97 53.57 1it8 s GLU 11 Cb -0.11 -0.21 -0.05 0.00 -0.44 0.00 0.00 34.13 33.32 1it8 s GLU 11 CO -0.19 0.01 0.73 0.42 0.95 0.00 0.00 175.26 177.19 1it8 s ILE 12 N -2.20 4.90 -0.12 1.83 1.01 -1.26 -1.00 121.20 124.36 1it8 s ILE 12 Ca -0.03 1.53 0.06 0.00 0.00 0.00 0.00 60.65 62.20 1it8 s ILE 12 Cb -0.04 -4.07 -0.11 0.00 0.01 0.00 0.00 42.46 38.24 1it8 s ILE 12 CO -0.02 0.31 -0.03 0.29 0.00 0.00 0.00 174.94 175.49 1it8 n LYS 13 N 3.28 1.45 -3.61 2.79 5.02 0.26 -4.83 118.16 122.53 1it8 n LYS 13 Ca -0.02 0.03 -0.13 0.00 -2.02 0.00 0.00 58.31 56.17 1it8 n LYS 13 Cb 0.51 -1.27 -0.05 0.00 -0.02 0.00 0.00 35.03 34.20 1it8 n LYS 13 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1it8 s ALA 14 N -2.26 -1.19 0.23 7.82 0.00 -1.04 -4.98 121.76 120.34 1it8 s ALA 14 Ca -0.11 0.45 -0.14 0.00 0.00 0.00 0.00 51.96 52.16 1it8 s ALA 14 Cb 0.04 0.41 0.01 0.00 0.00 0.00 0.00 23.12 23.57 1it8 s ALA 14 CO 0.37 -0.50 0.49 -0.98 0.00 0.00 0.00 175.76 175.14 1it8 s ARG 15 N -2.59 1.49 -0.29 0.00 1.70 -1.26 0.42 118.95 118.42 1it8 s ARG 15 Ca -0.05 -1.12 -0.18 0.00 -0.47 0.00 0.00 55.73 53.92 1it8 s ARG 15 Cb -0.01 0.49 0.16 0.00 -0.57 0.00 0.00 34.95 35.02 1it8 s ARG 15 CO -0.03 -0.62 1.09 0.34 -1.08 0.00 0.00 175.30 175.00 1it8 s ASP 16 N -2.97 -0.36 0.74 -2.89 2.15 -1.11 -4.80 116.67 107.43 1it8 s ASP 16 Ca 0.17 0.59 0.00 0.00 0.43 0.00 0.00 52.55 53.74 1it8 s ASP 16 Cb -0.01 1.04 0.00 0.00 -0.30 0.00 0.00 42.92 43.65 1it8 s ASP 16 CO 0.05 -0.09 0.00 0.61 -0.17 0.00 0.00 175.17 175.56 1it8 n GLY 17 N 3.21 0.55 0.83 2.66 0.00 -1.26 -1.16 105.19 110.02 1it8 n GLY 17 Ca -0.17 -0.81 0.03 0.00 0.00 0.00 0.00 46.02 45.07 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 3.94 2.83 -2.55 4.61 0.00 -0.77 -4.16 120.51 124.42 1it8 n ALA 18 Ca 0.00 -0.58 -0.23 0.00 0.00 0.00 0.00 53.44 52.63 1it8 n ALA 18 Cb 0.00 -1.03 -0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 -0.45 1.44 -0.17 0.00 0.00 -0.31 -2.90 107.32 104.93 1it8 s GLY 19 Ca 0.18 -1.05 -0.27 0.00 0.00 0.00 0.00 44.72 43.58 1it8 s GLY 19 CO 0.07 -0.95 0.69 1.09 0.00 0.00 0.00 173.10 173.99 1it8 s ARG 20 N -4.36 0.91 -0.18 2.90 3.03 -1.26 -2.77 118.95 117.22 1it8 s ARG 20 Ca 0.43 0.67 -0.15 0.00 2.03 0.00 0.00 55.73 58.71 1it8 s ARG 20 Cb -0.10 0.44 -0.04 0.00 -1.03 0.00 0.00 34.95 34.22 1it8 s ARG 20 CO 0.36 -0.19 0.34 0.42 -1.13 0.00 0.00 175.30 175.09 1it8 s ILE 21 N -0.28 5.26 0.24 4.99 1.01 0.17 -4.18 121.20 128.41 1it8 s ILE 21 Ca -0.05 0.61 0.04 0.00 0.00 0.00 0.00 60.65 61.25 1it8 s ILE 21 Cb -0.03 -3.67 -0.05 0.00 0.01 0.00 0.00 42.46 38.71 1it8 s ILE 21 CO 0.05 0.33 -0.00 -0.83 0.00 0.00 0.00 174.94 174.48 1it8 s GLY 22 N 0.75 1.62 -0.24 6.18 0.00 -0.56 -0.57 107.32 114.50 1it8 s GLY 22 Ca 0.17 -1.80 -0.04 0.00 0.00 0.00 0.00 44.72 43.05 1it8 s GLY 22 CO 0.06 -1.69 -0.01 1.25 0.00 0.00 0.00 173.10 172.71 1it8 s LYS 23 N -3.86 3.26 -0.18 2.90 2.20 -0.17 -0.45 119.74 123.44 1it8 s LYS 23 Ca 0.29 -0.71 -0.01 0.00 -0.36 0.00 0.00 55.97 55.18 1it8 s LYS 23 Cb 0.06 -3.10 0.00 0.00 -1.51 0.00 0.00 37.83 33.28 1it8 s LYS 23 CO 0.10 -0.28 -0.14 -1.17 -0.36 0.00 0.00 175.35 173.50 1it8 s LEU 24 N 1.47 2.51 -0.20 5.43 0.20 -0.14 -1.71 118.68 126.24 1it8 s LEU 24 Ca 0.04 -0.48 0.01 0.00 0.69 0.00 0.00 54.13 54.39 1it8 s LEU 24 Cb -0.15 -1.59 0.03 0.00 -0.43 0.00 0.00 46.19 44.05 1it8 s LEU 24 CO -0.02 0.04 -0.17 -0.70 -0.29 0.00 0.00 176.35 175.21 1it8 s GLU 25 N 1.06 2.85 -0.26 1.98 2.12 -0.25 -0.56 118.70 125.64 1it8 s GLU 25 Ca -0.01 -0.93 -0.03 0.00 0.36 0.00 0.00 54.97 54.36 1it8 s GLU 25 Cb -0.15 -2.66 0.02 0.00 0.26 0.00 0.00 34.13 31.61 1it8 s GLU 25 CO -0.03 -0.28 -0.02 0.08 -0.54 0.00 0.00 175.26 174.46 1it8 s VAL 26 N 1.26 3.21 -0.96 3.70 1.01 0.21 -0.86 120.40 127.98 1it8 s VAL 26 Ca 0.02 -0.92 -0.18 0.00 0.00 0.00 0.00 61.98 60.90 1it8 s VAL 26 Cb -0.14 -2.64 0.03 0.00 0.00 0.00 0.00 36.38 33.62 1it8 s VAL 26 CO -0.11 0.16 0.34 0.59 0.00 0.00 0.00 175.10 176.09 1it8 n ASN 27 N 4.73 -1.85 0.00 3.32 3.02 -0.81 -0.59 115.26 123.07 1it8 n ASN 27 Ca -0.16 -0.95 0.00 0.00 -0.03 0.00 0.00 54.58 53.44 1it8 n ASN 27 Cb 0.47 -1.15 0.00 0.00 -0.61 0.00 0.00 39.78 38.50 1it8 n ASN 27 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1it8 n GLY 28 N -1.90 2.91 3.66 7.41 0.00 -1.26 -5.02 105.19 110.98 1it8 n GLY 28 Ca -0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.07 4.24 -0.08 1.61 1.02 0.24 -5.05 119.74 121.64 1it8 s LYS 29 Ca 0.00 0.74 -0.03 0.00 0.02 0.00 0.00 55.97 56.70 1it8 s LYS 29 Cb 0.00 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 33.70 1it8 s LYS 29 CO 0.00 -0.27 0.06 0.15 -0.92 0.00 0.00 175.35 174.37 1it8 s LYS 30 N 1.99 3.13 0.03 1.68 1.02 -1.26 -0.62 119.74 125.71 1it8 s LYS 30 Ca 0.32 -0.34 -0.02 0.00 0.02 0.00 0.00 55.97 55.95 1it8 s LYS 30 Cb -0.16 -2.92 -0.02 0.00 -0.52 0.00 0.00 37.83 34.21 1it8 s LYS 30 CO 0.11 0.72 0.01 -1.50 -0.92 0.00 0.00 175.35 173.76 1it8 s ILE 31 N -0.99 0.13 -0.17 2.17 2.07 0.28 -5.00 121.20 119.70 1it8 s ILE 31 Ca 0.16 -1.10 -0.06 0.00 -1.41 0.00 0.00 60.65 58.24 1it8 s ILE 31 Cb -0.12 -0.63 -0.04 0.00 0.13 0.00 0.00 42.46 41.81 1it8 s ILE 31 CO 0.05 -0.61 0.04 -0.70 -1.91 0.00 0.00 174.94 171.81 1it8 s GLU 32 N -2.13 3.81 0.31 3.50 2.12 -1.26 -0.97 118.70 124.08 1it8 s GLU 32 Ca -0.10 -0.38 0.07 0.00 0.36 0.00 0.00 54.97 54.92 1it8 s GLU 32 Cb -0.05 -3.11 -0.03 0.00 0.26 0.00 0.00 34.13 31.21 1it8 s GLU 32 CO -0.03 0.32 0.30 0.95 -0.54 0.00 0.00 175.26 176.26 1it8 s THR 33 N 0.21 3.95 0.43 -1.70 -4.23 0.40 -4.24 115.64 110.46 1it8 s THR 33 Ca 0.03 -1.30 -0.25 0.00 -1.18 0.00 0.00 61.69 58.98 1it8 s THR 33 Cb -0.13 -3.31 -0.08 0.00 1.34 0.00 0.00 72.50 70.32 1it8 s THR 33 CO 0.01 -0.23 1.38 -2.84 -0.54 0.00 0.00 174.62 172.40 1it8 s PRO 34 N -3.98 3.79 0.05 3.99 0.02 -1.26 -1.50 135.00 136.10 1it8 s PRO 34 Ca 0.39 2.31 0.00 0.00 0.02 0.00 0.00 61.00 63.72 1it8 s PRO 34 Cb -0.07 -2.69 -0.03 0.00 0.02 0.00 0.00 34.50 31.73 1it8 s PRO 34 CO 0.27 -0.70 -0.05 0.00 -0.33 0.00 0.00 177.00 176.20 1it8 s ALA 35 N -1.23 0.49 -0.12 -1.55 0.00 -0.79 -5.01 121.76 113.55 1it8 s ALA 35 Ca 0.60 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.61 1it8 s ALA 35 Cb -0.41 0.17 0.01 0.00 0.00 0.00 0.00 23.12 22.89 1it8 s ALA 35 CO 0.53 -0.21 -0.17 -1.50 0.00 0.00 0.00 175.76 174.40 1it8 s ILE 36 N -2.63 1.68 -0.35 0.00 2.07 -1.26 -1.81 121.20 118.90 1it8 s ILE 36 Ca -0.02 -0.75 -0.16 0.00 -1.41 0.00 0.00 60.65 58.30 1it8 s ILE 36 Cb -0.01 -1.52 -0.01 0.00 0.13 0.00 0.00 42.46 41.05 1it8 s ILE 36 CO -0.04 0.48 0.42 0.00 -1.91 0.00 0.00 174.94 173.89 1it8 s MET 37 N 0.98 3.54 0.36 3.50 0.23 0.27 -4.87 119.30 123.31 1it8 s MET 37 Ca -0.06 -0.36 -0.28 0.00 -1.03 0.00 0.00 55.69 53.96 1it8 s MET 37 Cb -0.15 -3.82 -0.11 0.00 -1.53 0.00 0.00 34.83 29.22 1it8 s MET 37 CO -0.03 -0.59 1.49 -2.30 -2.03 0.00 0.00 175.02 171.56 1it8 n PRO 38 N 5.53 2.62 -3.10 3.16 -0.02 -1.25 -2.61 135.00 139.33 1it8 n PRO 38 Ca -0.07 0.92 -0.40 0.00 -2.02 0.00 0.00 63.50 61.93 1it8 n PRO 38 Cb 0.49 -2.65 -0.05 0.00 -0.02 0.00 0.00 33.50 31.27 1it8 n PRO 38 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1it8 s VAL 39 N -0.89 5.03 -0.13 -1.45 1.01 0.15 -1.70 120.40 122.41 1it8 s VAL 39 Ca 0.56 1.25 -0.02 0.00 0.00 0.00 0.00 61.98 63.77 1it8 s VAL 39 Cb -0.49 -3.97 -0.02 0.00 0.00 0.00 0.00 36.38 31.90 1it8 s VAL 39 CO 0.61 0.14 -0.08 0.54 0.00 0.00 0.00 175.10 176.31 1it8 s VAL 40 N 1.65 3.50 -0.18 2.92 0.11 -0.39 -4.77 120.40 123.24 1it8 s VAL 40 Ca 0.31 -0.51 -0.22 0.00 -2.93 0.00 0.00 61.98 58.63 1it8 s VAL 40 Cb -0.16 -2.49 -0.02 0.00 -1.53 0.00 0.00 36.38 32.17 1it8 s VAL 40 CO 0.12 0.52 0.69 0.21 -3.33 0.00 0.00 175.10 173.31 1it8 s ASN 41 N 0.23 6.79 0.27 3.54 3.04 -1.26 -4.49 114.94 123.05 1it8 s ASN 41 Ca -0.05 0.96 -0.01 0.00 0.04 0.00 0.00 52.86 53.80 1it8 s ASN 41 Cb -0.15 -2.38 0.58 0.00 -1.54 0.00 0.00 41.25 37.77 1it8 s ASN 41 CO 0.04 -0.29 1.70 -0.65 -3.04 0.00 0.00 177.10 174.86 1it8 h PRO 42 N 7.37 0.37 0.00 0.43 0.11 -1.97 -3.18 132.00 135.13 1it8 h PRO 42 Ca -0.32 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1it8 h PRO 42 Cb 1.14 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1it8 h PRO 42 CO 0.79 0.25 0.00 1.63 -0.21 0.00 0.00 178.00 180.46 1it8 n LYS 43 N -5.06 0.00 -2.73 1.05 5.02 -1.26 -4.68 118.16 110.49 1it8 n LYS 43 Ca 0.18 0.02 -0.43 0.00 -2.02 0.00 0.00 58.31 56.06 1it8 n LYS 43 Cb 0.54 -0.45 -0.00 0.00 -0.02 0.00 0.00 35.03 35.09 1it8 n LYS 43 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1it8 s GLN 44 N -0.05 4.00 -0.91 1.97 -0.21 -1.25 -4.95 119.66 118.26 1it8 s GLN 44 Ca 0.00 -2.18 -0.25 0.00 0.02 0.00 0.00 55.36 52.96 1it8 s GLN 44 Cb 0.00 -5.33 0.04 0.00 1.00 0.00 0.00 33.01 28.72 1it8 s GLN 44 CO 0.00 -2.05 1.39 -1.64 -2.12 0.00 0.00 175.29 170.87 1it8 s MET 45 N 3.19 3.43 0.35 2.91 -1.94 -1.20 -4.54 119.30 121.50 1it8 s MET 45 Ca 0.49 -0.78 0.09 0.00 -1.71 0.00 0.00 55.69 53.77 1it8 s MET 45 Cb 0.01 -4.91 0.81 0.00 2.01 0.00 0.00 34.83 32.75 1it8 s MET 45 CO 0.04 -2.19 1.85 0.28 -0.01 0.00 0.00 175.02 174.98 1it8 h VAL 46 N 6.51 0.80 -3.27 -6.03 2.07 -1.92 -3.37 116.25 111.04 1it8 h VAL 46 Ca 0.02 -0.24 -0.50 0.00 0.82 0.00 0.00 66.70 66.80 1it8 h VAL 46 Cb 1.03 0.04 -0.36 0.00 -1.52 0.00 0.00 31.29 30.48 1it8 h VAL 46 CO 1.37 0.13 -0.80 -0.69 0.02 0.00 0.00 177.57 177.60 1it8 s VAL 47 N -5.70 0.94 0.25 2.57 1.01 -1.26 -4.84 120.40 113.37 1it8 s VAL 47 Ca -0.10 -0.28 -0.31 0.00 0.00 0.00 0.00 61.98 61.29 1it8 s VAL 47 Cb 0.23 -0.94 -0.12 0.00 0.00 0.00 0.00 36.38 35.54 1it8 s VAL 47 CO 0.79 0.34 1.63 -0.62 0.00 0.00 0.00 175.10 177.24 1it8 n GLU 48 N 4.59 2.67 -0.31 2.72 -0.58 -1.26 -4.82 120.64 123.65 1it8 n GLU 48 Ca -0.16 0.95 0.23 0.00 -0.42 0.00 0.00 57.16 57.77 1it8 n GLU 48 Cb 0.50 -2.75 0.53 0.00 -0.57 0.00 0.00 31.44 29.15 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 5.51 0.35 -0.61 3.49 0.11 -1.91 0.67 132.00 139.61 1it8 h PRO 49 Ca -0.45 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.67 1it8 h PRO 49 Cb 1.22 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1it8 h PRO 49 CO 0.85 0.23 0.40 0.87 -0.21 0.00 0.00 178.00 180.15 1it8 h LYS 50 N 0.36 0.68 0.11 1.05 1.57 -1.73 -0.69 116.57 117.91 1it8 h LYS 50 Ca 0.57 -0.04 -0.30 0.00 -1.87 0.00 0.00 60.65 59.01 1it8 h LYS 50 Cb 1.50 -0.15 0.03 0.00 0.08 0.00 0.00 32.23 33.69 1it8 h LYS 50 CO -0.25 0.45 -1.24 1.49 -0.57 0.00 0.00 179.45 179.34 1it8 h GLU 51 N 0.70 0.64 -0.78 3.15 4.81 -0.02 -2.73 114.58 120.34 1it8 h GLU 51 Ca 0.25 -0.83 0.06 0.00 -0.13 0.00 0.00 59.36 58.71 1it8 h GLU 51 Cb 0.12 0.27 -0.05 0.00 0.63 0.00 0.00 28.75 29.72 1it8 h GLU 51 CO -0.07 1.38 0.51 -0.07 -0.73 0.00 0.00 179.01 180.03 1it8 h LEU 52 N 0.29 0.74 -0.12 1.64 3.38 -0.86 -0.30 115.31 120.08 1it8 h LEU 52 Ca -0.19 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.80 1it8 h LEU 52 Cb 1.90 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.48 1it8 h LEU 52 CO 0.24 0.48 0.02 -0.08 0.09 0.00 0.00 178.44 179.19 1it8 h GLU 53 N 0.84 0.07 -0.70 1.13 4.57 -1.07 -1.20 114.58 118.22 1it8 h GLU 53 Ca 0.33 -0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.45 1it8 h GLU 53 Cb 0.23 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.77 1it8 h GLU 53 CO -0.11 0.04 0.20 0.87 -1.18 0.00 0.00 179.01 178.83 1it8 h LYS 54 N 0.07 1.10 0.00 1.92 1.57 -0.94 -2.38 116.57 117.91 1it8 h LYS 54 Ca 0.05 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 1it8 h LYS 54 Cb 0.05 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 1it8 h LYS 54 CO -0.07 0.95 -0.03 0.52 -0.57 0.00 0.00 179.45 180.25 1it8 h MET 55 N 1.05 0.00 0.00 3.15 2.86 -0.78 -3.45 114.93 117.75 1it8 h MET 55 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 1it8 h MET 55 Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1it8 h MET 55 CO -0.00 0.03 0.00 0.41 1.06 0.00 0.00 176.91 178.40 1it8 n GLY 56 N -0.91 1.51 3.48 8.32 0.00 -0.90 -5.08 105.19 111.61 1it8 n GLY 56 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.00 2.75 -2.12 1.61 0.40 -0.50 -4.88 117.98 113.25 1it8 s PHE 57 Ca 0.00 -0.31 0.16 0.00 -0.60 0.00 0.00 56.93 56.18 1it8 s PHE 57 Cb 0.00 -4.13 0.67 0.00 0.51 0.00 0.00 43.02 40.07 1it8 s PHE 57 CO 0.00 -1.47 1.47 0.39 0.70 0.00 0.00 175.22 176.31 1it8 n GLU 58 N 7.48 1.47 -3.67 0.44 -0.58 -1.26 -4.32 120.64 120.20 1it8 n GLU 58 Ca -0.02 -0.71 -0.10 0.00 -0.42 0.00 0.00 57.16 55.92 1it8 n GLU 58 Cb 0.46 -1.30 -0.09 0.00 -0.57 0.00 0.00 31.44 29.95 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 -1.82 -0.01 0.38 -3.67 2.07 -1.26 -1.54 121.20 115.35 1it8 s ILE 59 Ca 0.26 0.04 0.04 0.00 -1.41 0.00 0.00 60.65 59.58 1it8 s ILE 59 Cb 0.13 -0.78 -0.03 0.00 0.13 0.00 0.00 42.46 41.91 1it8 s ILE 59 CO 0.20 0.02 0.16 0.27 -1.91 0.00 0.00 174.94 173.68 1it8 s ILE 60 N 1.28 0.44 -0.00 2.00 -4.36 -0.75 -3.84 121.20 115.97 1it8 s ILE 60 Ca -0.08 -2.00 -0.06 0.00 -0.26 0.00 0.00 60.65 58.25 1it8 s ILE 60 Cb -0.06 -2.41 0.00 0.00 1.25 0.00 0.00 42.46 41.24 1it8 s ILE 60 CO -0.13 0.00 0.12 -0.51 0.24 0.00 0.00 174.94 174.66 1it8 s ILE 61 N -3.32 0.07 0.27 8.37 2.07 -0.69 -1.02 121.20 126.96 1it8 s ILE 61 Ca 0.29 -0.60 0.02 0.00 -1.41 0.00 0.00 60.65 58.95 1it8 s ILE 61 Cb 0.03 -0.38 -0.03 0.00 0.13 0.00 0.00 42.46 42.21 1it8 s ILE 61 CO 0.18 -0.33 0.24 -0.89 -1.91 0.00 0.00 174.94 172.23 1it8 s THR 62 N -1.15 0.00 -0.47 4.00 2.01 -0.89 -1.26 115.64 117.88 1it8 s THR 62 Ca -0.12 -1.94 -0.17 0.00 0.31 0.00 0.00 61.69 59.77 1it8 s THR 62 Cb -0.07 -2.50 0.05 0.00 0.01 0.00 0.00 72.50 70.00 1it8 s THR 62 CO 0.01 0.00 0.47 0.21 -0.69 0.00 0.00 174.62 174.62 1it8 s ASN 63 N -3.26 6.18 0.15 3.53 3.84 -1.26 -0.07 114.94 124.05 1it8 s ASN 63 Ca 0.38 -1.02 -0.17 0.00 0.21 0.00 0.00 52.86 52.26 1it8 s ASN 63 Cb 0.04 -2.22 0.05 0.00 -0.55 0.00 0.00 41.25 38.57 1it8 s ASN 63 CO 0.20 -0.69 1.72 0.28 -2.79 0.00 0.00 177.10 175.82 1it8 h SER 64 N 8.81 -0.05 0.27 -4.21 0.02 -1.47 -2.45 113.55 114.47 1it8 h SER 64 Ca -0.28 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 60.74 1it8 h SER 64 Cb 1.11 0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.71 1it8 h SER 64 CO 0.87 0.01 -0.40 0.22 -1.14 0.00 0.00 176.83 176.39 1it8 h TYR 65 N 0.14 -1.11 -0.73 3.45 3.20 -1.72 0.48 116.97 120.68 1it8 h TYR 65 Ca 0.15 0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.18 1it8 h TYR 65 Cb 0.19 0.45 -0.09 0.00 1.54 0.00 0.00 36.73 38.81 1it8 h TYR 65 CO -0.20 -0.53 0.27 0.82 -1.64 0.00 0.00 178.16 176.88 1it8 h ILE 66 N -0.74 0.65 0.06 1.81 2.04 -1.89 0.24 117.51 119.69 1it8 h ILE 66 Ca -0.01 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1it8 h ILE 66 Cb 0.70 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1it8 h ILE 66 CO -0.14 0.07 -0.03 0.40 0.00 0.00 0.00 178.15 178.45 1it8 h ILE 67 N 0.41 1.03 -0.92 -0.67 2.04 -0.95 -2.65 117.51 115.79 1it8 h ILE 67 Ca 0.40 -0.31 0.15 0.00 1.00 0.00 0.00 64.86 66.10 1it8 h ILE 67 Cb 0.61 1.23 -0.09 0.00 -0.74 0.00 0.00 36.82 37.83 1it8 h ILE 67 CO -0.41 0.08 0.53 0.22 0.00 0.00 0.00 178.15 178.57 1it8 h TYR 68 N -0.22 0.95 -0.01 1.37 3.20 0.12 -1.36 116.97 121.02 1it8 h TYR 68 Ca -0.01 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1it8 h TYR 68 Cb 0.19 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.18 1it8 h TYR 68 CO -0.03 0.28 0.00 1.63 -1.64 0.00 0.00 178.16 178.40 1it8 n LYS 69 N -4.77 1.28 -3.88 1.82 4.76 -0.05 -4.78 118.16 112.55 1it8 n LYS 69 Ca 0.19 -0.41 -0.35 0.00 -2.87 0.00 0.00 58.31 54.87 1it8 n LYS 69 Cb 0.43 -1.48 -0.14 0.00 -1.84 0.00 0.00 35.03 32.01 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 -1.97 4.47 0.02 4.39 -1.08 -0.52 -5.02 116.67 116.96 1it8 s ASP 70 Ca 0.43 -0.35 -0.05 0.00 -0.52 0.00 0.00 52.55 52.06 1it8 s ASP 70 Cb 0.21 -1.78 -0.01 0.00 -1.46 0.00 0.00 42.92 39.88 1it8 s ASP 70 CO 0.35 -0.02 0.99 1.21 0.52 0.00 0.00 175.17 178.22 1it8 n GLU 71 N 4.82 -0.07 0.40 4.34 4.07 -1.26 -0.52 120.64 132.41 1it8 n GLU 71 Ca -0.18 0.99 -0.19 0.00 -0.06 0.00 0.00 57.16 57.72 1it8 n GLU 71 Cb 0.51 -1.47 -0.09 0.00 -0.06 0.00 0.00 31.44 30.32 1it8 n GLU 71 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1it8 h GLU 72 N 0.00 -1.01 -0.74 5.31 4.39 -1.95 -2.32 114.58 118.25 1it8 h GLU 72 Ca 0.02 0.07 0.16 0.00 0.34 0.00 0.00 59.36 59.95 1it8 h GLU 72 Cb 0.06 0.23 -0.13 0.00 -0.10 0.00 0.00 28.75 28.81 1it8 h GLU 72 CO -0.14 -0.68 -0.08 -0.07 -1.16 0.00 0.00 179.01 176.89 1it8 h LEU 73 N -1.05 -0.49 0.18 1.33 3.38 -1.78 -0.73 115.31 116.14 1it8 h LEU 73 Ca -0.09 0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.09 1it8 h LEU 73 Cb 0.83 0.39 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 1it8 h LEU 73 CO 0.12 -0.21 -0.24 -0.09 0.09 0.00 0.00 178.44 178.11 1it8 h ARG 74 N 0.05 -0.46 -0.79 1.13 2.43 -0.67 -0.70 114.38 115.37 1it8 h ARG 74 Ca 0.39 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.59 1it8 h ARG 74 Cb 0.65 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.26 1it8 h ARG 74 CO -0.70 -0.31 0.50 0.00 -1.51 0.00 0.00 179.97 177.95 1it8 h ARG 75 N -0.48 1.06 -0.28 0.20 3.08 -0.77 -1.33 114.38 115.86 1it8 h ARG 75 Ca 0.01 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 59.95 1it8 h ARG 75 Cb 0.47 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1it8 h ARG 75 CO -0.10 0.72 0.03 0.87 -1.07 0.00 0.00 179.97 180.42 1it8 h LYS 76 N 1.08 0.48 -0.38 0.04 1.79 -0.87 -0.71 116.57 117.99 1it8 h LYS 76 Ca 0.29 -0.14 -0.07 0.00 -2.18 0.00 0.00 60.65 58.54 1it8 h LYS 76 Cb -0.08 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 1it8 h LYS 76 CO -0.06 0.61 -0.08 0.00 -1.08 0.00 0.00 179.45 178.84 1it8 h ALA 77 N 0.85 1.17 0.00 3.86 0.00 -0.84 0.13 119.26 124.42 1it8 h ALA 77 Ca 0.08 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1it8 h ALA 77 Cb 0.38 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1it8 h ALA 77 CO 0.01 0.53 -0.20 -0.07 0.00 0.00 0.00 179.25 179.52 1it8 h LEU 78 N 0.59 0.00 0.05 0.00 3.38 -1.18 0.77 115.31 118.92 1it8 h LEU 78 Ca 0.11 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.77 1it8 h LEU 78 Cb 0.49 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 1it8 h LEU 78 CO 0.03 0.20 -1.69 -0.08 0.09 0.00 0.00 178.44 176.98 1it8 h GLU 79 N 0.00 0.11 0.00 1.13 4.57 -0.41 -3.42 114.58 116.56 1it8 h GLU 79 Ca -0.00 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 57.99 1it8 h GLU 79 Cb 1.06 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 1it8 h GLU 79 CO 0.03 0.82 -0.11 1.28 -1.18 0.00 0.00 179.01 179.85 1it8 n LEU 80 N -3.25 0.00 0.00 1.64 4.77 0.37 -5.07 117.00 115.46 1it8 n LEU 80 Ca -0.19 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.62 1it8 n LEU 80 Cb 1.04 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.13 1it8 n LEU 80 CO 0.46 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1it8 n GLY 81 N 0.60 -1.58 0.34 -0.72 0.00 0.26 -3.84 105.19 100.26 1it8 n GLY 81 Ca 0.00 -1.48 0.04 0.00 0.00 0.00 0.00 46.02 44.58 1it8 n GLY 81 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1it8 h ILE 82 N 0.00 0.98 -0.20 -0.61 -0.00 -1.63 -1.38 117.51 114.66 1it8 h ILE 82 Ca 0.00 -0.33 0.06 0.00 -0.00 0.00 0.00 64.86 64.58 1it8 h ILE 82 Cb 0.00 -0.07 -0.06 0.00 -0.00 0.00 0.00 36.82 36.68 1it8 h ILE 82 CO 0.00 0.18 -0.22 0.45 -0.00 0.00 0.00 178.15 178.56 1it8 h HIS 83 N 0.97 -0.57 -0.04 0.16 3.86 -1.82 0.38 115.15 118.08 1it8 h HIS 83 Ca 0.43 0.03 -0.16 0.00 -1.16 0.00 0.00 60.37 59.51 1it8 h HIS 83 Cb 0.32 0.28 -0.01 0.00 1.06 0.00 0.00 27.41 29.06 1it8 h HIS 83 CO -0.03 -0.30 -0.70 0.00 0.86 0.00 0.00 177.93 177.76 1it8 h ARG 84 N -0.24 0.21 -0.57 2.45 2.47 -1.61 