#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ea9 n PHE 2 N 0.00 -2.12 0.91 1.12 3.01 -1.26 -4.89 117.46 114.24 1ea9 n PHE 2 Ca 0.00 0.91 0.12 0.00 1.01 0.00 0.00 57.45 59.49 1ea9 n PHE 2 Cb 0.00 -4.83 0.31 0.00 -0.01 0.00 0.00 39.48 34.94 1ea9 n PHE 2 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1ea9 n LEU 3 N -4.21 0.45 0.33 4.37 4.32 -1.26 -3.59 117.00 117.40 1ea9 n LEU 3 Ca -0.28 0.15 0.21 0.00 -0.02 0.00 0.00 56.01 56.07 1ea9 n LEU 3 Cb 0.67 -0.29 1.14 0.00 -1.62 0.00 0.00 43.42 43.32 1ea9 n LEU 3 CO 0.64 0.06 1.18 -0.33 -1.22 0.00 0.00 177.39 177.72 1ea9 h GLU 4 N 0.00 0.00 -0.02 3.23 5.08 -2.02 0.59 114.58 121.44 1ea9 h GLU 4 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ea9 h GLU 4 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1ea9 h GLU 4 CO 0.00 0.00 -0.10 0.00 -1.00 0.00 0.00 179.01 177.91 1ea9 n ALA 5 N -2.07 2.75 -2.66 3.43 0.00 -1.24 -4.87 120.51 115.85 1ea9 n ALA 5 Ca -0.03 -0.51 -0.40 0.00 0.00 0.00 0.00 53.44 52.50 1ea9 n ALA 5 Cb 0.12 -1.05 -0.04 0.00 0.00 0.00 0.00 19.45 18.48 1ea9 n ALA 5 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ea9 s VAL 6 N -2.15 4.95 0.02 0.00 1.01 0.21 -4.01 120.40 120.43 1ea9 s VAL 6 Ca 0.31 1.61 -0.04 0.00 0.00 0.00 0.00 61.98 63.86 1ea9 s VAL 6 Cb 0.20 -4.11 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 1ea9 s VAL 6 CO 0.39 0.25 0.05 -0.47 0.00 0.00 0.00 175.10 175.32 1ea9 s TYR 7 N 0.68 0.20 -0.30 5.22 5.04 -1.23 -4.96 117.35 122.01 1ea9 s TYR 7 Ca 0.41 -0.43 -0.15 0.00 -2.44 0.00 0.00 57.07 54.45 1ea9 s TYR 7 Cb -0.19 -0.15 0.18 0.00 0.35 0.00 0.00 41.96 42.15 1ea9 s TYR 7 CO 0.21 -0.27 1.15 -1.58 -1.34 0.00 0.00 175.55 173.72 1ea9 s HIS 8 N -1.83 -0.17 -0.21 4.97 5.65 -1.26 -1.57 115.29 120.88 1ea9 s HIS 8 Ca -0.12 0.10 -0.01 0.00 0.25 0.00 0.00 55.06 55.28 1ea9 s HIS 8 Cb -0.06 0.03 0.01 0.00 -1.18 0.00 0.00 32.58 31.38 1ea9 s HIS 8 CO -0.01 -0.10 -0.12 0.50 -0.65 0.00 0.00 174.74 174.36 1ea9 s ARG 9 N 2.98 3.09 0.13 2.88 6.06 -1.26 -5.07 118.95 127.77 1ea9 s ARG 9 Ca 0.31 -0.79 -0.09 0.00 -2.50 0.00 0.00 55.73 52.67 1ea9 s ARG 9 Cb -0.00 -2.80 -0.06 0.00 0.06 0.00 0.00 34.95 32.15 1ea9 s ARG 9 CO -0.22 -0.24 0.08 -2.30 -2.50 0.00 0.00 175.30 170.12 1ea9 n PRO 10 N 4.69 0.00 0.00 5.12 -0.02 -1.26 -4.49 135.00 139.04 1ea9 n PRO 10 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 1ea9 n PRO 10 Cb 0.50 -0.38 0.00 0.00 -0.02 0.00 0.00 33.50 33.60 1ea9 n PRO 10 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ea9 n ARG 11 N 0.47 0.00 0.00 -0.52 5.12 0.25 -4.74 116.66 117.24 1ea9 n ARG 11 Ca 0.05 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 1ea9 n ARG 11 Cb 0.13 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.43 1ea9 n ARG 11 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1ea9 n LYS 12 N 0.00 0.00 -0.00 5.56 5.02 -1.26 -1.12 118.16 126.36 1ea9 n LYS 12 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 1ea9 n LYS 12 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 1ea9 n LYS 12 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1ea9 n ASN 13 N 8.16 0.67 -0.06 4.39 6.94 -1.26 -4.37 115.26 129.73 1ea9 n ASN 13 Ca 0.00 -0.66 -0.06 0.00 -0.02 0.00 0.00 54.58 53.84 1ea9 n ASN 13 Cb 0.00 1.04 -0.05 0.00 -2.36 0.00 0.00 39.78 38.42 1ea9 n ASN 13 CO 0.00 0.00 0.00 -0.26 -1.03 0.00 0.00 177.26 175.97 1ea9 h PHE 14 N 0.00 0.00 -2.86 -2.53 0.04 -1.33 -3.39 116.94 106.88 1ea9 h PHE 14 Ca 0.00 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.19 1ea9 h PHE 14 Cb 0.25 0.00 -0.40 0.00 2.20 0.00 0.00 35.95 38.00 1ea9 h PHE 14 CO 0.00 0.39 -0.79 -1.12 -0.60 0.00 0.00 178.31 176.19 1ea9 s SER 15 N -5.83 3.50 0.43 2.17 0.01 -0.93 0.80 113.70 113.86 1ea9 s SER 15 Ca -0.08 -1.97 0.03 0.00 1.31 0.00 0.00 55.95 55.24 1ea9 s SER 15 Cb -0.01 -0.65 -0.03 0.00 0.21 0.00 0.00 66.02 65.54 1ea9 s SER 15 CO 0.26 -0.35 0.06 -0.72 0.41 0.00 0.00 173.24 172.90 1ea9 s TYR 16 N 1.25 1.94 -0.38 2.43 -0.85 -0.95 -0.58 117.35 120.21 1ea9 s TYR 16 Ca 0.14 -1.03 -0.11 0.00 -0.52 0.00 0.00 57.07 55.55 1ea9 s TYR 16 Cb -0.21 -1.43 0.04 0.00 0.38 0.00 0.00 41.96 40.74 1ea9 s TYR 16 CO -0.13 0.04 0.21 0.00 -1.52 0.00 0.00 175.55 174.16 1ea9 s ALA 17 N -3.03 3.27 0.04 9.51 0.00 -1.26 0.35 121.76 130.64 1ea9 s ALA 17 Ca 0.21 -1.80 -0.27 0.00 0.00 0.00 0.00 51.96 50.10 1ea9 s ALA 17 Cb 0.04 -2.60 -0.15 0.00 0.00 0.00 0.00 23.12 20.41 1ea9 s ALA 17 CO 0.11 -1.44 1.32 -0.92 0.00 0.00 0.00 175.76 174.83 1ea9 h TYR 18 N 8.43 -0.90 -3.89 0.00 -0.00 -1.20 -3.36 116.97 116.05 1ea9 h TYR 18 Ca -0.25 -0.02 -0.29 0.00 -0.00 0.00 0.00 58.73 58.17 1ea9 h TYR 18 Cb 1.10 0.30 -0.07 0.00 -0.00 0.00 0.00 36.73 38.06 1ea9 h TYR 18 CO 0.58 -0.56 -0.25 0.27 -0.00 0.00 0.00 178.16 178.20 1ea9 n ASN 19 N -4.81 0.80 -2.21 -2.11 2.04 -1.12 -4.65 115.26 103.21 1ea9 n ASN 19 Ca -0.12 -2.16 -0.10 0.00 -0.44 0.00 0.00 54.58 51.76 1ea9 n ASN 19 Cb 0.38 0.62 -0.12 0.00 -2.53 0.00 0.00 39.78 38.14 1ea9 n ASN 19 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1ea9 n GLY 20 N 0.46 2.53 0.00 4.83 0.00 -1.26 -2.74 105.19 109.01 1ea9 n GLY 20 Ca -0.02 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1ea9 n GLY 20 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ea9 n THR 21 N 2.72 0.00 -3.66 2.61 5.66 -1.26 -5.04 114.28 115.32 1ea9 n THR 21 Ca 0.33 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 61.23 1ea9 n THR 21 Cb 0.64 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.31 1ea9 n THR 21 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1ea9 s THR 22 N 0.00 -0.59 0.01 1.09 2.01 -1.11 -4.46 115.64 112.59 1ea9 s THR 22 Ca 0.00 0.20 -0.01 0.00 0.31 0.00 0.00 61.69 62.19 1ea9 s THR 22 Cb 0.00 -0.61 -0.04 0.00 0.01 0.00 0.00 72.50 71.86 1ea9 s THR 22 CO 0.00 0.08 0.14 -0.69 -0.69 0.00 0.00 174.62 173.46 1ea9 s VAL 23 N 2.57 5.09 0.13 3.82 1.01 -0.17 -0.62 120.40 132.22 1ea9 s VAL 23 Ca -0.01 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.69 1ea9 s VAL 23 Cb -0.12 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 1ea9 s VAL 23 CO -0.12 0.30 0.06 -1.00 0.00 0.00 0.00 175.10 174.34 1ea9 s HIS 24 N -1.30 3.06 -0.01 5.22 3.76 0.16 -1.50 115.29 124.67 1ea9 s HIS 24 Ca 0.27 -0.02 0.03 0.00 -0.15 0.00 0.00 55.06 55.19 1ea9 s HIS 24 Cb -0.12 -1.52 -0.01 0.00 1.11 0.00 0.00 32.58 32.04 1ea9 s HIS 24 CO 0.18 0.51 -0.10 -0.51 -0.85 0.00 0.00 174.74 173.97 1ea9 s LEU 25 N -2.69 2.02 -0.21 0.89 2.01 0.65 -2.23 118.68 119.11 1ea9 s LEU 25 Ca 0.28 -0.18 -0.04 0.00 0.01 0.00 0.00 54.13 54.21 1ea9 s LEU 25 Cb -0.11 -0.51 0.11 0.00 0.01 0.00 0.00 46.19 45.69 1ea9 s LEU 25 CO 0.21 0.12 0.32 -0.13 1.01 0.00 0.00 176.35 177.88 1ea9 s ARG 26 N -0.22 0.27 -0.06 1.70 0.52 0.24 0.62 118.95 122.02 1ea9 s ARG 26 Ca 0.04 0.51 0.03 0.00 -0.52 0.00 0.00 55.73 55.79 1ea9 s ARG 26 Cb -0.04 -0.56 -0.02 0.00 0.52 0.00 0.00 34.95 34.85 1ea9 s ARG 26 CO -0.00 -0.56 -0.15 -1.50 0.02 0.00 0.00 175.30 173.11 1ea9 s ILE 27 N 2.47 3.00 0.55 1.52 2.07 -1.07 -4.41 121.20 125.33 1ea9 s ILE 27 Ca 0.08 -0.74 -0.12 0.00 -1.41 0.00 0.00 60.65 58.46 1ea9 s ILE 27 Cb -0.15 -2.18 -0.05 0.00 0.13 0.00 0.00 42.46 40.21 1ea9 s ILE 27 CO -0.13 0.58 0.97 -0.60 -1.91 0.00 0.00 174.94 173.84 1ea9 s ARG 28 N -0.55 3.72 0.00 3.50 3.52 -0.61 -1.04 118.95 127.49 1ea9 s ARG 28 Ca 0.08 0.73 -0.28 0.00 -0.13 0.00 0.00 55.73 56.12 1ea9 s ARG 28 Cb -0.11 -2.16 0.08 0.00 -1.56 0.00 0.00 34.95 31.20 1ea9 s ARG 28 CO 0.01 -0.39 0.71 0.95 -0.81 0.00 0.00 175.30 175.77 1ea9 s THR 29 N -2.89 0.00 0.21 4.11 -4.23 -1.26 -3.50 115.64 108.09 1ea9 s THR 29 Ca 0.55 0.00 -0.31 0.00 -1.18 0.00 0.00 61.69 60.75 1ea9 s THR 29 Cb -0.11 -1.00 -0.10 0.00 1.34 0.00 0.00 72.50 72.63 1ea9 s THR 29 CO 0.44 0.00 1.51 -0.75 -0.54 0.00 0.00 174.62 175.28 1ea9 s LYS 30 N -2.04 4.23 0.00 3.99 2.20 -1.26 -0.26 119.74 126.60 1ea9 s LYS 30 Ca -0.05 2.35 0.00 0.00 -0.36 0.00 0.00 55.97 57.91 1ea9 s LYS 30 Cb -0.00 -3.12 0.00 0.00 -1.51 0.00 0.00 37.83 33.19 1ea9 s LYS 30 CO 0.01 -0.52 0.00 1.63 -0.36 0.00 0.00 175.35 176.11 1ea9 n LYS 31 N 3.08 0.00 -2.58 4.03 5.02 0.69 0.53 118.16 128.93 1ea9 n LYS 31 Ca 0.10 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.29 1ea9 n LYS 31 Cb 0.39 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.44 1ea9 n LYS 31 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1ea9 n ASP 32 N 0.00 2.62 -0.35 4.39 8.00 -1.26 -4.44 116.55 125.52 1ea9 n ASP 32 Ca 0.00 -2.70 0.14 0.00 0.71 0.00 0.00 54.79 52.93 1ea9 n ASP 32 Cb 0.00 -0.45 0.60 0.00 -0.02 0.00 0.00 41.12 41.25 1ea9 n ASP 32 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1ea9 n ASP 33 N -0.52 1.07 -4.09 -2.24 2.03 0.19 -4.92 116.55 108.06 1ea9 n ASP 33 Ca 0.19 -1.41 -0.18 0.00 0.52 0.00 0.00 54.79 53.91 1ea9 n ASP 33 Cb 0.83 -0.02 -0.09 0.00 -0.72 0.00 0.00 41.12 41.12 1ea9 n ASP 33 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1ea9 s MET 34 N -1.97 1.52 -0.05 -0.67 -1.94 -1.26 -4.65 119.30 110.28 1ea9 s MET 34 Ca 0.39 -1.86 0.02 0.00 -1.71 0.00 0.00 55.69 52.53 1ea9 s MET 34 Cb 0.20 -0.13 -0.04 0.00 2.01 0.00 0.00 34.83 36.87 1ea9 s MET 34 CO 0.32 -0.40 -0.03 2.41 -0.01 0.00 0.00 175.02 177.31 1ea9 n THR 35 N -0.54 0.33 -3.64 2.05 -1.04 0.14 -4.94 114.28 106.64 1ea9 n THR 35 Ca 0.01 -0.15 -0.04 0.00 -2.04 0.00 0.00 64.05 61.82 1ea9 n THR 35 Cb 0.65 -0.76 -0.07 0.00 -1.82 0.00 0.00 70.33 68.33 1ea9 n THR 35 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ea9 s ALA 36 N -2.12 -2.21 -0.15 2.41 0.00 -1.25 -5.04 121.76 113.41 1ea9 s ALA 36 Ca -0.06 1.95 -0.02 0.00 0.00 0.00 0.00 51.96 53.82 1ea9 s ALA 36 Cb 0.02 -1.66 -0.02 0.00 0.00 0.00 0.00 23.12 21.45 1ea9 s ALA 36 CO 0.15 -0.25 -0.08 0.14 0.00 0.00 0.00 175.76 175.72 1ea9 s VAL 37 N 0.62 3.47 0.02 0.00 -7.23 -1.26 -3.40 120.40 112.61 1ea9 s VAL 37 Ca -0.01 -0.51 0.08 0.00 -1.81 0.00 0.00 61.98 59.73 1ea9 s VAL 37 Cb -0.04 -2.50 -0.02 0.00 0.56 0.00 0.00 36.38 34.38 1ea9 s VAL 37 CO -0.11 0.50 -0.23 -0.31 -0.31 0.00 0.00 175.10 174.64 1ea9 s TYR 38 N 0.44 2.02 0.17 2.82 4.12 -1.26 -2.23 117.35 123.43 1ea9 s TYR 38 Ca -0.06 -0.39 0.05 0.00 0.02 0.00 0.00 57.07 56.69 1ea9 s TYR 38 Cb -0.15 -1.25 -0.04 0.00 -1.52 0.00 0.00 41.96 39.01 1ea9 s TYR 38 CO 0.04 0.04 0.18 0.00 0.02 0.00 0.00 175.55 175.83 1ea9 s ALA 39 N -0.68 3.67 -0.59 3.71 0.00 -0.10 0.10 121.76 127.88 1ea9 s ALA 39 Ca 0.09 -1.20 -0.10 0.00 0.00 0.00 0.00 51.96 50.75 1ea9 s ALA 39 Cb -0.09 -1.46 0.15 0.00 0.00 0.00 0.00 23.12 21.72 1ea9 s ALA 39 CO 0.01 0.47 0.47 -0.51 0.00 0.00 0.00 175.76 176.20 1ea9 s LEU 40 N -3.25 5.91 -0.40 0.00 1.43 0.29 0.16 118.68 122.82 1ea9 s LEU 40 Ca 0.32 -2.25 -0.18 0.00 -1.03 0.00 0.00 54.13 50.99 1ea9 s LEU 40 Cb -0.10 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.08 1ea9 s LEU 40 CO 0.25 -0.63 0.49 0.00 0.23 0.00 0.00 176.35 176.69 1ea9 s ALA 41 N 0.86 3.43 -0.01 4.21 0.00 0.11 -3.21 121.76 127.16 1ea9 s ALA 41 Ca 0.10 -1.31 -0.17 0.00 0.00 0.00 0.00 51.96 50.59 1ea9 s ALA 41 Cb -0.22 -3.07 0.03 0.00 0.00 0.00 0.00 23.12 19.86 1ea9 s ALA 41 CO -0.03 -1.49 0.36 0.20 0.00 0.00 0.00 175.76 174.81 1ea9 s GLY 42 N 1.83 -0.21 -0.53 0.00 0.00 -1.16 -2.06 107.32 105.19 1ea9 s GLY 42 Ca 0.16 0.41 -0.28 0.00 0.00 0.00 0.00 44.72 45.00 1ea9 s GLY 42 CO 0.14 0.18 1.22 -0.35 0.00 0.00 0.00 173.10 174.30 1ea9 s ASP 43 N -1.41 6.45 0.00 1.64 3.68 -1.26 -1.68 116.67 124.10 1ea9 s ASP 43 Ca -0.12 0.30 0.00 0.00 2.13 0.00 0.00 52.55 54.85 1ea9 s ASP 43 Cb -0.04 -2.55 0.00 0.00 -1.45 0.00 0.00 42.92 38.88 1ea9 s ASP 43 CO 0.04 -1.44 0.53 2.29 0.13 0.00 0.00 175.17 176.72 1ea9 n LYS 44 N 8.27 0.00 -0.31 4.34 -0.00 -1.26 0.16 118.16 129.35 1ea9 n LYS 44 Ca 0.11 0.14 0.10 0.00 -0.00 0.00 0.00 58.31 58.66 1ea9 n LYS 44 Cb 0.49 -1.62 0.27 0.00 -0.00 0.00 0.00 35.03 34.17 1ea9 n LYS 44 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1ea9 n TYR 45 N -1.03 0.82 0.00 5.58 4.01 -1.26 -4.46 117.16 120.81 1ea9 n TYR 45 Ca 0.00 -0.50 0.00 0.00 -0.16 0.00 0.00 57.90 57.24 1ea9 n TYR 45 Cb 0.12 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 1ea9 n TYR 45 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ea9 n MET 46 N 1.27 0.00 0.00 -0.72 0.00 0.43 -5.12 117.12 112.98 1ea9 n MET 46 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.90 1ea9 n MET 46 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.78 1ea9 n MET 46 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 175.97 177.84 1ea9 n TRP 47 N 0.00 0.00 0.00 3.17 -0.00 0.12 -3.25 117.44 117.48 1ea9 n TRP 47 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1ea9 n TRP 47 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.31 1ea9 n TRP 47 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 177.69 177.44 1ea9 n ASP 48 N 0.00 0.00 0.00 5.87 8.00 -1.26 0.19 116.55 129.35 1ea9 n ASP 48 Ca 0.00 0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.65 1ea9 n ASP 48 Cb 0.00 -0.06 0.02 0.00 -0.02 0.00 0.00 41.12 41.05 1ea9 n ASP 48 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38 1ea9 n HIS 49 N -1.65 0.00 0.00 1.24 -0.00 -1.22 -1.71 115.22 111.88 1ea9 n HIS 49 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1ea9 n HIS 49 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1ea9 n HIS 49 CO 0.00 0.00 0.00 2.41 0.46 0.00 0.00 176.34 179.21 1ea9 n THR 50 N -0.55 0.00 -1.49 3.57 -1.04 0.51 -5.03 114.28 110.25 1ea9 n THR 50 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.58 1ea9 n THR 50 Cb 0.00 -0.45 -0.00 0.00 -1.82 0.00 0.00 70.33 68.06 1ea9 n THR 50 CO 0.00 0.00 0.00 1.15 -0.64 0.00 0.00 175.07 175.58 1ea9 n MET 51 N -2.28 0.71 -3.59 -2.82 3.85 0.30 -4.23 117.12 109.06 1ea9 n MET 51 Ca 0.00 0.25 -0.09 0.00 -1.00 0.00 0.00 57.70 56.86 1ea9 n MET 51 Cb 0.36 -1.53 -0.05 0.00 -1.05 0.00 0.00 33.22 30.94 1ea9 n MET 51 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 1ea9 s GLU 52 N -1.49 0.52 -0.54 3.17 -1.05 -0.87 -4.89 118.70 113.55 1ea9 s GLU 52 Ca 0.62 0.17 -0.23 0.00 -0.15 0.00 0.00 54.97 55.38 1ea9 s GLU 52 Cb -0.68 0.25 0.05 0.00 -0.44 0.00 0.00 34.13 33.30 1ea9 s GLU 52 CO 0.58 -0.15 0.87 0.71 0.95 0.00 0.00 175.26 178.22 1ea9 s TYR 53 N -0.97 2.85 -0.18 4.83 1.51 -1.25 -0.71 117.35 123.43 1ea9 s TYR 53 Ca -0.00 -0.14 -0.24 0.00 -1.01 0.00 0.00 57.07 55.67 1ea9 s TYR 53 Cb -0.01 -3.96 -0.02 0.00 -0.11 0.00 0.00 41.96 37.87 1ea9 s TYR 53 CO -0.00 -1.29 0.79 0.08 -1.11 0.00 0.00 175.55 174.02 1ea9 s VAL 54 N 3.65 4.91 0.55 0.71 1.01 0.43 -4.81 120.40 126.85 1ea9 s VAL 54 Ca 0.27 1.53 -0.20 0.00 0.00 0.00 0.00 61.98 63.58 1ea9 s VAL 54 Cb -0.14 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1ea9 s VAL 54 CO 0.17 0.04 1.19 -2.84 0.00 0.00 0.00 175.10 173.65 1ea9 s PRO 55 N 2.16 3.27 0.09 2.72 0.02 -1.26 -0.92 135.00 141.08 1ea9 s PRO 55 Ca 0.36 1.78 0.07 0.00 0.02 0.00 0.00 61.00 63.22 1ea9 s PRO 55 Cb -0.16 -2.07 -0.03 0.00 0.02 0.00 0.00 34.50 32.25 1ea9 s PRO 55 CO 0.11 -0.96 -0.17 -1.64 -0.33 0.00 0.00 177.00 174.02 1ea9 s MET 56 N -3.16 0.99 -0.35 5.54 -1.94 -0.95 -4.70 119.30 114.73 1ea9 s MET 56 Ca 0.73 -1.09 -0.01 0.00 -1.71 0.00 0.00 55.69 53.60 1ea9 s MET 56 Cb -0.29 -1.09 0.08 0.00 2.01 0.00 0.00 34.83 35.55 1ea9 s MET 56 CO 0.32 0.24 0.08 0.99 -0.01 0.00 0.00 175.02 176.65 1ea9 s THR 57 N -1.36 2.97 -0.33 2.05 2.01 0.73 -4.64 115.64 117.07 1ea9 s THR 57 Ca 0.03 -1.80 -0.38 0.00 0.31 0.00 0.00 61.69 59.85 1ea9 s THR 57 Cb -0.09 -2.91 -0.14 0.00 