0.34 114.38 117.42 1it8 h ARG 84 Ca 0.12 -0.17 -0.05 0.00 -1.26 0.00 0.00 59.98 58.61 1it8 h ARG 84 Cb 0.43 0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.76 1it8 h ARG 84 CO -0.34 0.83 0.14 1.98 0.56 0.00 0.00 179.97 183.14 1it8 h MET 85 N 0.15 0.88 -0.01 0.04 4.05 -0.48 -2.78 114.93 116.78 1it8 h MET 85 Ca -0.02 -0.18 0.00 0.00 -0.28 0.00 0.00 59.70 59.22 1it8 h MET 85 Cb 1.25 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.92 1it8 h MET 85 CO 0.11 0.79 -0.71 1.28 0.23 0.00 0.00 176.91 178.61 1it8 n LEU 86 N -4.27 1.41 -3.72 3.39 4.77 0.13 -4.98 117.00 113.73 1it8 n LEU 86 Ca 0.04 -0.62 -0.26 0.00 -0.03 0.00 0.00 56.01 55.14 1it8 n LEU 86 Cb 0.23 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.35 1it8 n LEU 86 CO 0.40 0.30 -0.10 -0.67 -1.33 0.00 0.00 177.39 175.98 1it8 n ASP 87 N -0.80 -2.83 -4.00 -1.43 2.03 0.06 -4.21 116.55 105.38 1it8 n ASP 87 Ca 0.06 -0.93 -0.20 0.00 0.52 0.00 0.00 54.79 54.24 1it8 n ASP 87 Cb 0.37 -3.64 -0.15 0.00 -0.72 0.00 0.00 41.12 36.98 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 -3.65 0.89 -1.24 -0.67 5.04 -0.93 -3.99 117.35 112.80 1it8 s TYR 88 Ca 0.21 -0.21 0.11 0.00 -2.44 0.00 0.00 57.07 54.73 1it8 s TYR 88 Cb -0.07 -0.64 0.06 0.00 0.35 0.00 0.00 41.96 41.67 1it8 s TYR 88 CO 0.84 -0.09 0.79 0.09 -1.34 0.00 0.00 175.55 175.84 1it8 n ASN 89 N 3.25 1.71 -2.53 4.32 3.02 -1.26 -4.60 115.26 119.17 1it8 n ASN 89 Ca -0.18 -1.36 0.00 0.00 -0.03 0.00 0.00 54.58 53.02 1it8 n ASN 89 Cb 0.55 0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.85 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 0.70 -0.01 3.64 7.41 0.00 -1.26 -4.98 105.19 110.69 1it8 n GLY 90 Ca 0.06 -1.66 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 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 0.35 4.27 -0.39 -0.61 1.01 -0.59 -4.97 121.20 120.27 1it8 s ILE 91 Ca 0.00 1.46 -0.12 0.00 0.00 0.00 0.00 60.65 61.99 1it8 s ILE 91 Cb 0.00 -4.18 0.03 0.00 0.01 0.00 0.00 42.46 38.32 1it8 s ILE 91 CO 0.00 -0.39 0.23 -0.63 0.00 0.00 0.00 174.94 174.15 1it8 s ILE 92 N 3.99 4.75 0.40 2.92 1.01 -1.26 -1.82 121.20 131.19 1it8 s ILE 92 Ca 0.53 -0.84 -0.03 0.00 0.00 0.00 0.00 60.65 60.32 1it8 s ILE 92 Cb -0.17 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 1it8 s ILE 92 CO 0.19 -0.27 0.66 -0.70 0.00 0.00 0.00 174.94 174.81 1it8 s GLU 93 N 1.58 3.53 -0.01 2.79 2.12 -0.18 -1.97 118.70 126.56 1it8 s GLU 93 Ca 0.03 -0.06 -0.04 0.00 0.36 0.00 0.00 54.97 55.26 1it8 s GLU 93 Cb -0.19 -2.53 -0.00 0.00 0.26 0.00 0.00 34.13 31.66 1it8 s GLU 93 CO 0.07 -0.00 0.08 0.54 -0.54 0.00 0.00 175.26 175.42 1it8 s VAL 94 N -2.48 0.06 0.26 3.70 0.11 -0.91 -2.10 120.40 119.04 1it8 s VAL 94 Ca 0.44 -0.49 0.06 0.00 -2.93 0.00 0.00 61.98 59.05 1it8 s VAL 94 Cb -0.10 -0.29 -0.03 0.00 -1.53 0.00 0.00 36.38 34.43 1it8 s VAL 94 CO 0.39 -0.27 0.35 -0.62 -3.33 0.00 0.00 175.10 171.62 1it8 s ASP 95 N -0.88 6.10 0.11 3.54 -1.08 0.90 -3.73 116.67 121.63 1it8 s ASP 95 Ca -0.10 -0.04 0.12 0.00 -0.52 0.00 0.00 52.55 52.01 1it8 s ASP 95 Cb -0.06 -1.65 -0.14 0.00 -1.46 0.00 0.00 42.92 39.61 1it8 s ASP 95 CO 0.00 -0.14 1.10 0.77 0.52 0.00 0.00 175.17 177.43 1it8 h SER 96 N 1.18 0.00 0.00 -0.34 4.64 -1.84 -0.88 113.55 116.31 1it8 h SER 96 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1it8 h SER 96 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1it8 h SER 96 CO 0.59 0.82 0.00 0.61 -0.87 0.00 0.00 176.83 177.99 1it8 n GLY 97 N 1.38 1.01 0.37 -0.77 0.00 -1.26 -4.14 105.19 101.78 1it8 n GLY 97 Ca -0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.10 1it8 n GLY 97 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1it8 h SER 98 N 0.00 0.69 -0.65 1.61 0.02 -1.89 0.25 113.55 113.57 1it8 h SER 98 Ca 0.00 0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 60.94 1it8 h SER 98 Cb 0.00 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 1it8 h SER 98 CO 0.00 0.31 0.16 0.15 -1.14 0.00 0.00 176.83 176.31 1it8 h PHE 99 N 0.71 1.12 -0.51 3.45 3.57 -1.94 0.11 116.94 123.45 1it8 h PHE 99 Ca 0.50 -0.13 -0.06 0.00 3.53 0.00 0.00 57.97 61.81 1it8 h PHE 99 Cb 0.82 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 1it8 h PHE 99 CO -0.00 0.92 0.07 1.96 -2.23 0.00 0.00 178.31 179.03 1it8 h GLN 100 N 1.01 0.80 0.00 1.11 7.50 -1.06 -0.31 115.11 124.17 1it8 h GLN 100 Ca 0.21 -0.18 -0.03 0.00 0.50 0.00 0.00 58.65 59.14 1it8 h GLN 100 Cb 0.37 -0.11 -0.00 0.00 0.05 0.00 0.00 27.48 27.78 1it8 h GLN 100 CO 0.00 0.76 -0.16 1.25 -1.50 0.00 0.00 178.83 179.18 1it8 h LEU 101 N 0.76 0.00 0.06 1.46 5.85 0.88 0.38 115.31 124.71 1it8 h LEU 101 Ca 0.16 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.74 1it8 h LEU 101 Cb 0.36 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.39 1it8 h LEU 101 CO 0.01 0.16 -0.71 -0.03 -0.34 0.00 0.00 178.44 177.53 1it8 h MET 102 N 0.00 0.14 -0.14 1.25 4.05 0.11 -1.83 114.93 118.51 1it8 h MET 102 Ca -0.00 -0.23 -0.01 0.00 -0.28 0.00 0.00 59.70 59.18 1it8 h MET 102 Cb 0.39 0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.27 1it8 h MET 102 CO 0.02 1.11 0.05 0.87 0.23 0.00 0.00 176.91 179.19 1it8 h LYS 103 N -0.68 0.21 0.00 0.39 1.57 -0.92 -3.33 116.57 113.81 1it8 h LYS 103 Ca -0.15 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1it8 h LYS 103 Cb 1.38 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1it8 h LYS 103 CO 0.02 0.34 -0.98 0.66 -0.57 0.00 0.00 179.45 178.92 1it8 n TYR 104 N -4.86 0.03 0.00 -1.35 0.53 0.11 -4.99 117.16 106.62 1it8 n TYR 104 Ca -0.05 0.01 0.00 0.00 -1.02 0.00 0.00 57.90 56.84 1it8 n TYR 104 Cb 0.14 -0.12 0.00 0.00 -1.03 0.00 0.00 39.34 38.32 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 1.47 2.49 3.48 2.72 0.00 -0.69 -4.97 105.19 109.69 1it8 n GLY 105 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 1it8 n GLY 105 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1it8 s SER 106 N -3.40 -0.36 -0.19 1.61 1.04 -1.25 -4.98 113.70 106.17 1it8 s SER 106 Ca 0.00 -0.29 -0.13 0.00 0.48 0.00 0.00 55.95 56.00 1it8 s SER 106 Cb 0.00 0.58 0.06 0.00 0.10 0.00 0.00 66.02 66.76 1it8 s SER 106 CO 0.00 -1.01 0.48 -0.51 0.98 0.00 0.00 173.24 173.17 1it8 s ILE 107 N -3.82 -0.01 -0.22 -1.02 2.07 -1.26 -4.50 121.20 112.44 1it8 s ILE 107 Ca 0.05 0.04 -0.06 0.00 -1.41 0.00 0.00 60.65 59.27 1it8 s ILE 107 Cb -0.01 -0.68 -0.23 0.00 0.13 0.00 0.00 42.46 41.66 1it8 s ILE 107 CO -0.07 0.02 3.40 -0.62 -1.91 0.00 0.00 174.94 175.75 1it8 n GLU 108 N 3.62 2.14 -3.63 3.50 4.71 -1.26 -4.80 120.64 124.91 1it8 n GLU 108 Ca -0.18 -1.12 -0.13 0.00 -0.01 0.00 0.00 57.16 55.72 1it8 n GLU 108 Cb 0.56 -2.09 -0.07 0.00 -1.01 0.00 0.00 31.44 28.84 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 1.27 0.00 0.42 2.62 0.11 -1.26 -5.09 120.40 118.47 1it8 s VAL 109 Ca 0.64 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 59.58 1it8 s VAL 109 Cb 0.29 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 34.07 1it8 s VAL 109 CO -0.01 0.00 0.80 -0.94 -3.33 0.00 0.00 175.10 171.62 1it8 s SER 110 N 0.44 6.53 0.41 3.54 1.04 -1.26 -4.95 113.70 119.44 1it8 s SER 110 Ca -0.00 1.19 0.12 0.00 0.48 0.00 0.00 55.95 57.73 1it8 s SER 110 Cb -0.05 -2.35 0.94 0.00 0.10 0.00 0.00 66.02 64.67 1it8 s SER 110 CO -0.02 -0.43 1.96 -1.13 0.98 0.00 0.00 173.24 174.61 1it8 h ASN 111 N 1.20 0.46 -0.00 7.02 -0.73 -1.99 -1.25 115.58 120.29 1it8 h ASN 111 Ca -0.47 0.01 -0.20 0.00 1.87 0.00 0.00 56.30 57.51 1it8 h ASN 111 Cb 1.19 -0.09 0.00 0.00 0.27 0.00 0.00 38.32 39.69 1it8 h ASN 111 CO 0.63 0.28 -0.73 -0.09 -0.37 0.00 0.00 177.43 177.15 1it8 h ARG 112 N 0.52 0.65 0.02 6.67 2.43 -1.97 -3.23 114.38 119.46 1it8 h ARG 112 Ca 0.31 -0.51 -0.00 0.00 -0.81 0.00 0.00 59.98 58.96 1it8 h ARG 112 Cb 0.51 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1it8 h ARG 112 CO -0.10 1.13 -0.01 0.93 -1.51 0.00 0.00 179.97 180.42 1it8 h GLU 113 N 0.45 -0.02 0.00 0.20 5.08 -1.62 -2.26 114.58 116.41 1it8 h GLU 113 Ca -0.04 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 1it8 h GLU 113 Cb 1.33 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 1it8 h GLU 113 CO 0.14 0.07 -0.40 -0.84 -1.00 0.00 0.00 179.01 176.99 1it8 h ILE 114 N -0.11 1.22 -0.13 3.13 -0.00 -1.61 -1.14 117.51 118.87 1it8 h ILE 114 Ca -0.00 -1.39 -0.02 0.00 -0.00 0.00 0.00 64.86 63.45 1it8 h ILE 114 Cb 0.10 1.76 -0.00 0.00 -0.00 0.00 0.00 36.82 38.68 1it8 h ILE 114 CO 0.00 0.39 -0.02 0.40 -0.00 0.00 0.00 178.15 178.93 1it8 h ILE 115 N 0.00 1.27 -0.59 0.16 2.04 -1.55 0.22 117.51 119.06 1it8 h ILE 115 Ca -0.00 -0.91 0.04 0.00 1.00 0.00 0.00 64.86 64.99 1it8 h ILE 115 Cb 0.73 1.62 -0.04 0.00 -0.74 0.00 0.00 36.82 38.39 1it8 h ILE 115 CO 0.05 0.26 0.34 -0.33 0.00 0.00 0.00 178.15 178.48 1it8 h GLU 116 N -0.06 0.64 -0.61 2.37 5.08 -1.19 -2.40 114.58 118.42 1it8 h GLU 116 Ca 0.03 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1it8 h GLU 116 Cb 0.41 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 1it8 h GLU 116 CO 0.01 0.42 0.22 0.35 -1.00 0.00 0.00 179.01 179.01 1it8 h PHE 117 N 0.66 0.91 -0.07 4.33 3.57 -1.01 -1.67 116.94 123.68 1it8 h PHE 117 Ca 0.25 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 1it8 h PHE 117 Cb 0.09 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 1it8 h PHE 117 CO -0.07 0.72 -0.15 1.96 -2.23 0.00 0.00 178.31 178.54 1it8 h GLN 118 N 0.88 0.10 -0.05 1.11 4.20 -0.47 -2.40 115.11 118.49 1it8 h GLN 118 Ca 0.20 -0.02 -0.09 0.00 0.06 0.00 0.00 58.65 58.81 1it8 h GLN 118 Cb 0.21 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1it8 h GLN 118 CO -0.01 0.25 -0.31 0.45 -0.67 0.00 0.00 178.83 178.53 1it8 h HIS 119 N 0.10 0.41 -0.04 2.96 3.86 -0.96 -2.84 115.15 118.63 1it8 h HIS 119 Ca 0.02 -0.19 0.01 0.00 -1.16 0.00 0.00 60.37 59.05 1it8 h HIS 119 Cb 0.32 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.73 1it8 h HIS 119 CO 0.00 0.94 0.11 0.00 0.86 0.00 0.00 177.93 179.83 1it8 h ARG 120 N -0.24 0.00 -0.59 2.45 3.08 -0.84 -1.77 114.38 116.48 1it8 h ARG 120 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1it8 h ARG 120 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1it8 h ARG 120 CO 0.06 0.00 0.00 0.44 -1.07 0.00 0.00 179.97 179.40 1it8 n ILE 121 N -3.36 1.43 -3.44 2.04 -5.35 -1.04 -4.80 119.36 104.84 1it8 n ILE 121 Ca -0.02 -1.15 -0.19 0.00 -0.27 0.00 0.00 62.75 61.12 1it8 n ILE 121 Cb 0.19 0.30 0.08 0.00 -1.74 0.00 0.00 39.64 38.46 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 1.04 -0.39 3.77 3.28 0.00 -0.66 -2.24 105.19 110.00 1it8 n GLY 122 Ca 0.22 0.14 -0.36 0.00 0.00 0.00 0.00 46.02 46.02 1it8 n GLY 122 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1it8 s VAL 123 N -3.32 3.24 -0.09 1.61 1.01 -1.07 -4.75 120.40 117.04 1it8 s VAL 123 Ca 0.30 0.88 -0.24 0.00 0.00 0.00 0.00 61.98 62.92 1it8 s VAL 123 Cb -0.13 -3.42 -0.29 0.00 0.00 0.00 0.00 36.38 32.55 1it8 s VAL 123 CO 0.68 -0.07 0.79 0.44 0.00 0.00 0.00 175.10 176.95 1it8 h ASP 124 N 1.82 0.29 -3.81 3.32 3.32 -1.75 -3.46 116.42 116.15 1it8 h ASP 124 Ca -0.49 -0.94 -0.45 0.00 0.02 0.00 0.00 57.03 55.16 1it8 h ASP 124 Cb 1.25 -0.09 -0.31 0.00 0.22 0.00 0.00 39.33 40.39 1it8 h ASP 124 CO 0.59 1.29 -0.79 -0.63 -1.72 0.00 0.00 179.24 177.98 1it8 s ILE 125 N -2.36 0.88 0.54 0.35 1.01 -1.16 -4.09 121.20 116.37 1it8 s ILE 125 Ca -0.17 -0.41 0.05 0.00 0.00 0.00 0.00 60.65 60.12 1it8 s ILE 125 Cb 0.00 -0.78 0.03 0.00 0.01 0.00 0.00 42.46 41.72 1it8 s ILE 125 CO 0.77 0.27 0.34 -0.83 0.00 0.00 0.00 174.94 175.49 1it8 s GLY 126 N 0.20 2.48 -0.14 6.18 0.00 0.36 -2.14 107.32 114.27 1it8 s GLY 126 Ca -0.04 -1.12 -0.11 0.00 0.00 0.00 0.00 44.72 43.45 1it8 s GLY 126 CO 0.01 -1.98 0.35 -1.59 0.00 0.00 0.00 173.10 169.89 1it8 s THR 127 N -2.79 -0.01 0.57 0.90 2.01 -1.24 0.16 115.64 115.24 1it8 s THR 127 Ca 0.29 0.02 0.04 0.00 0.31 0.00 0.00 61.69 62.36 1it8 s THR 127 Cb -0.02 -0.50 0.06 0.00 0.01 0.00 0.00 72.50 72.05 1it8 s THR 127 CO 0.18 0.01 0.78 0.72 -0.69 0.00 0.00 174.62 175.62 1it8 s PHE 128 N 0.40 2.21 0.00 4.92 -0.12 -1.26 -4.18 117.98 119.95 1it8 s PHE 128 Ca -0.02 -0.33 -0.02 0.00 -0.05 0.00 0.00 56.93 56.52 1it8 s PHE 128 Cb -0.04 -2.60 -0.08 0.00 -0.63 0.00 0.00 43.02 39.67 1it8 s PHE 128 CO -0.02 -1.04 1.56 1.28 -0.05 0.00 0.00 175.22 176.95 1it8 n LEU 129 N -2.33 2.34 -4.63 -1.99 4.77 -1.26 -4.68 117.00 109.22 1it8 n LEU 129 Ca 0.11 -1.48 -0.38 0.00 -0.03 0.00 0.00 56.01 54.23 1it8 n LEU 129 Cb 0.60 -0.59 0.04 0.00 -2.33 0.00 0.00 43.42 41.15 1it8 n LEU 129 CO 0.42 0.47 0.61 -0.90 -1.33 0.00 0.00 177.39 176.66 1it8 n ASP 130 N 2.44 1.13 -4.51 -1.43 5.68 -1.26 -4.91 116.55 113.70 1it8 n ASP 130 Ca 0.13 0.87 -0.42 0.00 -0.50 0.00 0.00 54.79 54.87 1it8 n ASP 130 Cb 0.35 -1.41 -0.10 0.00 -1.14 0.00 0.00 41.12 38.82 1it8 n ASP 130 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1it8 s ILE 131 N -1.44 5.20 -0.83 2.12 1.01 -1.26 -4.68 121.20 121.31 1it8 s ILE 131 Ca 0.73 -0.27 -0.25 0.00 0.00 0.00 0.00 60.65 60.85 1it8 s ILE 131 Cb -0.44 -3.88 0.00 0.00 0.01 0.00 0.00 42.46 38.16 1it8 s ILE 131 CO 0.49 -0.21 1.62 -2.84 0.00 0.00 0.00 174.94 174.01 1it8 s PRO 132 N 1.90 3.02 -0.06 2.79 0.02 -1.26 -4.81 135.00 136.60 1it8 s PRO 132 Ca 0.09 -0.32 -0.30 0.00 0.02 0.00 0.00 61.00 60.50 1it8 s PRO 132 Cb -0.17 -4.78 -0.04 0.00 0.02 0.00 0.00 34.50 29.52 1it8 s PRO 132 CO 0.11 -2.61 1.33 0.99 -0.33 0.00 0.00 177.00 176.50 1it8 s THR 133 N 7.36 4.00 1.07 0.99 2.01 -1.26 -4.78 115.64 125.03 1it8 s THR 133 Ca 0.54 1.31 -0.12 0.00 0.31 0.00 0.00 61.69 63.73 1it8 s THR 133 Cb -0.06 -3.84 0.21 0.00 0.01 0.00 0.00 72.50 68.81 1it8 s THR 133 CO 0.05 -0.04 0.92 -2.65 -0.69 0.00 0.00 174.62 172.21 1it8 n PRO 134 N 5.79 -1.60 -1.39 4.92 -0.02 -1.26 -4.03 135.00 137.41 1it8 n PRO 134 Ca 0.13 -0.43 -0.31 0.00 -2.02 0.00 0.00 63.50 60.88 1it8 n PRO 134 Cb 0.45 -2.17 0.09 0.00 -0.02 0.00 0.00 33.50 31.85 1it8 n PRO 134 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1it8 s PRO 135 N -4.33 2.18 0.00 0.52 0.02 -1.26 -3.44 135.00 128.69 1it8 s PRO 135 Ca 0.66 0.93 0.00 0.00 0.02 0.00 0.00 61.00 62.61 1it8 s PRO 135 Cb -0.23 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.38 1it8 s PRO 135 CO 0.63 -1.63 0.00 -0.25 -0.33 0.00 0.00 177.00 175.42 1it8 n ASP 136 N -3.48 -1.10 -4.69 2.53 8.00 -1.26 -4.91 116.55 111.63 1it8 n ASP 136 Ca 0.08 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.24 1it8 n ASP 136 Cb 0.54 -1.98 0.12 0.00 -0.02 0.00 0.00 41.12 39.78 1it8 n ASP 136 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1it8 n ALA 137 N 0.92 0.11 -1.57 2.24 0.00 -1.22 -4.89 120.51 116.10 1it8 n ALA 137 Ca 0.00 -0.29 -0.45 0.00 0.00 0.00 0.00 53.44 52.70 1it8 n ALA 137 Cb 0.09 -2.25 -0.02 0.00 0.00 0.00 0.00 19.45 17.27 1it8 n ALA 137 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1it8 n PRO 138 N -3.08 1.19 -0.25 0.00 -0.02 -1.26 -4.76 135.00 126.82 1it8 n PRO 138 Ca 0.14 0.42 0.04 0.00 -2.02 0.00 0.00 63.50 62.08 1it8 n PRO 138 Cb 0.50 -1.75 0.27 0.00 -0.02 0.00 0.00 33.50 32.50 1it8 n PRO 138 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1it8 h ARG 139 N 1.96 0.92 -0.18 -0.52 2.43 -2.00 -1.85 114.38 115.14 1it8 h ARG 139 Ca -0.38 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 58.73 1it8 h ARG 139 Cb 1.35 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.68 1it8 h ARG 139 CO 0.61 0.61 0.11 1.49 -1.51 0.00 0.00 179.97 181.27 1it8 h GLU 140 N 0.95 0.24 -0.63 0.20 4.81 -1.99 -1.03 114.58 117.12 1it8 h GLU 140 Ca 0.34 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.60 1it8 h GLU 140 Cb 0.14 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.42 1it8 h GLU 140 CO -0.11 0.20 0.36 0.37 -0.73 0.00 0.00 179.01 179.10 1it8 h GLN 141 N 0.21 0.66 -0.52 1.92 4.15 -1.75 0.18 115.11 119.96 1it8 h GLN 141 Ca 0.06 -0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.47 1it8 h GLN 141 Cb 0.02 -0.15 -0.04 0.00 0.21 0.00 0.00 27.48 27.52 1it8 h GLN 141 CO -0.01 0.44 0.30 0.00 -1.93 0.00 0.00 178.83 177.63 1it8 h ALA 142 N 1.31 0.67 0.16 3.38 0.00 -0.99 0.61 119.26 124.40 1it8 h ALA 142 Ca 0.27 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1it8 h ALA 142 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1it8 h ALA 142 CO -0.15 -0.01 -0.07 0.28 0.00 0.00 0.00 179.25 179.29 1it8 h VAL 143 N 0.59 0.98 0.01 0.00 2.07 -0.41 -0.13 116.25 119.36 1it8 h VAL 143 Ca 0.22 -0.74 0.03 0.00 0.82 0.00 0.00 66.70 67.03 1it8 h VAL 143 Cb 0.06 1.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.21 1it8 h VAL 143 CO -0.11 0.17 -0.31 0.50 0.02 0.00 0.00 177.57 177.84 1it8 h LYS 144 N -0.58 -0.45 -0.05 1.57 3.64 -0.56 -1.59 116.57 118.55 1it8 h LYS 144 Ca -0.02 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1it8 h LYS 144 Cb 0.44 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1it8 h LYS 144 CO 0.04 -0.30 -0.01 0.93 -2.27 0.00 0.00 179.45 177.84 1it8 h GLU 145 N -0.46 0.07 -0.21 1.90 5.08 -0.90 -2.01 114.58 118.04 1it8 h GLU 145 Ca 0.06 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.28 1it8 h GLU 145 Cb 0.55 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1it8 h GLU 145 CO -0.25 0.08 -0.44 1.25 -1.00 0.00 0.00 179.01 178.65 1it8 h LEU 146 N 0.07 0.56 -0.37 1.33 5.85 -0.10 -1.84 115.31 120.82 1it8 h LEU 146 Ca 0.02 -0.26 -0.19 0.00 0.84 0.00 0.00 57.88 58.29 1it8 h LEU 146 Cb 0.06 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.93 1it8 h LEU 146 CO 0.00 0.93 -0.69 -0.33 -0.34 0.00 0.00 178.44 178.01 1it8 h GLU 147 N 0.43 0.55 -0.40 1.25 4.39 -0.63 0.11 114.58 120.28 1it8 h GLU 147 Ca 0.03 -0.42 -0.06 0.00 0.34 0.00 0.00 59.36 59.25 1it8 h GLU 147 Cb 0.94 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.65 1it8 h GLU 147 CO 0.08 1.04 0.01 0.82 -1.16 0.00 0.00 179.01 179.80 1it8 h ILE 148 N 0.39 1.22 0.36 3.13 2.04 -1.35 0.50 117.51 123.80 1it8 h ILE 148 Ca -0.02 -0.87 -0.02 0.00 1.00 0.00 0.00 64.86 64.95 1it8 h ILE 148 Cb 1.27 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 1it8 h ILE 148 CO 0.13 0.30 -0.17 0.74 0.00 0.00 0.00 178.15 179.15 1it8 h THR 149 N 0.60 0.64 -0.04 -0.27 2.02 -0.97 -1.00 112.91 113.90 1it8 h THR 149 Ca 0.13 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 1it8 h THR 149 Cb 0.37 0.83 -0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1it8 h THR 149 CO 0.01 0.07 0.01 -0.07 0.37 0.00 0.00 175.52 175.92 1it8 h LEU 150 N -0.71 0.04 0.31 2.58 3.38 -0.45 0.03 115.31 120.49 1it8 h LEU 150 Ca -0.05 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1it8 h LEU 150 Cb 0.50 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1it8 h LEU 150 CO 0.08 0.05 -0.15 -1.28 0.09 0.00 0.00 178.44 177.23 1it8 h SER 151 N 0.05 -0.35 0.07 -0.43 0.87 0.27 -2.40 113.55 111.64 1it8 h SER 151 Ca 0.01 -0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 60.43 1it8 h SER 151 Cb 0.02 0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1it8 h SER 151 CO -0.00 -0.07 -0.06 0.03 -0.53 0.00 0.00 176.83 176.20 1it8 h ARG 152 N -0.64 0.00 -0.13 2.24 3.08 -0.49 -1.69 114.38 116.74 1it8 h ARG 152 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1it8 h ARG 152 Cb 0.46 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1it8 h ARG 152 CO 0.07 0.06 0.09 0.00 -1.07 0.00 0.00 179.97 179.12 1it8 h ALA 153 N 1.94 0.17 -0.07 0.04 0.00 -0.73 0.52 119.26 121.11 1it8 h ALA 153 Ca -0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1it8 h ALA 153 Cb 0.12 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1it8 h ALA 153 CO 0.01 -0.35 -0.09 0.00 0.00 0.00 0.00 179.25 178.82 1it8 h ARG 154 N 0.18 -0.12 0.13 0.00 3.08 -0.81 -0.04 114.38 116.80 1it8 h ARG 154 Ca 0.05 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.12 1it8 h ARG 154 Cb -0.02 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 1it8 h ARG 154 CO -0.01 -0.08 -0.43 1.49 -1.07 0.00 0.00 179.97 179.87 1it8 h GLU 155 N -0.12 -0.65 -0.98 0.04 4.81 -1.19 0.19 114.58 116.68 1it8 h GLU 155 Ca 0.06 0.04 0.26 0.00 -0.13 0.00 0.00 59.36 59.59 1it8 h GLU 155 Cb 0.21 0.15 -0.06 0.00 0.63 0.00 0.00 28.75 29.67 1it8 h GLU 155 CO -0.15 -0.43 0.66 0.00 -0.73 0.00 0.00 179.01 178.37 1it8 h ALA 156 N -0.22 2.51 0.00 2.92 0.00 -0.54 0.30 119.26 124.23 1it8 h ALA 156 Ca 0.02 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1it8 h ALA 156 Cb 0.69 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1it8 h ALA 156 CO -0.24 -0.83 -0.31 1.49 0.00 0.00 0.00 179.25 179.36 1it8 h GLU 157 N 0.24 0.00 0.00 0.00 4.81 0.99 -1.54 114.58 119.08 1it8 h GLU 157 Ca 0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.74 1it8 h GLU 157 Cb 1.