0.01 0.00 0.00 72.50 69.37 1ea9 s THR 57 CO 0.03 -0.41 1.99 2.29 -0.69 0.00 0.00 174.62 177.83 1ea9 n LYS 58 N 4.55 1.01 0.00 4.92 2.85 -1.26 -0.43 118.16 129.80 1ea9 n LYS 58 Ca -0.06 0.33 0.00 0.00 -1.05 0.00 0.00 58.31 57.52 1ea9 n LYS 58 Cb 0.42 -2.19 0.00 0.00 -0.65 0.00 0.00 35.03 32.61 1ea9 n LYS 58 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 1ea9 n LEU 59 N 7.55 0.41 0.00 -5.58 7.94 0.29 -4.75 117.00 122.86 1ea9 n LEU 59 Ca 0.36 0.60 0.00 0.00 -1.11 0.00 0.00 56.01 55.86 1ea9 n LEU 59 Cb 0.15 -0.22 0.00 0.00 0.53 0.00 0.00 43.42 43.88 1ea9 n LEU 59 CO 0.80 -0.22 0.00 0.00 -1.11 0.00 0.00 177.39 176.85 1ea9 n ALA 60 N -1.17 0.00 -3.51 1.96 0.00 -1.22 -5.03 120.51 111.54 1ea9 n ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ea9 n ALA 60 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1ea9 n ALA 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ea9 s THR 61 N 1.11 -0.24 0.00 0.00 2.01 -1.26 -4.32 115.64 112.94 1ea9 s THR 61 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1ea9 s THR 61 Cb 0.00 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1ea9 s THR 61 CO 0.00 0.00 0.00 -0.90 -0.69 0.00 0.00 174.62 173.03 1ea9 n ASP 62 N 4.29 0.03 0.19 3.53 3.85 -1.22 -4.08 116.55 123.15 1ea9 n ASP 62 Ca -0.13 0.00 0.05 0.00 -0.71 0.00 0.00 54.79 54.00 1ea9 n ASP 62 Cb 0.55 0.00 0.52 0.00 -1.35 0.00 0.00 41.12 40.84 1ea9 n ASP 62 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1ea9 h GLU 63 N 0.00 0.10 0.00 0.11 4.81 -1.94 -3.36 114.58 114.30 1ea9 h GLU 63 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1ea9 h GLU 63 Cb 0.00 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.36 1ea9 h GLU 63 CO 0.00 0.18 0.00 1.47 -0.73 0.00 0.00 179.01 179.93 1ea9 n LEU 64 N -4.40 0.00 -4.70 1.64 -0.00 -1.26 -4.99 117.00 103.30 1ea9 n LEU 64 Ca -0.02 -0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.70 1ea9 n LEU 64 Cb 0.18 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.51 1ea9 n LEU 64 CO 0.36 0.00 -0.24 -0.36 -0.00 0.00 0.00 177.39 177.15 1ea9 s PHE 65 N 0.00 2.30 -0.08 1.47 0.08 -1.26 -0.22 117.98 120.26 1ea9 s PHE 65 Ca 0.00 -0.75 -0.03 0.00 0.12 0.00 0.00 56.93 56.28 1ea9 s PHE 65 Cb 0.00 -1.77 -0.04 0.00 -0.57 0.00 0.00 43.02 40.64 1ea9 s PHE 65 CO 0.00 0.29 -0.10 -0.25 -0.10 0.00 0.00 175.22 175.06 1ea9 n ASP 66 N -1.14 1.48 -2.49 1.36 10.43 0.65 -3.37 116.55 123.45 1ea9 n ASP 66 Ca -0.08 0.06 -0.05 0.00 2.57 0.00 0.00 54.79 57.28 1ea9 n ASP 66 Cb 0.66 -0.21 -0.04 0.00 1.84 0.00 0.00 41.12 43.37 1ea9 n ASP 66 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1ea9 n TYR 67 N -3.18 -4.10 -3.60 1.24 4.01 -1.26 -3.40 117.16 106.87 1ea9 n TYR 67 Ca -0.16 2.37 -0.36 0.00 -0.16 0.00 0.00 57.90 59.58 1ea9 n TYR 67 Cb 0.63 -3.73 -0.08 0.00 -0.31 0.00 0.00 39.34 35.85 1ea9 n TYR 67 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1ea9 s TRP 68 N -0.64 3.38 0.20 -0.72 0.51 -0.21 0.10 118.94 121.56 1ea9 s TRP 68 Ca -0.26 0.40 -0.28 0.00 -2.12 0.00 0.00 56.10 53.84 1ea9 s TRP 68 Cb 0.02 -2.31 -0.08 0.00 -0.81 0.00 0.00 33.47 30.28 1ea9 s TRP 68 CO 0.73 0.14 0.87 -2.00 -0.51 0.00 0.00 176.95 176.17 1ea9 s GLU 69 N 0.83 4.73 -0.14 4.98 -6.30 0.43 -2.61 118.70 120.61 1ea9 s GLU 69 Ca 0.12 1.34 -0.07 0.00 -2.50 0.00 0.00 54.97 53.86 1ea9 s GLU 69 Cb -0.13 -3.28 0.06 0.00 0.00 0.00 0.00 34.13 30.78 1ea9 s GLU 69 CO 0.04 0.53 0.32 0.00 0.02 0.00 0.00 175.26 176.17 1ea9 s GLU 71 N 1.61 1.69 -0.27 0.00 2.12 -1.26 0.24 118.70 122.83 1ea9 s GLU 71 Ca -0.07 -1.40 -0.16 0.00 0.36 0.00 0.00 54.97 53.69 1ea9 s GLU 71 Cb -0.10 -1.97 0.08 0.00 0.26 0.00 0.00 34.13 32.40 1ea9 s GLU 71 CO -0.10 0.42 0.66 0.54 -0.54 0.00 0.00 175.26 176.24 1ea9 s VAL 72 N -1.58 -0.00 -0.70 3.70 0.11 -0.56 -4.94 120.40 116.42 1ea9 s VAL 72 Ca 0.21 0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.31 1ea9 s VAL 72 Cb -0.09 -0.96 0.31 0.00 -1.53 0.00 0.00 36.38 34.11 1ea9 s VAL 72 CO 0.11 0.00 1.05 0.35 -3.33 0.00 0.00 175.10 173.29 1ea9 n THR 73 N 4.12 3.48 -1.65 5.04 -2.24 -1.26 -1.00 114.28 120.76 1ea9 n THR 73 Ca -0.20 -5.56 -0.44 0.00 -2.27 0.00 0.00 64.05 55.58 1ea9 n THR 73 Cb 0.58 -1.69 -0.01 0.00 -2.10 0.00 0.00 70.33 67.11 1ea9 n THR 73 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1ea9 n PRO 74 N 0.24 1.83 -1.49 -0.78 -0.04 -1.26 -4.98 135.00 128.52 1ea9 n PRO 74 Ca 0.32 0.64 -0.29 0.00 -0.04 0.00 0.00 63.50 64.14 1ea9 n PRO 74 Cb 0.37 -2.17 0.16 0.00 -0.04 0.00 0.00 33.50 31.83 1ea9 n PRO 74 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1ea9 s PRO 75 N -1.49 0.70 -0.92 0.54 0.02 -1.26 -3.21 135.00 129.38 1ea9 s PRO 75 Ca 0.59 0.17 0.00 0.00 0.02 0.00 0.00 61.00 61.79 1ea9 s PRO 75 Cb -0.63 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.09 1ea9 s PRO 75 CO 0.59 -2.47 0.00 0.66 -0.33 0.00 0.00 177.00 175.45 1ea9 n TYR 76 N -3.94 -0.08 -1.13 6.54 4.01 -1.26 -2.60 117.16 118.71 1ea9 n TYR 76 Ca 0.08 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.74 1ea9 n TYR 76 Cb 0.59 -2.43 -0.04 0.00 -0.31 0.00 0.00 39.34 37.16 1ea9 n TYR 76 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1ea9 n ARG 77 N -0.63 -1.67 -3.77 -0.72 3.00 -1.20 -4.94 116.66 106.74 1ea9 n ARG 77 Ca -0.09 0.68 -0.12 0.00 -0.01 0.00 0.00 57.85 58.32 1ea9 n ARG 77 Cb 0.50 -4.86 -0.08 0.00 0.00 0.00 0.00 32.46 28.03 1ea9 n ARG 77 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 1ea9 s ARG 78 N -2.49 0.77 -0.16 5.56 3.03 -1.07 -1.83 118.95 122.77 1ea9 s ARG 78 Ca 0.00 -0.48 -0.29 0.00 2.03 0.00 0.00 55.73 56.99 1ea9 s ARG 78 Cb 0.00 0.33 0.10 0.00 -1.03 0.00 0.00 34.95 34.35 1ea9 s ARG 78 CO 0.00 -0.24 0.86 0.54 -1.13 0.00 0.00 175.30 175.33 1ea9 s VAL 79 N -2.39 0.00 0.32 4.99 0.11 -1.24 -4.56 120.40 117.62 1ea9 s VAL 79 Ca -0.06 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.05 1ea9 s VAL 79 Cb -0.01 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.82 1ea9 s VAL 79 CO -0.02 0.00 0.39 -0.75 -3.33 0.00 0.00 175.10 171.39 1ea9 s LYS 80 N -0.75 3.05 0.01 1.54 2.47 -0.67 -1.67 119.74 123.72 1ea9 s LYS 80 Ca -0.04 -1.05 -0.28 0.00 -1.56 0.00 0.00 55.97 53.04 1ea9 s LYS 80 Cb -0.02 -2.73 0.10 0.00 -1.46 0.00 0.00 37.83 33.73 1ea9 s LYS 80 CO 0.03 0.14 0.87 1.52 0.16 0.00 0.00 175.35 178.07 1ea9 s TYR 81 N -2.18 -0.35 0.34 4.03 1.13 -1.11 -2.99 117.35 116.22 1ea9 s TYR 81 Ca 0.42 0.21 -0.01 0.00 -1.41 0.00 0.00 57.07 56.27 1ea9 s TYR 81 Cb -0.08 0.54 -0.00 0.00 -1.10 0.00 0.00 41.96 41.32 1ea9 s TYR 81 CO 0.29 -0.58 0.45 0.20 -2.51 0.00 0.00 175.55 173.41 1ea9 s GLY 82 N -2.52 1.58 0.07 5.49 0.00 -1.20 -1.43 107.32 109.32 1ea9 s GLY 82 Ca 0.05 -1.58 0.06 0.00 0.00 0.00 0.00 44.72 43.25 1ea9 s GLY 82 CO -0.09 -1.05 -0.15 -1.36 0.00 0.00 0.00 173.10 170.45 1ea9 s PHE 83 N -3.10 1.32 -0.23 1.90 0.08 -1.12 0.10 117.98 116.93 1ea9 s PHE 83 Ca 0.32 -0.44 0.05 0.00 0.12 0.00 0.00 56.93 56.97 1ea9 s PHE 83 Cb -0.00 -0.74 -0.20 0.00 -0.57 0.00 0.00 43.02 41.51 1ea9 s PHE 83 CO 0.21 0.08 -0.08 -0.11 -0.10 0.00 0.00 175.22 175.22 1ea9 n LEU 84 N 1.31 2.22 -1.42 -0.37 0.00 0.28 -0.60 117.00 118.42 1ea9 n LEU 84 Ca -0.21 -0.06 0.19 0.00 0.00 0.00 0.00 56.01 55.93 1ea9 n LEU 84 Cb 0.54 -0.58 -0.05 0.00 0.00 0.00 0.00 43.42 43.33 1ea9 n LEU 84 CO 0.22 0.82 -0.29 0.18 0.00 0.00 0.00 177.39 178.32 1ea9 n LEU 85 N -3.16 -0.72 0.00 -1.96 4.32 -1.26 -4.15 117.00 110.07 1ea9 n LEU 85 Ca -0.41 1.59 0.00 0.00 -0.02 0.00 0.00 56.01 57.17 1ea9 n LEU 85 Cb 1.03 -4.34 0.00 0.00 -1.62 0.00 0.00 43.42 38.49 1ea9 n LEU 85 CO 0.32 -3.71 0.00 1.67 -1.22 0.00 0.00 177.39 174.45 1ea9 n GLN 86 N -4.17 0.00 -3.89 3.23 7.27 -1.22 -4.69 117.38 113.91 1ea9 n GLN 86 Ca 0.00 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.79 1ea9 n GLN 86 Cb 0.67 0.00 -0.13 0.00 2.41 0.00 0.00 30.24 33.19 1ea9 n GLN 86 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 1ea9 s GLN 87 N -0.65 2.22 0.00 3.69 0.74 -0.02 0.24 119.66 125.88 1ea9 s GLN 87 Ca 0.00 -3.03 0.00 0.00 0.05 0.00 0.00 55.36 52.38 1ea9 s GLN 87 Cb 0.00 -3.29 0.00 0.00 1.10 0.00 0.00 33.01 30.82 1ea9 s GLN 87 CO 0.00 -1.23 0.00 0.41 -0.55 0.00 0.00 175.29 173.92 1ea9 n GLY 88 N 2.41 1.20 0.02 2.59 0.00 -1.26 -3.49 105.19 106.66 1ea9 n GLY 88 Ca 0.15 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.62 1ea9 n GLY 88 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ea9 n HIS 89 N 0.00 0.00 -1.41 1.61 8.25 -1.26 -4.98 115.22 117.43 1ea9 n HIS 89 Ca 0.00 0.00 -0.55 0.00 -0.26 0.00 0.00 57.72 56.91 1ea9 n HIS 89 Cb 0.00 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.03 1ea9 n HIS 89 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1ea9 n GLU 90 N -1.48 0.00 -3.19 -0.41 2.13 -1.23 -4.89 120.64 111.57 1ea9 n GLU 90 Ca 0.00 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.60 1ea9 n GLU 90 Cb 0.00 -1.24 -0.05 0.00 0.27 0.00 0.00 31.44 30.42 1ea9 n GLU 90 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1ea9 n LYS 91 N 2.93 1.19 -1.34 5.31 2.85 -1.26 -0.84 118.16 127.00 1ea9 n LYS 91 Ca 0.24 -3.55 -0.35 0.00 -1.05 0.00 0.00 58.31 53.60 1ea9 n LYS 91 Cb -0.03 -1.59 0.10 0.00 -0.65 0.00 0.00 35.03 32.86 1ea9 n LYS 91 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1ea9 n ARG 92 N 0.77 0.52 -4.11 -1.58 1.74 -1.26 -4.81 116.66 107.93 1ea9 n ARG 92 Ca 0.24 0.24 -0.27 0.00 -0.77 0.00 0.00 57.85 57.30 1ea9 n ARG 92 Cb 0.56 -2.38 -0.06 0.00 -1.02 0.00 0.00 32.46 29.56 1ea9 n ARG 92 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1ea9 s TRP 93 N -1.84 3.09 -0.01 -1.55 0.52 0.27 -4.30 118.94 115.12 1ea9 s TRP 93 Ca 0.76 -0.03 0.06 0.00 0.02 0.00 0.00 56.10 56.90 1ea9 s TRP 93 Cb -0.33 -1.49 -0.02 0.00 -1.15 0.00 0.00 33.47 30.48 1ea9 s TRP 93 CO 0.48 0.52 -0.19 1.41 0.02 0.00 0.00 176.95 179.19 1ea9 s MET 94 N -3.01 1.56 0.15 4.98 1.75 0.23 -1.00 119.30 123.97 1ea9 s MET 94 Ca 0.30 -0.69 0.01 0.00 -1.25 0.00 0.00 55.69 54.06 1ea9 s MET 94 Cb -0.10 -1.51 -0.00 0.00 2.84 0.00 0.00 34.83 36.05 1ea9 s MET 94 CO 0.22 0.41 0.17 0.25 -0.65 0.00 0.00 175.02 175.43 1ea9 n THR 95 N 2.59 0.00 1.32 10.11 -2.24 -1.08 -2.81 114.28 122.16 1ea9 n THR 95 Ca -0.15 -0.92 0.14 0.00 -2.27 0.00 0.00 64.05 60.86 1ea9 n THR 95 Cb 0.53 0.51 0.69 0.00 -2.10 0.00 0.00 70.33 69.97 1ea9 n THR 95 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ea9 n GLU 96 N -0.27 0.35 -0.01 -0.78 1.02 0.70 -4.37 120.64 117.29 1ea9 n GLU 96 Ca 0.02 -0.03 -0.01 0.00 -0.02 0.00 0.00 57.16 57.11 1ea9 n GLU 96 Cb 0.26 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.18 1ea9 n GLU 96 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1ea9 n TYR 97 N -1.30 0.00 -4.33 -0.32 4.02 -1.25 -5.07 117.16 108.91 1ea9 n TYR 97 Ca 0.12 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.84 1ea9 n TYR 97 Cb 0.27 -0.08 -0.10 0.00 -0.02 0.00 0.00 39.34 39.41 1ea9 n TYR 97 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1ea9 s ASP 98 N -4.93 1.39 -0.79 7.72 1.01 -1.26 -5.10 116.67 114.71 1ea9 s ASP 98 Ca -0.05 -1.47 -0.09 0.00 0.71 0.00 0.00 52.55 51.66 1ea9 s ASP 98 Cb 0.01 0.27 0.21 0.00 1.01 0.00 0.00 42.92 44.41 1ea9 s ASP 98 CO 0.07 -0.80 0.69 -0.36 0.21 0.00 0.00 175.17 174.98 1ea9 s PHE 99 N -3.67 3.69 1.09 4.23 0.08 -1.26 -2.65 117.98 119.49 1ea9 s PHE 99 Ca 0.36 -2.35 -0.12 0.00 0.12 0.00 0.00 56.93 54.94 1ea9 s PHE 99 Cb 0.06 -3.58 0.24 0.00 -0.57 0.00 0.00 43.02 39.17 1ea9 s PHE 99 CO 0.15 -0.92 1.06 -0.51 -0.10 0.00 0.00 175.22 174.90 1ea9 s LEU 100 N -0.13 1.23 -0.22 -0.37 1.43 -0.17 -4.64 118.68 115.82 1ea9 s LEU 100 Ca 0.19 1.46 0.06 0.00 -1.03 0.00 0.00 54.13 54.82 1ea9 s LEU 100 Cb -0.13 -3.50 -0.18 0.00 0.03 0.00 0.00 46.19 42.41 1ea9 s LEU 100 CO -0.07 -3.76 -0.13 0.41 0.23 0.00 0.00 176.35 173.03 1ea9 n THR 101 N -4.62 1.34 -4.40 5.49 -1.04 -1.26 0.95 114.28 110.74 1ea9 n THR 101 Ca 0.04 -0.61 -0.20 0.00 -2.04 0.00 0.00 64.05 61.25 1ea9 n THR 101 Cb 0.55 -1.08 -0.10 0.00 -1.82 0.00 0.00 70.33 67.87 1ea9 n THR 101 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1ea9 s GLU 102 N -2.47 1.50 0.19 -2.82 2.56 -1.26 -4.50 118.70 111.91 1ea9 s GLU 102 Ca -0.25 -1.79 -0.19 0.00 0.00 0.00 0.00 54.97 52.74 1ea9 s GLU 102 Cb 0.07 -0.84 -0.12 0.00 2.00 0.00 0.00 34.13 35.24 1ea9 s GLU 102 CO 0.62 -0.10 0.29 -2.30 -0.56 0.00 0.00 175.26 173.21 1ea9 n PRO 103 N -0.55 0.00 -2.29 4.30 -0.02 -1.26 -4.86 135.00 130.31 1ea9 n PRO 103 Ca -0.04 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 61.09 1ea9 n PRO 103 Cb 0.65 -0.74 -0.00 0.00 -0.02 0.00 0.00 33.50 33.39 1ea9 n PRO 103 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1ea9 s PRO 104 N -0.74 3.46 0.42 0.52 0.02 -1.26 -4.93 135.00 132.49 1ea9 s PRO 104 Ca 0.46 1.61 0.16 0.00 0.02 0.00 0.00 61.00 63.25 1ea9 s PRO 104 Cb -0.62 -2.07 0.93 0.00 0.02 0.00 0.00 34.50 32.75 1ea9 s PRO 104 CO 0.43 -0.76 1.91 0.00 -0.33 0.00 0.00 177.00 178.25 1ea9 h ALA 105 N 1.36 1.45 -2.40 -1.55 0.00 -2.08 -3.47 119.26 112.58 1ea9 h ALA 105 Ca -0.50 -0.25 0.19 0.00 0.00 0.00 0.00 54.91 54.36 1ea9 h ALA 105 Cb 1.26 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1ea9 h ALA 105 CO 0.58 0.34 0.63 0.27 0.00 0.00 0.00 179.25 181.06 1ea9 n ASN 106 N -4.07 -1.51 -4.36 0.00 2.04 -1.26 -5.12 115.26 100.98 1ea9 n ASN 106 Ca -0.02 -1.70 -0.45 0.00 -0.44 0.00 0.00 54.58 51.97 1ea9 n ASN 106 Cb 0.33 2.44 -0.04 0.00 -2.53 0.00 0.00 39.78 39.97 1ea9 n ASN 106 CO 0.00 0.00 0.00 -2.16 -0.44 0.00 0.00 177.26 174.66 1ea9 s PRO 107 N -2.04 3.07 0.10 -0.53 0.04 -1.26 -4.73 135.00 129.65 1ea9 s PRO 107 Ca 0.23 -1.47 0.00 0.00 0.04 0.00 0.00 61.00 59.81 1ea9 s PRO 107 Cb -0.02 -4.30 0.00 0.00 0.04 0.00 0.00 34.50 30.22 1ea9 s PRO 107 CO 0.04 -1.49 0.00 -0.25 0.04 0.00 0.00 177.00 175.33 1ea9 n ASP 108 N 6.01 -0.23 -0.35 6.66 9.92 -1.26 -4.81 116.55 132.48 1ea9 n ASP 108 Ca -0.09 0.17 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 1ea9 n ASP 108 Cb 0.42 0.33 0.00 0.00 -0.64 0.00 0.00 41.12 41.23 1ea9 n ASP 108 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 1ea9 n ARG 109 N -2.80 0.56 -3.14 -1.24 0.00 -1.26 -4.75 116.66 104.03 1ea9 n ARG 109 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 57.85 57.59 1ea9 n ARG 109 Cb 0.00 -1.20 -0.01 0.00 -0.00 0.00 0.00 32.46 31.25 1ea9 n ARG 109 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1ea9 s LEU 110 N -0.29 3.91 0.00 2.89 1.43 -1.26 -0.21 118.68 125.14 1ea9 s LEU 110 Ca 0.00 0.68 0.00 0.00 -1.03 0.00 0.00 54.13 53.78 1ea9 s LEU 110 Cb 0.00 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.66 1ea9 s LEU 110 CO 0.00 -0.35 0.00 0.49 0.23 0.00 0.00 176.35 176.72 1ea9 n PHE 111 N -1.66 -1.45 0.00 0.29 3.72 -0.51 -4.82 117.46 113.02 1ea9 n PHE 111 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1ea9 n PHE 111 Cb 0.55 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.09 1ea9 n PHE 111 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1ea9 n GLU 112 N -0.50 0.00 -3.29 -1.08 2.13 -1.26 -2.74 120.64 113.91 1ea9 n GLU 112 Ca 0.00 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.56 1ea9 n GLU 112 Cb 0.00 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.64 1ea9 n GLU 112 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 1ea9 n TYR 113 N -0.36 2.67 0.00 4.31 9.36 -0.67 -4.96 117.16 127.51 1ea9 n TYR 113 Ca 0.00 -3.99 0.00 0.00 3.32 0.00 0.00 57.90 57.23 1ea9 n TYR 113 Cb 0.00 -0.50 0.00 0.00 -0.63 0.00 0.00 39.34 38.21 1ea9 n TYR 113 