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.94 1it8 h GLU 157 CO -0.14 0.31 -1.26 0.39 -0.73 0.00 0.00 179.01 177.58 1it8 n GLU 158 N -3.71 0.56 -0.00 1.92 1.02 0.10 -4.31 120.64 116.23 1it8 n GLU 158 Ca -0.01 0.01 0.06 0.00 -0.02 0.00 0.00 57.16 57.20 1it8 n GLU 158 Cb 0.41 -1.70 -0.07 0.00 -0.02 0.00 0.00 31.44 30.07 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 -2.43 0.00 -2.11 -3.67 -5.35 -0.95 -5.01 119.36 99.85 1it8 n ILE 159 Ca -0.01 -0.23 -0.41 0.00 -0.27 0.00 0.00 62.75 61.84 1it8 n ILE 159 Cb 0.53 0.93 -0.02 0.00 -1.74 0.00 0.00 39.64 39.34 1it8 n ILE 159 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 1it8 s LYS 160 N -2.16 4.35 0.00 6.28 -2.85 -0.58 -4.90 119.74 119.88 1it8 s LYS 160 Ca 0.04 2.22 0.00 0.00 -1.00 0.00 0.00 55.97 57.23 1it8 s LYS 160 Cb 0.09 -3.07 0.00 0.00 -2.06 0.00 0.00 37.83 32.79 1it8 s LYS 160 CO 0.48 -0.20 0.41 0.39 0.10 0.00 0.00 175.35 176.53 1it8 n GLU 161 N 0.85 0.07 -4.24 1.78 -0.58 -1.26 -5.03 120.64 112.22 1it8 n GLU 161 Ca 0.00 -0.49 -0.13 0.00 -0.42 0.00 0.00 57.16 56.12 1it8 n GLU 161 Cb 0.42 -0.77 -0.10 0.00 -0.57 0.00 0.00 31.44 30.41 1it8 n GLU 161 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 1it8 s ILE 162 N -0.15 0.58 0.57 -3.67 -4.36 -1.26 -5.13 121.20 107.77 1it8 s ILE 162 Ca 0.00 -1.97 -0.21 0.00 -0.26 0.00 0.00 60.65 58.21 1it8 s ILE 162 Cb 0.00 -2.18 -0.04 0.00 1.25 0.00 0.00 42.46 41.49 1it8 s ILE 162 CO 0.00 -0.41 1.33 -2.84 0.24 0.00 0.00 174.94 173.26 1it8 s PRO 163 N -3.95 3.04 0.02 0.37 0.02 -1.26 -4.85 135.00 128.39 1it8 s PRO 163 Ca 0.26 2.16 -0.04 0.00 0.02 0.00 0.00 61.00 63.39 1it8 s PRO 163 Cb 0.06 -2.16 -0.01 0.00 0.02 0.00 0.00 34.50 32.41 1it8 s PRO 163 CO 0.05 -1.25 0.06 -1.64 -0.33 0.00 0.00 177.00 173.90 1it8 s MET 164 N -3.02 0.46 -0.12 5.54 -1.94 -1.26 -0.48 119.30 118.48 1it8 s MET 164 Ca 0.74 -0.60 -0.23 0.00 -1.71 0.00 0.00 55.69 53.89 1it8 s MET 164 Cb -0.39 0.18 -0.03 0.00 2.01 0.00 0.00 34.83 36.60 1it8 s MET 164 CO 0.45 -0.10 0.72 -0.80 -0.01 0.00 0.00 175.02 175.27 1it8 s ASN 165 N -1.67 6.92 -0.64 3.03 0.02 0.12 -3.25 114.94 119.48 1it8 s ASN 165 Ca -0.12 1.11 0.02 0.00 -1.02 0.00 0.00 52.86 52.85 1it8 s ASN 165 Cb -0.06 -2.41 0.16 0.00 0.02 0.00 0.00 41.25 38.96 1it8 s ASN 165 CO -0.01 -0.22 0.42 0.00 0.02 0.00 0.00 177.10 177.31 1it8 s ALA 166 N 1.35 3.61 0.29 0.60 0.00 -0.46 -4.10 121.76 123.06 1it8 s ALA 166 Ca 0.36 -3.47 -0.29 0.00 0.00 0.00 0.00 51.96 48.56 1it8 s ALA 166 Cb -0.17 -2.38 -0.11 0.00 0.00 0.00 0.00 23.12 20.46 1it8 s ALA 166 CO 0.15 -2.08 1.46 0.99 0.00 0.00 0.00 175.76 176.29 1it8 s THR 167 N -0.62 2.44 -0.27 0.00 2.01 -1.26 -3.91 115.64 114.02 1it8 s THR 167 Ca 0.20 0.39 -0.17 0.00 0.31 0.00 0.00 61.69 62.41 1it8 s THR 167 Cb -0.18 -3.25 -0.03 0.00 0.01 0.00 0.00 72.50 69.06 1it8 s THR 167 CO -0.06 0.07 0.49 -0.63 -0.69 0.00 0.00 174.62 173.80 1it8 s ILE 168 N -0.35 5.08 0.00 1.82 1.09 -0.03 -4.87 121.20 123.95 1it8 s ILE 168 Ca 0.58 0.75 0.00 0.00 -1.10 0.00 0.00 60.65 60.87 1it8 s ILE 168 Cb -0.44 -3.82 0.00 0.00 -1.06 0.00 0.00 42.46 37.14 1it8 s ILE 168 CO 0.49 0.06 0.00 0.00 -0.10 0.00 0.00 174.94 175.39 1it8 n GLN 169 N 5.53 3.39 0.00 2.79 1.13 -1.26 -1.03 117.38 127.92 1it8 n GLN 169 Ca -0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.01 1it8 n GLN 169 Cb 0.50 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.85 1it8 n GLN 169 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1it8 n GLY 170 N 5.00 1.73 7.00 1.08 0.00 -1.26 -4.24 105.19 114.50 1it8 n GLY 170 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.00 -1.22 1.61 2.88 -1.26 -2.39 113.62 113.24 1it8 n SER 171 Ca 0.00 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.58 1it8 n SER 171 Cb 0.00 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 63.67 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 1.42 -3.54 2.46 -2.24 -1.26 -4.82 114.28 106.29 1it8 n THR 172 Ca 0.00 -0.73 -0.41 0.00 -2.27 0.00 0.00 64.05 60.64 1it8 n THR 172 Cb 0.00 -0.36 -0.11 0.00 -2.10 0.00 0.00 70.33 67.77 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 -1.91 3.23 0.47 4.78 1.51 -1.01 -4.96 117.35 119.47 1it8 s TYR 173 Ca 0.29 -0.67 0.19 0.00 -1.01 0.00 0.00 57.07 55.86 1it8 s TYR 173 Cb 0.22 -2.49 1.21 0.00 -0.11 0.00 0.00 41.96 40.79 1it8 s TYR 173 CO 0.09 -0.56 2.06 1.79 -1.11 0.00 0.00 175.55 177.82 1it8 h THR 174 N 5.70 0.95 -0.17 -0.71 1.35 -1.87 -1.81 112.91 116.34 1it8 h THR 174 Ca -0.28 -0.44 -0.14 0.00 -0.55 0.00 0.00 66.41 65.00 1it8 h THR 174 Cb 1.12 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 68.78 1it8 h THR 174 CO 0.68 0.12 -0.48 -2.24 -0.25 0.00 0.00 175.52 173.35 1it8 h ASP 175 N 0.00 0.48 0.32 5.36 2.03 -1.95 -1.40 116.42 121.26 1it8 h ASP 175 Ca -0.00 -0.23 -0.11 0.00 -0.73 0.00 0.00 57.03 55.96 1it8 h ASP 175 Cb 0.24 -0.14 -0.01 0.00 -0.83 0.00 0.00 39.33 38.59 1it8 h ASP 175 CO 0.02 0.89 -0.44 -0.07 -1.03 0.00 0.00 179.24 178.60 1it8 h LEU 176 N 0.35 0.16 -0.22 0.15 3.38 -1.67 -1.00 115.31 116.47 1it8 h LEU 176 Ca 0.02 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.77 1it8 h LEU 176 Cb 0.98 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1it8 h LEU 176 CO 0.09 0.59 -0.44 0.03 0.09 0.00 0.00 178.44 178.79 1it8 h ARG 177 N 0.13 0.69 -0.78 1.13 2.47 -1.13 0.61 114.38 117.51 1it8 h ARG 177 Ca 0.01 -0.45 -0.04 0.00 -1.26 0.00 0.00 59.98 58.24 1it8 h ARG 177 Cb 0.83 0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 29.18 1it8 h ARG 177 CO 0.06 1.07 0.33 0.00 0.56 0.00 0.00 179.97 182.00 1it8 h ARG 178 N 0.41 1.15 0.39 0.04 3.08 -1.07 0.69 114.38 119.07 1it8 h ARG 178 Ca 0.01 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.85 1it8 h ARG 178 Cb 1.05 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.90 1it8 h ARG 178 CO 0.10 0.92 -0.19 -0.92 -1.07 0.00 0.00 179.97 178.81 1it8 h TYR 179 N 1.13 -0.48 -0.65 3.04 3.20 -1.09 -0.26 116.97 121.87 1it8 h TYR 179 Ca 0.26 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.22 1it8 h TYR 179 Cb 0.18 0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.53 1it8 h TYR 179 CO 0.02 -0.15 0.27 0.00 -1.64 0.00 0.00 178.16 176.65 1it8 h ALA 180 N -0.42 0.86 -0.43 1.82 0.00 -0.74 -0.90 119.26 119.45 1it8 h ALA 180 Ca -0.05 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 1it8 h ALA 180 Cb 0.54 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1it8 h ALA 180 CO 0.09 -0.16 -0.30 0.00 0.00 0.00 0.00 179.25 178.88 1it8 h ALA 181 N 1.43 0.64 -0.57 0.00 0.00 -0.86 -1.56 119.26 118.34 1it8 h ALA 181 Ca 0.33 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1it8 h ALA 181 Cb 0.40 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1it8 h ALA 181 CO -0.31 0.68 0.30 -0.09 0.00 0.00 0.00 179.25 179.83 1it8 h ARG 182 N 0.81 0.80 -0.08 0.00 2.43 -0.27 -1.88 114.38 116.20 1it8 h ARG 182 Ca 0.09 -0.10 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 1it8 h ARG 182 Cb 0.89 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1it8 h ARG 182 CO 0.08 0.62 -0.17 0.00 -1.51 0.00 0.00 179.97 178.99 1it8 h ARG 183 N 0.77 0.25 0.00 0.20 2.47 -1.16 -3.22 114.38 113.69 1it8 h ARG 183 Ca 0.20 -0.17 -0.02 0.00 -1.26 0.00 0.00 59.98 58.73 1it8 h ARG 183 Cb 0.06 0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 28.40 1it8 h ARG 183 CO -0.03 0.77 -0.09 -0.07 0.56 0.00 0.00 179.97 181.11 1it8 h LEU 184 N -0.22 0.00 -1.25 3.04 4.07 -1.26 -1.92 115.31 117.77 1it8 h LEU 184 Ca 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 1it8 h LEU 184 Cb 0.77 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.50 1it8 h LEU 184 CO 0.04 0.09 -0.21 0.28 -1.08 0.00 0.00 178.44 177.56 1it8 h SER 185 N 0.00 0.00 1.57 -0.43 0.02 -1.35 -2.81 113.55 110.55 1it8 h SER 185 Ca -0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 1it8 h SER 185 Cb 0.17 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1it8 h SER 185 CO 0.01 0.21 -0.41 0.77 -1.14 0.00 0.00 176.83 176.27 1it8 h SER 186 N 0.00 0.00 -4.38 3.07 4.64 -1.37 -3.46 113.55 112.05 1it8 h SER 186 Ca -0.00 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.86 1it8 h SER 186 Cb 0.68 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 62.89 1it8 h SER 186 CO 0.03 0.41 0.40 -0.04 -0.87 0.00 0.00 176.83 176.76 1it8 s MET 187 N -3.02 1.56 -1.10 4.77 1.00 -1.06 -4.99 119.30 116.45 1it8 s MET 187 Ca 0.04 -0.08 -0.13 0.00 0.00 0.00 0.00 55.69 55.52 1it8 s MET 187 Cb 0.07 -1.93 0.20 0.00 0.00 0.00 0.00 34.83 33.17 1it8 s MET 187 CO 0.73 -1.84 1.23 1.21 0.00 0.00 0.00 175.02 176.35 1it8 s ASN 188 N -4.68 7.05 0.05 3.03 3.04 -1.26 -4.97 114.94 117.20 1it8 s ASN 188 Ca 0.66 -2.99 0.05 0.00 0.04 0.00 0.00 52.86 50.62 1it8 s ASN 188 Cb -0.09 -2.33 -0.02 0.00 -1.54 0.00 0.00 41.25 37.27 1it8 s ASN 188 CO 0.50 -0.65 -0.15 -0.36 -3.04 0.00 0.00 177.10 173.40 1it8 s PHE 189 N 0.81 1.30 -0.11 0.43 0.40 -1.26 -4.95 117.98 114.60 1it8 s PHE 189 Ca 0.35 -0.39 0.11 0.00 -0.60 0.00 0.00 56.93 56.41 1it8 s PHE 189 Cb -0.06 -0.76 -0.24 0.00 0.51 0.00 0.00 43.02 42.48 1it8 s PHE 189 CO -0.05 0.06 0.42 -0.85 0.70 0.00 0.00 175.22 175.50 1it8 n GLU 190 N 1.67 0.66 -4.74 0.44 0.00 -1.22 -4.95 120.64 112.49 1it8 n GLU 190 Ca -0.19 0.20 -0.24 0.00 0.00 0.00 0.00 57.16 56.93 1it8 n GLU 190 Cb 0.54 -1.69 -0.15 0.00 0.00 0.00 0.00 31.44 30.14 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 -2.56 1.35 -0.38 3.84 1.01 -1.20 -4.02 121.20 119.24 1it8 s ILE 191 Ca -0.10 -0.80 0.04 0.00 0.00 0.00 0.00 60.65 59.79 1it8 s ILE 191 Cb 0.07 -1.14 0.11 0.00 0.01 0.00 0.00 42.46 41.51 1it8 s ILE 191 CO 0.81 0.32 0.10 -1.00 0.00 0.00 0.00 174.94 175.17 1it8 s HIS 192 N -0.48 3.65 0.84 3.97 3.76 -0.33 -1.35 115.29 125.34 1it8 s HIS 192 Ca 0.06 -3.01 -0.11 0.00 -0.15 0.00 0.00 55.06 51.84 1it8 s HIS 192 Cb -0.07 -2.92 0.10 0.00 1.11 0.00 0.00 32.58 30.79 1it8 s HIS 192 CO -0.00 -0.91 1.09 -2.14 -0.85 0.00 0.00 174.74 171.93 1it8 s PRO 193 N 0.67 1.72 -0.29 8.40 0.02 -1.25 -2.33 135.00 141.95 1it8 s PRO 193 Ca 0.12 0.78 0.03 0.00 0.02 0.00 0.00 61.00 61.95 1it8 s PRO 193 Cb -0.20 -1.87 0.07 0.00 0.02 0.00 0.00 34.50 32.52 1it8 s PRO 193 CO -0.06 -1.91 -0.05 0.42 -0.33 0.00 0.00 177.00 175.07 1it8 s ILE 194 N -3.03 2.16 0.72 2.83 1.01 0.15 -0.85 121.20 124.20 1it8 s ILE 194 Ca 0.62 -1.86 -0.02 0.00 0.00 0.00 0.00 60.65 59.38 1it8 s ILE 194 Cb -0.16 -2.39 0.11 0.00 0.01 0.00 0.00 42.46 40.03 1it8 s ILE 194 CO 0.56 -0.24 0.99 -0.83 0.00 0.00 0.00 174.94 175.42 1it8 s GLY 195 N 1.05 1.77 0.00 6.18 0.00 -0.20 -3.37 107.32 112.75 1it8 s GLY 195 Ca -0.02 -1.56 0.00 0.00 0.00 0.00 0.00 44.72 43.14 1it8 s GLY 195 CO -0.06 -1.03 0.00 0.61 0.00 0.00 0.00 173.10 172.62 1it8 n GLY 196 N -2.85 0.31 0.02 0.20 0.00 -1.26 -4.78 105.19 96.82 1it8 n GLY 196 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.26 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 -2.53 0.07 -0.29 1.61 0.24 -1.26 -4.46 118.33 111.70 1it8 n VAL 197 Ca 0.00 -0.19 0.09 0.00 -2.04 0.00 0.00 64.34 62.20 1it8 n VAL 197 Cb 0.20 0.44 0.21 0.00 -1.47 0.00 0.00 33.84 33.22 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 0.00 0.23 -0.67 3.34 2.07 -1.91 0.30 116.25 119.62 1it8 h VAL 198 Ca 0.00 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.52 1it8 h VAL 198 Cb 0.69 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 1it8 h VAL 198 CO 0.00 0.02 0.42 -0.65 0.02 0.00 0.00 177.57 177.37 1it8 h PRO 199 N 0.09 0.80 -0.31 1.57 0.11 -1.97 -0.74 132.00 131.54 1it8 h PRO 199 Ca 0.49 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.54 1it8 h PRO 199 Cb 0.92 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.83 1it8 h PRO 199 CO -0.75 0.53 0.18 -0.07 -0.21 0.00 0.00 178.00 177.67 1it8 h LEU 200 N 0.82 0.38 -0.46 2.35 3.38 -0.75 -1.97 115.31 119.05 1it8 h LEU 200 Ca 0.27 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.21 1it8 h LEU 200 Cb 0.01 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1it8 h LEU 200 CO -0.10 0.34 0.22 -0.07 0.09 0.00 0.00 178.44 178.92 1it8 h LEU 201 N 0.39 0.30 -1.86 1.67 3.38 -0.58 -0.45 115.31 118.15 1it8 h LEU 201 Ca 0.11 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1it8 h LEU 201 Cb 0.04 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1it8 h LEU 201 CO -0.02 0.21 0.00 -0.33 0.09 0.00 0.00 178.44 178.39 1it8 h GLU 202 N 0.43 0.00 -0.30 1.13 5.08 -0.92 -1.26 114.58 118.74 1it8 h GLU 202 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1it8 h GLU 202 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1it8 h GLU 202 CO -0.16 0.00 0.00 0.43 -1.00 0.00 0.00 179.01 178.28 1it8 n SER 203 N -2.93 3.31 -1.87 1.42 7.64 -0.30 -4.94 113.62 115.96 1it8 n SER 203 Ca -0.01 -1.99 -0.20 0.00 1.01 0.00 0.00 58.87 57.69 1it8 n SER 203 Cb 0.20 -0.19 -0.05 0.00 -1.01 0.00 0.00 64.21 63.16 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 1.43 -0.43 -1.37 1.43 4.01 -0.48 -4.86 117.16 116.89 1it8 n TYR 204 Ca 0.18 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.68 1it8 n TYR 204 Cb 0.60 -3.58 -0.09 0.00 -0.31 0.00 0.00 39.34 35.96 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 -2.65 2.53 0.03 -0.72 1.74 -0.51 -4.67 116.66 112.41 1it8 n ARG 205 Ca -0.22 -2.00 0.21 0.00 -0.77 0.00 0.00 57.85 55.07 1it8 n ARG 205 Cb 0.67 -2.17 0.73 0.00 -1.02 0.00 0.00 32.46 30.67 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 3.24 0.00 -0.15 -1.55 0.05 -1.80 -0.88 116.94 115.85 1it8 h PHE 206 Ca 0.38 0.00 -0.10 0.00 3.82 0.00 0.00 57.97 62.07 1it8 h PHE 206 Cb 0.92 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.86 1it8 h PHE 206 CO 1.60 0.00 -0.33 -0.09 -0.18 0.00 0.00 178.31 179.31 1it8 h ARG 207 N 0.00 0.29 -0.15 1.51 2.43 -1.84 -0.59 114.38 116.03 1it8 h ARG 207 Ca 0.24 -0.12 -0.22 0.00 -0.81 0.00 0.00 59.98 59.07 1it8 h ARG 207 Cb 1.11 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.66 1it8 h ARG 207 CO -0.00 0.60 -0.76 -0.44 -1.51 0.00 0.00 179.97 177.86 1it8 h ASP 208 N 0.25 0.88 -0.68 -3.80 3.32 -1.57 -2.34 116.42 112.49 1it8 h ASP 208 Ca 0.03 -0.57 -0.00 0.00 0.02 0.00 0.00 57.03 56.51 1it8 h ASP 208 Cb 0.72 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 1it8 h ASP 208 CO 0.05 1.36 0.41 0.58 -1.72 0.00 0.00 179.24 179.93 1it8 h VAL 209 N 0.51 1.20 -0.03 -1.35 2.07 -1.25 -0.04 116.25 117.36 1it8 h VAL 209 Ca -0.04 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 1it8 h VAL 209 Cb 1.38 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1it8 h VAL 209 CO 0.15 0.21 0.01 0.58 0.02 0.00 0.00 177.57 178.54 1it8 h VAL 210 N 0.96 1.17 -0.62 2.57 2.07 -0.94 0.79 116.25 122.25 1it8 h VAL 210 Ca 0.25 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 1it8 h VAL 210 Cb -0.03 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1it8 h VAL 210 CO -0.05 0.14 0.37 0.44 0.02 0.00 0.00 177.57 178.49 1it8 h ASP 211 N -0.16 0.75 -0.38 0.57 3.32 -1.09 -0.88 116.42 118.55 1it8 h ASP 211 Ca 0.01 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 1it8 h ASP 211 Cb 0.22 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1it8 h ASP 211 CO -0.00 0.59 0.14 0.40 -1.72 0.00 0.00 179.24 178.65 1it8 h ILE 212 N 0.84 1.20 -0.29 0.35 2.04 -0.90 -2.12 117.51 118.63 1it8 h ILE 212 Ca 0.22 -0.62 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 1it8 h ILE 212 Cb -0.02 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1it8 h ILE 212 CO -0.04 0.22 0.08 0.58 0.00 0.00 0.00 178.15 178.99 1it8 h VAL 213 N 0.46 1.21 -0.49 1.67 2.07 -0.59 -2.78 116.25 117.80 1it8 h VAL 213 Ca 0.12 -0.67 -0.08 0.00 0.82 0.00 0.00 66.70 66.89 1it8 h VAL 213 Cb 0.21 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1it8 h VAL 213 CO -0.01 0.22 -0.02 0.40 0.02 0.00 0.00 177.57 178.19 1it8 h ILE 214 N 0.31 1.25 -0.28 4.57 2.04 -1.13 0.23 117.51 124.49 1it8 h ILE 214 Ca 0.09 -1.05 -0.07 0.00 1.00 0.00 0.00 64.86 64.83 1it8 h ILE 214 Cb 0.26 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1it8 h ILE 214 CO -0.00 0.37 -0.12 0.77 0.00 0.00 0.00 178.15 179.17 1it8 h SER 215 N 0.76 0.46 -0.13 1.72 4.64 -1.36 0.53 113.55 120.17 1it8 h SER 215 Ca 0.14 -0.11 -0.18 0.00 -0.47 0.00 0.00 61.79 61.17 1it8 h SER 215 Cb 0.49 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1it8 h SER 215 CO 0.02 0.61 -0.57 0.28 -0.87 0.00 0.00 176.83 176.31 1it8 h SER 216 N 0.44 0.81 0.86 4.97 0.02 -1.14 -3.01 113.55 116.50 1it8 h SER 216 Ca 0.08 -0.44 -0.07 0.00 -0.84 0.00 0.00 61.79 60.52 1it8 h SER 216 Cb 0.47 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 1it8 h SER 216 CO 0.03 1.21 -0.35 0.11 -1.14 0.00 0.00 176.83 176.69 1it8 h LYS 217 N 0.55 0.00 -0.13 3.45 1.79 -0.43 -2.25 116.57 119.55 1it8 h LYS 217 Ca 0.01 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 1it8 h LYS 217 Cb 1.15 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.79 1it8 h LYS 217 CO 0.12 0.35 -0.54 0.52 -1.08 0.00 0.00 179.45 178.81 1it8 h MET 218 N 0.00 0.39 -0.02 3.15 2.86 -0.78 -3.27 114.93 117.25 1it8 h MET 218 Ca -0.00 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1it8 h MET 218 Cb 0.87 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1it8 h MET 218 CO 0.04 0.83 -0.20 0.00 1.06 0.00 0.00 176.91 178.64 1it8 n ALA 219 N -2.49 2.94 -2.38 6.32 0.00 -1.14 -4.98 120.51 118.78 1it8 n ALA 219 Ca -0.02 -0.65 -0.28 0.00 0.00 0.00 0.00 53.44 52.48 1it8 n ALA 219 Cb 0.58 -0.83 -0.02 0.00 0.00 0.00 0.00 19.45 19.18 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 -2.21 3.87 0.21 0.00 1.43 -0.86 -3.56 118.68 117.56 1it8 s LEU 220 Ca 0.24 0.86 -0.30 0.00 -1.03 0.00 0.00 54.13 53.90 1it8 s LEU 220 Cb 0.19 -3.73 -0.09 0.00 0.03 0.00 0.00 46.19 42.59 1it8 s LEU 220 CO 0.42 -0.37 1.35 -0.13 0.23 0.00 0.00 176.35 177.85 1it8 s ARG 221 N -4.06 4.35 0.41 1.70 0.52 -1.26 -4.87 118.95 115.73 1it8 s ARG 221 Ca 0.46 2.13 0.29 0.00 -0.52 0.00 0.00 55.73 58.09 1it8 s ARG 221 Cb -0.10 -3.17 1.35 0.00 0.52 0.00 0.00 34.95 33.54 1it8 s ARG 221 CO 0.35 -0.30 1.87 -1.35 0.02 0.00 0.00 175.30 175.89 1it8 h PRO 222 N 5.31 0.00 -0.36 3.54 0.11 -1.95 -3.23 132.00 135.42 1it8 h PRO 222 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1it8 h PRO 222 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1it8 h PRO 222 CO 0.78 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.17 1it8 n ASP 223 N -2.57 2.07 -4.37 -2.05 5.75 -1.26 -4.88 116.55 109.23 1it8 n ASP 223 Ca 0.00 -1.96 -0.32 0.00 -0.01 0.00 0.00 54.79 52.51 1it8 n ASP 223 Cb 0.17 -0.24 -0.15 0.00 -1.03 0.00 0.00 41.12 39.88 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 -1.52 2.23 0.56 0.11 0.52 -1.22 -4.83 118.95 114.80 1it8 s ARG 224 Ca 0.27 -0.86 -0.20 0.00 -0.52 0.00 0.00 55.73 54.42 1it8 s ARG 224 Cb 0.14 -2.16 -0.06 0.00 0.52 0.00 0.00 34.95 33.40 1it8 s ARG 224 CO 0.19 0.58 1.11 -2.30 0.02 0.00 0.00 175.30 174.90 1it8 n PRO 225 N 2.33 1.22 -4.40 3.54 -0.02 -1.26 -4.79 135.00 131.63 1it8 n PRO 225 Ca -0.16 0.46 -0.33 0.00 -2.02 0.00 0.00 63.50 61.44 1it8 n PRO 225 Cb 0.51 -2.29 -0.15 0.00 -0.02 0.00 0.00 33.50 31.55 1it8 n PRO 225 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1it8 s VAL 226 N -1.40 2.63 -0.15 -1.45 1.01 -1.26 -1.19 120.40 118.59 1it8 s VAL 226 Ca 0.73 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 1it8 s VAL 226 Cb -0.44 -2.