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1ea9 n PRO 114 N 0.77 0.00 -3.63 2.98 -0.02 -1.26 -3.69 135.00 130.15 1ea9 n PRO 114 Ca 0.28 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.74 1ea9 n PRO 114 Cb 0.45 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.86 1ea9 n PRO 114 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1ea9 s PHE 115 N -4.71 -0.50 -1.16 6.00 2.19 -1.26 -4.44 117.98 114.10 1ea9 s PHE 115 Ca 0.00 0.99 -0.18 0.00 0.33 0.00 0.00 56.93 58.06 1ea9 s PHE 115 Cb 0.00 0.30 -0.04 0.00 -1.31 0.00 0.00 43.02 41.97 1ea9 s PHE 115 CO 0.00 -0.25 2.01 -0.89 1.83 0.00 0.00 175.22 177.93 1ea9 n ILE 116 N 3.66 2.76 -1.77 3.12 5.41 -0.76 -4.90 119.36 126.88 1ea9 n ILE 116 Ca -0.18 -2.54 -0.39 0.00 1.00 0.00 0.00 62.75 60.64 1ea9 n ILE 116 Cb 0.57 -2.42 -0.03 0.00 -0.71 0.00 0.00 39.64 37.06 1ea9 n ILE 116 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1ea9 s ASN 117 N 4.39 5.05 0.56 4.38 0.01 -1.26 -4.80 114.94 123.27 1ea9 s ASN 117 Ca 0.54 1.04 0.38 0.00 -0.71 0.00 0.00 52.86 54.11 1ea9 s ASN 117 Cb 0.11 -2.51 1.52 0.00 0.41 0.00 0.00 41.25 40.77 1ea9 s ASN 117 CO 0.04 -2.41 1.72 1.55 -1.51 0.00 0.00 177.10 176.48 1ea9 h PRO 118 N 16.55 0.00 0.00 -0.60 0.13 -1.96 0.36 132.00 146.48 1ea9 h PRO 118 Ca -0.29 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1ea9 h PRO 118 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1ea9 h PRO 118 CO 1.12 0.00 -0.02 -0.24 -0.23 0.00 0.00 178.00 178.64 1ea9 h VAL 119 N 0.00 0.30 -0.28 1.56 3.04 -2.01 -1.40 116.25 117.46 1ea9 h VAL 119 Ca 0.59 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 66.18 1ea9 h VAL 119 Cb 2.51 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 32.87 1ea9 h VAL 119 CO -0.01 0.02 0.00 0.47 -1.01 0.00 0.00 177.57 177.04 1ea9 n ASP 120 N -3.48 3.90 -4.64 3.17 8.00 0.13 -4.98 116.55 118.65 1ea9 n ASP 120 Ca -0.03 -2.93 -0.41 0.00 0.71 0.00 0.00 54.79 52.13 1ea9 n ASP 120 Cb 0.11 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 40.63 1ea9 n ASP 120 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ea9 s VAL 121 N -2.68 4.89 -0.58 2.53 1.01 -0.53 -4.96 120.40 120.09 1ea9 s VAL 121 Ca 0.41 1.43 -0.30 0.00 0.00 0.00 0.00 61.98 63.53 1ea9 s VAL 121 Cb 0.33 -4.06 -0.12 0.00 0.00 0.00 0.00 36.38 32.53 1ea9 s VAL 121 CO 0.10 -0.03 2.43 0.33 0.00 0.00 0.00 175.10 177.93 1ea9 n PHE 122 N 5.80 1.27 -3.94 5.22 -0.00 -1.26 -4.90 117.46 119.65 1ea9 n PHE 122 Ca 0.03 0.21 -0.31 0.00 -0.00 0.00 0.00 57.45 57.39 1ea9 n PHE 122 Cb 0.48 -2.55 -0.15 0.00 -0.00 0.00 0.00 39.48 37.26 1ea9 n PHE 122 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.76 175.62 1ea9 s GLN 123 N 7.91 1.48 0.51 -4.13 -0.44 -1.26 -4.86 119.66 118.86 1ea9 s GLN 123 Ca 1.11 -1.32 0.09 0.00 -2.50 0.00 0.00 55.36 52.73 1ea9 s GLN 123 Cb -0.62 -2.70 0.05 0.00 -1.64 0.00 0.00 33.01 28.09 1ea9 s GLN 123 CO 0.38 -0.77 0.64 -1.25 0.50 0.00 0.00 175.29 174.79 1ea9 s PRO 124 N 1.25 2.48 -0.81 1.67 0.04 -1.26 -4.97 135.00 133.39 1ea9 s PRO 124 Ca 0.02 -1.55 -0.26 0.00 0.04 0.00 0.00 61.00 59.25 1ea9 s PRO 124 Cb -0.19 -2.60 -0.18 0.00 0.04 0.00 0.00 34.50 31.58 1ea9 s PRO 124 CO -0.10 -0.59 2.51 -2.30 0.04 0.00 0.00 177.00 176.56 1ea9 n PRO 125 N -2.01 0.39 0.00 0.56 -0.02 -1.26 -4.71 135.00 127.96 1ea9 n PRO 125 Ca 0.10 -0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1ea9 n PRO 125 Cb 0.61 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1ea9 n PRO 125 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ea9 n ALA 126 N 12.42 1.07 -0.08 3.55 0.00 -1.26 -1.62 120.51 134.58 1ea9 n ALA 126 Ca 0.55 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.90 1ea9 n ALA 126 Cb 0.25 -0.73 -0.12 0.00 0.00 0.00 0.00 19.45 18.84 1ea9 n ALA 126 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 1ea9 n TRP 127 N -0.91 0.00 0.26 0.00 4.27 -1.26 -4.46 117.44 115.33 1ea9 n TRP 127 Ca 0.00 0.00 0.17 0.00 -3.89 0.00 0.00 57.50 53.78 1ea9 n TRP 127 Cb 0.01 -0.79 0.91 0.00 -1.36 0.00 0.00 31.31 30.08 1ea9 n TRP 127 CO 0.00 0.00 0.00 -0.39 -2.29 0.00 0.00 177.69 175.01 1ea9 h VAL 128 N 0.00 0.00 -0.13 -1.67 -1.51 -1.69 0.92 116.25 112.17 1ea9 h VAL 128 Ca -0.44 0.00 0.04 0.00 -1.23 0.00 0.00 66.70 65.07 1ea9 h VAL 128 Cb 1.94 0.74 -0.01 0.00 -2.13 0.00 0.00 31.29 31.84 1ea9 h VAL 128 CO 0.01 0.00 0.23 0.11 -1.23 0.00 0.00 177.57 176.69 1ea9 h LYS 129 N 0.00 0.00 -3.75 5.19 1.57 -1.78 -3.09 116.57 114.71 1ea9 h LYS 129 Ca 0.00 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.16 1ea9 h LYS 129 Cb 0.03 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 31.94 1ea9 h LYS 129 CO 0.00 0.00 -0.72 -0.51 -0.57 0.00 0.00 179.45 177.65 1ea9 s ASP 130 N -5.29 4.21 -0.30 0.86 1.01 0.32 -4.80 116.67 112.68 1ea9 s ASP 130 Ca -0.04 -2.22 -0.11 0.00 0.71 0.00 0.00 52.55 50.88 1ea9 s ASP 130 Cb 0.13 -1.25 0.17 0.00 1.01 0.00 0.00 42.92 42.98 1ea9 s ASP 130 CO 0.46 -0.34 0.89 0.00 0.21 0.00 0.00 175.17 176.38 1ea9 s ALA 131 N 0.84 -2.70 -0.12 5.23 0.00 -1.17 -4.95 121.76 118.89 1ea9 s ALA 131 Ca 0.13 1.92 -0.14 0.00 0.00 0.00 0.00 51.96 53.87 1ea9 s ALA 131 Cb -0.21 -2.13 -0.05 0.00 0.00 0.00 0.00 23.12 20.73 1ea9 s ALA 131 CO -0.10 -1.13 0.34 0.42 0.00 0.00 0.00 175.76 175.29 1ea9 s ILE 132 N 2.70 5.24 -0.07 0.00 1.09 -1.26 -3.34 121.20 125.56 1ea9 s ILE 132 Ca 0.01 0.65 0.00 0.00 -1.10 0.00 0.00 60.65 60.22 1ea9 s ILE 132 Cb -0.09 -3.66 -0.03 0.00 -1.06 0.00 0.00 42.46 37.61 1ea9 s ILE 132 CO -0.17 0.44 -0.05 -0.36 -0.10 0.00 0.00 174.94 174.70 1ea9 s PHE 133 N 0.04 3.00 -0.12 3.97 0.40 0.24 -1.17 117.98 124.34 1ea9 s PHE 133 Ca 0.20 0.07 0.02 0.00 -0.60 0.00 0.00 56.93 56.61 1ea9 s PHE 133 Cb -0.14 -1.73 -0.01 0.00 0.51 0.00 0.00 43.02 41.65 1ea9 s PHE 133 CO 0.07 0.37 -0.18 -0.47 0.70 0.00 0.00 175.22 175.70 1ea9 s TYR 134 N -0.82 2.69 -0.27 0.36 6.14 0.16 -0.60 117.35 125.01 1ea9 s TYR 134 Ca 0.13 -0.91 -0.05 0.00 0.64 0.00 0.00 57.07 56.88 1ea9 s TYR 134 Cb -0.11 -1.79 0.02 0.00 0.42 0.00 0.00 41.96 40.49 1ea9 s TYR 134 CO 0.02 -0.36 0.02 -1.14 0.64 0.00 0.00 175.55 174.72 1ea9 s GLN 135 N 0.44 2.99 -0.00 4.97 0.74 -1.17 0.16 119.66 127.78 1ea9 s GLN 135 Ca -0.13 -0.90 0.03 0.00 0.05 0.00 0.00 55.36 54.40 1ea9 s GLN 135 Cb -0.17 -3.20 -0.03 0.00 1.10 0.00 0.00 33.01 30.71 1ea9 s GLN 135 CO 0.06 -0.42 -0.06 0.96 -0.55 0.00 0.00 175.29 175.27 1ea9 s ILE 136 N 1.42 3.68 -0.63 -2.34 -4.36 -0.34 -0.02 121.20 118.62 1ea9 s ILE 136 Ca 0.02 -0.75 0.05 0.00 -0.26 0.00 0.00 60.65 59.70 1ea9 s ILE 136 Cb -0.17 -2.59 0.15 0.00 1.25 0.00 0.00 42.46 41.10 1ea9 s ILE 136 CO -0.01 0.41 0.40 0.12 0.24 0.00 0.00 174.94 176.10 1ea9 s PHE 137 N -0.99 3.42 0.09 1.37 2.19 -1.26 -4.13 117.98 118.66 1ea9 s PHE 137 Ca 0.17 -3.27 -0.17 0.00 0.33 0.00 0.00 56.93 53.99 1ea9 s PHE 137 Cb -0.11 -2.76 -0.04 0.00 -1.31 0.00 0.00 43.02 38.80 1ea9 s PHE 137 CO 0.07 -0.63 0.95 -2.30 1.83 0.00 0.00 175.22 175.15 1ea9 n PRO 138 N 2.44 -0.24 0.00 10.12 -0.02 -1.26 -0.47 135.00 145.58 1ea9 n PRO 138 Ca 0.14 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.55 1ea9 n PRO 138 Cb 0.34 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 1ea9 n PRO 138 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1ea9 n GLU 139 N -4.45 0.00 -1.18 -0.52 -0.58 -1.23 -0.50 120.64 112.19 1ea9 n GLU 139 Ca 0.01 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.71 1ea9 n GLU 139 Cb 0.14 -1.00 -0.04 0.00 -0.57 0.00 0.00 31.44 29.97 1ea9 n GLU 139 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1ea9 n ARG 140 N -0.41 0.04 0.00 3.49 5.12 0.38 -4.17 116.66 121.12 1ea9 n ARG 140 Ca 0.00 -1.29 0.00 0.00 -1.93 0.00 0.00 57.85 54.63 1ea9 n ARG 140 Cb 0.00 0.35 0.00 0.00 -1.16 0.00 0.00 32.46 31.65 1ea9 n ARG 140 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1ea9 n PHE 141 N 0.10 0.00 0.00 -1.55 7.35 0.35 -0.61 117.46 123.10 1ea9 n PHE 141 Ca -0.18 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.51 1ea9 n PHE 141 Cb 0.83 0.02 0.00 0.00 0.35 0.00 0.00 39.48 40.68 1ea9 n PHE 141 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ea9 n ALA 142 N -2.50 0.00 -3.70 3.13 0.00 -1.23 -3.90 120.51 112.30 1ea9 n ALA 142 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1ea9 n ALA 142 Cb 0.42 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.76 1ea9 n ALA 142 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ea9 s ASN 143 N 0.00 5.25 -0.04 0.00 3.04 -1.26 -2.23 114.94 119.69 1ea9 s ASN 143 Ca 0.00 -1.87 0.05 0.00 0.04 0.00 0.00 52.86 51.07 1ea9 s ASN 143 Cb 0.00 -1.83 0.21 0.00 -1.54 0.00 0.00 41.25 38.09 1ea9 s ASN 143 CO 0.00 -0.51 0.94 0.61 -3.04 0.00 0.00 177.10 175.10 1ea9 n GLY 144 N 4.63 1.29 3.64 1.21 0.00 -1.26 -4.83 105.19 109.87 1ea9 n GLY 144 Ca -0.05 -0.24 -0.05 0.00 0.00 0.00 0.00 46.02 45.69 1ea9 n GLY 144 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ea9 s ASP 145 N -0.46 -0.28 0.40 1.61 -1.08 -1.26 -4.63 116.67 110.98 1ea9 s ASP 145 Ca 0.14 0.50 0.26 0.00 -0.52 0.00 0.00 52.55 52.94 1ea9 s ASP 145 Cb 0.10 0.68 1.43 0.00 -1.46 0.00 0.00 42.92 43.66 1ea9 s ASP 145 CO 0.06 -0.08 1.80 0.74 0.52 0.00 0.00 175.17 178.20 1ea9 h THR 146 N 3.80 0.00 -0.94 1.71 2.02 -1.97 -3.36 112.91 114.17 1ea9 h THR 146 Ca -0.28 0.00 -0.57 0.00 0.77 0.00 0.00 66.41 66.33 1ea9 h THR 146 Cb 1.18 0.58 -0.08 0.00 -1.74 0.00 0.00 68.15 68.09 1ea9 h THR 146 CO 0.16 0.00 1.62 -0.13 0.37 0.00 0.00 175.52 177.54 1ea9 s ARG 147 N -3.68 3.53 0.00 6.66 0.52 -1.26 -4.61 118.95 120.12 1ea9 s ARG 147 Ca -0.03 -1.33 0.00 0.00 -0.52 0.00 0.00 55.73 53.85 1ea9 s ARG 147 Cb 0.08 -5.38 0.00 0.00 0.52 0.00 0.00 34.95 30.17 1ea9 s ARG 147 CO 0.24 -2.48 0.00 0.27 0.02 0.00 0.00 175.30 173.35 1ea9 n ASN 148 N 9.66 0.00 -4.23 0.23 2.04 -1.26 -4.82 115.26 116.88 1ea9 n ASN 148 Ca 0.40 0.00 -0.13 0.00 -0.44 0.00 0.00 54.58 54.41 1ea9 n ASN 148 Cb 0.49 0.00 -0.10 0.00 -2.53 0.00 0.00 39.78 37.64 1ea9 n ASN 148 CO 0.00 0.00 0.00 -1.81 -0.44 0.00 0.00 177.26 175.01 1ea9 s ASP 149 N 1.11 1.46 0.00 0.53 1.11 -1.26 -4.82 116.67 114.79 1ea9 s ASP 149 Ca 0.00 -1.07 0.00 0.00 0.18 0.00 0.00 52.55 51.66 1ea9 s ASP 149 Cb 0.00 0.05 0.00 0.00 1.07 0.00 0.00 42.92 44.04 1ea9 s ASP 149 CO 0.00 -0.45 0.83 -2.65 1.18 0.00 0.00 175.17 174.08 1ea9 n PRO 150 N -0.18 0.00 -3.96 8.23 -0.02 -1.26 -4.69 135.00 133.12 1ea9 n PRO 150 Ca -0.09 0.34 -0.09 0.00 -2.02 0.00 0.00 63.50 61.63 1ea9 n PRO 150 Cb 0.62 -1.52 -0.07 0.00 -0.02 0.00 0.00 33.50 32.50 1ea9 n PRO 150 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ea9 s GLU 151 N -2.65 1.11 0.00 -0.52 2.02 -1.26 -5.15 118.70 112.25 1ea9 s GLU 151 Ca 0.00 -1.16 0.00 0.00 0.02 0.00 0.00 54.97 53.83 1ea9 s GLU 151 Cb 0.00 0.37 0.00 0.00 0.10 0.00 0.00 34.13 34.60 1ea9 s GLU 151 CO 0.00 -0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.29 1ea9 n GLY 152 N -0.19 3.96 0.00 -1.39 0.00 -1.25 -4.59 105.19 101.73 1ea9 n GLY 152 Ca -0.08 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.63 1ea9 n GLY 152 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ea9 n THR 153 N -0.00 0.00 -3.71 2.61 -2.24 -1.26 -4.89 114.28 104.79 1ea9 n THR 153 Ca 0.00 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 1ea9 n THR 153 Cb 0.00 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.16 1ea9 n THR 153 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1ea9 s LEU 154 N 0.00 0.62 0.60 3.22 1.43 -1.26 -4.94 118.68 118.35 1ea9 s LEU 154 Ca 0.00 -0.02 -0.14 0.00 -1.03 0.00 0.00 54.13 52.93 1ea9 s LEU 154 Cb 0.00 1.54 -0.11 0.00 0.03 0.00 0.00 46.19 47.65 1ea9 s LEU 154 CO 0.00 -0.60 -0.78 -2.65 0.23 0.00 0.00 176.35 172.55 1ea9 n PRO 155 N 0.70 0.00 0.00 1.29 -0.02 -1.26 -5.04 135.00 130.66 1ea9 n PRO 155 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 1ea9 n PRO 155 Cb 0.59 -0.60 0.00 0.00 -0.02 0.00 0.00 33.50 33.47 1ea9 n PRO 155 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 1ea9 n TRP 156 N -1.89 0.00 -0.37 6.00 4.27 -1.26 -5.14 117.44 119.05 1ea9 n TRP 156 Ca -0.01 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.31 1ea9 n TRP 156 Cb 0.41 0.00 0.27 0.00 -1.36 0.00 0.00 31.31 30.63 1ea9 n TRP 156 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1ea9 n GLY 157 N 0.00 -3.06 1.92 -1.67 0.00 -1.26 -4.95 105.19 96.17 1ea9 n GLY 157 Ca 0.00 -1.39 -0.23 0.00 0.00 0.00 0.00 46.02 44.40 1ea9 n GLY 157 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ea9 n SER 158 N -4.89 5.15 0.00 1.61 3.41 -1.26 -4.60 113.62 113.04 1ea9 n SER 158 Ca 0.08 -3.77 0.00 0.00 -0.26 0.00 0.00 58.87 54.91 1ea9 n SER 158 Cb 0.56 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1ea9 n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ea9 n ALA 159 N -0.86 0.37 -2.31 7.33 0.00 -1.26 -4.94 120.51 118.83 1ea9 n ALA 159 Ca 0.47 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.64 1ea9 n ALA 159 Cb 0.90 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.36 1ea9 n ALA 159 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ea9 n ASP 160 N -2.33 5.00 -1.40 0.00 5.75 -1.26 -4.80 116.55 117.51 1ea9 n ASP 160 Ca 0.00 -3.74 0.00 0.00 -0.01 0.00 0.00 54.79 51.04 1ea9 n ASP 160 Cb 0.00 -0.48 0.00 0.00 -1.03 0.00 0.00 41.12 39.61 1ea9 n ASP 160 CO 0.00 0.00 0.00 -2.65 -0.11 0.00 0.00 177.20 174.44 1ea9 n PRO 161 N -0.55 0.55 -3.26 0.11 -0.02 -1.26 -4.19 135.00 126.37 1ea9 n PRO 161 Ca 0.42 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.68 1ea9 n PRO 161 Cb 0.71 -1.23 -0.08 0.00 -0.02 0.00 0.00 33.50 32.88 1ea9 n PRO 161 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ea9 s THR 162 N 0.70 0.04 -0.33 3.45 -4.23 -1.26 -4.94 115.64 109.07 1ea9 s THR 162 Ca 0.00 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.25 1ea9 s THR 162 Cb 0.00 -0.98 0.00 0.00 1.34 0.00 0.00 72.50 72.86 1ea9 s THR 162 CO 0.00 -0.97 0.73 -2.65 -0.54 0.00 0.00 174.62 171.19 1ea9 n PRO 163 N 2.91 0.87 -3.47 3.99 -0.02 -1.26 -4.68 135.00 133.34 1ea9 n PRO 163 Ca 0.27 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.57 1ea9 n PRO 163 Cb 0.49 -1.19 0.08 0.00 -0.02 0.00 0.00 33.50 32.87 1ea9 n PRO 163 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1ea9 n SER 164 N 0.40 -2.41 -3.80 2.55 7.64 -1.26 -5.01 113.62 111.73 1ea9 n SER 164 Ca 0.00 -0.63 -0.12 0.00 1.01 0.00 0.00 58.87 59.13 1ea9 n SER 164 Cb 0.36 -5.02 -0.09 0.00 -1.01 0.00 0.00 64.21 58.46 1ea9 n SER 164 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ea9 n PHE 166 N 1.05 -0.49 0.00 0.00 3.72 -1.26 -4.98 117.46 115.50 1ea9 n PHE 166 Ca -0.21 0.78 0.00 0.00 -0.05 0.00 0.00 57.45 57.97 1ea9 n PHE 166 Cb 0.57 -1.60 0.00 0.00 -0.94 0.00 0.00 39.48 37.51 1ea9 n PHE 166 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1ea9 n PHE 167 N -0.06 0.00 0.00 1.38 -0.00 -1.26 -4.41 117.46 113.12 1ea9 n PHE 167 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.59 1ea9 n PHE 167 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.69 1ea9 n PHE 167 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ea9 n GLY 168 N 2.86 0.67 1.29 7.13 0.00 -1.26 -3.83 105.19 112.05 1ea9 n GLY 168 Ca 0.00 -0.05 -0.17 0.00 0.00 0.00 0.00 46.02 45.79 1ea9 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ea9 n GLY 169 N 0.00 -0.15 0.00 -0.02 0.00 -1.26 -4.74 105.19 99.03 1ea9 n GLY 169 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1ea9 n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ea9 n ASP 170 N 3.62 0.00 -0.08 1.61 10.43 -0.95 -3.52 116.55 127.67 1ea9 n ASP 170 