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 1it8 s VAL 226 CO 0.49 0.51 -0.11 -2.28 0.00 0.00 0.00 175.10 173.71 1it8 s HIS 227 N 0.97 2.86 -0.84 5.22 5.04 -0.98 0.30 115.29 127.86 1it8 s HIS 227 Ca -0.02 -0.66 -0.14 0.00 -1.54 0.00 0.00 55.06 52.69 1it8 s HIS 227 Cb -0.15 -1.90 0.22 0.00 0.04 0.00 0.00 32.58 30.79 1it8 s HIS 227 CO -0.03 -0.25 0.79 -1.17 -2.34 0.00 0.00 174.74 171.75 1it8 s LEU 228 N 0.54 6.68 -0.05 8.88 2.96 0.17 0.34 118.68 138.20 1it8 s LEU 228 Ca -0.07 -2.68 -0.38 0.00 -0.22 0.00 0.00 54.13 50.77 1it8 s LEU 228 Cb -0.15 -2.22 -0.16 0.00 0.50 0.00 0.00 46.19 44.15 1it8 s LEU 228 CO 0.03 -0.59 1.50 0.49 -1.32 0.00 0.00 176.35 176.46 1it8 n PHE 229 N 4.07 1.72 0.00 5.38 0.99 -1.22 -1.91 117.46 126.48 1it8 n PHE 229 Ca 0.15 0.60 0.00 0.00 -0.00 0.00 0.00 57.45 58.19 1it8 n PHE 229 Cb 0.47 -2.38 0.00 0.00 -1.00 0.00 0.00 39.48 36.57 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 3.16 2.71 3.56 1.37 0.00 -1.26 -4.29 105.19 110.45 1it8 n GLY 230 Ca 0.21 -0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.55 1.29 -0.14 4.61 0.00 -0.81 -4.70 121.76 120.46 1it8 s ALA 231 Ca 0.00 -0.91 0.15 0.00 0.00 0.00 0.00 51.96 51.21 1it8 s ALA 231 Cb 0.00 -4.51 0.40 0.00 0.00 0.00 0.00 23.12 19.01 1it8 s ALA 231 CO 0.00 -5.15 1.19 0.41 0.00 0.00 0.00 175.76 172.22 1it8 n GLY 232 N 6.60 3.85 3.11 0.00 0.00 -1.20 -3.31 105.19 114.24 1it8 n GLY 232 Ca 0.40 -1.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.22 2.18 0.43 1.61 2.46 -1.26 -4.61 115.29 113.87 1it8 s HIS 233 Ca 0.35 -1.00 0.32 0.00 0.47 0.00 0.00 55.06 55.21 1it8 s HIS 233 Cb 0.36 -1.52 1.46 0.00 -0.13 0.00 0.00 32.58 32.75 1it8 s HIS 233 CO -0.09 -0.48 1.52 -2.30 -2.47 0.00 0.00 174.74 170.92 1it8 n PRO 234 N 4.01 -0.03 0.25 2.88 -0.02 -1.26 -1.85 135.00 138.97 1it8 n PRO 234 Ca -0.20 1.21 0.17 0.00 -2.02 0.00 0.00 63.50 62.67 1it8 n PRO 234 Cb 0.52 -2.40 0.80 0.00 -0.02 0.00 0.00 33.50 32.39 1it8 n PRO 234 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1it8 h ILE 235 N 0.00 0.15 0.00 4.25 2.10 -1.78 -2.43 117.51 119.81 1it8 h ILE 235 Ca 0.86 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.80 1it8 h ILE 235 Cb 2.80 0.67 0.00 0.00 -1.09 0.00 0.00 36.82 39.21 1it8 h ILE 235 CO -0.43 0.00 -1.11 1.33 -1.08 0.00 0.00 178.15 176.85 1it8 n VAL 236 N -3.21 0.00 -0.29 2.19 0.24 -0.77 -4.74 118.33 111.74 1it8 n VAL 236 Ca 0.01 -0.25 -0.09 0.00 -2.04 0.00 0.00 64.34 61.97 1it8 n VAL 236 Cb 0.45 0.55 -0.08 0.00 -1.47 0.00 0.00 33.84 33.29 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 -1.46 -0.58 6.34 0.05 -1.56 0.34 116.94 120.06 1it8 h PHE 237 Ca 0.00 0.10 0.11 0.00 3.82 0.00 0.00 57.97 61.99 1it8 h PHE 237 Cb 0.41 0.73 -0.08 0.00 2.00 0.00 0.00 35.95 39.01 1it8 h PHE 237 CO 0.00 -0.30 0.11 0.00 -0.18 0.00 0.00 178.31 177.93 1it8 h ALA 238 N 0.09 0.67 -0.05 2.45 0.00 -1.85 0.24 119.26 120.81 1it8 h ALA 238 Ca 0.11 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1it8 h ALA 238 Cb 0.34 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1it8 h ALA 238 CO -0.69 -0.32 0.01 1.25 0.00 0.00 0.00 179.25 179.50 1it8 h LEU 239 N 0.23 0.08 -0.42 0.00 5.85 -1.62 -1.72 115.31 117.72 1it8 h LEU 239 Ca 0.30 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1it8 h LEU 239 Cb 0.45 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 1it8 h LEU 239 CO -0.40 0.30 0.26 0.00 -0.34 0.00 0.00 178.44 178.26 1it8 h ALA 240 N 0.78 0.53 -0.93 1.25 0.00 -0.58 -2.07 119.26 118.23 1it8 h ALA 240 Ca 0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1it8 h ALA 240 Cb 0.25 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1it8 h ALA 240 CO 0.00 0.00 0.55 0.28 0.00 0.00 0.00 179.25 180.08 1it8 h VAL 241 N 0.56 1.26 -0.03 0.00 2.07 -0.94 -0.14 116.25 119.03 1it8 h VAL 241 Ca 0.15 -0.59 0.01 0.00 0.82 0.00 0.00 66.70 67.09 1it8 h VAL 241 Cb -0.03 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 29.69 1it8 h VAL 241 CO -0.03 0.28 0.03 0.00 0.02 0.00 0.00 177.57 177.86 1it8 h ALA 242 N 1.31 1.72 0.00 1.67 0.00 -0.66 -0.61 119.26 122.68 1it8 h ALA 242 Ca 0.33 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.19 1it8 h ALA 242 Cb -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1it8 h ALA 242 CO -0.06 -0.04 -0.48 0.52 0.00 0.00 0.00 179.25 179.19 1it8 h MET 243 N 0.00 0.00 0.00 0.00 2.86 -0.41 -2.03 114.93 115.35 1it8 h MET 243 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1it8 h MET 243 Cb 0.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1it8 h MET 243 CO -0.00 0.21 0.00 0.41 1.06 0.00 0.00 176.91 178.59 1it8 n GLY 244 N 1.19 1.54 3.78 8.32 0.00 -0.24 -4.73 105.19 115.05 1it8 n GLY 244 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 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 3.94 -0.00 1.61 1.01 -0.76 -4.58 120.40 119.62 1it8 s VAL 245 Ca 0.00 1.61 0.01 0.00 0.00 0.00 0.00 61.98 63.60 1it8 s VAL 245 Cb 0.00 -3.89 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1it8 s VAL 245 CO 0.00 0.13 0.02 0.47 0.00 0.00 0.00 175.10 175.72 1it8 n ASP 246 N 0.44 4.77 -4.01 3.32 8.00 0.15 -4.37 116.55 124.85 1it8 n ASP 246 Ca 0.03 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.36 1it8 n ASP 246 Cb 0.49 0.86 -0.14 0.00 -0.02 0.00 0.00 41.12 42.32 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 -3.42 2.07 0.09 0.64 1.43 -0.55 -1.89 118.68 117.07 1it8 s LEU 247 Ca -0.00 -0.23 0.05 0.00 -1.03 0.00 0.00 54.13 52.91 1it8 s LEU 247 Cb 0.01 -0.31 -0.03 0.00 0.03 0.00 0.00 46.19 45.88 1it8 s LEU 247 CO 0.04 0.02 -0.12 -0.36 0.23 0.00 0.00 176.35 176.15 1it8 s PHE 248 N -0.46 1.18 -0.06 0.29 0.40 -0.75 -0.65 117.98 117.93 1it8 s PHE 248 Ca -0.00 -0.56 0.01 0.00 -0.60 0.00 0.00 56.93 55.78 1it8 s PHE 248 Cb -0.04 -0.64 0.02 0.00 0.51 0.00 0.00 43.02 42.86 1it8 s PHE 248 CO 0.00 0.05 -0.07 0.16 0.70 0.00 0.00 175.22 176.06 1it8 s ASP 249 N -2.17 1.35 -0.11 1.36 1.47 -1.21 0.97 116.67 118.33 1it8 s ASP 249 Ca 0.03 -0.19 0.03 0.00 1.18 0.00 0.00 52.55 53.60 1it8 s ASP 249 Cb -0.06 -0.60 0.01 0.00 -0.34 0.00 0.00 42.92 41.92 1it8 s ASP 249 CO 0.02 -0.04 -0.21 -0.55 0.68 0.00 0.00 175.17 175.07 1it8 s SER 250 N 0.96 2.87 -0.02 2.11 0.15 -1.07 -3.21 113.70 115.48 1it8 s SER 250 Ca -0.10 -0.53 0.08 0.00 0.70 0.00 0.00 55.95 56.10 1it8 s SER 250 Cb -0.15 -1.31 -0.12 0.00 -1.71 0.00 0.00 66.02 62.73 1it8 s SER 250 CO 0.00 0.11 0.15 0.00 1.20 0.00 0.00 173.24 174.70 1it8 n ALA 251 N 3.78 2.22 -0.23 5.45 0.00 -1.26 0.32 120.51 130.79 1it8 n ALA 251 Ca -0.20 -0.23 0.02 0.00 0.00 0.00 0.00 53.44 53.03 1it8 n ALA 251 Cb 0.52 -0.22 0.14 0.00 0.00 0.00 0.00 19.45 19.89 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 0.29 -1.09 0.00 0.02 -1.91 0.21 113.55 111.07 1it8 h SER 252 Ca -0.03 0.08 0.30 0.00 -0.84 0.00 0.00 61.79 61.31 1it8 h SER 252 Cb 0.53 0.05 -0.11 0.00 0.14 0.00 0.00 62.40 63.01 1it8 h SER 252 CO 0.00 0.15 0.69 0.10 -1.14 0.00 0.00 176.83 176.63 1it8 h TYR 253 N 0.46 0.70 0.04 3.45 -0.00 -1.81 0.47 116.97 120.27 1it8 h TYR 253 Ca 0.35 0.03 -0.27 0.00 0.00 0.00 0.00 58.73 58.83 1it8 h TYR 253 Cb 0.44 -0.19 -0.03 0.00 0.00 0.00 0.00 36.73 36.95 1it8 h TYR 253 CO -0.16 -0.01 -1.49 0.00 -0.00 0.00 0.00 178.16 176.50 1it8 n ALA 254 N -2.45 0.82 -0.33 0.10 0.00 -0.08 -3.43 120.51 115.13 1it8 n ALA 254 Ca 0.28 -0.52 -0.03 0.00 0.00 0.00 0.00 53.44 53.17 1it8 n ALA 254 Cb 0.98 -0.59 0.09 0.00 0.00 0.00 0.00 19.45 19.93 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 -0.69 1.06 -0.51 0.00 3.38 -0.03 -2.14 115.31 116.38 1it8 h LEU 255 Ca -0.38 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.48 1it8 h LEU 255 Cb 1.52 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 1it8 h LEU 255 CO -0.13 0.80 0.10 1.88 0.09 0.00 0.00 178.44 181.19 1it8 h TYR 256 N 1.22 0.87 -0.64 1.13 0.99 -0.28 -3.00 116.97 117.27 1it8 h TYR 256 Ca 0.32 -0.11 0.09 0.00 2.00 0.00 0.00 58.73 61.03 1it8 h TYR 256 Cb -0.08 -0.24 -0.07 0.00 1.00 0.00 0.00 36.73 37.34 1it8 h TYR 256 CO -0.00 0.78 0.29 0.00 -0.00 0.00 0.00 178.16 179.23 1it8 h ALA 257 N 0.98 0.85 0.00 3.88 0.00 -1.44 0.44 119.26 123.98 1it8 h ALA 257 Ca 0.16 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1it8 h ALA 257 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1it8 h ALA 257 CO 0.01 -0.11 0.00 0.87 0.00 0.00 0.00 179.25 180.02 1it8 h LYS 258 N 0.51 0.00 -0.39 0.00 1.57 -1.27 -1.57 116.57 115.42 1it8 h LYS 258 Ca 0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1it8 h LYS 258 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1it8 h LYS 258 CO -0.27 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.36 1it8 n ASP 259 N -2.50 4.49 -4.14 0.86 8.00 0.14 -4.94 116.55 118.46 1it8 n ASP 259 Ca -0.01 -2.91 -0.35 0.00 0.71 0.00 0.00 54.79 52.24 1it8 n ASP 259 Cb 0.12 -0.58 -0.01 0.00 -0.02 0.00 0.00 41.12 40.64 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 -0.01 -3.82 -4.64 -2.24 8.00 -0.59 -4.85 116.55 108.41 1it8 n ASP 260 Ca 0.23 -0.94 -0.34 0.00 0.71 0.00 0.00 54.79 54.45 1it8 n ASP 260 Cb 0.97 -3.10 -0.10 0.00 -0.02 0.00 0.00 41.12 38.87 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 -6.84 2.81 -0.21 -1.24 0.52 -0.43 -0.38 118.95 113.18 1it8 s ARG 261 Ca 0.73 -0.53 -0.01 0.00 -0.52 0.00 0.00 55.73 55.40 1it8 s ARG 261 Cb -0.39 -2.67 0.02 0.00 0.52 0.00 0.00 34.95 32.43 1it8 s ARG 261 CO 0.90 0.66 -0.13 -0.47 0.02 0.00 0.00 175.30 176.29 1it8 s TYR 262 N -0.92 2.91 0.46 -0.53 5.04 0.14 -4.06 117.35 120.40 1it8 s TYR 262 Ca 0.15 -1.46 -0.21 0.00 -2.44 0.00 0.00 57.07 53.10 1it8 s TYR 262 Cb -0.11 -2.00 -0.09 0.00 0.35 0.00 0.00 41.96 40.11 1it8 s TYR 262 CO 0.04 -0.72 1.03 -1.64 -1.34 0.00 0.00 175.55 172.92 1it8 s MET 263 N 1.34 3.92 -0.00 4.97 -1.94 -1.26 -1.04 119.30 125.29 1it8 s MET 263 Ca 0.04 1.36 -0.13 0.00 -1.71 0.00 0.00 55.69 55.24 1it8 s MET 263 Cb -0.14 -2.19 0.02 0.00 2.01 0.00 0.00 34.83 34.52 1it8 s MET 263 CO -0.08 -0.32 0.27 0.99 -0.01 0.00 0.00 175.02 175.87 1it8 s THR 264 N -1.94 0.07 -0.09 2.05 2.01 0.20 -4.90 115.64 113.04 1it8 s THR 264 Ca 0.65 -0.55 0.26 0.00 0.31 0.00 0.00 61.69 62.35 1it8 s THR 264 Cb -0.16 -0.63 0.26 0.00 0.01 0.00 0.00 72.50 71.98 1it8 s THR 264 CO 0.20 -0.30 1.79 -0.65 -0.69 0.00 0.00 174.62 174.97 1it8 h PRO 265 N 3.85 0.00 -0.01 4.92 0.11 -1.93 -1.69 132.00 137.25 1it8 h PRO 265 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1it8 h PRO 265 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1it8 h PRO 265 CO 0.41 0.00 -0.22 0.39 -0.21 0.00 0.00 178.00 178.37 1it8 n GLU 266 N -2.41 1.57 -2.01 1.05 4.71 -1.26 -3.80 120.64 118.49 1it8 n GLU 266 Ca -0.01 -1.05 0.00 0.00 -0.01 0.00 0.00 57.16 56.09 1it8 n GLU 266 Cb 0.07 -1.30 0.00 0.00 -1.01 0.00 0.00 31.44 29.21 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 1.09 -0.16 3.27 0.62 0.00 -0.64 -4.73 105.19 104.65 1it8 n GLY 267 Ca 0.08 -1.19 -0.23 0.00 0.00 0.00 0.00 46.02 44.68 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 -3.34 1.63 0.04 2.61 2.01 -1.26 -0.63 115.64 116.71 1it8 s THR 268 Ca 0.00 -1.56 0.04 0.00 0.31 0.00 0.00 61.69 60.48 1it8 s THR 268 Cb 0.00 -1.52 -0.02 0.00 0.01 0.00 0.00 72.50 70.97 1it8 s THR 268 CO 0.00 -0.12 -0.11 -0.54 -0.69 0.00 0.00 174.62 173.16 1it8 s LYS 269 N -2.00 0.74 0.19 4.92 1.02 -0.21 -4.95 119.74 119.44 1it8 s LYS 269 Ca 0.06 -0.75 -0.30 0.00 0.02 0.00 0.00 55.97 55.01 1it8 s LYS 269 Cb -0.09 -0.68 -0.08 0.00 -0.52 0.00 0.00 37.83 36.46 1it8 s LYS 269 CO 0.04 0.16 0.95 1.03 -0.92 0.00 0.00 175.35 176.61 1it8 s ARG 270 N -1.31 4.79 0.26 1.68 0.52 -1.26 0.29 118.95 123.92 1it8 s ARG 270 Ca -0.03 1.48 -0.02 0.00 -0.52 0.00 0.00 55.73 56.65 1it8 s ARG 270 Cb -0.08 -3.32 0.50 0.00 0.52 0.00 0.00 34.95 32.57 1it8 s ARG 270 CO 0.01 0.39 1.78 1.25 0.02 0.00 0.00 175.30 178.76 1it8 h LEU 271 N 4.74 0.62 0.00 2.53 5.85 -1.04 0.41 115.31 128.42 1it8 h LEU 271 Ca -0.44 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1it8 h LEU 271 Cb 1.20 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.20 1it8 h LEU 271 CO 0.70 0.30 0.00 -0.90 -0.34 0.00 0.00 178.44 178.19 1it8 n ASP 272 N -4.80 0.00 -0.67 1.25 5.75 -1.26 -2.17 116.55 114.65 1it8 n ASP 272 Ca 0.16 0.39 0.10 0.00 -0.01 0.00 0.00 54.79 55.44 1it8 n ASP 272 Cb 0.38 -0.45 0.05 0.00 -1.03 0.00 0.00 41.12 40.07 1it8 n ASP 272 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 1it8 n GLU 273 N -1.45 1.70 -3.02 0.11 0.28 0.12 -4.93 120.64 113.46 1it8 n GLU 273 Ca 0.04 -1.38 -0.40 0.00 -0.16 0.00 0.00 57.16 55.26 1it8 n GLU 273 Cb 0.16 -1.41 -0.05 0.00 1.43 0.00 0.00 31.44 31.57 1it8 n GLU 273 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1it8 s LEU 274 N -2.04 4.35 -0.10 -1.84 1.43 -0.92 -4.92 118.68 114.65 1it8 s LEU 274 Ca 0.21 1.27 0.13 0.00 -1.03 0.00 0.00 54.13 54.72 1it8 s LEU 274 Cb 0.17 -3.14 -0.19 0.00 0.03 0.00 0.00 46.19 43.06 1it8 s LEU 274 CO 0.38 -0.09 0.14 0.47 0.23 0.00 0.00 176.35 177.49 1it8 n ASP 275 N 3.53 1.59 -4.21 2.29 9.92 -1.26 -4.77 116.55 123.64 1it8 n ASP 275 Ca -0.01 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.13 1it8 n ASP 275 Cb 0.51 1.12 -0.10 0.00 -0.64 0.00 0.00 41.12 42.01 1it8 n ASP 275 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1it8 s TYR 276 N -2.57 1.13 -0.40 1.24 1.51 -1.26 -4.73 117.35 112.28 1it8 s TYR 276 Ca -0.06 -1.25 -0.06 0.00 -1.01 0.00 0.00 57.07 54.69 1it8 s TYR 276 Cb 0.06 -0.61 0.09 0.00 -0.11 0.00 0.00 41.96 41.39 1it8 s TYR 276 CO 0.58 -0.49 0.21 -0.06 -1.11 0.00 0.00 175.55 174.68 1it8 s PHE 277 N -3.99 3.43 -1.33 2.71 0.08 -1.26 -4.88 117.98 112.74 1it8 s PHE 277 Ca 0.32 -1.96 -0.16 0.00 0.12 0.00 0.00 56.93 55.26 1it8 s PHE 277 Cb 0.07 -2.98 0.00 0.00 -0.57 0.00 0.00 43.02 39.55 1it8 s PHE 277 CO 0.08 -0.90 2.17 -0.35 -0.10 0.00 0.00 175.22 176.11 1it8 n PRO 278 N 4.75 2.60 -3.62 0.24 -0.04 -1.26 -4.77 135.00 132.89 1it8 n PRO 278 Ca -0.07 -2.47 -0.04 0.00 -0.04 0.00 0.00 63.50 60.88 1it8 n PRO 278 Cb 0.42 -3.23 -0.01 0.00 -0.04 0.00 0.00 33.50 30.64 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 -0.33 0.87 -4.56 0.00 7.64 -1.26 -4.55 113.62 111.43 1it8 n SER 280 Ca -0.06 -2.27 -0.28 0.00 1.01 0.00 0.00 58.87 57.27 1it8 n SER 280 Cb 0.61 -0.25 0.22 0.00 -1.01 0.00 0.00 64.21 63.79 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 -2.36 0.12 0.04 0.00 0.11 -1.98 0.23 132.00 128.16 1it8 h PRO 282 Ca -0.59 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.51 1it8 h PRO 282 Cb 1.33 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1it8 h PRO 282 CO 0.53 0.08 -0.02 0.28 -0.21 0.00 0.00 178.00 178.66 1it8 h VAL 283 N 0.13 0.00 0.00 3.15 2.07 -1.92 -3.37 116.25 116.30 1it8 h VAL 283 Ca 0.58 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1it8 h VAL 283 Cb 2.03 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1it8 h VAL 283 CO -0.11 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.48 1it8 n SER 285 N -2.49 0.69 0.00 0.00 3.41 0.77 -4.07 113.62 111.92 1it8 n SER 285 Ca -0.00 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 1it8 n SER 285 Cb 0.15 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 1it8 n SER 285 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1it8 n LYS 286 N -2.11 -0.27 -4.36 4.33 2.85 -0.97 -5.07 118.16 112.57 1it8 n LYS 286 Ca 0.05 -0.26 -0.18 0.00 -1.05 0.00 0.00 58.31 56.87 1it8 n LYS 286 Cb 0.42 -0.74 -0.10 0.00 -0.65 0.00 0.00 35.03 33.96 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 -0.03 1.70 0.14 5.58 4.12 -0.69 -5.11 117.35 123.05 1it8 s TYR 287 Ca 0.00 -0.69 0.10 0.00 0.02 0.00 0.00 57.07 56.49 1it8 s TYR 287 Cb 0.00 -0.89 -0.04 0.00 -1.52 0.00 0.00 41.96 39.51 1it8 s TYR 287 CO 0.00 0.23 -0.22 -0.08 0.02 0.00 0.00 175.55 175.50 1it8 s THR 288 N -3.10 1.98 0.26 -0.71 -1.32 -1.26 -4.68 115.64 106.80 1it8 s THR 288 Ca 0.25 -1.76 -0.03 0.00 -1.21 0.00 0.00 61.69 58.94 1it8 s THR 288 Cb 0.02 -1.82 0.25 0.00 -1.51 0.00 0.00 72.50 69.43 1it8 s THR 288 CO 0.08 -0.09 1.86 -0.65 -2.21 0.00 0.00 174.62 173.61 1it8 h PRO 289 N 3.70 1.01 0.00 7.08 0.11 -1.88 0.85 132.00 142.88 1it8 h PRO 289 Ca -0.47 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.58 1it8 h PRO 289 Cb 1.19 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 32.07 1it8 h PRO 289 CO 0.43 0.67 -0.02 1.96 -0.21 0.00 0.00 178.00 180.83 1it8 h GLN 290 N 1.04 0.00 0.00 1.05 1.08 -1.88 -1.09 115.11 115.32 1it8 h GLN 290 Ca 0.42 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.62 1it8 h GLN 290 Cb 0.23 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 1it8 h GLN 290 CO -0.19 0.02 -0.34 0.93 -0.95 0.00 0.00 178.83 178.30 1it8 h GLU 291 N 0.00 0.00 -0.93 1.46 5.08 -1.38 -3.38 114.58 115.43 1it8 h GLU 291 Ca -0.00 0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.52 1it8 h GLU 291 Cb 0.06 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.15 1it8 h GLU 291 CO 0.00 0.00 -0.31 -0.11 -1.00 0.00 0.00 179.01 177.59 1it8 n LEU 292 N -4.64 -0.50 -0.36 1.33 -0.00 0.08 -0.27 117.00 112.65 1it8 n LEU 292 Ca -0.05 1.61 0.37 0.00 -0.00 0.00 0.00 56.01 57.94 1it8 n LEU 292 Cb 0.18 -0.41 0.75 0.00 -0.00 0.00 0.00 43.42 43.94 1it8 n LEU 292 CO 0.07 -1.48 1.34 -0.09 -0.00 0.00 0.00 177.39 177.23 1it8 h ARG 293 N 0.00 0.01 -0.29 1.96 2.43 -1.38 -1.11 114.38 116.00 1it8 h ARG 293 Ca 0.37 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.54 1it8 h ARG 293 Cb 0.60 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1it8 h ARG 293 CO -0.93 0.01 0.00 0.39 -1.51 0.00 0.00 179.97 177.93 1it8 n GLU 294 N -4.17 2.16 -2.34 0.20 4.71 0.63 -5.00 120.64 116.83 1it8 n GLU 294 Ca 0.28 -2.00 -0.29 0.00 -0.01 0.00 0.00 57.16 55.14 1it8 n GLU 294 Cb 1.32 -1.40 0.01 0.00 -1.01 0.00 0.00 31.44 30.36 1it8 n GLU 294 CO 0.00 0.00 0.00 -1.64 0.09 0.00 0.00 177.13 175.58 1it8 s MET 295 N -1.28 3.47 0.50 3.49 -1.94 -0.42 -5.01 119.30 118.12 1it8 s MET 295 Ca 0.30 0.36 -0.21 0.00 -1.71 0.00 0.00 55.69 54.43 1it8 s MET 295 Cb 0.18 -2.26 -0.09 0.00 2.01 0.00 0.00 34.83 34.67 1it8 s MET 295 CO 0.25 -0.40 0.88 -2.30 -0.01 0.00 0.00 175.02 173.43 1it8 n PRO 296 N -2.48 1.01 -0.11 2.03 -0.02 -1.26 -4.63 135.00 129.55 1it8 n PRO 296 Ca 0.03 0.37 0.14 0.00 -2.02 0.00 0.00 63.50 62.02 1it8 n PRO 296 Cb 0.55 -1.99 0.52 0.00 -0.02 0.00 0.00 33.50 32.56 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 0.93 0.37 -0.13 -0.52 3.11 -1.96 0.26 116.57 118.63 1it8 h LYS 297 Ca -0.46 -0.02 -0.18 0.00 -2.81 0.00 0.00 60.65 57.18 1it8 h LYS 297 Cb 1.36 -0.08 -0.00 0.00 -1.00 0.00 0.00 32.23 32.50 1it8 h LYS 297 CO 0.53 0.24 -0.66 1.49 -2.81 0.00 0.00 179.45 178.24 1it8 h GLU 298 N 0.38 0.51 0.02 1.90 4.81 -2.00 -1.69 114.58 118.53 1it8 h GLU 298 Ca 0.31 -0.38 -0.21 0.00 -0.13 0.00 0.00 59.36 58.95 1it8 h GLU 298 Cb 0.70 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 1it8 h GLU 298 CO -0.09 1.00 -0.95 1.49 -0.73 0.00 0.00 179.01 179.73 1it8 h GLU 299 N 0.37 0.21 -0.37 1.92 4.57 -1.56 -2.30 114.58 117.42 1it8 h GLU 299 Ca -0.02 -0.26 -0.07 0.00 -1.18 0.00 0.00 59.36 57.84 1it8 h GLU 299 Cb 1.23 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.88 1it8 h GLU 299 CO 0.12 1.02 -0.03 -0.09 -1.18 0.00 0.00 179.01 178.85 1it8 h ARG 300 N 0.11 0.67 0.08 1.92 2.43 -0.44 -1.62 114.38 117.52 1it8 h ARG 300 Ca -0.06 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 58.88 1it8 h ARG 300 Cb 1.61 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.11 1it8 h ARG 300 CO 0.15 0.79 -0.04 1.15 -1.51 0.00 0.00 179.97 180.51 1it8 h THR 301 N 0.48 1.16 -0.88 0.20 2.02 -1.36 -1.58 112.91 112.94 1it8 h THR 301 Ca 0.10 -0.93 0.14 0.00 0.77 0.00 0.00 66.41 66.49 1it8 h THR 301 Cb 0.50 1.75 -0.09 0.00 -1.74 0.00 0.00 68.15 68.58 1it8 h THR 301 CO 0.02 0.23 0.49 -0.09 0.37 0.00 0.00 175.52 176.54 1it8 h ARG 302 N -0.54 0.68 -0.15 6.66 1.12 -1.43 0.22 114.38 120.95 1it8 h ARG 302 Ca -0.01 -0.04 -0.14 0.00 -1.11 0.00 0.00 59.98 58.68 1it8 h ARG 302 Cb 0.45 -0.15 0.00 0.00 -0.01 0.00 0.00 29.97 30.26 1it8 h ARG 302 CO 0.02 0.45 -0.46 -0.07 -3.11 0.00 0.00 179.97 176.80 1it8 h LEU 303 N 0.70 0.66 -0.92 3.80 3.38 -1.25 -2.41 115.31 119.27 1it8 h LEU 303 Ca 0.48 -0.60 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1it8 h LEU 303 Cb 0.64 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1it8 h LEU 303 CO -0.34 1.14 -0.33 -0.07 0.09 0.00 0.00 178.44 178.93 1it8 h LEU 304 N 0.21 0.40 0.51 1.67 3.38 -0.85 -1.73 115.31 118.90 1it8 h LEU 304 Ca -0.02 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1it8 h LEU 304 Cb 1.08 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 1it8 h LEU 304 CO 0.10 0.71 -0.32 0.00 0.09 0.00 0.00 178.44 179.01 1it8 h ALA 305 N 1.32 -0.80 -0.31 1.53 0.00 -0.55 0.88 119.26 121.33 1it8 h ALA 305 Ca 0.04 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.86 1it8 h ALA 305 Cb 0.75 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 18.87 1it8 h ALA 305 CO 0.06 -0.97 -0.15 -0.07 0.00 0.00 0.00 179.25 178.12 1it8 h LEU 306 N -0.79 -0.50 -0.10 0.00 3.38 -1.25 -0.45 115.31 115.59 1it8 h LEU 306 Ca -0.06 0.12 0.04 0.00 0.09 0.00 0.00 57.88 58.07 1it8 h LEU 306 Cb 0.65 0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.64 1it8 h LEU 306 CO 0.05 -0.18 -0.15 -0.74 0.09 0.00 0.00 178.44 177.50 1it8 h HIS 307 N -0.10 -0.39 -0.99 1.13 2.76 -1.12 0.01 115.15 116.44 1it8 h HIS 307 Ca 0.16 0.02 0.16 0.00 -2.20 0.00 0.00 60.37 58.51 1it8 h HIS 307 Cb 0.34 0.19 -0.09 0.00 1.55 0.00 0.00 27.41 29.40 1it8 h HIS 307 CO -0.35 -0.22 0.62 -0.91 -1.30 0.00 0.00 177.93 175.76 1it8 h ASN 308 N -0.20 0.82 -0.55 3.26 2.35 0.02 0.12 115.58 121.40 1it8 h ASN 308 Ca 0.09 0.07 -0.12 0.00 -0.55 0.00 0.00 56.30 55.79 1it8 h ASN 308 Cb 0.33 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 1it8 h ASN 308 CO -0.23 0.37 -0.11 -0.07 -1.65 0.00 0.00 177.43 175.75 1it8 h LEU 309 N 0.84 1.04 -0.70 1.61 3.38 -0.21 -1.58 115.31 119.70 1it8 h LEU 309 Ca 0.53 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1it8 h LEU 309 Cb 0.71 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1it8 h LEU 309 CO -0.30 1.15 0.23 -0.50 0.09 0.00 0.00 178.44 179.11 1it8 h TRP 310 N 0.92 1.11 -0.38 1.13 4.06 0.10 0.13 115.95 123.02 1it8 h TRP 310 Ca 0.14 -0.11 -0.04 0.00 2.06 0.00 0.00 58.89 60.94 1it8 h TRP 310 Cb 0.68 -0.32 -0.02 0.00 -1.00 0.00 0.00 29.16 28.50 1it8 h TRP 310 CO 0.05 0.88 0.08 0.28 -3.56 0.00 0.00 178.44 176.17 1it8 h VAL 311 N 1.02 1.23 0.29 1.49 2.07 -0.92 0.34 116.25 121.77 1it8 h VAL 311 Ca 0.23 -0.81 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 1it8 h VAL 311 Cb 0.28 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1it8 h VAL 311 CO -0.01 0.28 -0.17 0.40 0.02 0.00 0.00 177.57 178.09 1it8 h ILE 312 N 0.48 0.64 -1.00 4.57 2.04 -0.97 0.54 117.51 123.81 1it8 h ILE 312 Ca 0.12 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.06 1it8 h ILE 312 Cb 0.33 0.64 -0.07 0.00 -0.74 0.00 0.00 36.82 36.98 1it8 h ILE 312 CO 0.00 0.00 0.64 0.50 0.00 0.00 0.00 178.15 179.30 1it8 h LYS 313 N -0.44 1.08 -0.37 2.37 3.64 -0.63 -2.32 116.57 119.90 1it8 h LYS 313 Ca -0.03 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.22 1it8 h LYS 313 Cb 0.36 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1it8 h LYS 313 CO 0.03 0.71 -0.04 1.49 -2.27 0.00 0.00 179.45 179.38 1it8 h GLU 314 N 1.11 0.67 -0.37 1.90 4.81 0.47 -1.70 114.58 121.48 1it8 h GLU 314 Ca 0.46 -0.23 -0.04 0.00 -0.13 0.00 0.00 59.36 59.41 1it8 h GLU 314 Cb 0.28 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1it8 h GLU 314 CO -0.21 0.80 0.06 0.93 -0.73 0.00 0.00 179.01 179.86 1it8 h GLU 315 N 0.48 0.62 -0.46 1.92 4.39 -0.65 -0.59 114.58 120.28 1it8 h GLU 315 Ca 0.10 -0.17 0.06 0.00 0.34 0.00 0.00 59.36 59.70 1it8 h GLU 315 Cb 0.52 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.04 1it8 h GLU 315 CO 0.03 0.68 0.15 0.82 -1.16 0.00 0.00 179.01 179.52 1it8 h ILE 316 N 0.46 0.83 -0.78 3.13 1.08 -1.36 0.52 117.51 121.39 1it8 h ILE 316 Ca 0.11 -0.11 0.04 0.00 -0.39 0.00 0.00 64.86 64.52 1it8 h ILE 316 Cb 0.36 0.49 -0.05 0.00 -3.07 0.00 0.00 36.82 34.55 1it8 h ILE 316 CO 0.01 0.06 0.48 0.11 -0.69 0.00 0.00 178.15 178.12 1it8 h LYS 317 N 0.31 0.90 -0.39 2.37 1.57 -1.06 -1.53 116.57 118.73 1it8 h LYS 317 Ca 0.22 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 1it8 h LYS 317 Cb 0.24 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1it8 h LYS 317 CO -0.24 0.59 0.20 -0.09 -0.57 0.00 0.00 179.45 179.35 1it8 h ARG 318 N 0.93 0.56 0.22 3.15 2.43 0.85 -1.51 114.38 121.00 1it8 h ARG 318 Ca 0.32 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 1it8 h ARG 318 Cb 0.07 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1it8 h ARG 318 CO -0.13 0.47 -0.23 0.28 -1.51 0.00 0.00 179.97 178.85 1it8 h VAL 319 N 0.50 0.50 -0.66 0.20 2.07 0.29 -1.11 116.25 118.04 1it8 h VAL 319 Ca 0.14 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.72 1it8 h VAL 319 Cb 0.08 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.30 1it8 h VAL 319 CO -0.02 0.00 0.35 0.11 0.02 0.00 0.00 177.57 178.03 1it8 h LYS 320 N -0.49 0.62 0.00 1.57 1.57 -1.11 0.16 116.57 118.89 1it8 h LYS 320 Ca 0.00 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1it8 h LYS 320 Cb 0.46 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 1it8 h LYS 320 CO -0.06 0.41 -0.15 0.37 -0.57 0.00 0.00 179.45 179.45 1it8 h GLN 321 N 0.64 0.00 -0.18 3.15 5.75 -1.07 0.14 115.11 123.53 1it8 h GLN 321 Ca 0.30 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.71 1it8 h GLN 321 Cb 0.22 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.77 1it8 h GLN 321 CO -0.20 0.15 -0.26 0.00 -2.65 0.00 0.00 178.83 175.87 1it8 h ALA 322 N 1.85 0.27 -0.63 3.38 0.00 0.55 -2.87 119.26 121.82 1it8 h ALA 322 Ca -0.00 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 1it8 h ALA 322 Cb 0.35 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1it8 h ALA 322 CO 0.02 0.26 0.25 0.82 0.00 0.00 0.00 179.25 180.61 1it8 h ILE 323 N 0.15 1.23 -0.19 0.00 2.04 -0.39 0.72 117.51 121.07 1it8 h ILE 323 Ca 0.02 -0.73 0.06 0.00 1.00 0.00 0.00 64.86 65.20 1it8 h ILE 323 Cb 0.84 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1it8 h ILE 323 CO 0.06 0.29 0.16 0.50 0.00 0.00 0.00 178.15 179.16 1it8 h LYS 324 N 0.88 0.00 -0.28 2.37 1.63 -0.91 -1.33 116.57 118.93 1it8 h LYS 324 Ca 0.21 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.01 1it8 h LYS 324 Cb 0.21 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.84 1it8 h LYS 324 CO -0.02 0.00 0.00 -0.85 -3.45 0.00 0.00 179.45 175.13 1it8 n GLU 325 N -4.18 2.87 -3.67 1.90 0.28 -0.89 -4.91 120.64 112.04 1it8 n GLU 325 Ca 0.02 -2.46 -0.22 0.00 -0.16 0.00 0.00 57.16 54.34 1it8 n GLU 325 Cb 0.29 -1.56 0.05 0.00 1.43 0.00 0.00 31.44 31.65 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 -0.10 -0.35 1.16 -1.84 0.00 -0.50 -2.90 105.19 100.66 1it8 n GLY 326 Ca 0.16 0.14 0.05 0.00 0.00 0.00 0.00 46.02 46.37 1it8 n GLY 326 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1it8 n GLU 327 N -4.35 0.53 -0.12 1.61 2.13 0.16 -4.59 120.64 116.00 1it8 n GLU 327 Ca -0.23 -2.39 -0.11 0.00 0.66 0.00 0.00 57.16 55.09 1it8 n GLU 327 Cb 0.65 -0.56 -0.02 0.00 0.27 0.00 0.00 31.44 31.78 1it8 n GLU 327 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1it8 h LEU 328 N 0.95 0.57 -0.73 4.31 6.46 -1.91 -2.90 115.31 122.07 1it8 h LEU 328 Ca -0.15 -0.29 0.05 0.00 -0.12 0.00 0.00 57.88 57.37 1it8 h LEU 328 Cb 1.58 -0.15 -0.05 0.00 -0.73 0.00 0.00 40.66 41.31 1it8 h LEU 328 CO 0.06 0.72 0.44 -0.50 -0.62 0.00 0.00 178.44 178.55 1it8 h TRP 329 N 0.40 0.82 -0.42 1.25 -0.00 -1.94 -0.52 115.95 115.54 1it8 h TRP 329 Ca 0.10 0.02 0.05 0.00 -0.00 0.00 0.00 58.89 59.06 1it8 h TRP 329 Cb 0.42 -0.26 -0.04 0.00 -0.00 0.00 0.00 29.16 29.27 1it8 h TRP 329 CO 0.03 0.43 0.16 -0.09 -0.00 0.00 0.00 178.44 178.98 1it8 h ARG 330 N 0.83 0.32 -0.70 0.49 2.43 -1.92 0.12 114.38 115.96 1it8 h ARG 330 Ca 0.31 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.43 1it8 h ARG 330 Cb 0.10 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 1it8 h ARG 330 CO -0.14 0.21 0.33 1.25 -1.51 0.00 0.00 179.97 180.11 1it8 h LEU 331 N 0.33 0.93 -0.26 3.80 5.85 -1.17 -0.88 115.31 123.91 1it8 h LEU 331 Ca 0.19 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1it8 h LEU 331 Cb 0.16 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1it8 h LEU 331 CO -0.18 0.81 0.15 0.58 -0.34 0.00 0.00 178.44 179.46 1it8 h VAL 332 N 0.99 1.10 -0.62 1.05 2.07 -0.53 0.11 116.25 120.42 1it8 h VAL 332 Ca 0.24 -0.26 0.10 0.00 0.82 0.00 0.00 66.70 67.60 1it8 h VAL 332 Cb 0.14 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 30.64 1it8 h VAL 332 CO -0.03 0.10 0.23 -0.78 0.02 0.00 0.00 177.57 177.11 1it8 h ASP 333 N 0.32 0.22 0.43 0.57 1.82 -0.38 0.35 116.42 119.75 1it8 h ASP 333 Ca 0.09 0.08 -0.02 0.00 -0.39 0.00 0.00 57.03 56.79 1it8 h ASP 333 Cb 0.03 0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.11 1it8 h ASP 333 CO -0.02 0.13 -0.21 -0.08 -1.61 0.00 0.00 179.24 177.46 1it8 h GLU 334 N 0.41 -0.56 0.00 0.28 4.81 -0.62 -2.57 114.58 116.32 1it8 h GLU 334 Ca 0.31 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 1it8 h GLU 334 Cb 0.39 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1it8 h GLU 334 CO -0.31 -0.31 0.00 0.00 -0.73 0.00 0.00 179.01 177.66 1it8 h ARG 335 N -0.70 0.00 -0.06 1.92 2.47 -0.17 -2.03 114.38 115.80 1it8 h ARG 335 Ca -0.06 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.59 1it8 h ARG 335 Cb 0.51 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.82 1it8 h ARG 335 CO 0.10 0.00 -0.31 0.00 0.56 0.00 0.00 179.97 180.32 1it8 h ALA 336 N 2.03 1.37 0.00 0.04 0.00 0.12 -2.11 119.26 120.71 1it8 h ALA 336 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1it8 h ALA 336 Cb 0.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1it8 h ALA 336 CO 0.00 0.45 0.00 0.54 0.00 0.00 0.00 179.25 180.24 1it8 n ARG 337 N -4.14 0.64 0.18 0.00 5.12 -0.76 -3.17 116.66 114.52 1it8 n ARG 337 Ca -0.02 0.00 0.03 0.00 -1.93 0.00 0.00 57.85 55.93 1it8 n ARG 337 Cb 0.38 -1.40 0.31 0.00 -1.16 0.00 0.00 32.46 30.59 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 0.00 0.00 -3.39 0.55 0.02 -1.54 -3.46 113.55 105.73 1it8 h SER 338 Ca 0.00 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.01 1it8 h SER 338 Cb 0.00 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 62.29 1it8 h SER 338 CO 0.00 0.44 0.44 -2.28 -1.14 0.00 0.00 176.83 174.29 1it8 s HIS 339 N -3.80 -0.48 0.19 3.45 5.65 -1.20 -4.90 115.29 114.20 1it8 s HIS 339 Ca -0.01 1.13 -0.23 0.00 0.25 0.00 0.00 55.06 56.20 1it8 s HIS 339 Cb 0.13 0.37 0.11 0.00 -1.18 0.00 0.00 32.58 32.00 1it8 s HIS 339 CO 0.71 -0.26 1.57 -1.35 -0.65 0.00 0.00 174.74 174.76 1it8 h PRO 340 N 4.01 -0.13 -0.84 2.88 0.11 -1.89 0.23 132.00 136.37 1it8 h PRO 340 Ca -0.27 0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.93 1it8 h PRO 340 Cb 1.17 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.26 1it8 h PRO 340 CO 0.13 -0.09 0.55 0.87 -0.21 0.00 0.00 178.00 179.25 1it8 h LYS 341 N -0.14 0.84 -0.00 1.05 6.56 -1.94 0.69 116.57 123.63 1it8 h LYS 341 Ca 0.23 -0.05 -0.17 0.00 -1.06 0.00 0.00 60.65 59.61 1it8 h LYS 341 Cb 0.56 -0.19 -0.02 0.00 -0.57 0.00 0.00 32.23 32.01 1it8 h LYS 341 CO -0.78 0.56 -0.79 1.25 -2.06 0.00 0.00 179.45 177.63 1it8 h LEU 342 N 0.86 0.03 -0.34 2.94 7.12 -1.03 -1.81 115.31 123.09 1it8 h LEU 342 Ca 0.38 -0.03 -0.06 0.00 0.13 0.00 0.00 57.88 58.30 1it8 h LEU 342 Cb 0.33 -0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.44 1it8 h LEU 342 CO -0.15 0.81 -0.03 0.22 -0.13 0.00 0.00 178.44 179.16 1it8 h TYR 343 N 0.02 0.69 -0.47 1.25 3.20 0.63 -0.75 116.97 121.54 1it8 h TYR 343 Ca -0.01 -0.13 0.06 0.00 3.14 0.00 0.00 58.73 61.78 1it8 h TYR 343 Cb 1.39 -0.17 -0.05 0.00 1.54 0.00 0.00 36.73 39.44 1it8 h TYR 343 CO 0.00 0.76 0.19 1.03 -1.64 0.00 0.00 178.16 178.50 1it8 h SER 344 N 0.42 0.22 -0.71 -2.11 0.87 -0.75 -0.99 113.55 110.50 1it8 h SER 344 Ca 0.09 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.66 1it8 h SER 344 Cb 0.50 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.45 1it8 h SER 344 CO 0.02 0.16 0.30 0.00 -0.53 0.00 0.00 176.83 176.78 1it8 h ALA 345 N 1.29 0.93 -0.27 6.23 0.00 -1.04 -1.63 119.26 124.76 1it8 h ALA 345 Ca 0.22 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1it8 h ALA 345 Cb 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1it8 h ALA 345 CO -0.20 0.53 0.16 -0.92 0.00 0.00 0.00 179.25 178.82 1it8 h TYR 346 N 1.01 0.30 -0.91 0.00 3.20 -0.37 -0.13 116.97 120.08 1it8 h TYR 346 Ca 0.24 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.16 1it8 h TYR 346 Cb 0.18 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.30 1it8 h TYR 346 CO 0.01 0.18 0.59 0.87 -1.64 0.00 0.00 178.16 178.18 1it8 h LYS 347 N 0.33 1.08 -0.56 1.82 1.57 -0.93 -2.37 116.57 117.51 1it8 h LYS 347 Ca 0.11 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 1it8 h LYS 347 Cb -0.01 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 1it8 h LYS 347 CO -0.05 0.71 -0.04 -0.09 -0.57 0.00 0.00 179.45 179.42 1it8 h ARG 348 N 1.11 1.01 -0.09 3.15 9.65 -0.62 -2.96 114.38 125.64 1it8 h ARG 348 Ca 0.37 -0.34 -0.05 0.00 -1.10 0.00 0.00 59.98 58.86 1it8 h ARG 348 Cb 0.06 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.55 1it8 h ARG 348 CO -0.12 1.03 -0.16 1.25 2.80 0.00 0.00 179.97 184.77 1it8 h LEU 349 N 0.90 0.14 0.00 3.80 5.85 -0.53 -2.19 115.31 123.28 1it8 h LEU 349 Ca 0.15 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1it8 h LEU 349 Cb 0.59 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.59 1it8 h LEU 349 CO 0.04 0.32 0.00 0.18 -0.34 0.00 0.00 178.44 178.63 1it8 n LEU 350 N -4.28 0.00 0.08 2.25 4.77 -1.04 -2.85 117.00 115.93 1it8 n LEU 350 Ca -0.01 0.47 -0.08 0.00 -0.03 0.00 0.00 56.01 56.36 1it8 n LEU 350 Cb 0.27 -0.47 0.03 0.00 -2.33 0.00 0.00 43.42 40.91 1it8 n LEU 350 CO 0.37 -0.10 0.31 -0.33 -1.33 0.00 0.00 177.39 176.32 1it8 h GLU 351 N 0.00 0.22 -2.92 3.23 5.08 -1.42 -3.33 114.58 115.44 1it8 h GLU 351 Ca 0.00 -0.21 -0.43 0.00 -1.00 0.00 0.00 59.36 57.72 1it8 h GLU 351 Cb 0.37 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1it8 h GLU 351 CO 0.00 0.90 2.35 0.72 -1.00 0.00 0.00 179.01 181.98 1it8 n HIS 352 N -3.72 1.42 -0.34 4.33 8.25 -1.13 -4.58 115.22 119.44 1it8 n HIS 352 Ca -0.03 -2.22 -0.02 0.00 -0.26 0.00 0.00 57.72 55.19 1it8 n HIS 352 Cb 0.75 -1.92 0.13 0.00 1.12 0.00 0.00 29.99 30.06 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 5.03 1.20 -0.02 4.41 3.20 -1.83 -1.76 116.97 127.20 1it8 h TYR 353 Ca 0.56 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.45 1it8 h TYR 353 Cb 0.50 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 1it8 h TYR 353 CO 1.84 0.79 -0.03 1.15 -1.64 0.00 0.00 178.16 180.27 1it8 h THR 354 N 1.27 0.91 0.22 1.81 2.02 -1.95 0.26 112.91 117.46 1it8 h THR 354 Ca 0.34 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.50 1it8 h THR 354 Cb -0.09 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1it8 h THR 354 CO -0.07 0.00 -0.11 0.15 0.37 0.00 0.00 175.52 175.87 1it8 h PHE 355 N -0.05 -0.28 0.00 3.16 3.57 -1.89 -3.10 116.94 118.35 1it8 h PHE 355 Ca 0.02 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 1it8 h PHE 355 Cb 0.08 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 1it8 h PHE 355 CO -0.12 -0.16 -0.27 -0.07 -2.23 0.00 0.00 178.31 175.46 1it8 h LEU 356 N -0.31 0.00 -1.03 0.59 3.38 -1.14 -3.15 115.31 113.64 1it8 h LEU 356 Ca -0.03 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1it8 h LEU 356 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1it8 h LEU 356 CO 0.05 0.27 -0.29 -0.08 0.09 0.00 0.00 178.44 178.48 1it8 h GLU 357 N 0.00 0.34 -0.39 1.13 4.22 -0.41 -2.15 114.58 117.32 1it8 h GLU 357 Ca -0.00 -0.13 0.03 0.00 0.08 0.00 0.00 59.36 59.34 1it8 h GLU 357 Cb 0.48 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1it8 h GLU 357 CO 0.03 0.60 0.26 1.49 -2.18 0.00 0.00 179.01 179.22 1it8 h GLU 358 N 0.30 0.39 0.00 1.92 4.81 -1.57 -3.00 114.58 117.44 1it8 h GLU 358 Ca 0.04 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1it8 h GLU 358 Cb 0.67 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1it8 h GLU 358 CO 0.05 0.26 -1.44 1.19 -0.73 0.00 0.00 179.01 178.34 1it8 n PHE 359 N -4.48 0.00 -1.62 0.92 3.01 -1.16 -4.66 117.46 109.46 1it8 n PHE 359 Ca 0.04 0.00 -0.47 0.00 1.01 0.00 0.00 57.45 58.03 1it8 n PHE 359 Cb 0.16 -0.26 -0.05 0.00 -0.01 0.00 0.00 39.48 39.32 1it8 n PHE 359 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1it8 n GLU 360 N -1.85 2.04 -1.14 -1.08 4.07 -0.82 -4.61 120.64 117.25 1it8 n GLU 360 Ca -0.01 0.69 -0.37 0.00 -0.06 0.00 0.00 57.16 57.42 1it8 n GLU 360 Cb 0.39 -2.78 0.05 0.00 -0.06 0.00 0.00 31.44 29.04 1it8 n GLU 360 CO 0.00 0.00 0.00 -2.30 -0.06 0.00 0.00 177.13 174.77 1it8 n PRO 361 N 7.45 0.08 0.04 5.31 -0.02 -1.26 -4.59 135.00 142.01 1it8 n PRO 361 Ca 0.27 0.05 -0.07 0.00 -2.02 0.00 0.00 63.50 61.73 1it8 n PRO 361 Cb 0.33 -1.38 -0.11 0.00 -0.02 0.00 0.00 33.50 32.31 1it8 n PRO 361 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1it8 h ILE 362 N -0.57 1.37 -3.18 4.25 6.09 -1.47 -3.47 117.51 120.54 1it8 h ILE 362 Ca -0.44 -3.09 -0.14 0.00 -1.37 0.00 0.00 64.86 59.82 1it8 h ILE 362 Cb 1.35 2.67 -0.23 0.00 0.47 0.00 0.00 36.82 41.09 1it8 h ILE 362 CO 0.36 0.78 -0.38 0.28 -3.07 0.00 0.00 178.15 176.12 1it8 s THR 363 N -2.70 0.04 0.26 2.19 -1.32 -1.26 -4.94 115.64 107.90 1it8 s THR 363 Ca -0.01 -0.32 0.08 0.00 -1.21 0.00 0.00 61.69 60.23 1it8 s THR 363 Cb 0.09 -0.47 -0.05 0.00 -1.51 0.00 0.00 72.50 70.56 1it8 s THR 363 CO 0.82 -0.18 -0.10 -0.54 -2.21 0.00 0.00 174.62 172.41 1it8 s LYS 364 N -0.70 1.51 0.19 7.08 1.02 -1.26 -4.99 119.74 122.59 1it8 s LYS 364 Ca -0.08 -1.73 0.01 0.00 0.02 0.00 0.00 55.97 54.19 1it8 s LYS 364 Cb -0.04 -1.24 0.08 0.00 -0.52 0.00 0.00 37.83 36.11 1it8 s LYS 364 CO 0.02 0.12 1.44 0.87 -0.92 0.00 0.00 175.35 176.88 1it8 h LYS 365 N 2.35 0.28 -7.69 1.68 1.57 -1.90 -3.46 116.57 109.40 1it8 h LYS 365 Ca -0.39 -0.25 -0.46 0.00 -1.87 0.00 0.00 60.65 57.68 1it8 h LYS 365 Cb 1.23 0.06 0.13 0.00 0.08 0.00 0.00 32.23 33.73 1it8 h LYS 365 CO 0.65 0.91 0.40 0.45 -0.57 0.00 0.00 179.45 181.30 1it8 s SER 366 N -6.94 3.85 0.12 0.86 0.15 -1.14 -5.05 113.70 105.55 1it8 s SER 366 Ca -0.04 0.50 0.03 0.00 0.70 0.00 0.00 55.95 57.13 1it8 s SER 366 Cb 0.11 -0.78 -0.04 0.00 -1.71 0.00 0.00 66.02 63.60 1it8 s SER 366 CO 0.83 -2.29 0.17 0.00 1.20 0.00 0.00 173.24 173.15 1it8 s ALA 367 N -3.70 3.75 -0.51 5.45 0.00 -1.26 -5.01 121.76 120.48 1it8 s ALA 367 Ca 0.68 -1.05 -0.27 0.00 0.00 0.00 0.00 51.96 51.32 1it8 s ALA 367 Cb -0.07 -1.58 -0.01 0.00 0.00 0.00 0.00 23.12 21.46 1it8 s ALA 367 CO 0.51 0.64 1.71 -1.17 0.00 0.00 0.00 175.76 177.45 1it8 s LEU 368 N -2.84 3.40 -0.35 0.00 0.20 0.16 -4.88 118.68 114.37 1it8 s LEU 368 Ca 0.32 0.63 -0.18 0.00 0.69 0.00 0.00 