Ca 0.24 -0.66 -0.10 0.00 2.57 0.00 0.00 54.79 56.84 1ea9 n ASP 170 Cb 0.00 0.00 -0.05 0.00 1.84 0.00 0.00 41.12 42.91 1ea9 n ASP 170 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 1ea9 h LEU 171 N 0.00 0.00 -0.26 0.64 6.46 -1.70 -3.40 115.31 117.05 1ea9 h LEU 171 Ca 0.00 -0.21 0.02 0.00 -0.12 0.00 0.00 57.88 57.57 1ea9 h LEU 171 Cb 0.00 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 39.90 1ea9 h LEU 171 CO 0.00 0.96 -0.15 0.00 -0.62 0.00 0.00 178.44 178.63 1ea9 n GLN 172 N -4.58 -0.11 -0.15 1.25 1.13 -1.26 -0.01 117.38 113.65 1ea9 n GLN 172 Ca -0.14 0.62 0.01 0.00 -1.94 0.00 0.00 57.00 55.55 1ea9 n GLN 172 Cb 0.37 -0.91 0.04 0.00 0.11 0.00 0.00 30.24 29.85 1ea9 n GLN 172 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ea9 n GLY 173 N -1.06 -0.73 0.15 1.08 0.00 -1.26 0.12 105.19 103.49 1ea9 n GLY 173 Ca 0.01 0.44 -0.05 0.00 0.00 0.00 0.00 46.02 46.42 1ea9 n GLY 173 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ea9 h VAL 174 N 0.00 0.00 0.00 1.61 2.07 -0.68 0.14 116.25 119.39 1ea9 h VAL 174 Ca 0.17 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.69 1ea9 h VAL 174 Cb 0.27 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1ea9 h VAL 174 CO -0.41 0.00 0.00 -0.38 0.02 0.00 0.00 177.57 176.80 1ea9 n ILE 175 N -3.58 0.00 -0.47 4.57 5.41 0.33 0.75 119.36 126.37 1ea9 n ILE 175 Ca -0.01 1.25 0.39 0.00 1.00 0.00 0.00 62.75 65.37 1ea9 n ILE 175 Cb 0.11 -1.70 0.70 0.00 -0.71 0.00 0.00 39.64 38.04 1ea9 n ILE 175 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1ea9 h ASP 176 N 0.00 0.15 -0.49 4.38 1.82 -1.30 1.43 116.42 122.42 1ea9 h ASP 176 Ca 0.00 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.70 1ea9 h ASP 176 Cb 0.00 0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.06 1ea9 h ASP 176 CO 0.00 -0.06 0.00 1.41 -1.61 0.00 0.00 179.24 178.98 1ea9 n HIS 177 N -4.38 1.43 0.15 0.28 8.25 0.23 -4.62 115.22 116.56 1ea9 n HIS 177 Ca 0.35 -0.53 -0.07 0.00 -0.26 0.00 0.00 57.72 57.21 1ea9 n HIS 177 Cb 1.47 -0.32 -0.04 0.00 1.12 0.00 0.00 29.99 32.22 1ea9 n HIS 177 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1ea9 h LEU 178 N 3.21 -0.46 0.00 2.41 4.07 0.41 -3.27 115.31 121.68 1ea9 h LEU 178 Ca 0.00 0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1ea9 h LEU 178 Cb 1.45 0.14 0.00 0.00 1.08 0.00 0.00 40.66 43.33 1ea9 h LEU 178 CO 0.29 -0.27 0.00 -0.90 -1.08 0.00 0.00 178.44 176.49 1ea9 n ASP 179 N -3.36 0.00 -0.33 -0.43 3.85 -1.26 0.78 116.55 115.79 1ea9 n ASP 179 Ca -0.05 0.00 0.15 0.00 -0.71 0.00 0.00 54.79 54.18 1ea9 n ASP 179 Cb 0.18 0.00 0.30 0.00 -1.35 0.00 0.00 41.12 40.25 1ea9 n ASP 179 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.20 177.76 1ea9 n HIS 180 N -3.83 0.64 0.18 2.11 -0.00 -1.23 0.84 115.22 113.92 1ea9 n HIS 180 Ca 0.00 1.15 -0.14 0.00 0.46 0.00 0.00 57.72 59.19 1ea9 n HIS 180 Cb 0.00 -1.24 -0.07 0.00 -0.12 0.00 0.00 29.99 28.56 1ea9 n HIS 180 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 1ea9 h LEU 181 N 0.00 -0.84 -2.17 0.27 3.38 0.14 0.19 115.31 116.27 1ea9 h LEU 181 Ca 0.59 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.63 1ea9 h LEU 181 Cb 1.26 0.30 -0.00 0.00 0.09 0.00 0.00 40.66 42.30 1ea9 h LEU 181 CO -0.89 -0.43 -0.07 0.28 0.09 0.00 0.00 178.44 177.43 1ea9 h SER 182 N -0.61 0.00 0.76 -0.43 0.02 -0.34 0.94 113.55 113.89 1ea9 h SER 182 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ea9 h SER 182 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1ea9 h SER 182 CO -0.09 0.07 0.00 0.29 -1.14 0.00 0.00 176.83 175.95 1ea9 n LYS 183 N -3.65 0.10 -0.11 3.45 5.02 0.25 -3.19 118.16 120.03 1ea9 n LYS 183 Ca -0.02 0.28 -0.22 0.00 -2.02 0.00 0.00 58.31 56.32 1ea9 n LYS 183 Cb 0.18 -1.68 -0.08 0.00 -0.02 0.00 0.00 35.03 33.43 1ea9 n LYS 183 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1ea9 n LEU 184 N -1.87 1.58 0.00 -0.35 0.00 0.26 -4.92 117.00 111.71 1ea9 n LEU 184 Ca 0.04 0.24 0.00 0.00 0.00 0.00 0.00 56.01 56.29 1ea9 n LEU 184 Cb 0.24 -0.63 0.00 0.00 0.00 0.00 0.00 43.42 43.03 1ea9 n LEU 184 CO 0.19 0.47 0.00 0.61 0.00 0.00 0.00 177.39 178.66 1ea9 n GLY 185 N 1.71 1.64 3.88 -3.96 0.00 0.23 -4.60 105.19 104.09 1ea9 n GLY 185 Ca -0.42 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 1ea9 n GLY 185 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ea9 s VAL 186 N -2.00 3.69 0.00 1.61 1.01 -1.18 -4.92 120.40 118.62 1ea9 s VAL 186 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.53 1ea9 s VAL 186 Cb 0.00 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.84 1ea9 s VAL 186 CO 0.00 -0.72 0.00 0.59 0.00 0.00 0.00 175.10 174.97 1ea9 n ASN 187 N -2.97 0.00 -4.82 3.32 3.02 -0.35 -4.81 115.26 108.65 1ea9 n ASN 187 Ca 0.07 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.31 1ea9 n ASN 187 Cb 0.57 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.78 1ea9 n ASN 187 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ea9 s ALA 188 N -3.25 2.67 -0.38 5.41 0.00 -0.32 -2.68 121.76 123.22 1ea9 s ALA 188 Ca 0.00 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.10 1ea9 s ALA 188 Cb 0.00 -3.19 0.13 0.00 0.00 0.00 0.00 23.12 20.07 1ea9 s ALA 188 CO 0.00 -1.20 0.21 0.08 0.00 0.00 0.00 175.76 174.85 1ea9 s VAL 189 N -2.97 0.72 -0.20 0.00 1.01 -1.00 -0.67 120.40 117.29 1ea9 s VAL 189 Ca 0.59 -1.97 -0.29 0.00 0.00 0.00 0.00 61.98 60.31 1ea9 s VAL 189 Cb -0.14 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 1ea9 s VAL 189 CO 0.53 -0.90 1.81 -0.47 0.00 0.00 0.00 175.10 176.06 1ea9 s TYR 190 N 0.90 1.77 0.00 5.22 5.04 0.41 -3.72 117.35 126.96 1ea9 s TYR 190 Ca 0.16 0.41 0.00 0.00 -2.44 0.00 0.00 57.07 55.20 1ea9 s TYR 190 Cb -0.23 -4.03 0.00 0.00 0.35 0.00 0.00 41.96 38.05 1ea9 s TYR 190 CO -0.04 -3.54 0.00 1.19 -1.34 0.00 0.00 175.55 171.82 1ea9 n PHE 191 N 9.17 -0.78 -4.25 4.97 0.99 -1.20 -1.20 117.46 125.17 1ea9 n PHE 191 Ca 0.22 0.00 -0.14 0.00 -0.00 0.00 0.00 57.45 57.53 1ea9 n PHE 191 Cb 0.45 0.00 -0.10 0.00 -1.00 0.00 0.00 39.48 38.83 1ea9 n PHE 191 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1ea9 s THR 192 N 0.94 0.49 0.25 4.37 -4.23 -1.26 -4.20 115.64 112.00 1ea9 s THR 192 Ca 0.00 -1.98 -0.31 0.00 -1.18 0.00 0.00 61.69 58.22 1ea9 s THR 192 Cb 0.00 -2.33 -0.13 0.00 1.34 0.00 0.00 72.50 71.38 1ea9 s THR 192 CO 0.00 -0.25 1.51 -0.81 -0.54 0.00 0.00 174.62 174.53 1ea9 n PRO 193 N -0.30 2.34 -0.88 3.99 -0.04 -1.26 -4.09 135.00 134.74 1ea9 n PRO 193 Ca -0.03 0.83 0.03 0.00 -0.04 0.00 0.00 63.50 64.29 1ea9 n PRO 193 Cb 0.65 -2.56 0.04 0.00 -0.04 0.00 0.00 33.50 31.59 1ea9 n PRO 193 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1ea9 n LEU 194 N 2.36 0.87 -5.02 1.53 -0.00 -1.26 -4.38 117.00 111.10 1ea9 n LEU 194 Ca 0.11 -1.86 -0.21 0.00 -0.00 0.00 0.00 56.01 54.05 1ea9 n LEU 194 Cb 0.33 -0.09 0.08 0.00 -0.00 0.00 0.00 43.42 43.75 1ea9 n LEU 194 CO 0.63 0.50 0.44 -0.36 -0.00 0.00 0.00 177.39 178.60 1ea9 s PHE 195 N -0.55 1.48 -0.72 1.47 2.99 -1.26 -1.15 117.98 120.25 1ea9 s PHE 195 Ca 0.20 -0.52 -0.30 0.00 0.00 0.00 0.00 56.93 56.31 1ea9 s PHE 195 Cb 0.22 -2.57 -0.15 0.00 0.00 0.00 0.00 43.02 40.52 1ea9 s PHE 195 CO -0.07 -1.41 2.52 1.63 -0.00 0.00 0.00 175.22 177.89 1ea9 n LYS 196 N -2.51 0.53 -3.33 0.44 4.76 0.13 -3.31 118.16 114.87 1ea9 n LYS 196 Ca 0.15 0.03 -0.12 0.00 -2.87 0.00 0.00 58.31 55.50 1ea9 n LYS 196 Cb 0.61 -2.38 -0.06 0.00 -1.84 0.00 0.00 35.03 31.36 1ea9 n LYS 196 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ea9 s ALA 197 N 10.06 -0.94 -1.11 7.82 0.00 -1.26 0.18 121.76 136.51 1ea9 s ALA 197 Ca 1.18 -0.33 -0.26 0.00 0.00 0.00 0.00 51.96 52.55 1ea9 s ALA 197 Cb -0.79 -2.11 -0.20 0.00 0.00 0.00 0.00 23.12 20.01 1ea9 s ALA 197 CO 0.40 -1.96 2.08 0.95 0.00 0.00 0.00 175.76 177.24 1ea9 s THR 198 N 1.99 3.13 -0.24 0.00 -4.23 -1.26 -4.61 115.64 110.42 1ea9 s THR 198 Ca 0.13 -0.21 -0.27 0.00 -1.18 0.00 0.00 61.69 60.16 1ea9 s THR 198 Cb -0.13 -4.11 0.12 0.00 1.34 0.00 0.00 72.50 69.72 1ea9 s THR 198 CO -0.17 -0.23 1.01 0.42 -0.54 0.00 0.00 174.62 175.11 1ea9 s THR 199 N 16.01 0.00 0.54 3.99 -4.23 -1.26 -4.85 115.64 125.84 1ea9 s THR 199 Ca 0.79 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 61.59 1ea9 s THR 199 Cb -0.04 -1.00 0.44 0.00 1.34 0.00 0.00 72.50 73.24 1ea9 s THR 199 CO 0.17 0.00 1.93 -0.55 -0.54 0.00 0.00 174.62 175.64 1ea9 h ASN 200 N 3.67 0.00 -3.60 3.99 7.08 -1.85 -3.25 115.58 121.62 1ea9 h ASN 200 Ca -0.25 0.00 -0.67 0.00 -3.08 0.00 0.00 56.30 52.30 1ea9 h ASN 200 Cb 1.17 0.00 -0.34 0.00 -2.08 0.00 0.00 38.32 37.07 1ea9 h ASN 200 CO 0.18 0.00 -0.78 -1.38 -2.08 0.00 0.00 177.43 173.37 1ea9 s HIS 201 N -4.97 3.12 -0.41 4.14 -3.43 -1.26 -4.83 115.29 107.65 1ea9 s HIS 201 Ca -0.05 -1.88 -0.27 0.00 -0.80 0.00 0.00 55.06 52.06 1ea9 s HIS 201 Cb 0.20 -2.00 -0.27 0.00 -1.43 0.00 0.00 32.58 29.09 1ea9 s HIS 201 CO 0.74 -0.81 1.77 1.63 -2.00 0.00 0.00 174.74 176.07 1ea9 n LYS 202 N 4.57 0.72 0.00 -0.38 4.76 -1.23 -4.10 118.16 122.50 1ea9 n LYS 202 Ca -0.16 -1.44 0.00 0.00 -2.87 0.00 0.00 58.31 53.84 1ea9 n LYS 202 Cb 0.45 -2.77 0.00 0.00 -1.84 0.00 0.00 35.03 30.87 1ea9 n LYS 202 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1ea9 n TYR 203 N 8.89 0.00 1.22 2.13 4.01 -1.26 -4.46 117.16 127.69 1ea9 n TYR 203 Ca 0.48 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 58.24 1ea9 n TYR 203 Cb 0.42 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.54 1ea9 n TYR 203 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1ea9 n ASP 204 N -0.90 0.00 0.00 7.72 2.03 -1.26 -4.06 116.55 120.09 1ea9 n ASP 204 Ca 0.00 -1.12 0.00 0.00 0.52 0.00 0.00 54.79 54.19 1ea9 n ASP 204 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1ea9 n ASP 204 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1ea9 n THR 205 N -0.58 0.00 0.00 5.18 5.66 -1.26 -2.77 114.28 120.51 1ea9 n THR 205 Ca 0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.02 1ea9 n THR 205 Cb 0.01 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.79 1ea9 n THR 205 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1ea9 n GLU 206 N 0.00 3.61 -3.15 1.09 2.13 0.47 -0.29 120.64 124.49 1ea9 n GLU 206 Ca 0.00 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.87 1ea9 n GLU 206 Cb 0.00 -0.63 -0.00 0.00 0.27 0.00 0.00 31.44 31.07 1ea9 n GLU 206 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1ea9 s ASP 207 N -1.18 -1.22 0.01 4.31 3.68 -0.88 -4.31 116.67 117.07 1ea9 s ASP 207 Ca 0.00 0.16 -0.21 0.00 2.13 0.00 0.00 52.55 54.63 1ea9 s ASP 207 Cb 0.00 1.78 -0.11 0.00 -1.45 0.00 0.00 42.92 43.14 1ea9 s ASP 207 CO 0.00 -0.22 1.00 1.88 0.13 0.00 0.00 175.17 177.95 1ea9 h TYR 208 N 7.76 -0.69 -1.25 -5.34 -1.99 -1.94 -1.61 116.97 111.92 1ea9 h TYR 208 Ca -0.04 -0.02 0.38 0.00 2.00 0.00 0.00 58.73 61.05 1ea9 h TYR 208 Cb 1.18 0.23 -0.11 0.00 2.00 0.00 0.00 36.73 40.03 1ea9 h TYR 208 CO 0.13 -0.43 0.81 0.74 -0.00 0.00 0.00 178.16 179.41 1ea9 h PHE 209 N -0.99 0.52 -2.87 4.88 0.04 -1.97 -3.26 116.94 113.28 1ea9 h PHE 209 Ca -0.08 0.02 -0.69 0.00 2.80 0.00 0.00 57.97 60.02 1ea9 h PHE 209 Cb 0.57 -0.14 -0.19 0.00 2.20 0.00 0.00 35.95 38.39 1ea9 h PHE 209 CO 0.03 -0.11 0.16 -1.14 -0.60 0.00 0.00 178.31 176.66 1ea9 s GLN 210 N -5.32 3.05 0.57 1.51 0.74 -1.18 -4.87 119.66 114.16 1ea9 s GLN 210 Ca -0.08 -1.28 -0.19 0.00 0.05 0.00 0.00 55.36 53.87 1ea9 s GLN 210 Cb 0.28 -4.27 -0.07 0.00 1.10 0.00 0.00 33.01 30.05 1ea9 s GLN 210 CO 0.82 -1.58 0.79 -0.89 -0.55 0.00 0.00 175.29 173.88 1ea9 n ILE 211 N 5.58 3.01 -2.01 -2.34 5.41 -1.23 0.21 119.36 127.98 1ea9 n ILE 211 Ca -0.09 -0.50 -0.42 0.00 1.00 0.00 0.00 62.75 62.74 1ea9 n ILE 211 Cb 0.43 -0.96 -0.03 0.00 -0.71 0.00 0.00 39.64 38.37 1ea9 n ILE 211 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1ea9 s ASP 212 N -1.17 6.60 0.00 4.38 -1.08 -0.30 -4.01 116.67 121.09 1ea9 s ASP 212 Ca 0.72 2.14 0.00 0.00 -0.52 0.00 0.00 52.55 54.88 1ea9 s ASP 212 Cb -0.44 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.48 1ea9 s ASP 212 CO 0.51 -1.00 0.21 -0.81 0.52 0.00 0.00 175.17 174.60 1ea9 n PRO 213 N 7.24 0.00 0.00 4.34 -0.04 -1.26 -1.45 135.00 143.84 1ea9 n PRO 213 Ca 0.18 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.77 1ea9 n PRO 213 Cb 0.43 -1.26 0.66 0.00 -0.04 0.00 0.00 33.50 33.29 1ea9 n PRO 213 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1ea9 n GLN 214 N -0.67 0.28 0.00 0.54 6.02 -1.26 -3.62 117.38 118.66 1ea9 n GLN 214 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 1ea9 n GLN 214 Cb 0.00 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.76 1ea9 n GLN 214 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1ea9 n PHE 215 N -1.35 0.00 -0.49 1.08 3.01 -0.53 -4.19 117.46 115.00 1ea9 n PHE 215 Ca 0.11 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.57 1ea9 n PHE 215 Cb 0.25 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.72 1ea9 n PHE 215 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ea9 n GLY 216 N 2.33 0.77 3.68 1.37 0.00 -1.21 -2.95 105.19 109.19 1ea9 n GLY 216 Ca 0.00 -1.80 -0.20 0.00 0.00 0.00 0.00 46.02 44.02 1ea9 n GLY 216 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ea9 n ASP 217 N 0.92 2.15 0.15 1.61 5.68 -1.26 -4.13 116.55 121.67 1ea9 n ASP 217 Ca 0.00 -2.53 0.06 0.00 -0.50 0.00 0.00 54.79 51.82 1ea9 n ASP 217 Cb 0.00 -0.32 0.54 0.00 -1.14 0.00 0.00 41.12 40.20 1ea9 n ASP 217 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1ea9 h LYS 218 N 0.00 0.23 0.70 0.11 2.10 -1.94 -2.69 116.57 115.08 1ea9 h LYS 218 Ca -0.27 -0.01 -0.03 0.00 -2.00 0.00 0.00 60.65 58.33 1ea9 h LYS 218 Cb 1.19 -0.05 0.01 0.00 -0.90 0.00 0.00 32.23 32.47 1ea9 h LYS 218 CO 0.40 0.16 -0.34 -0.44 -2.00 0.00 0.00 179.45 177.23 1ea9 h ASP 219 N 0.24 -0.80 -1.16 7.07 3.32 -1.97 0.87 116.42 123.99 1ea9 h ASP 219 Ca 0.06 0.01 0.41 0.00 0.02 0.00 0.00 57.03 57.53 1ea9 h ASP 219 Cb -0.02 0.21 -0.15 0.00 0.22 0.00 0.00 39.33 39.59 1ea9 h ASP 219 CO -0.01 -0.44 0.70 0.71 -1.72 0.00 0.00 179.24 178.48 1ea9 h THR 220 N -1.19 0.13 0.10 0.35 1.35 -1.87 0.45 112.91 112.22 1ea9 h THR 220 Ca -0.10 -0.04 -0.16 0.00 -0.55 0.00 0.00 66.41 65.56 1ea9 h THR 220 Cb 0.74 0.00 0.01 0.00 -1.73 0.00 0.00 68.15 67.18 1ea9 h THR 220 CO 0.16 0.02 -0.76 0.25 -0.25 0.00 0.00 175.52 174.94 1ea9 h LEU 221 N 0.11 0.34 -0.08 3.87 5.85 -1.21 -3.17 115.31 121.02 1ea9 h LEU 221 Ca 0.81 -0.93 0.02 0.00 0.84 0.00 0.00 57.88 58.62 1ea9 h LEU 221 Cb 2.28 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 43.17 1ea9 h LEU 221 CO -0.56 1.35 -0.27 0.50 -0.34 0.00 0.00 178.44 179.12 1ea9 h LYS 222 N -0.52 -0.27 -0.95 1.25 3.11 0.49 0.16 116.57 119.84 1ea9 h LYS 222 Ca -0.15 0.02 0.28 0.00 -2.81 0.00 0.00 60.65 57.99 1ea9 h LYS 222 Cb 1.51 0.06 -0.18 0.00 -1.00 0.00 0.00 32.23 32.63 1ea9 h LYS 222 CO 0.09 -0.18 0.08 1.63 -2.81 0.00 0.00 179.45 178.26 1ea9 n LYS 223 N -3.99 -0.07 0.40 1.90 5.02 0.91 -0.81 118.16 121.52 1ea9 n LYS 223 Ca -0.03 1.41 -0.19 0.00 -2.02 0.00 0.00 58.31 57.48 1ea9 n LYS 223 Cb 0.19 -2.27 -0.10 0.00 -0.02 0.00 0.00 35.03 32.82 1ea9 n LYS 223 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1ea9 h LEU 224 N 0.00 -1.28 -0.41 -0.35 6.46 -0.69 0.38 115.31 119.42 1ea9 h LEU 224 Ca 0.60 0.08 0.05 0.00 -0.12 0.00 0.00 57.88 58.49 1ea9 h LEU 224 Cb 1.30 0.38 -0.08 0.00 -0.73 0.00 0.00 40.66 41.54 1ea9 h LEU 224 CO -0.87 -0.73 -0.55 0.58 -0.62 0.00 0.00 178.44 176.25 1ea9 h VAL 225 N -1.16 0.00 -0.72 1.05 2.07 0.07 0.90 