54.13 55.59 1it8 s LEU 368 Cb -0.11 -2.99 -0.00 0.00 -0.43 0.00 0.00 46.19 42.65 1it8 s LEU 368 CO 0.25 -1.97 0.52 -0.36 -0.29 0.00 0.00 176.35 174.50 1it8 s PHE 369 N 7.53 3.18 -0.63 5.38 2.99 -1.26 -0.95 117.98 134.21 1it8 s PHE 369 Ca 0.67 0.20 -0.26 0.00 0.00 0.00 0.00 56.93 57.54 1it8 s PHE 369 Cb -0.15 -2.93 0.04 0.00 0.00 0.00 0.00 43.02 39.98 1it8 s PHE 369 CO 0.26 -0.54 1.12 0.21 -0.00 0.00 0.00 175.22 176.28 1it8 s LYS 370 N 2.41 3.31 -0.07 0.44 2.36 -0.51 -4.78 119.74 122.90 1it8 s LYS 370 Ca 0.19 -0.18 0.11 0.00 -2.55 0.00 0.00 55.97 53.54 1it8 s LYS 370 Cb -0.15 -4.10 0.16 0.00 -1.05 0.00 0.00 37.83 32.68 1it8 s LYS 370 CO 0.13 -1.80 1.06 0.44 1.55 0.00 0.00 175.35 176.73 1it8 n ILE 371 N 6.36 1.16 0.00 5.43 -6.64 -1.26 -4.64 119.36 119.77 1it8 n ILE 371 Ca 0.03 -1.37 0.00 0.00 -1.77 0.00 0.00 62.75 59.64 1it8 n ILE 371 Cb 0.48 0.11 0.00 0.00 -1.44 0.00 0.00 39.64 38.79 1it8 n ILE 371 CO 0.00 0.00 0.00 -1.54 -1.77 0.00 0.00 176.55 173.24 1it8 n SER 372 N -0.86 0.00 0.03 7.28 3.41 -1.26 -4.96 113.62 117.25 1it8 n SER 372 Ca 0.09 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.57 1it8 n SER 372 Cb 0.61 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.53 1it8 n SER 372 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1it8 h ASN 373 N 0.00 0.67 -0.74 4.04 4.21 -2.01 -3.13 115.58 118.61 1it8 h ASN 373 Ca 0.00 -0.46 0.06 0.00 1.21 0.00 0.00 56.30 57.11 1it8 h ASN 373 Cb 0.00 -0.20 -0.05 0.00 -1.12 0.00 0.00 38.32 36.95 1it8 h ASN 373 CO 0.00 1.23 0.49 -0.33 -1.29 0.00 0.00 177.43 177.53 1it8 h GLU 374 N 0.37 0.76 0.00 0.81 3.07 -2.00 -0.94 114.58 116.65 1it8 h GLU 374 Ca -0.05 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.76 1it8 h GLU 374 Cb 1.40 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 1it8 h GLU 374 CO 0.15 0.50 0.00 0.66 -1.40 0.00 0.00 179.01 178.92 1it8 h SER 375 N 0.78 0.00 0.72 1.42 4.64 -1.91 0.11 113.55 119.32 1it8 h SER 375 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1it8 h SER 375 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1it8 h SER 375 CO -0.11 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.03 1it8 n LEU 376 N -3.04 0.00 -0.65 5.97 4.77 -0.36 -2.56 117.00 121.14 1it8 n LEU 376 Ca -0.02 0.49 0.07 0.00 -0.03 0.00 0.00 56.01 56.52 1it8 n LEU 376 Cb 0.12 -0.49 0.19 0.00 -2.33 0.00 0.00 43.42 40.90 1it8 n LEU 376 CO 0.21 -0.13 0.65 0.54 -1.33 0.00 0.00 177.39 177.32 1it8 n ARG 377 N -1.49 2.78 -2.15 3.23 1.74 0.38 -4.64 116.66 116.51 1it8 n ARG 377 Ca 0.05 -2.40 -0.36 0.00 -0.77 0.00 0.00 57.85 54.38 1it8 n ARG 377 Cb 0.25 -1.52 0.01 0.00 -1.02 0.00 0.00 32.46 30.18 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 -1.95 2.60 0.18 -1.55 0.51 -1.06 -4.84 118.94 112.83 1it8 s TRP 378 Ca 0.30 1.52 -0.18 0.00 -2.12 0.00 0.00 56.10 55.62 1it8 s TRP 378 Cb 0.22 -3.41 0.14 0.00 -0.81 0.00 0.00 33.47 29.61 1it8 s TRP 378 CO 0.10 -1.86 1.62 -1.35 -0.51 0.00 0.00 176.95 174.96 1it8 h PRO 379 N 1.32 -0.10 0.00 4.98 0.11 -1.92 -0.39 132.00 135.99 1it8 h PRO 379 Ca -0.50 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1it8 h PRO 379 Cb 1.27 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1it8 h PRO 379 CO 0.57 -0.07 0.03 -0.24 -0.21 0.00 0.00 178.00 178.09 1it8 h VAL 380 N -0.11 0.00 0.05 3.15 3.04 -1.92 -2.29 116.25 118.17 1it8 h VAL 380 Ca 0.23 0.00 -0.27 0.00 -1.01 0.00 0.00 66.70 65.65 1it8 h VAL 380 Cb 0.46 0.63 -0.02 0.00 -2.01 0.00 0.00 31.29 30.35 1it8 h VAL 380 CO -0.56 0.00 -1.44 0.58 -1.01 0.00 0.00 177.57 175.14 1it8 h VAL 381 N 0.00 0.88 -0.07 1.51 2.07 -1.40 -2.99 116.25 116.24 1it8 h VAL 381 Ca 0.00 -2.26 -0.07 0.00 0.82 0.00 0.00 66.70 65.19 1it8 h VAL 381 Cb 0.06 2.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 1it8 h VAL 381 CO 0.00 0.53 -0.28 0.03 0.02 0.00 0.00 177.57 177.87 1it8 h ARG 382 N -0.62 0.13 0.05 1.57 3.08 -1.31 -1.36 114.38 115.92 1it8 h ARG 382 Ca -0.35 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.65 1it8 h ARG 382 Cb 1.55 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.59 1it8 h ARG 382 CO -0.09 0.41 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.11 1it8 h ARG 383 N 0.12 -0.06 -0.02 0.04 2.43 -1.58 -2.76 114.38 112.55 1it8 h ARG 383 Ca 0.02 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1it8 h ARG 383 Cb 0.56 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1it8 h ARG 383 CO 0.04 0.47 0.02 0.00 -1.51 0.00 0.00 179.97 178.99 1it8 h ALA 384 N 0.23 1.77 0.52 2.80 0.00 -1.43 -2.37 119.26 120.78 1it8 h ALA 384 Ca -0.01 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1it8 h ALA 384 Cb 0.57 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1it8 h ALA 384 CO 0.01 -0.03 -0.25 0.87 0.00 0.00 0.00 179.25 179.85 1it8 h LYS 385 N 0.00 -0.67 -0.31 0.00 1.57 -1.13 -2.80 116.57 113.23 1it8 h LYS 385 Ca 0.01 0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1it8 h LYS 385 Cb 0.05 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1it8 h LYS 385 CO -0.00 -0.37 0.17 0.93 -0.57 0.00 0.00 179.45 179.61 1it8 h GLU 386 N -1.05 0.43 -0.51 3.15 5.08 -1.27 -1.65 114.58 118.76 1it8 h GLU 386 Ca -0.07 -0.05 0.13 0.00 -1.00 0.00 0.00 59.36 58.37 1it8 h GLU 386 Cb 0.61 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1it8 h GLU 386 CO 0.12 0.36 0.36 0.00 -1.00 0.00 0.00 179.01 178.85 1it8 h ARG 387 N 0.38 0.12 -0.12 2.33 3.08 -1.55 -1.79 114.38 116.82 1it8 h ARG 387 Ca 0.11 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 1it8 h ARG 387 Cb 0.06 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 1it8 h ARG 387 CO -0.02 0.08 -0.12 0.00 -1.07 0.00 0.00 179.97 178.83 1it8 h ALA 388 N 1.75 0.18 -0.60 0.04 0.00 -1.04 -3.34 119.26 116.24 1it8 h ALA 388 Ca 0.24 -0.31 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1it8 h ALA 388 Cb 0.80 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.49 1it8 h ALA 388 CO -0.03 0.04 -0.35 1.63 0.00 0.00 0.00 179.25 180.54 1it8 n LYS 389 N -4.60 -0.26 -0.13 0.00 5.02 -0.67 -0.30 118.16 117.20 1it8 n LYS 389 Ca -0.07 1.02 -0.08 0.00 -2.02 0.00 0.00 58.31 57.16 1it8 n LYS 389 Cb 0.35 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.83 1it8 n LYS 389 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1it8 h SER 390 N 0.00 -1.27 0.10 4.39 0.87 -1.68 -2.33 113.55 113.63 1it8 h SER 390 Ca 0.10 0.21 0.02 0.00 -1.23 0.00 0.00 61.79 60.88 1it8 h SER 390 Cb 0.24 0.58 -0.03 0.00 -0.44 0.00 0.00 62.40 62.75 1it8 h SER 390 CO -0.56 -0.34 -0.20 0.40 -0.53 0.00 0.00 176.83 175.60 1it8 h ILE 391 N -0.28 0.55 -0.52 2.23 1.08 -0.79 -3.01 117.51 116.78 1it8 h ILE 391 Ca 0.16 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.73 1it8 h ILE 391 Cb 0.56 0.55 -0.09 0.00 -3.07 0.00 0.00 36.82 34.78 1it8 h ILE 391 CO -0.57 0.00 0.01 0.78 -0.69 0.00 0.00 178.15 177.67 1it8 h ASN 392 N -0.37 -0.21 0.08 1.72 2.35 -0.83 0.53 115.58 118.85 1it8 h ASN 392 Ca 0.03 0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 1it8 h ASN 392 Cb 0.39 0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.98 1it8 h ASN 392 CO -0.11 -0.07 -0.04 -0.33 -1.65 0.00 0.00 177.43 175.22 1it8 h GLU 393 N 0.12 0.00 0.03 0.81 5.08 -1.30 0.35 114.58 119.68 1it8 h GLU 393 Ca 0.27 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.27 1it8 h GLU 393 Cb 0.40 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 1it8 h GLU 393 CO -0.43 0.04 -2.17 -2.13 -1.00 0.00 0.00 179.01 173.32 1it8 n ARG 394 N -3.97 0.68 0.00 2.33 0.63 -0.58 -4.48 116.66 111.27 1it8 n ARG 394 Ca -0.03 0.17 0.10 0.00 -0.92 0.00 0.00 57.85 57.18 1it8 n ARG 394 Cb 0.13 -1.63 -0.09 0.00 0.45 0.00 0.00 32.46 31.32 1it8 n ARG 394 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1it8 n PHE 395 N -3.14 0.00 -0.25 -0.14 3.01 0.07 -5.05 117.46 111.97 1it8 n PHE 395 Ca -0.33 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.13 1it8 n PHE 395 Cb 1.06 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.53 1it8 n PHE 395 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1it8 n GLY 396 N 1.48 1.25 3.89 1.37 0.00 0.12 -4.84 105.19 108.47 1it8 n GLY 396 Ca 0.05 -0.33 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 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 12.40 -4.46 -1.86 1.61 1.02 -1.26 -4.23 120.64 123.85 1it8 n GLU 397 Ca 0.00 0.53 -0.38 0.00 -0.02 0.00 0.00 57.16 57.29 1it8 n GLU 397 Cb 0.00 -5.08 0.03 0.00 -0.02 0.00 0.00 31.44 26.37 1it8 n GLU 397 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1it8 s LEU 398 N -7.00 3.87 0.20 -4.62 1.43 -1.26 -1.48 118.68 109.82 1it8 s LEU 398 Ca 0.28 2.68 0.06 0.00 -1.03 0.00 0.00 54.13 56.12 1it8 s LEU 398 Cb -0.14 -4.28 -0.05 0.00 0.03 0.00 0.00 46.19 41.75 1it8 s LEU 398 CO 0.85 -1.47 -0.09 0.54 0.23 0.00 0.00 176.35 176.41 1it8 s VAL 399 N -1.35 1.39 0.29 -1.59 0.11 -1.14 -4.80 120.40 113.31 1it8 s VAL 399 Ca 0.70 -2.11 -0.24 0.00 -2.93 0.00 0.00 61.98 57.40 1it8 s VAL 399 Cb -0.38 -2.07 -0.09 0.00 -1.53 0.00 0.00 36.38 32.30 1it8 s VAL 399 CO 0.45 -0.57 0.87 -1.61 -3.33 0.00 0.00 175.10 170.91 1it8 s GLU 400 N -3.73 4.49 -0.04 1.54 2.02 -1.26 -1.14 118.70 120.58 1it8 s GLU 400 Ca 0.22 1.18 0.00 0.00 0.02 0.00 0.00 54.97 56.40 1it8 s GLU 400 Cb 0.02 -2.84 0.02 0.00 0.10 0.00 0.00 34.13 31.43 1it8 s GLU 400 CO 0.05 0.33 -0.02 -1.58 0.02 0.00 0.00 175.26 174.06 1it8 s HIS 401 N -1.57 0.53 0.16 1.61 2.46 1.06 -4.81 115.29 114.74 1it8 s HIS 401 Ca 0.47 -0.10 -0.21 0.00 0.47 0.00 0.00 55.06 55.70 1it8 s HIS 401 Cb -0.18 -0.57 0.06 0.00 -0.13 0.00 0.00 32.58 31.77 1it8 s HIS 401 CO 0.23 -0.18 1.63 -1.35 -2.47 0.00 0.00 174.74 172.60 1it8 h PRO 402 N 7.38 -0.17 0.00 2.88 0.11 -1.87 0.53 132.00 140.87 1it8 h PRO 402 Ca -0.37 0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.59 1it8 h PRO 402 Cb 1.14 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1it8 h PRO 402 CO 0.44 -0.11 -0.87 0.82 -0.21 0.00 0.00 178.00 178.07 1it8 h ILE 403 N -0.18 1.19 0.00 4.15 2.04 -1.96 -3.40 117.51 119.35 1it8 h ILE 403 Ca 0.17 -2.23 0.00 0.00 1.00 0.00 0.00 64.86 63.79 1it8 h ILE 403 Cb 0.44 2.60 0.00 0.00 -0.74 0.00 0.00 36.82 39.11 1it8 h ILE 403 CO -0.43 0.41 -0.60 0.49 0.00 0.00 0.00 178.15 178.01 1it8 n PHE 404 N -4.48 0.41 0.00 1.37 3.01 -1.23 -5.02 117.46 111.52 1it8 n PHE 404 Ca -0.25 0.12 0.00 0.00 1.01 0.00 0.00 57.45 58.33 1it8 n PHE 404 Cb 0.62 -0.56 0.00 0.00 -0.01 0.00 0.00 39.48 39.53 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 1.38 1.71 2.74 1.37 0.00 0.19 -4.80 105.19 107.78 1it8 n GLY 405 Ca 0.04 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.36 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 0.49 -0.05 1.61 3.03 -1.25 0.35 118.95 123.13 1it8 s ARG 406 Ca 0.00 0.06 -0.00 0.00 2.03 0.00 0.00 55.73 57.82 1it8 s ARG 406 Cb 0.00 -1.11 0.03 0.00 -1.03 0.00 0.00 34.95 32.83 1it8 s ARG 406 CO 0.00 -0.37 -0.00 0.54 -1.13 0.00 0.00 175.30 174.34 1it8 s VAL 407 N 1.99 0.27 0.09 4.99 0.11 -0.29 -4.85 120.40 122.71 1it8 s VAL 407 Ca 0.04 0.10 -0.22 0.00 -2.93 0.00 0.00 61.98 58.96 1it8 s VAL 407 Cb -0.13 -0.39 -0.12 0.00 -1.53 0.00 0.00 36.38 34.20 1it8 s VAL 407 CO -0.06 0.20 0.50 -0.24 -3.33 0.00 0.00 175.10 172.17 1it8 n SER 408 N 4.55 -0.55 0.15 3.54 2.88 -1.26 -2.90 113.62 120.03 1it8 n SER 408 Ca -0.18 0.78 0.09 0.00 -1.33 0.00 0.00 58.87 58.24 1it8 n SER 408 Cb 0.50 -0.65 0.49 0.00 -0.75 0.00 0.00 64.21 63.81 1it8 n SER 408 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1it8 n ARG 409 N 0.81 0.12 0.18 -1.46 1.85 -0.55 -1.71 116.66 115.90 1it8 n ARG 409 Ca 0.13 0.61 0.12 0.00 -1.00 0.00 0.00 57.85 57.71 1it8 n ARG 409 Cb 0.13 -1.94 0.15 0.00 -1.05 0.00 0.00 32.46 29.76 1it8 n ARG 409 CO 0.00 0.00 0.00 1.88 -0.01 0.00 0.00 177.63 179.50 1it8 h TYR 410 N 0.00 0.00 -0.12 2.89 -1.99 -1.85 -3.20 116.97 112.70 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 0.10 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.83 1it8 h TYR 410 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.44 1it8 n LEU 411 N -2.91 2.78 0.12 3.88 4.77 -0.70 -4.57 117.00 120.37 1it8 n LEU 411 Ca 0.03 -1.16 0.11 0.00 -0.03 0.00 0.00 56.01 54.97 1it8 n LEU 411 Cb 0.52 -0.06 0.48 0.00 -2.33 0.00 0.00 43.42 42.03 1it8 n LEU 411 CO 0.35 0.52 0.84 -1.54 -1.33 0.00 0.00 177.39 176.24 1it8 n SER 412 N 1.12 0.62 -0.68 -1.43 3.41 -1.19 -1.92 113.62 113.55 1it8 n SER 412 Ca 0.13 0.66 0.12 0.00 -0.26 0.00 0.00 58.87 59.51 1it8 n SER 412 Cb 0.50 -0.79 0.09 0.00 -0.26 0.00 0.00 64.21 63.75 1it8 n SER 412 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1it8 n LEU 413 N -2.19 2.37 -4.83 1.04 4.77 -1.26 -3.46 117.00 113.44 1it8 n LEU 413 Ca 0.02 -0.82 -0.34 0.00 -0.03 0.00 0.00 56.01 54.84 1it8 n LEU 413 Cb 0.21 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.23 1it8 n LEU 413 CO 0.19 0.41 -0.21 -0.89 -1.33 0.00 0.00 177.39 175.56 1it8 s THR 414 N -2.25 5.05 0.45 -5.08 2.01 -0.81 -3.72 115.64 111.29 1it8 s THR 414 Ca 0.24 -0.21 -0.25 0.00 0.31 0.00 0.00 61.69 61.79 1it8 s THR 414 Cb 0.19 -3.29 -0.08 0.00 0.01 0.00 0.00 72.50 69.33 1it8 s THR 414 CO 0.44 0.41 1.30 -0.47 -0.69 0.00 0.00 174.62 175.61 1it8 s TYR 415 N -1.18 2.69 -2.43 4.92 5.04 0.22 -1.58 117.35 125.04 1it8 s TYR 415 Ca 0.22 1.41 0.28 0.00 -2.44 0.00 0.00 57.07 56.54 1it8 s TYR 415 Cb -0.12 -3.67 0.95 0.00 0.35 0.00 0.00 41.96 39.47 1it8 s TYR 415 CO 0.13 -2.22 1.69 -0.35 -1.34 0.00 0.00 175.55 173.45 1it8 n PRO 416 N -0.23 1.59 0.18 4.97 -0.04 -1.26 -4.90 135.00 135.32 1it8 n PRO 416 Ca 0.06 -0.96 -0.15 0.00 -0.04 0.00 0.00 63.50 62.41 1it8 n PRO 416 Cb 0.44 -1.48 -0.08 0.00 -0.04 0.00 0.00 33.50 32.34 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 2.34 -0.39 0.00 0.54 -1.00 -1.58 -3.10 116.94 113.75 1it8 h PHE 417 Ca 0.00 -0.01 -0.16 0.00 2.81 0.00 0.00 57.97 60.61 1it8 h PHE 417 Cb 0.53 0.13 -0.02 0.00 3.61 0.00 0.00 35.95 40.20 1it8 h PHE 417 CO 0.00 -0.18 -0.78 0.00 -1.61 0.00 0.00 178.31 175.73 1it8 h ALA 418 N 0.14 0.55 -0.80 2.45 0.00 -1.36 -3.31 119.26 116.93 1it8 h ALA 418 Ca -0.04 -0.71 -0.62 0.00 0.00 0.00 0.00 54.91 53.54 1it8 h ALA 418 Cb 0.39 -0.13 -0.23 0.00 0.00 0.00 0.00 17.79 17.82 1it8 h ALA 418 CO 0.07 0.98 0.75 1.04 0.00 0.00 0.00 179.25 182.09 1it8 n GLN 419 N -3.38 2.51 -3.97 0.00 1.13 -1.21 -4.91 117.38 107.55 1it8 n GLN 419 Ca 0.00 -2.88 -0.09 0.00 -1.94 0.00 0.00 57.00 52.10 1it8 n GLN 419 Cb 0.82 -2.15 -0.10 0.00 0.11 0.00 0.00 30.24 28.92 1it8 n GLN 419 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1it8 s SER 420 N -0.65 0.23 0.00 1.08 1.04 -1.18 0.39 113.70 114.62 1it8 s SER 420 Ca 0.54 -0.55 0.01 0.00 0.48 0.00 0.00 55.95 56.42 1it8 s SER 420 Cb 0.41 0.17 -0.00 0.00 0.10 0.00 0.00 66.02 66.70 1it8 s SER 420 CO -0.23 -0.42 -0.02 -0.70 0.98 0.00 0.00 173.24 172.85 1it8 s GLU 421 N -2.21 0.18 0.00 4.02 2.12 -0.13 -4.76 118.70 117.93 1it8 s GLU 421 Ca -0.09 -0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.09 1it8 s GLU 421 Cb -0.04 -0.13 0.00 0.00 0.26 0.00 0.00 34.13 34.22 1it8 s GLU 421 CO -0.03 0.03 0.00 0.00 -0.54 0.00 0.00 175.26 174.72 1it8 n ALA 422 N 2.81 0.00 -0.13 6.30 0.00 -1.26 -1.43 120.51 126.80 1it8 n ALA 422 Ca -0.14 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.27 1it8 n ALA 422 Cb 0.59 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.23 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 0.83 -5.40 0.00 3.07 -1.98 -3.41 114.58 107.69 1it8 h GLU 423 Ca 0.00 -0.17 -0.66 0.00 -0.50 0.00 0.00 59.36 58.03 1it8 h GLU 423 Cb 0.00 -0.12 -0.27 0.00 -0.84 0.00 0.00 28.75 27.52 1it8 h GLU 423 CO 0.00 0.75 -0.77 -0.51 -1.40 0.00 0.00 179.01 177.08 1it8 s ASP 424 N -6.58 3.99 0.31 1.42 1.01 -1.26 -5.10 116.67 110.47 1it8 s ASP 424 Ca -0.10 -0.32 -0.30 0.00 0.71 0.00 0.00 52.55 52.54 1it8 s ASP 424 Cb 0.15 -1.55 -0.12 0.00 1.01 0.00 0.00 42.92 42.42 1it8 s ASP 424 CO 0.80 0.18 1.57 0.47 0.21 0.00 0.00 175.17 178.40 1it8 n ASP 425 N 3.43 3.80 -4.73 0.27 8.00 -1.26 -4.79 116.55 121.27 1it8 n ASP 425 Ca -0.18 1.16 -0.39 0.00 0.71 0.00 0.00 54.79 56.10 1it8 n ASP 425 Cb 0.53 -1.59 -0.05 0.00 -0.02 0.00 0.00 41.12 39.98 1it8 n ASP 425 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1it8 s PHE 426 N -0.24 3.58 -0.60 1.24 5.36 -1.26 -4.96 117.98 121.10 1it8 s PHE 426 Ca 0.62 1.10 -0.18 0.00 -0.96 0.00 0.00 56.93 57.51 1it8 s PHE 426 Cb -0.50 -2.66 0.12 0.00 -0.34 0.00 0.00 43.02 39.64 1it8 s PHE 426 CO 0.52 0.19 0.67 0.15 -1.46 0.00 0.00 175.22 175.28 1it8 s LYS 427 N 0.48 3.06 0.56 10.12 1.02 -1.26 -5.04 119.74 128.68 1it8 s LYS 427 Ca 0.31 -1.47 -0.20 0.00 0.02 0.00 0.00 55.97 54.63 1it8 s LYS 427 Cb -0.17 -4.30 -0.06 0.00 -0.52 0.00 0.00 37.83 32.79 1it8 s LYS 427 CO 0.15 -1.49 1.06 -0.89 -0.92 0.00 0.00 175.35 173.26 1it8 n ILE 428 N 5.41 3.50 -3.87 2.17 5.41 -1.26 -4.98 119.36 125.75 1it8 n ILE 428 Ca -0.09 -0.50 -0.34 0.00 1.00 0.00 0.00 62.75 62.82 1it8 n ILE 428 Cb 0.42 -1.27 -0.13 0.00 -0.71 0.00 0.00 39.64 37.96 1it8 n ILE 428 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1it8 s GLU 429 N -2.65 1.95 0.81 0.38 2.56 -1.26 -5.11 118.70 115.38 1it8 s GLU 429 Ca 0.73 -2.11 -0.12 0.00 0.00 0.00 0.00 54.97 53.46 1it8 s GLU 429 Cb -0.44 -3.45 0.08 0.00 2.00 0.00 0.00 34.13 32.32 1it8 s GLU 429 CO 0.49 -1.06 1.16 0.15 -0.56 0.00 0.00 175.26 175.44 1it8 s LYS 430 N 0.59 1.73 1.01 4.30 1.02 -1.26 -4.85 119.74 122.29 1it8 s LYS 430 Ca 0.12 1.55 -0.16 0.00 0.02 0.00 0.00 55.97 57.50 1it8 s LYS 430 Cb -0.22 -1.81 0.21 0.00 -0.52 0.00 0.00 37.83 35.49 1it8 s LYS 430 CO -0.04 -2.10 1.24 -2.14 -0.92 0.00 0.00 175.35 171.38 1it8 s PRO 431 N -4.41 0.30 0.20 -1.68 0.02 -1.25 -5.09 135.00 123.08 1it8 s PRO 431 Ca 0.68 -0.21 0.08 0.00 0.02 0.00 0.00 61.00 61.57 1it8 s PRO 431 Cb -0.24 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.45 1it8 s PRO 431 CO 0.52 -2.67 -0.16 0.95 -0.33 0.00 0.00 177.00 175.31 1it8 s THR 432 N -3.58 1.78 0.47 0.99 -4.23 -1.26 -4.92 115.64 104.89 1it8 s THR 432 Ca 0.71 -2.13 0.27 0.00 -1.18 0.00 0.00 61.69 59.36 1it8 s THR 432 Cb -0.07 -1.99 0.47 0.00 1.34 0.00 0.00 72.50 72.25 1it8 s THR 432 CO 0.54 -0.51 1.80 0.50 -0.54 0.00 0.00 174.62 176.41 1it8 h LYS 433 N 2.75 0.18 0.00 3.99 3.64 -1.99 0.34 116.57 125.49 1it8 h LYS 433 Ca -0.39 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 58.82 1it8 h LYS 433 Cb 1.22 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 1it8 h LYS 433 CO 0.59 0.12 -0.88 0.93 -2.27 0.00 0.00 179.45 177.94 1it8 h GLU 434 N 0.19 0.00 0.07 1.90 3.07 -2.01 -3.37 114.58 114.43 1it8 h GLU 434 Ca 0.56 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.42 1it8 h GLU 434 Cb 1.82 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.73 1it8 h GLU 434 CO -0.15 0.57 -0.03 -0.44 -1.40 0.00 0.00 179.01 177.56 1it8 h ASP 435 N 0.00 -0.08 0.00 1.42 3.32 -0.75 -3.43 116.42 116.90 1it8 h ASP 435 Ca -0.05 -0.53 0.00 0.00 0.02 0.00 0.00 57.03 56.47 1it8 h ASP 435 Cb 1.55 0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.12 1it8 h ASP 435 CO 0.08 0.60 0.00 0.00 -1.72 0.00 0.00 179.24 178.19 1it8 n ALA 436 N -2.58 0.00 -0.30 3.45 0.00 -0.47 1.00 120.51 121.61 1it8 n ALA 436 Ca -0.08 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.48 1it8 n ALA 436 Cb 0.30 0.00 0.28 0.00 0.00 0.00 0.00 19.45 20.02 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 0.49 -0.60 0.00 6.09 -1.88 0.15 117.51 121.76 1it8 h ILE 437 Ca 0.00 -0.13 0.17 0.00 -1.37 0.00 0.00 64.86 63.53 1it8 h ILE 437 Cb 0.00 0.07 -0.02 0.00 0.47 0.00 0.00 36.82 37.34 1it8 h ILE 437 CO 0.00 0.07 0.51 0.50 -3.07 0.00 0.00 178.15 176.16 1it8 h LYS 438 N 0.38 0.00 0.19 2.19 1.63 0.34 0.62 116.57 121.92 1it8 h LYS 438 Ca 0.53 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.32 1it8 h LYS 438 Cb 0.98 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.61 1it8 h LYS 438 CO -0.52 0.00 -0.09 1.88 -3.45 0.00 0.00 179.45 177.27 1it8 h TYR 439 N 0.00 -0.23 -1.03 1.91 -1.99 -0.74 -2.45 116.97 112.44 1it8 h TYR 439 Ca 0.29 -0.01 0.32 0.00 2.00 0.00 0.00 58.73 61.33 1it8 h TYR 439 Cb 1.31 0.08 -0.14 0.00 2.00 0.00 0.00 36.73 39.98 1it8 h TYR 439 CO 0.00 -0.14 0.60 0.28 -0.00 0.00 0.00 178.16 178.89 1it8 h VAL 440 N -0.55 0.33 -0.07 -2.88 2.07 -1.30 0.66 116.25 114.50 1it8 h VAL 440 Ca -0.03 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1it8 h VAL 440 Cb 0.19 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 29.92 1it8 h VAL 440 CO 0.04 0.06 0.03 0.24 0.02 0.00 0.00 177.57 177.96 1it8 h MET 441 N 0.34 0.11 0.28 1.57 2.86 -0.98 0.97 114.93 120.09 1it8 h MET 441 Ca 0.72 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 58.34 1it8 h MET 441 Cb 1.68 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 33.31 1it8 h MET 441 CO -0.56 0.26 -0.23 0.00 1.06 0.00 0.00 176.91 177.44 1it8 h ALA 442 N 0.85 -0.51 -0.39 6.32 0.00 0.66 0.07 119.26 126.26 1it8 h ALA 442 Ca 0.02 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1it8 h ALA 442 Cb 0.19 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 1it8 h ALA 442 CO -0.00 -0.81 0.02 0.82 0.00 0.00 0.00 179.25 179.28 1it8 h ILE 443 N -0.52 0.73 -0.13 0.00 2.04 -0.54 0.84 117.51 119.92 1it8 h ILE 443 Ca -0.01 -0.04 0.05 0.00 1.00 0.00 0.00 64.86 65.85 1it8 h ILE 443 Cb 0.47 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 1it8 h ILE 443 CO -0.03 0.02 -0.21 0.00 0.00 0.00 0.00 178.15 177.93 1it8 h ALA 444 N 1.33 -0.17 -0.69 1.87 0.00 -0.53 0.67 119.26 121.72 1it8 h ALA 444 Ca 0.19 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.20 1it8 h ALA 444 Cb 0.26 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1it8 h ALA 444 CO -0.30 -0.67 0.46 1.49 0.00 0.00 0.00 179.25 180.23 1it8 h GLU 445 N -0.27 0.69 0.18 0.00 4.57 -0.17 0.64 114.58 120.23 1it8 h GLU 445 Ca 0.10 -0.04 -0.31 0.00 -1.18 0.00 0.00 59.36 57.92 1it8 h GLU 445 Cb 0.42 -0.16 0.03 0.00 -0.16 0.00 0.00 28.75 28.88 1it8 h GLU 445 CO -0.29 0.46 -1.35 -0.92 -1.18 0.00 0.00 179.01 175.73 1it8 h TYR 446 N 0.71 0.94 0.18 0.92 3.20 0.63 -2.39 116.97 121.17 1it8 h TYR 446 Ca 0.30 -0.64 -0.30 0.00 3.14 0.00 0.00 58.73 61.23 1it8 h TYR 446 Cb 0.26 -0.05 0.02 0.00 1.54 0.00 0.00 36.73 38.49 1it8 h TYR 446 CO -0.00 1.49 -1.42 0.37 -1.64 0.00 0.00 178.16 176.96 1it8 h GLN 447 N 0.19 0.39 -0.00 1.82 4.15 0.47 -3.38 115.11 118.74 1it8 h GLN 447 Ca -0.21 -0.67 0.00 0.00 0.77 0.00 0.00 58.65 58.54 1it8 h GLN 447 Cb 2.04 0.25 0.00 0.00 0.21 0.00 0.00 27.48 29.98 1it8 h GLN 447 CO 0.25 1.32 -0.83 1.19 -1.93 0.00 0.00 178.83 178.83 1it8 n PHE 448 N -3.80 0.00 -0.04 3.99 0.99 0.20 -4.95 117.46 113.85 1it8 n PHE 448 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.25 1it8 n PHE 448 Cb 1.00 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.48 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 1.47 -3.94 3.56 1.37 0.00 -0.90 -4.82 105.19 101.94 1it8 n GLY 449 Ca 0.06 -2.02 -0.48 0.00 0.00 0.00 0.00 46.02 43.57 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 -0.16 1.04 0.00 1.61 4.07 -1.26 -2.37 120.64 123.58 1it8 n GLU 450 Ca 0.00 0.37 0.00 0.00 -0.06 0.00 0.00 57.16 57.47 1it8 n GLU 450 Cb 0.00 -1.78 0.00 0.00 -0.06 0.00 0.00 31.44 29.60 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 1.80 2.13 0.38 8.31 0.00 -1.26 -4.86 105.19 111.69 1it8 n GLY 451 Ca 0.14 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.33 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 1.90 -0.17 4.61 0.00 -1.77 -2.07 119.26 121.77 1it8 h ALA 452 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1it8 h ALA 452 Cb 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1it8 h ALA 452 CO 0.00 -0.71 -0.06 0.66 0.00 0.00 0.00 179.25 179.14 1it8 h SER 453 N 0.00 0.23 -0.16 0.00 4.64 -1.83 -2.83 113.55 113.60 1it8 h SER 453 Ca 0.13 -0.03 0.05 0.00 -0.47 0.00 0.00 61.79 61.46 1it8 h SER 453 Cb 1.27 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1it8 h SER 453 CO -0.00 0.32 0.34 0.03 -0.87 0.00 0.00 176.83 176.65 1it8 h ARG 454 N 0.24 0.00 0.00 4.77 3.08 -1.76 0.32 114.38 121.03 1it8 h ARG 454 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1it8 h ARG 454 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1it8 h ARG 454 CO 0.01 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.91 1it8 n ALA 455 N -2.10 2.23 0.00 0.04 0.00 -1.07 -3.88 120.51 115.74 1it8 n ALA 455 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1it8 n ALA 455 Cb 0.44 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.47 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 -1.42 0.00 0.00 0.00 3.01 0.11 -4.88 117.46 114.28 1it8 n PHE 456 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.55 1it8 n PHE 456 Cb 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.74 1it8 n PHE 456 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1it8 n ASP 457 N -0.75 0.00 -0.92 4.37 8.00 -0.92 -0.11 116.55 126.21 1it8 n ASP 457 Ca 0.00 0.45 0.00 0.00 0.71 0.00 0.00 54.79 55.95 1it8 n ASP 457 Cb 0.00 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 40.88 1it8 n ASP 457 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1it8 n ASP 458 N -2.42 1.83 -4.92 -2.24 5.75 -1.26 -4.86 116.55 108.43 1it8 n ASP 458 Ca 0.00 -1.37 -0.27 0.00 -0.01 0.00 0.00 54.79 53.15 1it8 n ASP 458 Cb 0.00 -0.34 -0.04 0.00 -1.03 0.00 0.00 41.12 39.71 1it8 n ASP 458 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1it8 s ALA 459 N 0.11 3.91 -0.14 2.12 0.00 0.84 -4.81 121.76 123.79 1it8 s ALA 459 Ca 0.00 -1.04 -0.05 0.00 0.00 0.00 0.00 51.96 50.86 1it8 s ALA 459 Cb 0.00 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 1it8 s ALA 459 CO 0.00 0.56 0.06 0.21 0.00 0.00 0.00 175.76 176.59 1it8 s LYS 460 N -3.14 3.52 -0.24 0.00 2.20 -0.14 -4.82 119.74 117.12 1it8 s LYS 460 Ca 0.34 -0.31 -0.06 0.00 -0.36 0.00 0.00 55.97 55.58 1it8 s LYS 460 Cb -0.11 -3.07 -0.02 0.00 -1.51 0.00 0.00 37.83 33.12 1it8 s LYS 460 CO 0.28 0.54 0.02 0.08 -0.36 0.00 0.00 175.35 175.91 1it8 s VAL 461 N -0.38 3.91 0.13 4.02 1.01 -1.26 -1.93 120.40 125.89 1it8 s VAL 461 Ca 0.09 -0.32 -0.29 0.00 0.00 0.00 0.00 61.98 61.47 1it8 s VAL 461 Cb -0.12 -2.81 -0.07 0.00 0.00 0.00 0.00 36.38 33.38 1it8 s VAL 461 CO 0.02 0.37 0.91 -1.61 0.00 0.00 0.00 175.10 174.79 1it8 s GLU 462 N 1.56 4.68 0.00 2.72 2.02 -0.30 -4.93 118.70 124.45 1it8 s GLU 462 Ca 0.06 1.37 0.01 0.00 0.02 0.00 0.00 54.97 56.43 1it8 s GLU 462 Cb -0.15 -3.35 -0.04 0.00 0.10 0.00 0.00 34.13 30.70 1it8 s GLU 462 CO 0.01 0.32 0.02 -0.51 0.02 0.00 0.00 175.26 175.11 1it8 s LEU 463 N -0.34 3.60 0.00 1.80 1.43 -1.26 -0.74 118.68 123.16 1it8 s LEU 463 Ca 0.43 0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 53.46 1it8 s LEU 463 Cb -0.23 -2.09 0.14 0.00 0.03 0.00 0.00 46.19 44.04 1it8 s LEU 463 CO 0.29 0.27 0.83 -1.54 0.23 0.00 0.00 176.35 176.43 1it8 n SER 464 N 1.29 0.18 -0.03 2.29 3.41 0.85 -4.88 113.62 116.73 1it8 n SER 464 Ca -0.14 -1.37 0.24 0.00 -0.26 0.00 0.00 58.87 57.34 1it8 n SER 464 Cb 0.53 -0.62 0.71 0.00 -0.26 0.00 0.00 64.21 64.56 1it8 n SER 464 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1it8 h LYS 465 N 0.00 0.00 -6.25 4.33 2.10 -2.00 -3.39 116.57 111.37 1it8 h LYS 465 Ca -0.27 0.00 -0.47 0.00 -2.00 0.00 0.00 60.65 57.91 1it8 h LYS 465 Cb 0.77 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.08 1it8 h LYS 465 CO 0.20 0.00 -0.41 0.99 -2.00 0.00 0.00 179.45 178.23 1it8 s THR 466 N -4.72 4.15 0.00 0.07 2.01 -1.26 -4.95 115.64 110.93 1it8 s THR 466 Ca -0.04 -1.15 -0.01 0.00 0.31 0.00 0.00 61.69 60.80 1it8 s THR 466 Cb 0.17 -3.42 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 1it8 s THR 466 CO 0.62 -0.21 1.04 0.61 -0.69 0.00 0.00 174.62 175.99 1it8 n GLY 467 N -1.47 1.43 3.63 4.40 0.00 -1.26 -4.81 105.19 107.11 1it8 n GLY 467 Ca -0.03 -0.12 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 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 1.43 3.71 0.12 1.61 -1.94 -1.26 -3.83 119.30 119.13 1it8 s MET 468 Ca 0.07 -0.38 -0.31 0.00 -1.71 0.00 0.00 55.69 53.36 1it8 s MET 468 Cb 0.03 -3.07 -0.08 0.00 2.01 0.00 0.00 34.83 33.72 1it8 s MET 468 CO 0.00 0.37 1.34 -2.14 -0.01 0.00 0.00 175.02 174.59 1it8 s PRO 469 N 0.07 4.35 0.00 2.03 0.02 -1.26 -0.10 135.00 140.10 1it8 s PRO 469 Ca 0.04 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.08 1it8 s PRO 469 Cb -0.13 -3.25 0.00 0.00 0.02 0.00 0.00 34.50 31.14 1it8 s PRO 469 CO 0.01 -0.38 0.00 0.54 -0.33 0.00 0.00 177.00 176.85 1it8 n ARG 470 N 3.72 0.00 -1.68 5.54 5.12 0.08 -4.39 116.66 125.05 1it8 n ARG 470 Ca 0.10 0.00 -0.46 0.00 -1.93 0.00 0.00 57.85 55.57 1it8 n ARG 470 Cb 0.43 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.69 1it8 n ARG 470 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 1it8 n GLN 471 N 0.00 2.36 -3.68 5.56 -0.06 -1.26 -2.05 117.38 118.25 1it8 n GLN 471 Ca 0.00 0.86 -0.38 0.00 -2.00 0.00 0.00 57.00 55.48 1it8 n GLN 471 Cb 0.00 -2.69 -0.10 0.00 -4.06 0.00 0.00 30.24 23.40 1it8 n GLN 471 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 1it8 s VAL 472 N 2.33 3.78 0.42 1.69 1.01 -0.64 -1.15 120.40 127.84 1it8 s VAL 472 Ca 0.84 -2.45 0.08 0.00 0.00 0.00 0.00 61.98 60.44 1it8 s VAL 472 Cb -0.62 -3.50 -0.00 0.00 0.00 0.00 0.00 36.38 32.26 1it8 s VAL 472 CO 0.41 -0.81 0.50 -0.54 0.00 0.00 0.00 175.10 174.66 1it8 s LYS 473 N 0.56 2.71 -0.23 2.72 1.02 -0.81 -0.30 119.74 125.41 1it8 s LYS 473 Ca 0.12 -1.36 -0.14 0.00 0.02 0.00 0.00 55.97 54.61 1it8 s LYS 473 Cb -0.21 -2.61 0.07 0.00 -0.52 0.00 0.00 37.83 34.56 1it8 s LYS 473 CO -0.04 -0.25 0.56 0.54 -0.92 0.00 0.00 175.35 175.25 1it8 s VAL 474 N -2.40 -0.01 0.00 3.17 0.11 -1.19 -0.97 120.40 119.11 1it8 s VAL 474 Ca 0.52 0.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.61 1it8 s VAL 474 Cb -0.07 -0.81 0.00 0.00 -1.53 0.00 0.00 36.38 33.96 1it8 s VAL 474 CO 0.31 0.01 0.00 -0.46 -3.33 0.00 0.00 175.10 171.63 1it8 n ASN 475 N 4.03 0.00 0.00 3.54 6.94 -1.26 -3.07 115.26 125.44 1it8 n ASN 475 Ca -0.20 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.36 1it8 n ASN 475 Cb 0.57 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.99 1it8 n ASN 475 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1it8 n GLY 476 N -0.13 1.10 3.82 4.83 0.00 -1.26 -5.11 105.19 108.45 1it8 n GLY 476 Ca 0.00 -0.43 -0.22 0.00 0.00 0.00 0.00 46.02 45.37 1it8 n GLY 476 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1it8 s LYS 477 N 0.00 2.43 -0.03 1.61 2.20 -1.17 -5.08 119.74 119.69 1it8 s LYS 477 Ca 0.00 -1.63 -0.30 0.00 -0.36 0.00 0.00 55.97 53.68 1it8 s LYS 477 Cb 0.00 -2.24 -0.06 0.00 -1.51 0.00 0.00 37.83 34.02 1it8 s LYS 477 CO 0.00 -0.14 1.65 0.50 -0.36 0.00 0.00 175.35 176.99 1it8 s ARG 478 N -4.04 4.19 -0.15 4.03 3.52 -1.26 -3.15 118.95 122.09 1it8 s ARG 478 Ca 0.45 2.20 -0.26 0.00 -0.13 0.00 0.00 55.73 57.99 1it8 s ARG 478 Cb -0.01 -3.92 -0.24 0.00 -1.56 0.00 0.00 34.95 29.23 1it8 s ARG 478 CO 0.26 -0.82 0.64 -0.07 -0.81 0.00 0.00 175.30 174.50 1it8 h LEU 479 N 9.92 0.00 0.00 -0.88 3.38 -0.99 -3.39 115.31 123.35 1it8 h LEU 479 Ca -0.40 -0.87 0.00 0.00 0.09 0.00 0.00 57.88 56.70 1it8 h LEU 479 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1it8 h LEU 479 CO 0.95 1.05 0.00 0.00 0.09 0.00 0.00 178.44 180.53 1it8 n ALA 480 N -2.75 0.00 -3.64 1.53 0.00 -1.08 -0.22 120.51 114.35 1it8 n ALA 480 Ca -0.13 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.23 1it8 n ALA 480 Cb 0.49 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.87 1it8 n ALA 480 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1it8 s THR 481 N -2.38 0.00 -0.10 0.00 2.01 -0.65 -1.62 115.64 112.91 1it8 s THR 481 Ca 0.00 0.00 -0.28 0.00 0.31 0.00 0.00 61.69 61.72 1it8 s THR 481 Cb 0.00 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.49 1it8 s THR 481 CO 0.00 0.00 0.93 -0.69 -0.69 0.00 0.00 174.62 174.17 1it8 s VAL 482 N 1.29 4.85 0.12 3.82 1.01 -0.87 -0.86 120.40 129.76 1it8 s VAL 482 Ca -0.07 1.89 -0.30 0.00 0.00 0.00 0.00 61.98 63.49 1it8 s VAL 482 Cb -0.05 -4.24 -0.06 0.00 0.00 0.00 0.00 36.38 32.02 1it8 s VAL 482 CO -0.14 0.06 1.08 -0.13 0.00 0.00 0.00 175.10 175.97 1it8 s ARG 483 N 1.74 4.58 0.16 2.72 0.52 0.07 -4.66 118.95 124.08 1it8 s ARG 483 Ca 0.45 1.64 -0.11 0.00 -0.52 0.00 0.00 55.73 57.19 1it8 s ARG 483 Cb -0.18 -3.33 0.03 0.00 0.52 0.00 0.00 34.95 31.99 1it8 s ARG 483 CO 0.18 0.02 1.60 0.00 0.02 0.00 0.00 175.30 177.13 1it8 h ALA 484 N 5.76 0.73 0.00 2.13 0.00 -1.91 0.52 119.26 126.50 1it8 h ALA 484 Ca -0.43 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.16 1it8 h ALA 484 Cb 1.21 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1it8 h ALA 484 CO 0.74 0.60 -0.02 0.38 0.00 0.00 0.00 179.25 180.95 1it8 h ASP 485 N 0.86 0.00 0.00 0.00 -0.00 -1.98 -3.36 116.42 111.95 1it8 h ASP 485 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.18 1it8 h ASP 485 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.93 1it8 h ASP 485 CO 0.04 0.02 0.00 -0.90 -0.00 0.00 0.00 179.24 178.40 1it8 n ASP 486 N -3.40 0.00 -2.25 4.15 3.85 -1.15 -5.01 116.55 112.74 1it8 n ASP 486 Ca -0.02 -1.00 -0.21 0.00 -0.71 0.00 0.00 54.79 52.85 1it8 n ASP 486 Cb 0.12 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 39.87 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 -0.14 3.80 6.12 0.00 0.18 -0.61 105.19 114.55 1it8 n GLY 487 Ca 0.00 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 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 -5.78 3.27 -0.04 0.99 1.43 -1.26 -4.29 118.68 113.00 1it8 s LEU 488 Ca 0.00 -0.89 -0.13 0.00 -1.03 0.00 0.00 54.13 52.08 1it8 s LEU 488 Cb 0.00 -1.76 -0.05 0.00 0.03 0.00 0.00 46.19 44.40 1it8 s LEU 488 CO 0.00 -0.57 0.35 -0.76 0.23 0.00 0.00 176.35 175.60 1it8 s LEU 489 N -4.00 4.43 -0.24 1.79 1.43 -1.26 -0.75 118.68 120.07 1it8 s LEU 489 Ca 0.44 0.83 -0.06 0.00 -1.03 0.00 0.00 54.13 54.31 1it8 s LEU 489 Cb -0.00 -2.48 -0.02 0.00 0.03 0.00 0.00 46.19 43.72 1it8 s LEU 489 CO 0.25 0.31 0.03 -0.89 0.23 0.00 0.00 176.35 176.28 1it8 s THR 490 N -0.87 4.00 0.31 5.49 2.01 -0.04 -4.89 115.64 121.64 1it8 s THR 490 Ca 0.22 -0.28 -0.28 0.00 0.31 0.00 0.00 61.69 61.66 1it8 s THR 490 Cb -0.15 -2.85 -0.09 0.00 0.01 0.00 0.00 72.50 69.41 1it8 s THR 490 CO 0.11 0.37 1.01 -0.76 -0.69 0.00 0.00 174.62 174.66 1it8 s LEU 491 N 1.55 4.44 0.11 4.42 1.43 -1.26 -1.63 118.68 127.74 1it8 s LEU 491 Ca 0.06 2.04 0.04 0.00 -1.03 0.00 0.00 54.13 55.24 1it8 s LEU 491 Cb -0.15 -3.83 -0.04 0.00 0.03 0.00 0.00 46.19 42.20 1it8 s LEU 491 CO 0.01 -0.12 0.10 -0.83 0.23 0.00 0.00 176.35 175.74 1it8 s GLY 492 N -1.27 1.90 0.36 -3.19 0.00 0.69 -4.92 107.32 100.89 1it8 s GLY 492 Ca 0.48 -1.09 0.17 0.00 0.00 0.00 0.00 44.72 44.27 1it8 s GLY 492 CO 0.32 -1.09 1.67 1.19 0.00 0.00 0.00 173.10 175.19 1it8 h ILE 493 N 2.38 0.29 0.00 0.90 -0.00 -1.83 0.74 117.51 120.00 1it8 h ILE 493 Ca -0.47 -0.10 -0.03 0.00 -0.00 0.00 0.00 64.86 64.26 1it8 h ILE 493 Cb 1.18 -0.03 -0.00 0.00 -0.00 0.00 0.00 36.82 37.96 1it8 h ILE 493 CO 0.65 0.05 -0.15 -0.08 -0.00 0.00 0.00 178.15 178.62 1it8 h GLU 494 N 0.30 0.00 0.04 2.19 4.57 -1.82 -1.81 114.58 118.05 1it8 h GLU 494 Ca 0.74 0.00 -0.31 0.00 -1.18 0.00 0.00 59.36 58.61 1it8 h GLU 494 Cb 1.79 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 30.34 1it8 h GLU 494 CO -0.56 0.15 -1.77 0.78 -1.18 0.00 0.00 179.01 176.44 1it8 h GLY 495 N 1.03 0.09 1.00 1.92 0.00 0.59 -3.19 103.07 104.51 1it8 h GLY 495 Ca -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1it8 h GLY 495 CO 0.02 0.19 0.41 0.00 0.00 0.00 0.00 176.54 177.16 1it8 h ALA 496 N 0.75 0.90 -0.20 3.60 0.00 -0.86 0.63 119.26 124.08 1it8 h ALA 496 Ca -0.32 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.54 1it8 h ALA 496 Cb 2.02 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 19.49 1it8 h ALA 496 CO 0.08 0.39 -0.03 0.87 0.00 0.00 0.00 179.25 180.56 1it8 h LYS 497 N 0.96 0.02 -0.48 0.00 1.57 -1.44 0.29 116.57 117.49 1it8 h LYS 497 Ca 0.25 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1it8 h LYS 497 Cb -0.00 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1it8 h LYS 497 CO -0.04 0.01 0.29 0.00 -0.57 0.00 0.00 179.45 179.14 1it8 h ARG 498 N 0.02 0.65 -0.68 3.15 3.08 -1.39 -2.06 114.38 117.16 1it8 h ARG 498 Ca 0.10 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 1it8 h ARG 498 Cb 0.14 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1it8 h ARG 498 CO -0.19 0.48 0.21 -0.07 -1.07 0.00 0.00 179.97 179.33 1it8 h LEU 499 N 0.64 0.98 -0.67 3.04 -0.00 -0.50 -1.51 115.31 117.29 1it8 h LEU 499 Ca 0.17 -0.18 0.04 0.00 -0.00 0.00 0.00 57.88 57.91 1it8 h LEU 499 Cb -0.00 -0.25 -0.05 0.00 -0.00 0.00 0.00 40.66 40.36 1it8 h LEU 499 CO -0.03 0.91 0.41 -0.74 -0.00 0.00 0.00 178.44 178.99 1it8 h HIS 500 N 1.01 0.76 0.08 1.13 2.76 0.08 0.13 115.15 121.09 1it8 h HIS 500 Ca 0.22 0.02 -0.26 0.00 -2.20 0.00 0.00 60.37 58.15 1it8 h HIS 500 Cb 0.29 -0.24 0.01 0.00 1.55 0.00 0.00 27.41 29.01 1it8 h HIS 500 CO 0.02 0.42 -1.13 0.07 -1.30 0.00 0.00 177.93 176.01 1it8 h ARG 501 N 0.79 0.40 -0.23 5.26 0.11 -1.23 -3.34 114.38 116.14 1it8 h ARG 501 Ca 0.28 -0.54 -0.17 0.00 0.10 0.00 0.00 59.98 59.65 1it8 h ARG 501 Cb 0.06 0.18 -0.00 0.00 1.11 0.00 0.00 29.97 31.32 1it8 h ARG 501 CO -0.12 1.21 -0.54 0.28 0.10 0.00 0.00 179.97 180.90 1it8 h VAL 502 N 0.18 1.30 -3.01 0.08 2.07 -1.06 -3.44 116.25 112.37 1it8 h VAL 502 Ca -0.13 -1.76 -0.65 0.00 0.82 0.00 0.00 66.70 64.98 1it8 h VAL 502 Cb 1.81 1.70 -0.11 0.00 -1.52 0.00 0.00 31.29 33.17 1it8 h VAL 502 CO 0.20 0.56 -0.53 -0.76 0.02 0.00 0.00 177.57 177.05 1it8 s LEU 503 N -8.47 4.05 0.50 2.57 1.43 0.01 -4.99 118.68 113.79 1it8 s LEU 503 Ca -0.08 0.28 -0.21 0.00 -1.03 0.00 0.00 54.13 53.09 1it8 s LEU 503 Cb 0.11 -1.99 -0.07 0.00 0.03 0.00 0.00 46.19 44.27 1it8 s LEU 503 CO 0.86 0.33 1.16 -2.16 0.23 0.00 0.00 176.35 176.76 1it8 s PRO 504 N -0.55 3.55 0.61 1.29 0.04 -1.26 -4.76 135.00 133.92 1it8 s PRO 504 Ca 0.11 1.72 -0.19 0.00 0.04 0.00 0.00 61.00 62.68 1it8 s PRO 504 Cb -0.12 -2.22 -0.03 0.00 0.04 0.00 0.00 34.50 32.17 1it8 s PRO 504 CO 0.02 -0.71 1.25 -0.47 0.04 0.00 0.00 177.00 177.14 1it8 s TYR 505 N -1.63 2.26 -2.32 0.56 5.04 -1.26 -2.07 117.35 117.93 1it8 s TYR 505 Ca 0.68 1.49 0.22 0.00 -2.44 0.00 0.00 57.07 57.02 1it8 s TYR 505 Cb -0.27 -3.60 0.82 0.00 0.35 0.00 0.00 41.96 39.27 1it8 s TYR 505 CO 0.32 -2.55 1.59 -0.35 -1.34 0.00 0.00 175.55 173.22 1it8 n PRO 506 N -1.65 1.70 -1.53 4.97 -0.04 -1.26 -5.12 135.00 132.08 1it8 n PRO 506 Ca 0.14 -1.05 -0.60 0.00 -0.04 0.00 0.00 63.50 61.96 1it8 n PRO 506 Cb 0.49 -1.41 -0.09 0.00 -0.04 0.00 0.00 33.50 32.45 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 0.27 0.00 -0.77 0.54 5.12 -0.88 -0.37 116.66 120.57 1it8 n ARG 507 Ca 0.17 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.09 1it8 n ARG 507 Cb 0.33 -1.35 0.00 0.00 -1.16 0.00 0.00 32.46 30.28 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 3.18 -0.39 -3.62 5.56 2.81 -1.26 -4.92 117.12 118.48 1it8 n MET 508 Ca 0.26 0.10 -0.32 0.00 -1.81 0.00 0.00 57.70 55.93 1it8 n MET 508 Cb -0.03 -3.95 -0.05 0.00 -0.71 0.00 0.00 33.22 28.48 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 -0.84 3.66 -0.19 0.03 3.00 0.50 0.28 118.95 125.39 1it8 s ARG 509 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 55.73 55.71 1it8 s ARG 509 Cb 0.00 -2.82 0.06 0.00 0.00 0.00 0.00 34.95 32.19 1it8 s ARG 509 CO 0.00 0.44 0.01 0.14 0.00 0.00 0.00 175.30 175.89 1it8 