116.25 118.46 1ea9 h VAL 225 Ca -0.10 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.58 1ea9 h VAL 225 Cb 0.94 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 1ea9 h VAL 225 CO 0.07 0.00 0.49 0.44 0.02 0.00 0.00 177.57 178.59 1ea9 h ASP 226 N -0.38 0.29 -0.06 0.57 5.19 -1.33 1.42 116.42 122.12 1ea9 h ASP 226 Ca 0.07 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.48 1ea9 h ASP 226 Cb 0.57 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 40.04 1ea9 h ASP 226 CO -0.59 0.15 -0.03 -0.07 -3.12 0.00 0.00 179.24 175.58 1ea9 h LEU 227 N 0.31 0.14 -0.10 1.55 3.38 0.46 -1.33 115.31 119.71 1ea9 h LEU 227 Ca 0.35 -0.41 -0.18 0.00 0.09 0.00 0.00 57.88 57.73 1ea9 h LEU 227 Cb 0.94 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.66 1ea9 h LEU 227 CO -0.09 0.52 -0.65 0.00 0.09 0.00 0.00 178.44 178.31 1ea9 h HIS 229 N 0.26 0.86 0.00 0.00 3.86 0.19 1.60 115.15 121.91 1ea9 h HIS 229 Ca -0.05 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1ea9 h HIS 229 Cb 1.30 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 29.52 1ea9 h HIS 229 CO 0.11 0.20 0.09 -1.91 0.86 0.00 0.00 177.93 177.27 1ea9 n GLU 230 N -4.84 0.13 -0.29 2.45 2.13 -0.50 0.12 120.64 119.84 1ea9 n GLU 230 Ca 0.19 0.62 0.07 0.00 0.66 0.00 0.00 57.16 58.70 1ea9 n GLU 230 Cb 0.47 -2.01 0.20 0.00 0.27 0.00 0.00 31.44 30.37 1ea9 n GLU 230 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1ea9 n ARG 231 N -2.23 2.87 -3.12 5.31 1.74 0.54 -4.96 116.66 116.81 1ea9 n ARG 231 Ca -0.01 -2.41 -0.14 0.00 -0.77 0.00 0.00 57.85 54.52 1ea9 n ARG 231 Cb 0.12 -1.53 0.06 0.00 -1.02 0.00 0.00 32.46 30.09 1ea9 n ARG 231 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ea9 n GLY 232 N -0.04 -0.09 2.88 -0.13 0.00 0.33 -5.01 105.19 103.13 1ea9 n GLY 232 Ca 0.16 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 1ea9 n GLY 232 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ea9 s ILE 233 N -3.23 1.53 0.71 -0.61 1.01 -0.73 -4.75 121.20 115.14 1ea9 s ILE 233 Ca 0.21 -1.73 -0.14 0.00 0.00 0.00 0.00 60.65 59.00 1ea9 s ILE 233 Cb -0.09 -2.08 0.03 0.00 0.01 0.00 0.00 42.46 40.33 1ea9 s ILE 233 CO 0.50 -0.54 1.12 -0.13 0.00 0.00 0.00 174.94 175.90 1ea9 s ARG 234 N 1.30 2.44 -0.02 2.79 3.00 -1.09 -3.35 118.95 124.02 1ea9 s ARG 234 Ca 0.07 1.42 0.02 0.00 0.00 0.00 0.00 55.73 57.24 1ea9 s ARG 234 Cb -0.18 -1.90 0.00 0.00 0.00 0.00 0.00 34.95 32.87 1ea9 s ARG 234 CO -0.15 -1.53 -0.07 0.08 0.00 0.00 0.00 175.30 173.63 1ea9 s VAL 235 N -2.42 0.61 0.23 3.52 1.01 -1.26 -2.39 120.40 119.70 1ea9 s VAL 235 Ca 0.67 -0.28 0.11 0.00 0.00 0.00 0.00 61.98 62.48 1ea9 s VAL 235 Cb -0.21 -0.55 -0.05 0.00 0.00 0.00 0.00 36.38 35.57 1ea9 s VAL 235 CO 0.46 0.20 -0.21 -0.76 0.00 0.00 0.00 175.10 174.78 1ea9 s LEU 236 N 0.14 2.51 -0.00 3.92 1.02 -1.24 0.46 118.68 125.48 1ea9 s LEU 236 Ca -0.02 -0.94 0.04 0.00 0.02 0.00 0.00 54.13 53.23 1ea9 s LEU 236 Cb -0.07 -1.09 -0.01 0.00 0.02 0.00 0.00 46.19 45.04 1ea9 s LEU 236 CO 0.00 0.06 -0.13 -0.76 0.02 0.00 0.00 176.35 175.55 1ea9 s LEU 237 N -3.05 2.05 0.33 1.79 1.02 0.16 -3.21 118.68 117.76 1ea9 s LEU 237 Ca 0.24 -0.26 -0.29 0.00 0.02 0.00 0.00 54.13 53.85 1ea9 s LEU 237 Cb -0.06 -0.62 -0.10 0.00 0.02 0.00 0.00 46.19 45.42 1ea9 s LEU 237 CO 0.12 0.13 1.23 -0.62 0.02 0.00 0.00 176.35 177.23 1ea9 s ASP 238 N -0.44 6.88 -0.19 2.29 -1.08 -1.26 -1.66 116.67 121.21 1ea9 s ASP 238 Ca 0.04 2.54 0.01 0.00 -0.52 0.00 0.00 52.55 54.62 1ea9 s ASP 238 Cb -0.05 -2.64 0.04 0.00 -1.46 0.00 0.00 42.92 38.81 1ea9 s ASP 238 CO -0.00 -0.44 -0.12 0.00 0.52 0.00 0.00 175.17 175.12 1ea9 s ALA 239 N -1.18 2.07 -0.59 3.66 0.00 0.83 -4.25 121.76 122.31 1ea9 s ALA 239 Ca 0.49 -1.20 -0.10 0.00 0.00 0.00 0.00 51.96 51.14 1ea9 s ALA 239 Cb -0.37 -1.25 0.15 0.00 0.00 0.00 0.00 23.12 21.65 1ea9 s ALA 239 CO 0.48 -0.71 0.48 0.08 0.00 0.00 0.00 175.76 176.09 1ea9 s VAL 240 N 1.37 4.61 -0.20 0.00 1.01 -1.26 -1.68 120.40 124.24 1ea9 s VAL 240 Ca 0.00 -2.08 -0.02 0.00 0.00 0.00 0.00 61.98 59.89 1ea9 s VAL 240 Cb -0.15 -3.97 -0.12 0.00 0.00 0.00 0.00 36.38 32.14 1ea9 s VAL 240 CO -0.09 -0.86 -0.20 0.49 0.00 0.00 0.00 175.10 174.43 1ea9 n PHE 241 N 4.54 0.00 -0.32 5.22 3.72 -1.26 -4.59 117.46 124.77 1ea9 n PHE 241 Ca -0.02 0.00 0.25 0.00 -0.05 0.00 0.00 57.45 57.63 1ea9 n PHE 241 Cb 0.41 -0.76 0.47 0.00 -0.94 0.00 0.00 39.48 38.66 1ea9 n PHE 241 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1ea9 n ASN 242 N -3.33 0.17 -4.10 4.37 5.15 -1.26 -4.44 115.26 111.82 1ea9 n ASN 242 Ca -0.37 1.63 -0.09 0.00 -0.60 0.00 0.00 54.58 55.15 1ea9 n ASN 242 Cb 0.85 -0.72 -0.10 0.00 -0.53 0.00 0.00 39.78 39.29 1ea9 n ASN 242 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 1ea9 s HIS 243 N -5.66 0.70 0.38 1.20 -3.43 -1.26 -0.05 115.29 107.17 1ea9 s HIS 243 Ca -0.10 -1.11 0.04 0.00 -0.80 0.00 0.00 55.06 53.08 1ea9 s HIS 243 Cb 0.31 -0.39 -0.03 0.00 -1.43 0.00 0.00 32.58 31.04 1ea9 s HIS 243 CO 0.76 -0.51 0.14 -1.54 -2.00 0.00 0.00 174.74 171.59 1ea9 s SER 244 N -3.00 2.50 0.91 7.38 1.04 0.30 -4.79 113.70 118.04 1ea9 s SER 244 Ca 0.18 -1.64 -0.13 0.00 0.48 0.00 0.00 55.95 54.84 1ea9 s SER 244 Cb 0.07 0.45 0.17 0.00 0.10 0.00 0.00 66.02 66.81 1ea9 s SER 244 CO -0.02 -0.91 1.26 -0.83 0.98 0.00 0.00 173.24 173.72 1ea9 s GLY 245 N -3.55 1.75 0.15 7.32 0.00 0.60 0.18 107.32 113.76 1ea9 s GLY 245 Ca 0.28 -1.18 -0.03 0.00 0.00 0.00 0.00 44.72 43.78 1ea9 s GLY 245 CO 0.16 -0.48 1.36 -0.09 0.00 0.00 0.00 173.10 174.04 1ea9 h ARG 246 N -1.41 0.42 0.00 2.90 2.43 -1.76 -2.92 114.38 114.03 1ea9 h ARG 246 Ca -0.44 -0.40 0.00 0.00 -0.81 0.00 0.00 59.98 58.33 1ea9 h ARG 246 Cb 1.25 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.90 1ea9 h ARG 246 CO 0.43 1.05 0.00 2.41 -1.51 0.00 0.00 179.97 182.35 1ea9 n THR 247 N -3.78 0.82 -1.61 0.20 -1.04 -1.26 -3.56 114.28 104.05 1ea9 n THR 247 Ca -0.06 0.21 -0.43 0.00 -2.04 0.00 0.00 64.05 61.73 1ea9 n THR 247 Cb 0.78 -1.02 -0.03 0.00 -1.82 0.00 0.00 70.33 68.24 1ea9 n THR 247 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1ea9 s PHE 248 N -2.66 1.17 0.09 -1.42 5.36 -1.10 -4.73 117.98 114.69 1ea9 s PHE 248 Ca 0.10 0.58 -0.09 0.00 -0.96 0.00 0.00 56.93 56.56 1ea9 s PHE 248 Cb 0.08 -3.92 0.07 0.00 -0.34 0.00 0.00 43.02 38.91 1ea9 s PHE 248 CO 0.18 -4.01 0.66 -0.35 -1.46 0.00 0.00 175.22 170.24 1ea9 n PRO 249 N 8.78 -0.12 0.13 10.12 -0.04 -1.26 -0.25 135.00 152.35 1ea9 n PRO 249 Ca 0.30 0.65 -0.12 0.00 -0.04 0.00 0.00 63.50 64.29 1ea9 n PRO 249 Cb 0.45 -0.97 -0.07 0.00 -0.04 0.00 0.00 33.50 32.87 1ea9 n PRO 249 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1ea9 h PRO 250 N 0.00 -0.59 -0.82 0.54 0.11 -1.93 1.35 132.00 130.66 1ea9 h PRO 250 Ca 0.13 0.04 0.19 0.00 0.11 0.00 0.00 66.00 66.47 1ea9 h PRO 250 Cb 0.24 0.13 -0.12 0.00 0.11 0.00 0.00 31.00 31.37 1ea9 h PRO 250 CO -0.42 -0.39 0.30 0.35 -0.21 0.00 0.00 178.00 177.63 1ea9 h PHE 251 N -0.61 0.49 0.55 0.65 3.57 -1.12 -0.04 116.94 120.43 1ea9 h PHE 251 Ca -0.02 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 1ea9 h PHE 251 Cb 0.57 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 1ea9 h PHE 251 CO -0.33 -0.05 -0.47 0.28 -2.23 0.00 0.00 178.31 175.51 1ea9 h VAL 252 N 0.36 0.07 -0.52 1.41 2.07 0.84 -0.70 116.25 119.77 1ea9 h VAL 252 Ca 0.49 0.00 0.15 0.00 0.82 0.00 0.00 66.70 68.16 1ea9 h VAL 252 Cb 0.87 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1ea9 h VAL 252 CO -0.51 0.00 0.76 -0.78 0.02 0.00 0.00 177.57 177.05 1ea9 h ASP 253 N -1.00 0.00 0.01 0.57 1.82 0.36 0.71 116.42 118.89 1ea9 h ASP 253 Ca -0.06 0.00 -0.27 0.00 -0.39 0.00 0.00 57.03 56.31 1ea9 h ASP 253 Cb 0.86 0.00 0.02 0.00 0.68 0.00 0.00 39.33 40.89 1ea9 h ASP 253 CO -0.02 0.00 -1.04 0.58 -1.61 0.00 0.00 179.24 177.14 1ea9 h VAL 254 N 0.00 1.28 0.00 2.25 2.07 -0.29 -2.04 116.25 119.53 1ea9 h VAL 254 Ca 0.25 -2.25 0.00 0.00 0.82 0.00 0.00 66.70 65.51 1ea9 h VAL 254 Cb 1.76 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 33.94 1ea9 h VAL 254 CO -0.00 0.70 0.00 0.18 0.02 0.00 0.00 177.57 178.46 1ea9 n LEU 255 N -3.87 0.00 0.00 2.57 4.77 0.25 0.66 117.00 121.38 1ea9 n LEU 255 Ca -0.11 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1ea9 n LEU 255 Cb 0.88 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 1ea9 n LEU 255 CO 0.56 -0.07 0.00 0.29 -1.33 0.00 0.00 177.39 176.83 1ea9 n LYS 256 N -1.07 0.00 0.00 3.23 5.02 -1.15 -4.74 118.16 119.45 1ea9 n LYS 256 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 1ea9 n LYS 256 Cb 0.00 -0.01 0.22 0.00 -0.02 0.00 0.00 35.03 35.22 1ea9 n LYS 256 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ea9 n ASN 257 N -1.62 0.00 0.00 4.39 4.13 -0.78 -4.79 115.26 116.59 1ea9 n ASN 257 Ca 0.00 0.43 0.00 0.00 1.68 0.00 0.00 54.58 56.69 1ea9 n ASN 257 Cb 0.00 -0.46 0.00 0.00 -1.54 0.00 0.00 39.78 37.78 1ea9 n ASN 257 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ea9 n GLY 258 N -0.48 0.43 0.41 7.41 0.00 0.21 -1.37 105.19 111.80 1ea9 n GLY 258 Ca 0.03 0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.28 1ea9 n GLY 258 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ea9 n GLU 259 N 0.74 0.02 -0.05 1.61 2.13 -1.26 -1.48 120.64 122.36 1ea9 n GLU 259 Ca 0.00 0.97 -0.06 0.00 0.66 0.00 0.00 57.16 58.73 1ea9 n GLU 259 Cb 0.00 -2.53 -0.05 0.00 0.27 0.00 0.00 31.44 29.13 1ea9 n GLU 259 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1ea9 n LYS 260 N -2.78 0.87 -0.91 5.31 5.02 -0.47 -5.00 118.16 120.19 1ea9 n LYS 260 Ca 0.09 0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 56.10 1ea9 n LYS 260 Cb 1.21 -1.20 -0.09 0.00 -0.02 0.00 0.00 35.03 34.93 1ea9 n LYS 260 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ea9 n SER 261 N -2.66 0.32 -0.03 4.39 2.88 -0.55 -4.70 113.62 113.27 1ea9 n SER 261 Ca -0.16 0.26 0.23 0.00 -1.33 0.00 0.00 58.87 57.87 1ea9 n SER 261 Cb 0.70 -0.60 0.57 0.00 -0.75 0.00 0.00 64.21 64.14 1ea9 n SER 261 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1ea9 h LYS 262 N 6.97 0.00 0.00 -1.46 1.57 -1.94 0.52 116.57 122.23 1ea9 h LYS 262 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1ea9 h LYS 262 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1ea9 h LYS 262 CO 0.82 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 180.36 1ea9 n TYR 263 N -3.38 0.00 0.00 -1.35 0.53 -1.26 -3.75 117.16 107.95 1ea9 n TYR 263 Ca 0.14 0.00 -0.00 0.00 -1.02 0.00 0.00 57.90 57.02 1ea9 n TYR 263 Cb 1.07 0.00 -0.00 0.00 -1.03 0.00 0.00 39.34 39.38 1ea9 n TYR 263 CO 0.00 0.00 0.00 -0.22 -1.02 0.00 0.00 176.86 175.62 1ea9 h LYS 264 N 0.00 -0.02 -0.70 -0.72 3.64 -0.26 -2.40 116.57 116.11 1ea9 h LYS 264 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1ea9 h LYS 264 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1ea9 h LYS 264 CO 0.00 -0.01 0.00 -0.40 -2.27 0.00 0.00 179.45 176.77 1ea9 n ASP 265 N -2.50 0.00 -0.03 4.20 5.68 -1.25 -1.90 116.55 120.76 1ea9 n ASP 265 Ca -0.00 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.32 1ea9 n ASP 265 Cb 0.01 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 39.84 1ea9 n ASP 265 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1ea9 n TRP 266 N 0.61 0.16 -4.62 2.11 7.02 -0.90 -4.74 117.44 117.07 1ea9 n TRP 266 Ca 0.00 0.05 -0.23 0.00 -1.02 0.00 0.00 57.50 56.30 1ea9 n TRP 266 Cb 0.00 -0.74 -0.14 0.00 -2.42 0.00 0.00 31.31 28.00 1ea9 n TRP 266 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 1ea9 s PHE 267 N -3.13 1.51 -0.32 -5.99 0.08 -0.80 -1.01 117.98 108.32 1ea9 s PHE 267 Ca -0.08 -0.33 -0.29 0.00 0.12 0.00 0.00 56.93 56.36 1ea9 s PHE 267 Cb 0.11 -0.93 0.00 0.00 -0.57 0.00 0.00 43.02 41.63 1ea9 s PHE 267 CO 0.87 0.03 1.34 -1.01 -0.10 0.00 0.00 175.22 176.35 1ea9 s HIS 268 N -0.64 2.58 -0.03 0.36 3.76 -1.17 -4.94 115.29 115.22 1ea9 s HIS 268 Ca 0.05 0.80 0.05 0.00 -0.15 0.00 0.00 55.06 55.82 1ea9 s HIS 268 Cb -0.07 -4.01 -0.03 0.00 1.11 0.00 0.00 32.58 29.58 1ea9 s HIS 268 CO 0.01 -1.85 -0.17 0.42 -0.85 0.00 0.00 174.74 172.30 1ea9 s ILE 269 N 4.67 2.85 -1.29 0.60 1.01 -1.26 -0.08 121.20 127.70 1ea9 s ILE 269 Ca 0.58 -0.88 0.20 0.00 0.00 0.00 0.00 60.65 60.55 1ea9 s ILE 269 Cb -0.16 -2.12 -0.14 0.00 0.01 0.00 0.00 42.46 40.05 1ea9 s ILE 269 CO 0.26 0.54 0.91 0.54 0.00 0.00 0.00 174.94 177.19 1ea9 n ARG 270 N 2.17 0.75 -3.27 2.79 1.74 -1.02 -4.86 116.66 114.95 1ea9 n ARG 270 Ca -0.17 -0.34 0.01 0.00 -0.77 0.00 0.00 57.85 56.58 1ea9 n ARG 270 Cb 0.52 -1.44 -0.03 0.00 -1.02 0.00 0.00 32.46 30.50 1ea9 n ARG 270 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ea9 s SER 271 N -2.69 -1.10 0.22 0.55 0.15 -0.82 -4.99 113.70 105.02 1ea9 s SER 271 Ca 0.11 0.90 0.03 0.00 0.70 0.00 0.00 55.95 57.69 1ea9 s SER 271 Cb 0.16 2.02 0.59 0.00 -1.71 0.00 0.00 66.02 67.08 1ea9 s SER 271 CO 0.72 -0.26 1.07 0.00 1.20 0.00 0.00 173.24 175.97 1ea9 n LEU 272 N 5.42 -0.03 -4.67 3.45 -0.00 -1.26 -4.17 117.00 115.75 1ea9 n LEU 272 Ca -0.03 1.15 -0.43 0.00 -0.00 0.00 0.00 56.01 56.70 1ea9 n LEU 272 Cb 0.51 -0.44 -0.02 0.00 -0.00 0.00 0.00 43.42 43.46 1ea9 n LEU 272 CO 0.02 -1.19 1.05 -2.84 -0.00 0.00 0.00 177.39 174.44 1ea9 s PRO 273 N -5.49 4.26 -0.94 1.47 0.02 -1.26 -4.75 135.00 128.32 1ea9 s PRO 273 Ca -0.08 1.67 -0.21 0.00 0.02 0.00 0.00 61.00 62.39 1ea9 s PRO 273 Cb 0.21 -3.71 0.09 0.00 0.02 0.00 0.00 34.50 31.10 1ea9 s PRO 273 CO 0.53 -0.64 1.26 -0.51 -0.33 0.00 0.00 177.00 177.31 1ea9 s LEU 274 N 3.16 4.24 -0.06 -5.54 1.43 -1.26 -4.88 118.68 115.77 1ea9 s LEU 274 Ca 0.55 -1.63 -0.30 0.00 -1.03 0.00 0.00 54.13 51.73 1ea9 s LEU 274 Cb -0.23 -2.48 0.10 0.00 0.03 0.00 0.00 46.19 43.61 1ea9 s LEU 274 CO 0.17 -1.32 0.82 -1.83 0.23 0.00 0.00 176.35 174.41 1ea9 s GLU 275 N 3.92 0.88 -0.00 1.70 4.04 -1.26 -5.06 118.70 122.92 1ea9 s GLU 275 Ca 0.38 0.06 0.00 0.00 0.04 0.00 0.00 54.97 55.45 1ea9 s GLU 275 Cb -0.04 0.41 -0.00 0.00 0.02 0.00 0.00 34.13 34.52 1ea9 s GLU 275 CO -0.07 -0.31 0.00 1.55 -1.84 0.00 0.00 175.26 174.60 1ea9 n VAL 276 N 0.54 0.01 -2.88 1.83 3.14 -1.26 -3.89 118.33 115.81 1ea9 n VAL 276 Ca -0.14 -0.01 -0.13 0.00 -2.96 0.00 0.00 64.34 61.10 1ea9 n VAL 276 Cb 0.59 -0.76 0.01 0.00 -1.06 0.00 0.00 33.84 32.62 1ea9 n VAL 276 CO 0.00 0.00 0.00 1.33 -6.46 0.00 0.00 176.83 171.70 1ea9 n VAL 277 N -1.93 -2.28 -3.03 1.55 0.24 -1.26 -4.14 118.33 107.47 1ea9 n VAL 277 Ca -0.00 0.27 -0.00 0.00 -2.04 0.00 0.00 64.34 62.57 1ea9 n VAL 277 Cb 0.43 -2.66 -0.00 0.00 -1.47 0.00 0.00 33.84 30.13 1ea9 n VAL 277 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1ea9 n ASP 278 N 0.80 -7.02 0.00 -1.34 5.68 -1.26 -4.90 116.55 108.51 1ea9 n ASP 278 Ca -0.03 0.75 0.00 0.00 -0.50 0.00 0.00 54.79 55.01 1ea9 n ASP 278 Cb 0.48 -2.81 0.00 0.00 -1.14 0.00 0.00 41.12 37.65 1ea9 n ASP 278 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ea9 n GLY 279 N 1.12 -0.22 3.66 6.12 0.00 -1.26 -5.12 105.19 109.49 1ea9 n GLY 279 Ca -0.00 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 1ea9 n GLY 279 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ea9 s ILE 280 N 0.00 4.25 0.47 -0.61 1.01 -1.26 -5.08 121.20 119.97 1ea9 s ILE 280 Ca 0.00 -0.27 -0.20 0.00 0.00 0.00 0.00 60.65 60.18 1ea9 s ILE 280 Cb 0.00 -2.79 -0.12 0.00 0.01 0.00 0.00 42.46 39.56 1ea9 s ILE 280 CO 0.00 0.59 0.37 -2.65 0.00 0.00 0.00 174.94 173.25 1ea9 n PRO 281 N 2.27 0.38 -0.26 2.79 -0.02 -1.26 -4.74 135.00 134.17 1ea9 n PRO 281 Ca -0.18 0.14 0.07 0.00 -2.02 0.00 0.00 63.50 61.51 1ea9 n PRO 281 Cb 0.53 -1.40 0.20 0.00 -0.02 0.00 0.00 33.50 32.82 1ea9 n PRO 281 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1ea9 n THR 282 N -1.18 0.70 -3.62 3.45 5.66 -1.25 -4.88 114.28 113.16 1ea9 n THR 282 Ca 0.11 -0.62 -0.15 0.00 -3.05 0.00 0.00 64.05 60.34 1ea9 n THR 282 Cb 0.43 0.24 -0.06 0.00 -1.55 0.00 0.00 70.33 69.38 1ea9 n THR 282 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1ea9 s TYR 283 N -1.46 -0.41 -0.13 1.09 1.13 -1.26 -1.94 117.35 114.38 1ea9 s TYR 283 Ca 0.30 0.55 -0.29 0.00 -1.41 0.00 0.00 57.07 56.23 1ea9 s TYR 283 Cb 0.16 0.29 -0.06 0.00 -1.10 0.00 0.00 41.96 41.25 1ea9 s TYR 283 CO 0.19 -0.57 2.10 -0.51 -2.51 0.00 0.00 175.55 174.26 1ea9 s ASP 284 N -1.64 5.85 0.00 -0.18 1.11 0.89 -4.86 116.67 117.84 1ea9 s ASP 284 Ca -0.09 2.16 0.00 0.00 0.18 0.00 0.00 52.55 54.81 1ea9 s ASP 284 Cb -0.01 -2.52 0.00 0.00 1.07 0.00 0.00 42.92 41.46 1ea9 s ASP 284 CO 0.02 -1.60 0.00 0.35 1.18 0.00 0.00 175.17 175.12 1ea9 n THR 285 N 6.90 0.00 0.28 -1.27 -2.24 -1.26 -1.99 114.28 114.69 1ea9 n THR 285 Ca 0.26 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.87 1ea9 n THR 285 Cb 0.44 -0.41 -0.09 0.00 -2.10 0.00 0.00 70.33 68.16 1ea9 n THR 285 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1ea9 h PHE 286 N 0.00 -1.32 0.00 4.78 3.57 -1.66 -3.41 116.94 118.90 1ea9 h PHE 286 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1ea9 h PHE 286 Cb 0.00 0.52 0.00 0.00 2.79 0.00 0.00 35.95 39.26 1ea9 h PHE 286 CO 0.00 -0.63 0.00 0.00 -2.23 0.00 0.00 178.31 175.45 1ea9 n ALA 287 N -2.78 2.77 -1.38 2.41 0.00 -1.26 -4.91 120.51 115.36 1ea9 n ALA 287 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1ea9 n ALA 287 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 1ea9 n ALA 287 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ea9 n PHE 288 N -2.16 0.00 -1.60 0.00 3.01 -1.26 -4.96 117.46 110.48 1ea9 n PHE 288 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 1ea9 n PHE 288 Cb 0.00 0.05 -0.03 0.00 -0.01 0.00 0.00 39.48 39.49 1ea9 n PHE 288 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1ea9 s GLU 289 N 0.00 3.01 0.19 -1.08 2.56 -1.26 -4.59 118.70 117.53 1ea9 s GLU 289 Ca 0.00 1.96 -0.19 0.00 0.00 0.00 0.00 54.97 56.74 1ea9 s GLU 289 Cb 0.00 -4.40 0.15 0.00 2.00 0.00 0.00 34.13 31.88 1ea9 s GLU 289 CO 0.00 -2.24 1.60 -1.35 -0.56 0.00 0.00 175.26 172.71 1ea9 h PRO 290 N 15.58 -0.13 -2.44 4.30 0.11 -2.00 -3.08 132.00 144.33 1ea9 h PRO 290 Ca -0.39 0.01 -0.81 0.00 0.11 0.00 0.00 66.00 64.92 1ea9 h PRO 290 Cb 1.24 0.03 -0.27 0.00 0.11 0.00 0.00 31.00 32.11 1ea9 h PRO 290 CO 0.98 -0.09 0.98 1.28 -0.21 0.00 0.00 178.00 180.95 1ea9 n LEU 291 N -5.43 7.11 -2.69 2.35 4.77 -1.26 -4.53 117.00 117.32 1ea9 n LEU 291 Ca 0.05 -5.33 -0.06 0.00 -0.03 0.00 0.00 56.01 50.63 1ea9 n LEU 291 Cb 0.35 -1.20 0.08 0.00 -2.33 0.00 0.00 43.42 40.32 1ea9 n LEU 291 CO 0.03 1.95 0.52 0.23 -1.33 0.00 0.00 177.39 178.79 1ea9 n MET 292 N 0.35 0.80 -1.56 3.23 2.81 -1.16 -4.13 117.12 117.46 1ea9 n MET 292 Ca 0.41 -1.46 -0.49 0.00 -1.81 0.00 0.00 57.70 54.35 1ea9 n MET 292 Cb 0.28 -0.29 -0.04 0.00 -0.71 0.00 0.00 33.22 32.46 1ea9 n MET 292 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 1ea9 n PRO 293 N -0.20 0.97 -2.69 0.03 -0.02 0.13 -2.37 135.00 130.85 1ea9 n PRO 293 Ca -0.06 0.35 -0.43 0.00 -2.02 0.00 0.00 63.50 61.33 1ea9 n PRO 293 Cb 0.76 -1.79 -0.02 0.00 -0.02 0.00 0.00 33.50 32.42 1ea9 n PRO 293 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1ea9 s LYS 294 N -0.48 4.30 1.39 -0.52 2.20 -0.84 0.11 119.74 125.90 1ea9 s LYS 294 Ca 0.73 1.33 -0.23 0.00 -0.36 0.00 0.00 55.97 57.44 1ea9 s LYS 294 Cb -0.88 -3.61 0.36 0.00 -1.51 0.00 0.00 37.83 32.18 1ea9 s LYS 294 CO 0.53 -0.53 0.88 1.28 -0.36 0.00 0.00 175.35 177.16 1ea9 n LEU 295 N 5.90 0.00 -3.26 5.43 7.99 0.93 -3.07 117.00 130.93 1ea9 n LEU 295 Ca 0.10 -0.91 -0.25 0.00 -0.01 0.00 0.00 56.01 54.95 1ea9 n LEU 295 Cb 0.47 -0.97 -0.07 0.00 -0.11 0.00 0.00 43.42 42.74 1ea9 n LEU 295 CO 0.52 -2.69 -0.21 -3.20 -1.51 0.00 0.00 177.39 170.30 1ea9 n ASN 296 N -5.59 1.05 -1.71 -1.43 4.05 -0.18 -4.29 115.26 107.16 1ea9 n ASN 296 Ca 0.14 -2.87 0.00 0.00 0.45 0.00 0.00 54.58 52.30 1ea9 n ASN 296 Cb 0.58 -0.65 0.00 0.00 1.23 0.00 0.00 39.78 40.95 1ea9 n ASN 296 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 177.26 174.56 1ea9 n THR 297 N 1.31 0.44 0.00 -0.44 -2.24 -1.26 -0.79 114.28 111.29 1ea9 n THR 297 Ca 0.23 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1ea9 n THR 297 Cb 0.50 -1.02 0.00 0.00 -2.10 0.00 0.00 70.33 67.70 1ea9 n THR 297 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ea9 n GLU 298 N 1.69 3.88 -3.31 -0.78 1.02 -1.26 -4.67 120.64 117.21 1ea9 n GLU 298 Ca 0.00 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.75 1ea9 n GLU 298 Cb 0.12 -0.54 -0.08 0.00 -0.02 0.00 0.00 31.44 30.92 1ea9 n GLU 298 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1ea9 s HIS 299 N -0.98 3.28 0.20 -0.32 2.46 0.03 -4.98 115.29 114.98 1ea9 s HIS 299 Ca 0.00 0.57 -0.21 0.00 0.47 0.00 0.00 55.06 55.89 1ea9 s HIS 299 Cb 0.00 -2.64 0.14 0.00 -0.13 0.00 0.00 32.58 29.95 1ea9 s HIS 299 CO 0.00 -0.21 1.56 -1.00 -2.47 0.00 0.00 174.74 172.62 1ea9 h PRO 300 N 7.93 -0.08 -0.84 2.88 0.13 -1.92 -0.08 132.00 140.01 1ea9 h PRO 300 Ca -0.31 0.01 0.13 0.00 -0.87 0.00 0.00 66.00 64.96 1ea9 h PRO 300 Cb 1.15 0.02 -0.09 0.00 0.13 0.00 0.00 31.00 32.21 1ea9 h PRO 300 CO 0.69 -0.05 0.44 -0.44 -0.23 0.00 0.00 178.00 178.41 1ea9 h ASP 301 N -0.08 0.55 0.59 1.44 3.32 -1.95 -0.88 116.42 119.41 1ea9 h ASP 301 Ca 0.27 0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.37 1ea9 h ASP 301 Cb 0.56 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.11 1ea9 h ASP 301 CO -0.85 0.26 -0.28 0.58 -1.72 0.00 0.00 179.24 177.23 1ea9 h VAL 302 N 0.66 0.00 -0.30 -1.35 2.07 -1.33 -2.86 116.25 113.14 1ea9 h VAL 302 Ca 0.44 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.87 1ea9 h VAL 302 Cb 0.57 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.29 1ea9 h VAL 302 CO -0.33 0.00 -0.32 0.50 0.02 0.00 0.00 177.57 177.44 1ea9 h LYS 303 N -0.91 -0.17 -1.30 1.57 3.64 -1.09 0.20 116.57 118.50 1ea9 h LYS 303 Ca -0.08 0.01 0.45 0.00 -1.27 0.00 0.00 60.65 59.76 1ea9 h LYS 303 Cb 0.60 0.04 -0.13 0.00 -0.41 0.00 0.00 32.23 32.33 1ea9 h LYS 303 CO 0.13 -0.11 0.84 -1.91 -2.27 0.00 0.00 179.45 176.12 1ea9 n GLU 304 N -4.21 -0.03 0.00 1.90 4.07 -0.36 -1.50 120.64 120.51 1ea9 n GLU 304 Ca -0.01 1.19 0.00 0.00 -0.06 0.00 0.00 57.16 58.27 1ea9 n GLU 304 Cb 0.18 -2.34 0.00 0.00 -0.06 0.00 0.00 31.44 29.22 1ea9 n GLU 304 CO 0.00 0.00 0.00 0.98 -0.06 0.00 0.00 177.13 178.05 1ea9 n TYR 305 N -4.60 0.00 -0.30 4.31 9.36 0.68 -0.68 117.16 125.93 1ea9 n TYR 305 Ca 0.38 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.72 1ea9 n TYR 305 Cb 1.48 -0.43 0.27 0.00 -0.63 0.00 0.00 39.34 40.03 1ea9 n TYR 305 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1ea9 h LEU 306 N 0.00 -0.13 0.30 2.98 4.07 -1.17 0.28 115.31 121.64 1ea9 h LEU 306 Ca 0.00 0.21 -0.00 0.00 0.08 0.00 0.00 57.88 58.17 1ea9 h LEU 306 Cb 0.00 0.32 -0.02 0.00 1.08 0.00 0.00 40.66 42.04 1ea9 h LEU 306 CO 0.00 -0.20 -0.26 -0.07 -1.08 0.00 0.00 178.44 176.83 1ea9 h LEU 307 N 0.15 -0.67 -2.27 1.67 3.38 -1.35 0.70 115.31 116.91 1ea9 h LEU 307 Ca 0.54 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.58 1ea9 h LEU 307 Cb 1.09 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 1ea9 h LEU 307 CO -0.70 -0.38 0.24 0.50 0.09 0.00 0.00 178.44 178.19 1ea9 h LYS 308 N -0.57 0.00 0.00 1.13 3.64 0.18 1.22 116.57 122.17 1ea9 h LYS 308 Ca -0.02 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1ea9 h LYS 308 Cb 0.51 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1ea9 h LYS 308 CO -0.03 0.00 -0.33 0.00 -2.27 0.00 0.00 179.45 176.82 1ea9 h ALA 309 N 1.54 0.83 0.06 5.00 0.00 0.11 -2.95 119.26 123.86 1ea9 h ALA 309 Ca 0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ea9 h ALA 309 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1ea9 h ALA 309 CO -0.00 0.03 -0.03 0.00 0.00 0.00 0.00 179.25 179.25 1ea9 h ALA 310 N 1.98 -0.16 -0.92 0.00 0.00 0.27 -2.73 119.26 117.69 1ea9 h ALA 310 Ca -0.00 -0.02 0.19 0.00 0.00 0.00 0.00 54.91 55.08 1ea9 h ALA 310 Cb 1.02 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.76 1ea9 h ALA 310 CO 0.00 -0.16 0.60 1.49 0.00 0.00 0.00 179.25 181.18 1ea9 h GLU 311 N -0.44 0.51 0.00 0.00 4.22 -1.67 -1.45 114.58 115.75 1ea9 h GLU 311 Ca -0.01 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.40 1ea9 h GLU 311 Cb 0.06 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1ea9 h GLU 311 CO 0.01 0.34 0.00 0.98 -2.18 0.00 0.00 179.01 178.16 1ea9 n TYR 312 N -4.57 0.00 0.13 0.92 4.19 -1.11 -1.15 117.16 115.57 1ea9 n TYR 312 Ca 0.20 0.00 0.19 0.00 3.31 0.00 0.00 57.90 61.60 1ea9 n TYR 312 Cb 0.63 -0.19 0.75 0.00 0.49 0.00 0.00 39.34 41.02 1ea9 n TYR 312 CO 0.00 0.00 0.00 -1.49 0.91 0.00 0.00 176.86 176.28 1ea9 h TRP 313 N 0.00 0.00 0.69 2.98 4.06 -1.14 -1.50 115.95 121.04 1ea9 h TRP 313 Ca 0.00 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.92 1ea9 h TRP 313 Cb 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.17 1ea9 h TRP 313 CO -0.10 0.00 -0.33 0.82 -3.56 0.00 0.00 178.44 175.27 1ea9 h ILE 314 N 0.00 0.00 0.31 1.49 1.08 -0.84 -2.97 117.51 116.58 1ea9 h ILE 314 Ca 0.16 -0.29 -0.01 0.00 -0.39 0.00 0.00 64.86 64.33 1ea9 h ILE 314 Cb 1.02 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.76 1ea9 h ILE 314 CO -0.00 0.00 -0.28 -0.09 -0.69 0.00 0.00 178.15 177.09 1ea9 h ARG 315 N -1.22 -0.56 -0.08 2.37 2.43 -0.14 0.53 114.38 117.71 1ea9 h ARG 315 Ca -0.09 0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1ea9 h ARG 315 Cb 0.71 0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.34 1ea9 h ARG 315 CO 0.16 -0.38 -0.43 0.93 -1.51 0.00 0.00 179.97 178.74 1ea9 h GLU 316 N -0.59 -0.46 0.00 0.20 4.39 -1.54 -3.07 114.58 113.52 1ea9 h GLU 316 Ca -0.04 0.03 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 1ea9 h GLU 316 Cb 0.50 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 1ea9 h GLU 316 CO -0.02 -0.31 -0.65 1.15 -1.16 0.00 0.00 179.01 178.03 1ea9 h THR 317 N -0.48 0.96 -3.10 1.13 2.02 -1.63 -3.47 112.91 108.34 1ea9 h THR 317 Ca 0.02 -2.38 -0.15 0.00 0.77 0.00 0.00 66.41 64.68 1ea9 h THR 317 Cb 0.54 2.46 0.06 0.00 -1.74 0.00 0.00 68.15 69.47 1ea9 h THR 317 CO -0.33 0.55 -0.28 0.61 0.37 0.00 0.00 175.52 176.44 1ea9 n GLY 318 N 1.26 0.28 1.83 2.16 0.00 0.18 -4.55 105.19 106.35 1ea9 n GLY 318 Ca 0.01 -0.29 -0.14 0.00 0.00 0.00 0.00 46.02 45.60 1ea9 n GLY 318 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ea9 n ILE 319 N -3.02 0.00 0.00 -0.61 -5.35 -1.17 -4.90 119.36 104.32 1ea9 n ILE 319 Ca -0.04 -0.42 0.00 0.00 -0.27 0.00 0.00 62.75 62.02 1ea9 n ILE 319 Cb 0.54 -1.61 0.00 0.00 -1.74 0.00 0.00 39.64 36.83 1ea9 n ILE 319 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1ea9 n ASP 320 N -3.53 1.06 -4.21 7.28 8.00 0.17 -4.94 116.55 120.38 1ea9 n ASP 320 Ca 0.08 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.37 1ea9 n ASP 320 Cb 0.28 0.14 -0.12 0.00 -0.02 0.00 0.00 41.12 41.39 1ea9 n ASP 320 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1ea9 s GLY 321 N -1.13 0.98 -0.30 0.44 0.00 -0.55 -2.00 107.32 104.75 1ea9 s GLY 321 Ca 0.00 -1.05 0.01 0.00 0.00 0.00 0.00 44.72 43.68 1ea9 s GLY 321 CO 0.00 -1.05 0.05 -0.98 0.00 0.00 0.00 173.10 171.12 1ea9 s TRP 322 N -1.14 2.52 -0.00 1.90 0.23 -1.14 0.37 118.94 121.68 1ea9 s TRP 322 Ca 0.02 -2.14 -0.30 0.00 -2.03 0.00 0.00 56.10 51.64 1ea9 s TRP 322 Cb -0.10 -2.08 -0.03 0.00 0.03 0.00 0.00 33.47 31.30 1ea9 s TRP 322 CO 0.03 -0.87 1.02 0.50 0.96 0.00 0.00 176.95 178.58 1ea9 s ARG 323 N 1.34 4.52 -0.95 4.98 3.00 -0.66 -3.85 118.95 127.33 1ea9 s ARG 323 Ca 0.07 1.47 -0.09 0.00 -1.00 0.00 0.00 55.73 56.18 1ea9 s ARG 323 Cb -0.18 -3.45 0.24 0.00 0.00 0.00 0.00 34.95 31.56 1ea9 s ARG 323 CO -0.15 -0.12 0.90 -0.51 0.00 0.00 0.00 175.30 175.42 1ea9 s LEU 324 N 1.15 6.24 -0.42 -0.88 1.43 -0.60 0.29 118.68 125.89 1ea9 s LEU 324 Ca 0.53 -3.30 -0.40 0.00 -1.03 0.00 0.00 54.13 49.93 1ea9 s LEU 324 Cb -0.22 -2.13 -0.16 0.00 0.03 0.00 0.00 46.19 43.71 1ea9 s LEU 324 CO 0.27 -0.36 2.11 -0.67 0.23 0.00 0.00 176.35 177.93 1ea9 n ASP 325 N 3.07 1.43 -2.71 2.29 -0.08 -0.68 0.60 116.55 120.48 1ea9 n ASP 325 Ca 0.19 0.62 -0.18 0.00 -1.51 0.00 0.00 54.79 53.92 1ea9 n ASP 325 Cb 0.41 -1.06 0.05 0.00 2.34 0.00 0.00 41.12 42.86 1ea9 n ASP 325 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1ea9 n VAL 326 N 6.53 -2.05 -0.24 5.18 0.31 -1.24 -4.60 118.33 122.23 1ea9 n VAL 326 Ca 0.46 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.75 1ea9 n VAL 326 Cb 0.08 -3.25 0.02 0.00 -0.91 0.00 0.00 33.84 29.77 1ea9 n VAL 326 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ea9 h ALA 327 N 0.78 0.02 -1.30 3.52 0.00 -0.01 -2.18 119.26 120.09 1ea9 h ALA 327 Ca -0.43 0.19 0.38 0.00 0.00 0.00 0.00 54.91 55.05 1ea9 h ALA 327 Cb 1.28 0.82 -0.08 0.00 0.00 0.00 0.00 17.79 19.82 1ea9 h ALA 327 CO 0.43 -0.65 0.91 -2.95 0.00 0.00 0.00 179.25 176.99 1ea9 h ASN 328 N -0.12 0.14 0.40 0.00 -0.00 -1.85 0.41 115.58 114.55 1ea9 h ASN 328 Ca 0.26 0.04 -0.05 0.00 -0.00 0.00 0.00 56.30 56.56 1ea9 h ASN 328 Cb 0.56 0.02 -0.01 0.00 -0.00 0.00 0.00 38.32 38.90 1ea9 h ASN 328 CO -0.74 -0.01 -0.22 -0.08 -0.00 0.00 0.00 177.43 176.38 1ea9 h GLU 329 N 0.10 0.00 -6.39 4.14 4.81 -1.78 -3.42 114.58 112.04 1ea9 h GLU 329 Ca 0.67 0.00 -0.54 0.00 -0.13 0.00 0.00 59.36 59.36 1ea9 h GLU 329 Cb 2.40 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.76 1ea9 h GLU 329 CO -0.14 0.22 0.34 0.08 -0.73 0.00 0.00 179.01 178.77 1ea9 s VAL 330 N -4.20 4.84 0.33 0.32 1.01 0.14 -4.98 120.40 117.87 1ea9 s VAL 330 Ca -0.03 1.99 -0.25 0.00 0.00 0.00 0.00 61.98 63.70 1ea9 s VAL 330 Cb 0.14 -4.29 -0.14 0.00 0.00 0.00 0.00 36.38 32.08 1ea9 s VAL 330 CO 0.65 0.19 0.61 -1.54 0.00 0.00 0.00 175.10 175.01 1ea9 n SER 331 N 3.74 -0.64 -0.33 3.32 3.41 -1.26 -4.79 113.62 117.06 1ea9 n SER 331 Ca 0.05 1.02 0.02 0.00 -0.26 0.00 0.00 58.87 59.70 1ea9 n SER 331 Cb 0.51 -1.09 0.16 0.00 -0.26 0.00 0.00 64.21 63.52 1ea9 n SER 331 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 1ea9 h HIS 332 N 1.09 1.06 -0.19 7.33 3.86 -1.93 -2.74 115.15 123.62 1ea9 h HIS 332 Ca -0.37 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 58.89 1ea9 h HIS 332 Cb 1.40 -0.34 -0.03 0.00 1.06 0.00 0.00 27.41 29.50 1ea9 h HIS 332 CO 0.40 0.53 -0.17 0.37 0.86 0.00 0.00 177.93 179.92 1ea9 h GLN 333 N 1.03 -0.06 -0.60 2.45 5.75 -1.96 1.75 115.11 123.47 1ea9 h GLN 333 Ca 0.40 0.00 0.11 0.00 -0.15 0.00 0.00 58.65 59.02 1ea9 h GLN 333 Cb 0.20 0.01 -0.12 0.00 1.07 0.00 0.00 27.48 28.65 1ea9 h GLN 333 CO -0.18 -0.04 -0.29 0.35 -2.65 0.00 0.00 178.83 176.02 1ea9 h PHE 334 N -0.07 -0.76 -0.89 3.99 3.04 -1.76 0.22 116.94 120.70 1ea9 h PHE 334 Ca 0.03 0.07 0.05 0.00 3.98 0.00 0.00 57.97 62.10 1ea9 h PHE 334 Cb 0.15 0.42 -0.06 0.00 2.56 0.00 0.00 35.95 39.02 1ea9 h PHE 334 CO -0.78 -0.36 0.57 -1.49 -2.02 0.00 0.00 178.31 174.23 1ea9 h TRP 335 N -0.13 1.05 -0.56 0.41 -0.00 -0.84 0.95 115.95 116.84 1ea9 h TRP 335 Ca 0.25 0.03 0.10 0.00 -0.00 0.00 0.00 58.89 59.27 1ea9 h TRP 335 Cb 0.53 -0.34 -0.03 0.00 -0.00 0.00 0.00 29.16 29.32 1ea9 h TRP 335 CO -0.60 0.56 0.38 0.00 -0.00 0.00 0.00 178.44 178.78 1ea9 h ARG 336 N 1.05 0.32 0.01 0.49 3.08 0.58 -2.32 114.38 117.60 1ea9 h ARG 336 Ca 0.38 -0.02 -0.26 0.00 0.07 0.00 0.00 59.98 60.15 1ea9 h ARG 336 Cb 0.12 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1ea9 h ARG 336 CO -0.16 0.21 -1.41 0.39 -1.07 0.00 0.00 179.97 177.93 1ea9 n GLU 337 N -4.46 0.59 -0.33 0.04 1.02 -0.12 -3.99 120.64 113.39 1ea9 n GLU 337 Ca 0.09 0.53 0.15 0.00 -0.02 0.00 0.00 57.16 57.91 1ea9 n GLU 337 Cb 0.39 -1.73 0.30 0.00 -0.02 0.00 0.00 31.44 30.38 1ea9 n GLU 337 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1ea9 n PHE 338 N -4.32 0.64 0.13 -0.32 7.35 0.31 0.36 117.46 121.61 1ea9 n PHE 338 Ca -0.33 1.14 -0.08 0.00 -0.76 0.00 0.00 57.45 57.42 1ea9 n PHE 338 Cb 0.73 -1.23 -0.04 0.00 0.35 0.00 0.00 39.48 39.29 1ea9 n PHE 338 CO 0.00 0.00 0.00 -0.09 -0.76 0.00 0.00 176.76 175.91 1ea9 h ARG 339 N 0.00 -0.42 -0.42 -4.13 2.43 -1.58 0.28 114.38 110.53 1ea9 h ARG 339 Ca 0.59 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.87 1ea9 h ARG 339 Cb 1.25 0.10 -0.09 0.00 -0.42 0.00 0.00 29.97 30.80 1ea9 h ARG 339 CO -0.88 -0.28 -0.38 -0.09 -1.51 0.00 0.00 179.97 176.83 1ea9 h ARG 340 N -0.44 -0.27 -0.99 0.20 2.43 -0.98 0.20 114.38 114.53 1ea9 h ARG 340 Ca -0.03 0.02 0.33 0.00 -0.81 0.00 0.00 59.98 59.49 1ea9 h ARG 340 Cb 0.38 0.06 -0.15 0.00 -0.42 0.00 0.00 29.97 29.84 1ea9 h ARG 340 CO -0.03 -0.18 0.52 0.28 -1.51 0.00 0.00 179.97 179.05 1ea9 h VAL 341 N -0.28 0.24 0.00 0.20 2.07 0.38 0.23 116.25 119.08 1ea9 h VAL 341 Ca 0.16 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.59 1ea9 h VAL 341 Cb 0.57 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1ea9 h VAL 341 CO -0.57 0.05 -0.19 -0.37 0.02 0.00 0.00 177.57 176.50 1ea9 h VAL 342 N 0.25 0.05 -1.02 2.57 -1.51 0.20 -3.26 116.25 113.54 1ea9 h VAL 342 Ca 0.73 -1.05 0.33 0.00 -1.23 0.00 0.00 66.70 65.48 1ea9 h VAL 342 Cb 1.71 0.11 -0.15 0.00 -2.13 0.00 0.00 31.29 30.83 1ea9 h VAL 342 CO -0.65 0.02 0.59 0.11 -1.23 0.00 0.00 177.57 176.41 1ea9 h LYS 343 N -1.00 0.31 0.09 5.19 1.79 -0.40 1.17 116.57 123.72 1ea9 h LYS 343 Ca -0.00 -0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1ea9 h LYS 343 Cb 0.21 -0.07 -0.05 0.00 -1.58 0.00 0.00 32.23 30.75 1ea9 h LYS 343 CO -0.00 0.20 -0.51 0.37 -1.08 0.00 0.00 179.45 178.43 1ea9 h GLN 344 N 0.32 -0.68 -1.00 3.15 4.15 -0.69 -0.75 115.11 119.60 1ea9 h GLN 344 Ca 0.74 0.05 0.08 0.00 0.77 0.00 0.00 58.65 60.28 1ea9 h GLN 344 Cb 1.72 0.15 -0.07 0.00 0.21 0.00 0.00 27.48 29.49 1ea9 h GLN 344 CO -0.58 -0.45 0.64 0.00 -1.93 0.00 0.00 178.83 176.50 1ea9 h ALA 345 N -0.56 1.44 -3.34 3.38 0.00 0.11 -3.40 119.26 116.90 1ea9 h ALA 345 Ca -0.00 -0.01 -0.42 0.00 0.00 0.00 0.00 54.91 54.48 1ea9 h ALA 345 Cb 0.72 -0.28 -0.37 0.00 0.00 0.00 0.00 17.79 17.87 1ea9 h ALA 345 CO -0.29 0.38 -0.77 1.21 0.00 0.00 0.00 179.25 179.78 1ea9 s ASN 346 N -5.85 1.27 0.11 0.00 3.84 0.14 -4.95 114.94 109.49 1ea9 s ASN 346 Ca -0.12 -0.08 -0.28 0.00 0.21 0.00 0.00 52.86 52.59 1ea9 s ASN 346 Cb 0.21 -0.41 -0.10 0.00 -0.55 0.00 0.00 41.25 40.40 1ea9 s ASN 346 CO 0.81 -0.15 1.64 -0.65 -2.79 0.00 0.00 177.10 175.96 1ea9 h PRO 347 N 7.91 -0.48 -3.06 0.43 0.11 -1.75 -3.32 132.00 131.85 1ea9 h PRO 347 Ca -0.27 0.03 -0.67 0.00 0.11 0.00 0.00 66.00 65.21 1ea9 h PRO 347 Cb 1.13 0.11 -0.38 0.00 0.11 0.00 0.00 31.00 31.97 1ea9 h PRO 347 CO 0.34 -0.32 -0.26 -0.25 -0.21 0.00 0.00 178.00 177.29 1ea9 n ASP 348 N -5.38 3.90 -4.50 -2.05 8.00 -1.26 -4.91 116.55 110.35 1ea9 n ASP 348 Ca -0.07 -3.22 -0.33 0.00 0.71 0.00 0.00 54.79 51.87 1ea9 n ASP 348 Cb 0.29 -0.92 -0.12 0.00 -0.02 0.00 0.00 41.12 40.35 1ea9 n ASP 348 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ea9 s ALA 349 N -1.66 2.83 0.11 2.24 0.00 -1.25 -4.88 121.76 119.16 1ea9 s ALA 349 Ca 0.29 -0.90 -0.29 0.00 0.00 0.00 0.00 51.96 51.06 1ea9 s ALA 349 Cb -0.02 -1.21 -0.06 0.00 0.00 0.00 0.00 23.12 21.83 1ea9 s ALA 349 CO -0.11 0.45 0.90 -0.47 0.00 0.00 0.00 175.76 176.53 1ea9 s TYR 350 N -0.39 3.82 -0.06 0.00 5.04 -0.85 -4.57 117.35 120.34 1ea9 s TYR 350 Ca 0.05 1.73 -0.01 0.00 -2.44 0.00 0.00 57.07 56.40 1ea9 s TYR 350 Cb -0.12 -2.97 0.03 0.00 0.35 0.00 0.00 41.96 39.24 1ea9 s TYR 350 CO 0.02 0.27 -0.01 0.42 -1.34 0.00 0.00 175.55 174.92 1ea9 s ILE 351 N -0.22 0.39 0.07 3.14 1.01 -1.26 -2.90 121.20 121.43 1ea9 s ILE 351 Ca 0.44 0.07 -0.09 0.00 0.00 0.00 0.00 60.65 61.07 1ea9 s ILE 351 Cb -0.23 -0.51 -0.00 0.00 0.01 0.00 0.00 42.46 41.73 1ea9 s ILE 351 CO 0.28 0.24 0.18 -1.48 0.00 0.00 0.00 174.94 174.17 1ea9 s LEU 352 N 1.67 1.45 0.09 2.97 2.34 -1.25 0.92 118.68 126.86 1ea9 s LEU 352 Ca 0.00 -0.59 0.04 0.00 0.06 0.00 0.00 54.13 53.65 1ea9 s LEU 352 Cb -0.13 0.98 -0.03 0.00 -0.56 0.00 0.00 46.19 46.45 1ea9 s LEU 352 CO -0.04 -0.68 -0.11 -0.83 -1.06 0.00 0.00 176.35 173.63 1ea9 s GLY 353 N -2.65 0.84 -0.62 -3.48 0.00 -1.26 -1.55 107.32 98.61 1ea9 s GLY 353 Ca 0.02 -1.13 -0.20 0.00 0.00 0.00 0.00 44.72 43.41 1ea9 s GLY 353 CO -0.09 -1.19 1.85 -2.21 0.00 0.00 0.00 173.10 171.46 1ea9 n GLU 354 N 0.77 1.25 -3.68 2.90 2.13 -0.79 -2.05 120.64 121.18 1ea9 n GLU 354 Ca -0.18 -1.57 -0.38 0.00 0.66 0.00 0.00 57.16 55.69 1ea9 n GLU 354 Cb 0.57 -2.73 -0.10 0.00 0.27 0.00 0.00 31.44 29.44 1ea9 n GLU 354 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1ea9 s VAL 355 N 5.12 3.70 0.00 6.31 1.01 -1.26 -3.60 120.40 131.68 1ea9 s VAL 355 Ca 0.54 -1.97 0.00 0.00 0.00 0.00 0.00 61.98 60.55 1ea9 s VAL 355 Cb 0.13 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1ea9 s VAL 355 CO 0.13 -0.74 0.83 0.79 0.00 0.00 0.00 175.10 176.12 1ea9 n TRP 356 N 4.69 0.00 -0.54 5.22 8.01 -1.26 -4.66 117.44 128.90 1ea9 n TRP 356 Ca -0.04 0.00 -0.28 0.00 -1.31 0.00 0.00 57.50 55.87 1ea9 n TRP 356 Cb 0.41 -0.33 0.26 0.00 -2.01 0.00 0.00 31.31 29.64 1ea9 n TRP 356 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 177.69 173.30 1ea9 s HIS 357 N -2.32 1.24 0.20 -5.99 -3.43 -1.26 -4.39 115.29 99.34 1ea9 s HIS 357 Ca 0.00 1.11 -0.31 0.00 -0.80 0.00 0.00 55.06 55.06 1ea9 s HIS 357 Cb 0.00 -3.08 -0.16 0.00 -1.43 0.00 0.00 32.58 27.91 1ea9 s HIS 357 CO 0.00 -4.01 0.91 -1.91 -2.00 0.00 0.00 174.74 167.74 1ea9 n GLU 358 N -5.00 0.76 -3.02 -0.38 0.00 -1.26 -4.94 120.64 106.79 1ea9 n GLU 358 Ca 0.03 0.27 -0.21 0.00 0.00 0.00 0.00 57.16 57.25 1ea9 n GLU 358 Cb 0.55 -1.58 -0.03 0.00 0.00 0.00 0.00 31.44 30.38 1ea9 n GLU 358 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 1ea9 n SER 359 N 1.73 2.31 0.00 4.31 3.41 -1.26 -4.98 113.62 119.14 1ea9 n SER 359 Ca 0.15 -3.25 0.00 0.00 -0.26 0.00 0.00 58.87 55.51 1ea9 n SER 359 Cb 0.25 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 1ea9 n SER 359 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ea9 n SER 360 N 0.03 0.00 -0.32 4.04 7.64 -1.26 -3.33 113.62 120.42 1ea9 n SER 360 Ca 0.26 0.76 0.28 0.00 1.01 0.00 0.00 58.87 61.19 1ea9 n SER 360 Cb 0.58 -0.26 0.49 0.00 -1.01 0.00 0.00 64.21 64.01 1ea9 n SER 360 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1ea9 n ILE 361 N -1.29 -0.22 1.39 0.44 -5.35 -1.26 0.14 119.36 113.22 1ea9 n ILE 361 Ca 0.00 1.39 0.01 0.00 -0.27 0.00 0.00 62.75 63.88 1ea9 n ILE 361 Cb 0.00 -2.27 0.02 0.00 -1.74 0.00 0.00 39.64 35.65 1ea9 n ILE 361 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 1ea9 n TRP 362 N -4.31 0.08 -2.80 4.28 8.01 -1.21 -3.70 117.44 117.79 1ea9 n TRP 362 Ca 0.30 -0.03 -0.01 0.00 -1.31 0.00 0.00 57.50 56.45 1ea9 n TRP 362 Cb 1.12 -0.06 0.06 0.00 -2.01 0.00 0.00 31.31 30.42 1ea9 n TRP 362 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 1ea9 n LEU 363 N -0.18 1.02 0.02 -0.99 4.77 0.38 -3.59 117.00 118.42 1ea9 n LEU 363 Ca 0.01 -3.08 -0.01 0.00 -0.03 0.00 0.00 56.01 52.90 1ea9 n LEU 363 Cb 0.17 0.41 -0.10 0.00 -2.33 0.00 0.00 43.42 41.57 1ea9 n LEU 363 CO 0.01 1.17 -0.38 1.21 -1.33 0.00 0.00 177.39 178.07 1ea9 n GLU 364 N -0.75 0.63 0.00 3.23 4.07 -1.24 -4.92 120.64 121.66 1ea9 n GLU 364 Ca 0.03 0.21 0.00 0.00 -0.06 0.00 0.00 57.16 57.34 1ea9 n GLU 364 Cb 0.81 -1.78 0.00 0.00 -0.06 0.00 0.00 31.44 30.41 1ea9 n GLU 364 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ea9 n GLY 365 N 1.43 0.17 1.02 8.31 0.00 -1.26 -4.65 105.19 110.20 1ea9 n GLY 365 Ca -0.12 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 1ea9 n GLY 365 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ea9 n ASP 366 N 0.00 2.65 0.00 1.61 5.75 -1.26 -4.85 116.55 120.45 1ea9 n ASP 366 Ca 0.00 -3.86 0.00 0.00 -0.01 0.00 0.00 54.79 50.92 1ea9 n ASP 366 Cb 0.00 -0.48 0.00 0.00 -1.03 0.00 0.00 41.12 39.61 1ea9 n ASP 366 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ea9 n GLN 367 N -1.01 0.00 -1.61 0.11 6.02 -1.26 -4.05 117.38 115.58 1ea9 n GLN 367 Ca 0.26 0.00 -0.51 0.00 -0.01 0.00 0.00 57.00 56.74 1ea9 n GLN 367 Cb 0.78 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.98 1ea9 n GLN 367 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1ea9 n PHE 368 N 0.00 1.67 -0.27 1.08 3.72 -1.24 -4.82 117.46 117.61 1ea9 n PHE 368 Ca 0.00 0.57 0.04 0.00 -0.05 0.00 0.00 57.45 58.01 1ea9 n PHE 368 Cb 0.00 -2.38 0.18 0.00 -0.94 0.00 0.00 39.48 36.34 1ea9 n PHE 368 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1ea9 h ASP 369 N 5.01 0.47 -0.82 4.37 3.32 0.23 -3.41 116.42 125.59 1ea9 h ASP 369 Ca -0.47 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1ea9 h ASP 369 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.88 1ea9 h ASP 369 CO 0.81 0.23 0.00 0.00 -1.72 0.00 0.00 179.24 178.56 1ea9 n ALA 370 N -2.43 0.00 -2.15 3.45 0.00 -0.33 -4.86 120.51 114.19 1ea9 n ALA 370 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.49 1ea9 n ALA 370 Cb 0.35 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.70 1ea9 n ALA 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1ea9 s VAL 371 N -1.81 0.13 -1.25 0.00 -7.23 -1.26 -3.89 120.40 105.09 1ea9 s VAL 371 Ca 0.00 -1.88 -0.19 0.00 -1.81 0.00 0.00 61.98 58.10 1ea9 s VAL 371 Cb 0.00 -1.93 0.04 0.00 0.56 0.00 0.00 36.38 35.06 1ea9 s VAL 371 CO 0.00 -0.57 1.74 -0.32 -0.31 0.00 0.00 175.10 175.64 1ea9 s MET 372 N -4.02 3.69 -0.55 4.82 1.75 -0.87 -2.52 119.30 121.59 1ea9 s MET 372 Ca 0.20 -1.75 -0.28 0.00 -1.25 0.00 0.00 55.69 52.62 1ea9 s MET 372 Cb 0.07 -5.47 0.01 0.00 2.84 0.00 0.00 34.83 32.28 1ea9 s MET 372 CO -0.01 -2.54 1.51 1.21 -0.65 0.00 0.00 175.02 174.54 1ea9 s ASN 373 N 4.73 5.98 0.02 1.11 2.47 -0.90 -4.38 114.94 123.96 1ea9 s ASN 373 Ca 0.56 0.36 0.15 0.00 0.42 0.00 0.00 52.86 54.35 1ea9 s ASN 373 Cb 0.03 -2.54 -0.17 0.00 -1.45 0.00 0.00 41.25 37.11 1ea9 s ASN 373 CO 0.07 -1.82 0.76 -1.22 -3.72 0.00 0.00 177.10 171.17 1ea9 n TYR 374 N 10.12 0.98 0.08 0.43 4.01 -1.26 -3.85 117.16 127.67 1ea9 n TYR 374 Ca 0.14 0.34 0.00 0.00 -0.16 0.00 0.00 57.90 58.22 1ea9 n TYR 374 Cb 0.49 -1.12 0.00 0.00 -0.31 0.00 0.00 39.34 38.40 1ea9 n TYR 374 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1ea9 n PRO 375 N -2.94 0.04 -0.11 -0.72 -0.04 -1.26 0.14 135.00 130.11 1ea9 n PRO 375 Ca -0.12 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.11 1ea9 n PRO 375 Cb 0.92 -1.02 -0.08 0.00 -0.04 0.00 0.00 33.50 33.28 1ea9 n PRO 375 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1ea9 n PHE 376 N -0.52 0.00 0.00 0.54 7.35 -1.25 -3.95 117.46 119.63 1ea9 n PHE 376 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1ea9 n PHE 376 Cb 0.00 -0.78 0.00 0.00 0.35 0.00 0.00 39.48 39.05 1ea9 n PHE 376 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 1ea9 n THR 377 N -4.04 0.00 -0.32 -2.13 -1.04 0.38 0.38 114.28 107.51 1ea9 n THR 377 Ca -0.42 1.39 0.19 0.00 -2.04 0.00 0.00 64.05 63.17 1ea9 n THR 377 Cb 0.78 -2.11 0.38 0.00 -1.82 0.00 0.00 70.33 67.57 1ea9 n THR 377 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1ea9 h ASN 378 N 0.00 -0.02 0.13 8.00 -0.26 -1.56 0.31 115.58 122.18 1ea9 h ASN 378 Ca 0.00 0.24 -0.00 0.00 -0.56 0.00 0.00 56.30 55.98 1ea9 h ASN 378 Cb 0.00 0.32 -0.01 0.00 -1.06 0.00 0.00 38.32 37.57 1ea9 h ASN 378 CO 0.00 -0.28 -0.17 0.00 -1.06 0.00 0.00 177.43 175.92 1ea9 h ALA 379 N 1.90 -0.83 -0.95 -0.83 0.00 -1.23 -1.68 119.26 115.65 1ea9 h ALA 379 Ca 0.65 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.51 1ea9 h ALA 379 Cb 1.47 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1ea9 h ALA 379 CO -0.76 -0.85 0.00 0.28 0.00 0.00 0.00 179.25 177.91 1ea9 n VAL 380 N -3.38 0.00 -0.23 0.00 0.31 0.16 -3.05 118.33 112.15 1ea9 n VAL 380 Ca -0.04 1.34 -0.03 0.00 -0.01 0.00 0.00 64.34 65.61 1ea9 n VAL 380 Cb 0.15 -2.16 -0.00 0.00 -0.91 0.00 0.00 33.84 30.92 1ea9 n VAL 380 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1ea9 n LEU 381 N -1.83 -0.45 -0.30 7.52 4.77 0.73 0.18 117.00 127.62 1ea9 n LEU 381 Ca 0.00 1.00 0.24 0.00 -0.03 0.00 0.00 56.01 57.22 1ea9 n LEU 381 Cb 0.00 -0.20 0.55 0.00 -2.33 0.00 0.00 43.42 41.44 1ea9 n LEU 381 CO 0.00 -0.87 1.23 0.44 -1.33 0.00 0.00 177.39 176.86 1ea9 h ASP 382 N 0.00 0.37 0.85 -1.43 5.19 -1.22 5.00 116.42 125.19 1ea9 h ASP 382 Ca 0.16 0.06 -0.16 0.00 -0.62 0.00 0.00 57.03 56.48 1ea9 h ASP 382 Cb 0.30 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.79 1ea9 h ASP 382 CO -0.56 0.08 -1.24 0.15 -3.12 0.00 0.00 179.24 174.56 1ea9 h PHE 383 N 0.33 0.00 0.00 4.55 3.57 0.20 0.46 116.94 126.06 1ea9 h PHE 383 Ca 0.57 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.97 1ea9 h PHE 383 Cb 1.55 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.27 1ea9 h PHE 383 CO -0.00 0.58 -1.37 1.19 -2.23 0.00 0.00 178.31 176.47 1ea9 n PHE 384 N -2.97 0.00 0.00 0.41 3.01 -0.24 -4.64 117.46 113.03 1ea9 n PHE 384 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.39 1ea9 n PHE 384 Cb 0.83 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 40.04 1ea9 n PHE 384 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 1ea9 n ILE 385 N -2.63 0.00 -0.09 4.37 -0.00 1.60 -4.57 119.36 118.04 1ea9 n ILE 385 Ca -0.11 0.01 0.17 0.00 -0.00 0.00 0.00 62.75 62.83 1ea9 n ILE 385 Cb 0.63 -0.69 0.59 0.00 -0.00 0.00 0.00 39.64 40.16 1ea9 n ILE 385 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.55 177.00 1ea9 h HIS 386 N 0.00 0.27 -6.22 1.39 3.86 -0.55 -3.46 115.15 110.44 1ea9 h HIS 386 Ca 0.00 0.01 -0.46 0.00 -1.16 0.00 0.00 60.37 58.76 1ea9 h HIS 386 Cb 0.00 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 28.38 1ea9 h HIS 386 CO 0.00 0.10 -0.75 1.04 0.86 0.00 0.00 177.93 179.18 1ea9 n GLN 387 N -4.43 -5.87 -0.03 2.45 6.02 0.13 -4.86 117.38 110.78 1ea9 n GLN 387 Ca 0.12 0.64 -0.05 0.00 -0.01 0.00 0.00 57.00 57.69 1ea9 n GLN 387 Cb 0.56 -5.53 -0.13 0.00 1.02 0.00 0.00 30.24 26.15 1ea9 n GLN 387 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1ea9 n ILE 388 N -4.70 1.31 -2.63 5.09 2.08 0.72 -4.93 119.36 116.29 1ea9 n ILE 388 Ca 0.01 -0.77 -0.23 0.00 0.56 0.00 0.00 62.75 62.32 1ea9 n ILE 388 Cb 0.54 -0.69 0.10 0.00 -0.75 0.00 0.00 39.64 38.84 1ea9 n ILE 388 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ea9 s ALA 389 N -2.72 3.80 -0.29 -1.39 0.00 -0.97 -5.04 121.76 115.16 1ea9 s ALA 389 Ca -0.06 -1.76 0.03 0.00 0.00 0.00 0.00 51.96 50.17 1ea9 s ALA 389 Cb 0.08 -1.96 0.18 0.00 0.00 0.00 0.00 23.12 21.42 1ea9 s ALA 389 CO 0.83 -1.39 0.53 0.16 0.00 0.00 0.00 175.76 175.89 1ea9 s ASP 390 N -4.72 -0.95 0.00 0.00 -4.77 -1.26 -4.73 116.67 100.24 1ea9 s ASP 390 Ca 0.66 0.16 0.00 0.00 -3.30 0.00 0.00 52.55 50.07 1ea9 s ASP 390 Cb -0.05 1.76 0.00 0.00 -1.09 0.00 0.00 42.92 43.54 1ea9 s ASP 390 CO 0.44 -0.31 0.00 0.00 0.70 0.00 0.00 175.17 176.00 1ea9 n ALA 391 