s VAL 510 N -1.67 0.75 -0.02 3.52 -7.23 -0.69 -0.21 120.40 114.84 1it8 s VAL 510 Ca 0.42 -0.64 -0.23 0.00 -1.81 0.00 0.00 61.98 59.72 1it8 s VAL 510 Cb -0.12 -1.16 -0.05 0.00 0.56 0.00 0.00 36.38 35.61 1it8 s VAL 510 CO 0.23 -0.13 0.69 -0.69 -0.31 0.00 0.00 175.10 174.89 1it8 s VAL 511 N 1.76 4.92 0.28 1.32 1.01 0.53 -1.38 120.40 128.85 1it8 s VAL 511 Ca -0.01 1.43 0.11 0.00 0.00 0.00 0.00 61.98 63.51 1it8 s VAL 511 Cb -0.17 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.13 1it8 s VAL 511 CO -0.07 0.33 -0.18 0.68 0.00 0.00 0.00 175.10 175.85 1it8 s VAL 512 N 0.28 2.40 0.82 2.92 -7.23 -0.38 -1.23 120.40 117.98 1it8 s VAL 512 Ca 0.36 -2.37 -0.15 0.00 -1.81 0.00 0.00 61.98 58.01 1it8 s VAL 512 Cb -0.19 -2.34 -0.02 0.00 0.56 0.00 0.00 36.38 34.40 1it8 s VAL 512 CO 0.19 -0.38 0.37 0.59 -0.31 0.00 0.00 175.10 175.56 1it8 n ASN 513 N -0.63 -1.93 -0.11 4.85 4.13 -0.14 -4.32 115.26 117.11 1it8 n ASN 513 Ca -0.05 0.47 -0.07 0.00 1.68 0.00 0.00 54.58 56.61 1it8 n ASN 513 Cb 0.61 -1.17 0.11 0.00 -1.54 0.00 0.00 39.78 37.79 1it8 n ASN 513 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1it8 h LYS 514 N -0.82 0.82 -0.14 3.52 6.56 -2.00 -1.50 116.57 123.00 1it8 h LYS 514 Ca -0.45 -0.28 -0.05 0.00 -1.06 0.00 0.00 60.65 58.82 1it8 h LYS 514 Cb 1.32 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 32.91 1it8 h LYS 514 CO 0.38 0.89 -0.14 1.49 -2.06 0.00 0.00 179.45 180.01 1it8 h GLU 515 N 0.74 0.23 0.00 3.15 4.81 -1.97 -2.82 114.58 118.72 1it8 h GLU 515 Ca 0.12 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.14 1it8 h GLU 515 Cb 0.60 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 1it8 h GLU 515 CO 0.04 0.38 -0.77 0.00 -0.73 0.00 0.00 179.01 177.93 1it8 h ALA 516 N 1.64 0.50 -0.94 2.92 0.00 -1.72 -3.39 119.26 118.27 1it8 h ALA 516 Ca 0.04 -0.70 0.09 0.00 0.00 0.00 0.00 54.91 54.34 1it8 h ALA 516 Cb 0.39 -0.12 -0.12 0.00 0.00 0.00 0.00 17.79 17.94 1it8 h ALA 516 CO 0.02 0.97 -0.54 -1.91 0.00 0.00 0.00 179.25 177.79 1it8 n GLU 517 N -3.30 -0.40 -0.34 0.00 2.13 -0.63 -1.58 120.64 116.52 1it8 n GLU 517 Ca 0.01 1.42 0.15 0.00 0.66 0.00 0.00 57.16 59.40 1it8 n GLU 517 Cb 0.84 -2.09 0.37 0.00 0.27 0.00 0.00 31.44 30.83 1it8 n GLU 517 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 1it8 h PRO 518 N 0.00 0.64 -0.08 5.31 0.11 -1.76 -1.87 132.00 134.35 1it8 h PRO 518 Ca 0.16 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.22 1it8 h PRO 518 Cb 0.40 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.36 1it8 h PRO 518 CO -0.89 0.42 -0.00 0.74 -0.21 0.00 0.00 178.00 178.06 1it8 h PHE 519 N 0.66 0.15 -0.24 0.65 0.05 -1.56 -2.02 116.94 114.64 1it8 h PHE 519 Ca 0.58 -0.03 0.03 0.00 3.82 0.00 0.00 57.97 62.37 1it8 h PHE 519 Cb 1.04 -0.04 -0.03 0.00 2.00 0.00 0.00 35.95 38.92 1it8 h PHE 519 CO -0.00 0.42 0.05 0.00 -0.18 0.00 0.00 178.31 178.60 1it8 h ALA 520 N 0.72 0.25 -0.83 2.45 0.00 -1.12 -0.55 119.26 120.18 1it8 h ALA 520 Ca 0.02 0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.11 1it8 h ALA 520 Cb 0.36 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.11 1it8 h ALA 520 CO 0.00 -0.37 0.42 0.00 0.00 0.00 0.00 179.25 179.31 1it8 h ARG 521 N 0.15 0.60 0.00 0.00 3.08 -1.29 0.29 114.38 117.21 1it8 h ARG 521 Ca 0.11 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1it8 h ARG 521 Cb 0.10 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.02 1it8 h ARG 521 CO -0.14 0.40 0.00 1.63 -1.07 0.00 0.00 179.97 180.79 1it8 n LYS 522 N -4.87 0.14 0.00 0.04 4.01 -0.73 -2.36 118.16 114.40 1it8 n LYS 522 Ca 0.16 0.06 0.00 0.00 -0.51 0.00 0.00 58.31 58.02 1it8 n LYS 522 Cb 0.41 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.43 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 0.98 0.52 3.69 0.72 0.00 0.10 -4.79 105.19 106.41 1it8 n GLY 523 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.73 0.36 -1.46 1.61 4.76 -0.48 -4.64 118.16 116.59 1it8 n LYS 524 Ca 0.00 0.20 -0.32 0.00 -2.87 0.00 0.00 58.31 55.32 1it8 n LYS 524 Cb 0.00 -2.44 0.08 0.00 -1.84 0.00 0.00 35.03 30.83 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 -1.95 4.68 -0.24 4.39 1.01 -1.26 -4.36 116.67 118.93 1it8 s ASP 525 Ca 0.75 1.94 -0.16 0.00 0.71 0.00 0.00 52.55 55.79 1it8 s ASP 525 Cb -0.31 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.04 1it8 s ASP 525 CO 0.49 -1.92 0.41 -0.69 0.21 0.00 0.00 175.17 173.67 1it8 s VAL 526 N -2.61 5.16 -0.02 -1.27 1.01 -0.54 -4.89 120.40 117.24 1it8 s VAL 526 Ca 0.64 0.69 -0.14 0.00 0.00 0.00 0.00 61.98 63.17 1it8 s VAL 526 Cb -0.19 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 1it8 s VAL 526 CO 0.49 0.18 0.39 -0.36 0.00 0.00 0.00 175.10 175.80 1it8 s PHE 527 N 1.80 3.69 0.29 5.22 0.40 -1.26 -0.22 117.98 127.91 1it8 s PHE 527 Ca 0.18 0.93 0.02 0.00 -0.60 0.00 0.00 56.93 57.46 1it8 s PHE 527 Cb -0.15 -2.28 0.72 0.00 0.51 0.00 0.00 43.02 41.82 1it8 s PHE 527 CO 0.09 0.61 1.63 0.00 0.70 0.00 0.00 175.22 178.25 1it8 h ALA 528 N 4.94 1.26 0.00 5.36 0.00 -1.56 0.50 119.26 129.75 1it8 h ALA 528 Ca -0.51 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1it8 h ALA 528 Cb 1.22 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1it8 h ALA 528 CO 0.63 -0.50 0.00 1.57 0.00 0.00 0.00 179.25 180.95 1it8 h LYS 529 N 0.16 0.00 -0.44 0.00 2.10 -1.74 0.69 116.57 117.34 1it8 h LYS 529 Ca 0.56 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.21 1it8 h LYS 529 Cb 1.15 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.48 1it8 h LYS 529 CO -0.70 0.00 0.00 1.19 -2.00 0.00 0.00 179.45 177.94 1it8 n PHE 530 N -3.01 0.58 -3.43 0.07 3.01 0.16 -4.85 117.46 109.98 1it8 n PHE 530 Ca -0.03 -0.29 -0.39 0.00 1.01 0.00 0.00 57.45 57.75 1it8 n PHE 530 Cb 0.09 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.46 1it8 n PHE 530 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1it8 s VAL 531 N -1.42 5.20 -0.13 -4.37 1.01 0.23 -0.96 120.40 119.95 1it8 s VAL 531 Ca 0.37 0.30 0.17 0.00 0.00 0.00 0.00 61.98 62.82 1it8 s VAL 531 Cb 0.20 -3.71 -0.14 0.00 0.00 0.00 0.00 36.38 32.73 1it8 s VAL 531 CO 0.27 0.09 0.79 2.30 0.00 0.00 0.00 175.10 178.55 1it8 n ILE 532 N 5.15 1.11 -3.57 2.22 -5.35 -0.37 -4.69 119.36 113.86 1it8 n ILE 532 Ca -0.10 -0.68 -0.13 0.00 -0.27 0.00 0.00 62.75 61.58 1it8 n ILE 532 Cb 0.50 -0.67 -0.06 0.00 -1.74 0.00 0.00 39.64 37.68 1it8 n ILE 532 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 1it8 s PHE 533 N -2.96 -0.49 0.02 4.28 5.36 -1.14 -4.98 117.98 118.07 1it8 s PHE 533 Ca -0.03 0.92 -0.15 0.00 -0.96 0.00 0.00 56.93 56.71 1it8 s PHE 533 Cb 0.09 0.42 0.02 0.00 -0.34 0.00 0.00 43.02 43.21 1it8 s PHE 533 CO 0.81 -0.40 0.32 0.00 -1.46 0.00 0.00 175.22 174.50 1it8 s ALA 534 N -0.85 -0.77 0.04 11.12 0.00 -1.26 0.20 121.76 130.24 1it8 s ALA 534 Ca -0.03 0.18 -0.34 0.00 0.00 0.00 0.00 51.96 51.77 1it8 s ALA 534 Cb -0.01 0.22 -0.13 0.00 0.00 0.00 0.00 23.12 23.21 1it8 s ALA 534 CO 0.03 -0.36 1.74 -3.47 0.00 0.00 0.00 175.76 173.70 1it8 n ASP 535 N 0.84 3.34 0.26 0.00 -0.08 0.70 -4.77 116.55 116.85 1it8 n ASP 535 Ca -0.20 1.02 0.09 0.00 -1.51 0.00 0.00 54.79 54.20 1it8 n ASP 535 Cb 0.58 -1.41 0.68 0.00 2.34 0.00 0.00 41.12 43.31 1it8 n ASP 535 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1it8 h PRO 536 N 7.69 0.00 0.00 -0.67 0.11 -1.91 -2.40 132.00 134.82 1it8 h PRO 536 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1it8 h PRO 536 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1it8 h PRO 536 CO 0.92 0.02 0.00 0.78 -0.21 0.00 0.00 178.00 179.51 1it8 h GLY 537 N 0.08 0.00 -4.88 -0.55 0.00 -1.98 -3.40 103.07 92.34 1it8 h GLY 537 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 1it8 h GLY 537 CO 0.00 0.00 0.91 1.39 0.00 0.00 0.00 176.54 178.84 1it8 n ILE 538 N -2.87 0.04 -4.34 2.60 5.41 -0.90 -4.89 119.36 114.40 1it8 n ILE 538 Ca 0.01 -0.01 -0.27 0.00 1.00 0.00 0.00 62.75 63.49 1it8 n ILE 538 Cb 0.29 -1.75 -0.10 0.00 -0.71 0.00 0.00 39.64 37.37 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 1.20 1.86 0.25 0.38 3.00 -1.26 -1.27 118.95 123.11 1it8 s ARG 539 Ca 0.78 -1.36 -0.30 0.00 0.00 0.00 0.00 55.73 54.85 1it8 s ARG 539 Cb -0.60 -2.04 -0.14 0.00 0.00 0.00 0.00 34.95 32.16 1it8 s ARG 539 CO 0.36 0.42 1.11 -2.30 0.00 0.00 0.00 175.30 174.89 1it8 n PRO 540 N 0.12 1.40 -1.07 3.54 -0.02 -1.26 -1.95 135.00 135.77 1it8 n PRO 540 Ca -0.11 0.49 -0.02 0.00 -2.02 0.00 0.00 63.50 61.84 1it8 n PRO 540 Cb 0.56 -1.94 -0.01 0.00 -0.02 0.00 0.00 33.50 32.08 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 0.82 0.00 -1.61 6.00 4.02 0.23 -1.24 117.16 125.38 1it8 n TYR 541 Ca 0.11 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.69 1it8 n TYR 541 Cb 0.30 -1.02 0.05 0.00 -0.02 0.00 0.00 39.34 38.65 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 -2.27 5.35 0.19 7.72 1.01 -0.82 -4.65 116.67 123.19 1it8 s ASP 542 Ca 0.00 1.67 -0.29 0.00 0.71 0.00 0.00 52.55 54.63 1it8 s ASP 542 Cb 0.00 -2.50 -0.08 0.00 1.01 0.00 0.00 42.92 41.35 1it8 s ASP 542 CO 0.00 -1.46 0.92 -1.61 0.21 0.00 0.00 175.17 173.23 1it8 s GLU 543 N -4.89 4.77 0.03 8.23 0.41 -1.26 -1.29 118.70 124.70 1it8 s GLU 543 Ca 0.59 1.43 0.04 0.00 -0.41 0.00 0.00 54.97 56.62 1it8 s GLU 543 Cb -0.15 -3.31 -0.02 0.00 -1.78 0.00 0.00 34.13 28.88 1it8 s GLU 543 CO 0.52 0.43 -0.11 0.08 -0.49 0.00 0.00 175.26 175.68 1it8 s VAL 544 N -0.78 0.89 -0.42 2.63 1.01 0.12 -4.89 120.40 118.95 1it8 s VAL 544 Ca 0.42 -0.86 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 1it8 s VAL 544 Cb -0.25 -0.82 0.03 0.00 0.00 0.00 0.00 36.38 35.34 1it8 s VAL 544 CO 0.30 -0.03 0.31 -0.76 0.00 0.00 0.00 175.10 174.93 1it8 s LEU 545 N -1.01 5.18 0.01 3.92 1.43 0.14 -1.99 118.68 126.36 1it8 s LEU 545 Ca -0.00 -0.99 -0.28 0.00 -1.03 0.00 0.00 54.13 51.83 1it8 s LEU 545 Cb -0.07 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 1it8 s LEU 545 CO 0.01 -0.48 0.87 -0.69 0.23 0.00 0.00 176.35 176.29 1it8 s VAL 546 N 1.66 4.84 0.17 -1.59 1.01 -0.22 -1.71 120.40 124.57 1it8 s VAL 546 Ca 0.05 1.84 -0.09 0.00 0.00 0.00 0.00 61.98 63.78 1it8 s VAL 546 Cb -0.20 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 31.95 1it8 s VAL 546 CO 0.09 0.24 0.29 0.54 0.00 0.00 0.00 175.10 176.25 1it8 s VAL 547 N 0.66 0.06 0.64 2.92 0.11 -0.48 -0.69 120.40 123.63 1it8 s VAL 547 Ca 0.46 -1.44 0.06 0.00 -2.93 0.00 0.00 61.98 58.13 1it8 s VAL 547 Cb -0.20 -1.91 0.11 0.00 -1.53 0.00 0.00 36.38 32.84 1it8 s VAL 547 CO 0.25 -0.26 0.89 0.54 -3.33 0.00 0.00 175.10 173.19 1it8 s ASN 548 N -2.98 4.74 0.23 3.54 2.20 -1.10 -1.24 114.94 120.32 1it8 s ASN 548 Ca 0.19 -0.72 0.16 0.00 -0.94 0.00 0.00 52.86 51.55 1it8 s ASN 548 Cb 0.03 0.29 0.84 0.00 -2.00 0.00 0.00 41.25 40.41 1it8 s ASN 548 CO 0.01 -1.60 1.49 -0.62 -2.94 0.00 0.00 177.10 173.44 1it8 n GLU 549 N -2.51 0.10 -0.49 3.55 1.02 -1.26 -0.56 120.64 120.49 1it8 n GLU 549 Ca 0.16 0.58 0.11 0.00 -0.02 0.00 0.00 57.16 57.99 1it8 n GLU 549 Cb 0.61 -1.82 0.35 0.00 -0.02 0.00 0.00 31.44 30.56 1it8 n GLU 549 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1it8 n ASN 550 N -2.04 4.39 -3.66 1.62 3.02 -1.26 -4.94 115.26 112.38 1it8 n ASN 550 Ca -0.01 -2.20 -0.25 0.00 -0.03 0.00 0.00 54.58 52.09 1it8 n ASN 550 Cb 0.04 -0.54 0.07 0.00 -0.61 0.00 0.00 39.78 38.74 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 1.46 -5.63 -4.65 6.41 4.64 0.28 -4.98 116.55 114.07 1it8 n ASP 551 Ca 0.26 -0.61 -0.37 0.00 -1.38 0.00 0.00 54.79 52.69 1it8 n ASP 551 Cb 0.76 -4.76 -0.10 0.00 -1.04 0.00 0.00 41.12 35.98 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 -6.32 4.06 0.14 -0.67 2.02 -1.26 -4.87 118.70 111.81 1it8 s GLU 552 Ca 0.55 -0.26 -0.33 0.00 0.02 0.00 0.00 54.97 54.95 1it8 s GLU 552 Cb -0.25 -3.55 -0.13 0.00 0.10 0.00 0.00 34.13 30.29 1it8 s GLU 552 CO 0.75 0.03 1.66 -0.11 0.02 0.00 0.00 175.26 177.62 1it8 n LEU 553 N 4.39 3.40 -0.04 1.80 -0.00 -1.26 -2.70 117.00 122.58 1it8 n LEU 553 Ca -0.15 1.06 -0.05 0.00 -0.00 0.00 0.00 56.01 56.87 1it8 n LEU 553 Cb 0.52 -1.46 -0.05 0.00 -0.00 0.00 0.00 43.42 42.43 1it8 n LEU 553 CO 0.35 -0.13 -0.76 0.18 -0.00 0.00 0.00 177.39 177.03 1it8 n LEU 554 N 4.09 1.08 -3.65 -1.96 4.77 0.14 -4.86 117.00 116.61 1it8 n LEU 554 Ca 0.17 -0.02 0.03 0.00 -0.03 0.00 0.00 56.01 56.16 1it8 n LEU 554 Cb 0.31 -0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1it8 n LEU 554 CO 0.65 0.35 1.13 0.00 -1.33 0.00 0.00 177.39 178.19 1it8 s ALA 555 N -2.18 -2.39 0.02 -1.18 0.00 -1.19 -1.25 121.76 113.58 1it8 s ALA 555 Ca -0.07 0.71 0.05 0.00 0.00 0.00 0.00 51.96 52.65 1it8 s ALA 555 Cb 0.03 0.39 -0.02 0.00 0.00 0.00 0.00 23.12 23.51 1it8 s ALA 555 CO 0.27 -1.07 -0.16 -0.08 0.00 0.00 0.00 175.76 174.72 1it8 s THR 556 N -2.21 1.26 0.00 0.00 -1.32 -0.33 -1.06 115.64 111.98 1it8 s THR 556 Ca 0.17 -0.89 0.00 0.00 -1.21 0.00 0.00 61.69 59.75 1it8 s THR 556 Cb 0.05 -1.10 0.00 0.00 -1.51 0.00 0.00 72.50 69.95 1it8 s THR 556 CO -0.05 0.19 0.00 0.61 -2.21 0.00 0.00 174.62 173.16 1it8 n GLY 557 N 2.22 2.37 3.30 6.08 0.00 -0.84 -0.73 105.19 117.59 1it8 n GLY 557 Ca -0.16 -0.80 -0.32 0.00 0.00 0.00 0.00 46.02 44.74 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 0.19 2.81 0.36 1.61 0.74 0.16 0.10 119.66 125.63 1it8 s GLN 558 Ca 0.00 -0.84 -0.26 0.00 0.05 0.00 0.00 55.36 54.31 1it8 s GLN 558 Cb 0.00 -2.30 -0.09 0.00 1.10 0.00 0.00 33.01 31.72 1it8 s GLN 558 CO 0.00 0.33 1.06 0.00 -0.55 0.00 0.00 175.29 176.12 1it8 s ALA 559 N -0.01 3.19 -0.05 1.58 0.00 -0.41 -0.08 121.76 125.99 1it8 s ALA 559 Ca -0.07 0.75 0.12 0.00 0.00 0.00 0.00 51.96 52.76 1it8 s ALA 559 Cb -0.15 -3.28 -0.18 0.00 0.00 0.00 0.00 23.12 19.51 1it8 s ALA 559 CO 0.05 -0.17 0.21 1.28 0.00 0.00 0.00 175.76 177.13 1it8 n LEU 560 N 0.37 0.00 -4.64 0.00 4.77 -0.62 0.78 117.00 117.66 1it8 n LEU 560 Ca 0.03 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.73 1it8 n LEU 560 Cb 0.48 0.08 -0.11 0.00 -2.33 0.00 0.00 43.42 41.55 1it8 n LEU 560 CO 0.48 0.08 -0.28 -0.76 -1.33 0.00 0.00 177.39 175.58 1it8 s LEU 561 N -4.15 2.85 0.41 2.23 1.43 -1.25 -4.70 118.68 115.49 1it8 s LEU 561 Ca -0.05 -1.38 -0.02 0.00 -1.03 0.00 0.00 54.13 51.65 1it8 s LEU 561 Cb 0.07 -0.92 -0.03 0.00 0.03 0.00 0.00 46.19 45.33 1it8 s LEU 561 CO 0.51 -0.49 0.66 -0.94 0.23 0.00 0.00 176.35 176.32 1it8 s SER 562 N -3.74 6.28 0.17 2.29 1.04 -1.26 -4.04 113.70 114.44 1it8 s SER 562 Ca 0.33 0.68 -0.27 0.00 0.48 0.00 0.00 55.95 57.18 1it8 s SER 562 Cb 0.09 -2.14 0.01 0.00 0.10 0.00 0.00 66.02 64.08 1it8 s SER 562 CO 0.17 -0.43 1.50 0.61 0.98 0.00 0.00 173.24 176.07 1it8 n GLY 563 N -1.99 -2.40 0.24 7.32 0.00 -0.40 -0.77 105.19 107.19 1it8 n GLY 563 Ca -0.02 1.14 -0.03 0.00 0.00 0.00 0.00 46.02 47.10 1it8 n GLY 563 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1it8 h ARG 564 N 0.00 0.64 -0.73 1.61 3.08 -1.80 -2.46 114.38 114.72 1it8 h ARG 564 Ca 0.20 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 1it8 h ARG 564 Cb 0.44 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 1it8 h ARG 564 CO -0.92 0.42 0.43 0.93 -1.07 0.00 0.00 179.97 179.76 1it8 h GLU 565 N 0.66 1.00 -0.87 0.04 5.08 -1.32 -1.75 114.58 117.41 1it8 h GLU 565 Ca 0.26 -0.10 0.24 0.00 -1.00 0.00 0.00 59.36 58.76 1it8 h GLU 565 Cb 0.12 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.12 1it8 h GLU 565 CO -0.15 0.72 0.61 0.52 -1.00 0.00 0.00 179.01 179.71 1it8 h MET 566 N 1.00 0.12 0.03 2.33 2.86 -0.46 0.90 114.93 121.71 1it8 h MET 566 Ca 0.26 -0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.83 1it8 h MET 566 Cb -0.02 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.61 1it8 h MET 566 CO -0.05 0.08 -0.29 0.82 1.06 0.00 0.00 176.91 178.54 1it8 h ILE 567 N 0.13 1.65 -0.27 -1.22 2.04 -1.25 -3.38 117.51 115.20 1it8 h ILE 567 Ca 0.43 -2.37 -0.03 0.00 1.00 0.00 0.00 64.86 63.89 1it8 h ILE 567 Cb 1.50 3.24 -0.01 0.00 -0.74 0.00 0.00 36.82 40.81 1it8 h ILE 567 CO -0.06 0.60 0.06 0.58 0.00 0.00 0.00 178.15 179.33 1it8 h VAL 568 N -0.87 1.22 -3.90 1.67 2.07 -0.91 -3.45 116.25 112.08 1it8 h VAL 568 Ca -0.06 -0.75 -0.55 0.00 0.82 0.00 0.00 66.70 66.15 1it8 h VAL 568 Cb 1.16 1.19 0.14 0.00 -1.52 0.00 0.00 31.29 32.25 1it8 h VAL 568 CO 0.01 0.24 0.58 0.49 0.02 0.00 0.00 177.57 178.91 1it8 n PHE 569 N -4.68 2.28 -0.23 1.57 3.01 0.23 -4.93 117.46 114.71 1it8 n PHE 569 Ca -0.03 0.44 0.00 0.00 1.01 0.00 0.00 57.45 58.88 1it8 n PHE 569 Cb 0.19 -2.38 0.00 0.00 -0.01 0.00 0.00 39.48 37.29 1it8 n PHE 569 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1it8 n GLN 570 N -0.64 1.33 -3.86 -1.08 1.13 -1.26 -3.80 117.38 109.20 1it8 n GLN 570 Ca 0.09 -0.99 -0.11 0.00 -1.94 0.00 0.00 57.00 54.05 1it8 n GLN 570 Cb 0.43 -0.88 -0.10 0.00 0.11 0.00 0.00 30.24 29.80 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 -0.52 0.04 0.00 1.08 1.51 -1.26 -4.26 117.35 113.93 1it8 s TYR 571 Ca 0.00 -0.14 0.00 0.00 -1.01 0.00 0.00 57.07 55.92 1it8 s TYR 571 Cb 0.00 -0.04 0.00 0.00 -0.11 0.00 0.00 41.96 41.81 1it8 s TYR 571 CO 0.00 -0.32 0.00 0.41 -1.11 0.00 0.00 175.55 174.53 1it8 n GLY 572 N 1.31 0.30 3.75 0.71 0.00 -1.26 -4.71 105.19 105.29 1it8 n GLY 572 Ca -0.22 -1.91 -0.36 0.00 0.00 0.00 0.00 46.02 43.53 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 -1.62 4.11 -0.04 1.61 0.52 -1.26 -1.54 118.95 120.72 1it8 s ARG 573 Ca 0.00 -0.01 0.10 0.00 -0.52 0.00 0.00 55.73 55.30 1it8 s ARG 573 Cb 0.00 -3.38 -0.23 0.00 0.52 0.00 0.00 34.95 31.85 1it8 s ARG 573 CO 0.00 0.35 0.66 0.00 0.02 0.00 0.00 175.30 176.33 1it8 h ALA 574 N 6.34 0.71 -3.58 2.13 0.00 -0.87 -3.41 119.26 120.57 1it8 h ALA 574 Ca -0.43 -1.43 -0.28 0.00 0.00 0.00 0.00 54.91 52.76 1it8 h ALA 574 Cb 1.17 0.48 -0.32 0.00 0.00 0.00 0.00 17.79 19.12 1it8 h ALA 574 CO 0.73 1.54 -0.73 0.08 0.00 0.00 0.00 179.25 180.86 1it8 s VAL 575 N -2.60 -0.03 -0.33 0.00 1.01 -0.56 -1.60 120.40 116.29 1it8 s VAL 575 Ca -0.06 0.15 -0.17 0.00 0.00 0.00 0.00 61.98 61.89 1it8 s VAL 575 Cb 0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 36.38 36.38 1it8 s VAL 575 CO 0.82 0.07 0.48 -0.75 0.00 0.00 0.00 175.10 175.72 1it8 s LYS 576 N 0.75 3.70 -0.09 2.72 2.20 0.89 -1.47 119.74 128.44 1it8 s LYS 576 Ca -0.06 -0.12 -0.21 0.00 -0.36 0.00 0.00 55.97 55.21 1it8 s LYS 576 Cb -0.09 -3.78 -0.04 0.00 -1.51 0.00 0.00 37.83 32.41 1it8 s LYS 576 CO -0.02 -0.57 0.61 0.08 -0.36 0.00 0.00 175.35 175.09 1it8 s VAL 577 N 2.31 5.10 -0.11 4.02 1.01 -1.26 0.36 120.40 131.83 1it8 s VAL 577 Ca 0.18 1.24 -0.04 0.00 0.00 0.00 0.00 61.98 63.36 1it8 s VAL 577 Cb -0.16 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 1it8 s VAL 577 CO 0.12 0.28 -0.07 0.03 0.00 0.00 0.00 175.10 175.46 1it8 h ARG 578 N 6.76 0.00 -3.29 2.72 3.08 -1.22 -3.46 114.38 118.98 1it8 h ARG 578 Ca -0.41 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.48 1it8 h ARG 578 Cb 1.19 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 31.00 1it8 h ARG 578 CO 0.75 0.00 -0.46 0.21 -1.07 0.00 0.00 179.97 179.41 1it8 s LYS 579 N -1.81 0.35 0.33 0.04 2.20 -1.09 -5.03 119.74 114.74 1it8 s LYS 579 Ca -0.06 0.05 0.06 0.00 -0.36 0.00 0.00 55.97 55.66 1it8 s LYS 579 Cb 0.01 0.16 -0.01 0.00 -1.51 0.00 0.00 37.83 36.48 1it8 s LYS 579 CO 0.09 -0.07 0.47 0.20 -0.36 0.00 0.00 175.35 175.68 1it8 s GLY 580 N -0.45 1.53 0.43 5.54 0.00 -1.26 -1.18 107.32 111.93 1it8 s GLY 580 Ca -0.05 -1.38 0.17 0.00 0.00 0.00 0.00 44.72 43.46 1it8 s GLY 580 CO 0.01 -1.30 1.93 -2.08 0.00 0.00 0.00 173.10 171.66 1it8 h VAL 581 N 0.89 1.04 -0.01 1.40 2.07 -1.24 -3.47 116.25 116.93 1it8 h VAL 581 Ca -0.47 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.15 1it8 h VAL 581 Cb 1.25 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.53 1it8 h VAL 581 CO 0.55 0.25 0.00 -0.62 0.02 0.00 0.00 177.57 177.76