N 5.40 -0.69 0.00 2.11 0.00 -0.69 -2.93 120.51 123.72 1ea9 n ALA 391 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1ea9 n ALA 391 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1ea9 n ALA 391 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1ea9 n GLU 392 N -0.65 0.00 -0.34 0.00 2.13 -1.26 -1.90 120.64 118.62 1ea9 n GLU 392 Ca 0.00 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.86 1ea9 n GLU 392 Cb 0.00 0.00 0.21 0.00 0.27 0.00 0.00 31.44 31.92 1ea9 n GLU 392 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1ea9 h LYS 393 N 0.00 1.05 0.00 5.31 1.63 -1.87 1.42 116.57 124.11 1ea9 h LYS 393 Ca 0.00 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1ea9 h LYS 393 Cb 0.00 -0.24 0.00 0.00 -0.60 0.00 0.00 32.23 31.39 1ea9 h LYS 393 CO 0.00 0.70 0.00 0.34 -3.45 0.00 0.00 179.45 177.04 1ea9 n PHE 394 N -4.51 0.00 -0.34 1.91 7.35 -1.26 -1.73 117.46 118.87 1ea9 n PHE 394 Ca 0.15 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.76 1ea9 n PHE 394 Cb 0.22 -0.37 -0.07 0.00 0.35 0.00 0.00 39.48 39.62 1ea9 n PHE 394 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1ea9 n SER 395 N -1.60 -0.83 0.00 -2.13 3.41 -1.03 -0.16 113.62 111.28 1ea9 n SER 395 Ca 0.00 1.46 0.00 0.00 -0.26 0.00 0.00 58.87 60.07 1ea9 n SER 395 Cb 0.00 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 1ea9 n SER 395 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1ea9 n PHE 396 N -5.05 0.00 0.28 7.33 0.99 0.48 0.16 117.46 121.65 1ea9 n PHE 396 Ca 0.03 0.00 0.11 0.00 -0.00 0.00 0.00 57.45 57.59 1ea9 n PHE 396 Cb 0.23 -0.48 0.60 0.00 -1.00 0.00 0.00 39.48 38.83 1ea9 n PHE 396 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1ea9 h MET 397 N 0.00 0.00 0.14 -1.08 -0.00 -0.34 1.10 114.93 114.75 1ea9 h MET 397 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 59.70 59.34 1ea9 h MET 397 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.59 1ea9 h MET 397 CO 0.00 0.00 -1.94 1.25 -0.00 0.00 0.00 176.91 176.22 1ea9 h LEU 398 N 0.00 0.45 -1.18 -0.10 6.46 0.23 -2.86 115.31 118.31 1ea9 h LEU 398 Ca 0.00 -0.95 -0.04 0.00 -0.12 0.00 0.00 57.88 56.77 1ea9 h LEU 398 Cb 0.75 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.53 1ea9 h LEU 398 CO 0.00 1.85 -0.17 1.23 -0.62 0.00 0.00 178.44 180.72 1ea9 h GLY 399 N 0.99 0.00 0.59 3.75 0.00 0.63 -2.48 103.07 106.55 1ea9 h GLY 399 Ca -0.41 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 1ea9 h GLY 399 CO 0.10 0.00 -0.28 1.70 0.00 0.00 0.00 176.54 178.06 1ea9 h LYS 400 N 0.00 -0.77 0.00 4.80 1.63 0.90 -2.81 116.57 120.32 1ea9 h LYS 400 Ca -0.00 0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.85 1ea9 h LYS 400 Cb 0.69 0.17 0.00 0.00 -0.60 0.00 0.00 32.23 32.50 1ea9 h LYS 400 CO 0.02 -0.51 0.04 1.04 -3.45 0.00 0.00 179.45 176.59 1ea9 n GLN 401 N -4.98 0.04 -0.08 1.90 1.13 -1.08 -2.23 117.38 112.08 1ea9 n GLN 401 Ca -0.10 0.52 -0.17 0.00 -1.94 0.00 0.00 57.00 55.31 1ea9 n GLN 401 Cb 0.31 -1.67 -0.12 0.00 0.11 0.00 0.00 30.24 28.87 1ea9 n GLN 401 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1ea9 h LEU 402 N 0.00 0.00 0.00 1.08 5.85 -1.26 -3.32 115.31 117.66 1ea9 h LEU 402 Ca 0.00 -0.80 0.00 0.00 0.84 0.00 0.00 57.88 57.92 1ea9 h LEU 402 Cb 0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1ea9 h LEU 402 CO 0.00 1.17 0.00 0.00 -0.34 0.00 0.00 178.44 179.27 1ea9 n ALA 403 N -2.91 2.03 -0.07 1.25 0.00 -0.94 -3.46 120.51 116.39 1ea9 n ALA 403 Ca -0.18 -0.08 -0.12 0.00 0.00 0.00 0.00 53.44 53.06 1ea9 n ALA 403 Cb 0.55 -1.34 -0.05 0.00 0.00 0.00 0.00 19.45 18.60 1ea9 n ALA 403 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ea9 h GLY 404 N 3.59 0.41 -4.51 0.00 0.00 -1.54 -3.45 103.07 97.57 1ea9 h GLY 404 Ca 0.00 -0.31 -0.67 0.00 0.00 0.00 0.00 47.33 46.34 1ea9 h GLY 404 CO 0.00 0.29 -0.75 -0.19 0.00 0.00 0.00 176.54 175.89 1ea9 s TYR 405 N -4.92 2.74 0.50 5.60 1.51 -1.23 -4.44 117.35 117.11 1ea9 s TYR 405 Ca -0.14 -0.14 -0.22 0.00 -1.01 0.00 0.00 57.07 55.56 1ea9 s TYR 405 Cb 0.07 -1.51 -0.09 0.00 -0.11 0.00 0.00 41.96 40.33 1ea9 s TYR 405 CO 0.74 0.35 0.92 -0.35 -1.11 0.00 0.00 175.55 176.10 1ea9 n PRO 406 N 1.28 1.08 0.00 -1.71 -0.04 -1.26 -4.45 135.00 129.89 1ea9 n PRO 406 Ca -0.15 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 1ea9 n PRO 406 Cb 0.52 -2.02 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 1ea9 n PRO 406 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1ea9 n ARG 407 N -0.23 0.00 0.09 0.54 0.63 -1.26 0.77 116.66 117.20 1ea9 n ARG 407 Ca 0.11 0.73 0.05 0.00 -0.92 0.00 0.00 57.85 57.82 1ea9 n ARG 407 Cb 0.43 -1.18 0.27 0.00 0.45 0.00 0.00 32.46 32.43 1ea9 n ARG 407 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ea9 n GLN 408 N -2.17 0.07 -0.05 -0.14 0.00 -1.26 -1.51 117.38 112.31 1ea9 n GLN 408 Ca 0.00 0.53 -0.00 0.00 0.00 0.00 0.00 57.00 57.53 1ea9 n GLN 408 Cb 0.00 -1.79 -0.00 0.00 0.00 0.00 0.00 30.24 28.45 1ea9 n GLN 408 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ea9 h ALA 409 N 1.76 0.00 -0.92 2.61 0.00 0.03 -3.31 119.26 119.43 1ea9 h ALA 409 Ca 0.00 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.00 1ea9 h ALA 409 Cb 0.15 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.88 1ea9 h ALA 409 CO 0.00 0.01 0.59 0.77 0.00 0.00 0.00 179.25 180.62 1ea9 h SER 410 N -1.00 0.81 -0.48 0.00 0.02 0.28 -2.04 113.55 111.14 1ea9 h SER 410 Ca -0.00 0.03 0.06 0.00 -0.84 0.00 0.00 61.79 61.04 1ea9 h SER 410 Cb 0.03 -0.13 -0.09 0.00 0.14 0.00 0.00 62.40 62.35 1ea9 h SER 410 CO -0.00 0.45 -0.53 -0.33 -1.14 0.00 0.00 176.83 175.29 1ea9 h GLU 411 N 0.88 -0.32 0.00 3.45 5.08 -1.41 0.67 114.58 122.93 1ea9 h GLU 411 Ca 0.44 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.81 1ea9 h GLU 411 Cb 0.48 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1ea9 h GLU 411 CO -0.20 -0.21 -0.07 0.28 -1.00 0.00 0.00 179.01 177.81 1ea9 h VAL 412 N -0.33 0.92 -1.03 3.13 2.07 -1.47 -3.20 116.25 116.34 1ea9 h VAL 412 Ca 0.11 -0.23 -0.45 0.00 0.82 0.00 0.00 66.70 66.94 1ea9 h VAL 412 Cb 0.58 1.13 0.10 0.00 -1.52 0.00 0.00 31.29 31.58 1ea9 h VAL 412 CO -0.64 0.06 -0.57 0.23 0.02 0.00 0.00 177.57 176.67 1ea9 n MET 413 N -4.28 0.00 -3.47 1.57 2.81 0.23 -4.27 117.12 109.71 1ea9 n MET 413 Ca -0.03 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.45 1ea9 n MET 413 Cb 0.15 -0.70 -0.10 0.00 -0.71 0.00 0.00 33.22 31.85 1ea9 n MET 413 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 1ea9 s PHE 414 N -1.03 3.22 -0.42 2.03 5.36 -1.05 -1.57 117.98 124.53 1ea9 s PHE 414 Ca 0.43 -0.20 -0.10 0.00 -0.96 0.00 0.00 56.93 56.10 1ea9 s PHE 414 Cb -0.52 -2.58 0.07 0.00 -0.34 0.00 0.00 43.02 39.66 1ea9 s PHE 414 CO 0.43 -0.43 0.26 -0.80 -1.46 0.00 0.00 175.22 173.21 1ea9 s ASN 415 N 1.73 5.67 0.19 6.13 0.02 -0.50 -2.11 114.94 126.08 1ea9 s ASN 415 Ca 0.08 -1.43 0.10 0.00 -1.02 0.00 0.00 52.86 50.59 1ea9 s ASN 415 Cb -0.17 -2.00 -0.04 0.00 0.02 0.00 0.00 41.25 39.05 1ea9 s ASN 415 CO 0.11 -0.52 -0.15 -1.48 0.02 0.00 0.00 177.10 175.08 1ea9 s LEU 416 N 1.45 2.77 -0.00 0.60 2.34 -1.26 -2.12 118.68 122.46 1ea9 s LEU 416 Ca 0.03 -0.71 0.07 0.00 0.06 0.00 0.00 54.13 53.57 1ea9 s LEU 416 Cb -0.23 -1.45 -0.08 0.00 -0.56 0.00 0.00 46.19 43.87 1ea9 s LEU 416 CO 0.03 0.10 0.27 0.18 -1.06 0.00 0.00 176.35 175.87 1ea9 n LEU 417 N 0.05 0.27 -3.54 1.48 4.77 -1.26 -4.02 117.00 114.76 1ea9 n LEU 417 Ca -0.11 -0.43 -0.10 0.00 -0.03 0.00 0.00 56.01 55.34 1ea9 n LEU 417 Cb 0.56 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.61 1ea9 n LEU 417 CO 0.33 0.07 0.69 1.51 -1.33 0.00 0.00 177.39 178.67 1ea9 s ASP 418 N -1.81 -0.40 0.02 -1.43 1.47 -1.26 -4.74 116.67 108.52 1ea9 s ASP 418 Ca 0.02 0.25 -0.02 0.00 1.18 0.00 0.00 52.55 53.98 1ea9 s ASP 418 Cb 0.05 0.37 0.01 0.00 -0.34 0.00 0.00 42.92 43.01 1ea9 s ASP 418 CO 0.28 -0.51 0.09 -1.54 0.68 0.00 0.00 175.17 174.17 1ea9 n SER 419 N 0.29 -0.17 0.00 2.11 3.41 -1.26 -4.18 113.62 113.82 1ea9 n SER 419 Ca -0.11 -1.10 0.00 0.00 -0.26 0.00 0.00 58.87 57.40 1ea9 n SER 419 Cb 0.60 0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 1ea9 n SER 419 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ea9 n HIS 420 N -0.06 0.00 1.32 7.33 1.44 -1.26 -1.99 115.22 122.00 1ea9 n HIS 420 Ca -0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1ea9 n HIS 420 Cb 0.05 -0.39 0.00 0.00 0.12 0.00 0.00 29.99 29.77 1ea9 n HIS 420 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1ea9 n ASP 421 N -2.51 0.66 0.00 4.39 10.43 -1.26 -4.71 116.55 123.55 1ea9 n ASP 421 Ca 0.00 -1.97 0.00 0.00 2.57 0.00 0.00 54.79 55.39 1ea9 n ASP 421 Cb 0.00 -0.33 0.00 0.00 1.84 0.00 0.00 41.12 42.63 1ea9 n ASP 421 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 1ea9 n THR 422 N -0.16 0.00 -3.96 -3.53 -2.24 -0.84 -4.87 114.28 98.68 1ea9 n THR 422 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1ea9 n THR 422 Cb 0.16 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.37 1ea9 n THR 422 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ea9 s ALA 423 N -2.40 -0.21 0.97 6.98 0.00 -1.25 -3.50 121.76 122.33 1ea9 s ALA 423 Ca 0.00 -0.95 -0.12 0.00 0.00 0.00 0.00 51.96 50.89 1ea9 s ALA 423 Cb 0.00 0.97 0.17 0.00 0.00 0.00 0.00 23.12 24.26 1ea9 s ALA 423 CO 0.00 -0.89 1.09 1.03 0.00 0.00 0.00 175.76 176.98 1ea9 s ARG 424 N -3.35 0.69 -0.15 0.00 1.81 -1.26 -3.98 118.95 112.70 1ea9 s ARG 424 Ca 0.21 0.74 -0.20 0.00 -1.72 0.00 0.00 55.73 54.76 1ea9 s ARG 424 Cb -0.02 -1.75 -0.18 0.00 -0.45 0.00 0.00 34.95 32.55 1ea9 s ARG 424 CO 0.12 -2.61 0.42 1.25 -0.68 0.00 0.00 175.30 173.80 1ea9 h LEU 425 N -1.81 0.00 0.00 2.53 5.85 -1.89 -3.17 115.31 116.82 1ea9 h LEU 425 Ca -0.52 -0.62 0.00 0.00 0.84 0.00 0.00 57.88 57.58 1ea9 h LEU 425 Cb 1.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.34 1ea9 h LEU 425 CO 0.55 1.00 0.00 -0.11 -0.34 0.00 0.00 178.44 179.53 1ea9 n LEU 426 N -4.60 0.00 -0.13 2.25 7.94 -1.26 -1.79 117.00 119.40 1ea9 n LEU 426 Ca -0.13 0.00 -0.28 0.00 -1.11 0.00 0.00 56.01 54.49 1ea9 n LEU 426 Cb 0.42 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.26 1ea9 n LEU 426 CO 0.22 0.00 -1.35 0.35 -1.11 0.00 0.00 177.39 175.50 1ea9 n THR 427 N -0.70 1.53 0.06 1.96 -2.24 -1.24 -2.27 114.28 111.37 1ea9 n THR 427 Ca 0.04 -0.39 0.20 0.00 -2.27 0.00 0.00 64.05 61.63 1ea9 n THR 427 Cb 0.02 -1.83 0.73 0.00 -2.10 0.00 0.00 70.33 67.14 1ea9 n THR 427 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1ea9 h GLN 428 N -0.85 0.00 -4.55 -0.78 4.20 -1.32 -3.20 115.11 108.61 1ea9 h GLN 428 Ca -0.66 0.00 -0.71 0.00 0.06 0.00 0.00 58.65 57.35 1ea9 h GLN 428 Cb 1.63 0.00 -0.29 0.00 0.30 0.00 0.00 27.48 29.13 1ea9 h GLN 428 CO -0.36 0.00 -0.53 0.00 -0.67 0.00 0.00 178.83 177.27 1ea9 s ALA 429 N -4.85 3.18 -0.31 3.87 0.00 -0.94 -4.79 121.76 117.92 1ea9 s ALA 429 Ca -0.05 -2.00 -0.04 0.00 0.00 0.00 0.00 51.96 49.87 1ea9 s ALA 429 Cb 0.18 -2.48 -0.10 0.00 0.00 0.00 0.00 23.12 20.72 1ea9 s ALA 429 CO 0.65 -1.53 1.36 -0.25 0.00 0.00 0.00 175.76 175.99 1ea9 n ASP 430 N 4.85 -1.69 0.00 0.00 9.92 -1.21 -3.50 116.55 124.93 1ea9 n ASP 430 Ca -0.10 -1.23 0.00 0.00 -0.53 0.00 0.00 54.79 52.93 1ea9 n ASP 430 Cb 0.44 -0.64 0.00 0.00 -0.64 0.00 0.00 41.12 40.28 1ea9 n ASP 430 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ea9 n GLY 431 N 4.85 0.00 3.49 0.44 0.00 -0.96 -4.83 105.19 108.18 1ea9 n GLY 431 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1ea9 n GLY 431 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ea9 n ASP 432 N 0.00 0.51 0.00 1.61 -0.08 -1.23 -4.76 116.55 112.61 1ea9 n ASP 432 Ca 0.00 0.14 -0.12 0.00 -1.51 0.00 0.00 54.79 53.30 1ea9 n ASP 432 Cb 0.00 -0.98 -0.07 0.00 2.34 0.00 0.00 41.12 42.41 1ea9 n ASP 432 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1ea9 h LYS 433 N 12.59 0.08 0.00 -0.67 1.79 -1.89 -3.31 116.57 125.17 1ea9 h LYS 433 Ca -0.07 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1ea9 h LYS 433 Cb 1.31 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.95 1ea9 h LYS 433 CO 1.35 0.17 0.00 0.54 -1.08 0.00 0.00 179.45 180.43 1ea9 n ARG 434 N -4.99 0.00 -0.37 3.15 3.00 -1.26 -0.13 116.66 116.06 1ea9 n ARG 434 Ca -0.06 0.68 0.28 0.00 -0.01 0.00 0.00 57.85 58.74 1ea9 n ARG 434 Cb 0.08 -1.05 0.56 0.00 0.00 0.00 0.00 32.46 32.05 1ea9 n ARG 434 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 1ea9 h LYS 435 N 0.00 0.26 0.63 5.56 1.57 -1.87 -0.46 116.57 122.26 1ea9 h LYS 435 Ca 0.00 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1ea9 h LYS 435 Cb 0.00 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1ea9 h LYS 435 CO 0.00 0.17 -0.32 1.98 -0.57 0.00 0.00 179.45 180.71 1ea9 h MET 436 N 0.27 -0.83 -0.56 3.15 4.05 -0.62 -3.06 114.93 117.33 1ea9 h MET 436 Ca 0.70 0.06 0.09 0.00 -0.28 0.00 0.00 59.70 60.26 1ea9 h MET 436 Cb 1.93 0.19 -0.09 0.00 -0.80 0.00 0.00 31.60 32.83 1ea9 h MET 436 CO -0.38 -0.56 -0.21 1.63 0.23 0.00 0.00 176.91 177.63 1ea9 n LYS 437 N -5.47 -0.12 0.00 0.39 5.02 -0.18 -2.26 118.16 115.54 1ea9 n LYS 437 Ca -0.13 0.86 0.00 0.00 -2.02 0.00 0.00 58.31 57.02 1ea9 n LYS 437 Cb 0.36 -1.28 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 1ea9 n LYS 437 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ea9 n LEU 438 N -4.84 0.00 -0.32 -0.35 4.77 -1.15 -0.78 117.00 114.33 1ea9 n LEU 438 Ca 0.06 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.64 1ea9 n LEU 438 Cb 0.23 -0.10 0.05 0.00 -2.33 0.00 0.00 43.42 41.28 1ea9 n LEU 438 CO -0.07 -0.10 0.50 0.00 -1.33 0.00 0.00 177.39 176.39 1ea9 n ALA 439 N -1.18 -0.04 0.02 -1.18 0.00 -0.96 0.15 120.51 117.32 1ea9 n ALA 439 Ca 0.00 0.85 -0.05 0.00 0.00 0.00 0.00 53.44 54.23 1ea9 n ALA 439 Cb 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 19.45 19.01 1ea9 n ALA 439 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ea9 h VAL 440 N 0.00 0.00 -0.32 0.00 2.07 -1.32 2.70 116.25 119.39 1ea9 h VAL 440 Ca 0.31 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.88 1ea9 h VAL 440 Cb 0.52 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.21 1ea9 h VAL 440 CO -0.83 0.00 -0.54 0.25 0.02 0.00 0.00 177.57 176.47 1ea9 h LEU 441 N -0.23 -1.76 -0.97 2.57 5.85 0.19 0.47 115.31 121.42 1ea9 h LEU 441 Ca 0.00 0.23 0.20 0.00 0.84 0.00 0.00 57.88 59.15 1ea9 h LEU 441 Cb 0.24 0.71 -0.11 0.00 0.37 0.00 0.00 40.66 41.88 1ea9 h LEU 441 CO -0.12 -0.43 0.56 0.15 -0.34 0.00 0.00 178.44 178.27 1ea9 h PHE 442 N -0.45 0.97 -0.10 1.25 3.57 0.19 0.14 116.94 122.50 1ea9 h PHE 442 Ca 0.07 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1ea9 h PHE 442 Cb 0.62 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 1ea9 h PHE 442 CO -0.66 0.16 0.01 0.37 -2.23 0.00 0.00 178.31 175.95 1ea9 h GLN 443 N 0.67 0.05 -0.11 1.11 4.15 0.94 0.47 115.11 122.38 1ea9 h GLN 443 Ca 0.58 -0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.79 1ea9 h GLN 443 Cb 0.96 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.64 1ea9 h GLN 443 CO -0.42 0.03 -0.77 0.74 -1.93 0.00 0.00 178.83 176.48 1ea9 h PHE 444 N 0.05 0.84 -0.62 3.99 -1.00 0.15 -2.79 116.94 117.56 1ea9 h PHE 444 Ca 0.05 -0.38 -0.03 0.00 2.81 0.00 0.00 57.97 60.42 1ea9 h PHE 444 Cb 0.05 -0.13 -0.03 0.00 3.61 0.00 0.00 35.95 39.45 1ea9 h PHE 444 CO -0.12 1.18 0.26 1.79 -1.61 0.00 0.00 178.31 179.81 1ea9 h THR 445 N 0.42 1.21 -4.13 -1.55 1.35 -0.65 -3.42 112.91 106.15 1ea9 h THR 445 Ca -0.05 -0.64 -0.49 0.00 -0.55 0.00 0.00 66.41 64.68 1ea9 h THR 445 Cb 1.38 0.46 0.15 0.00 -1.73 0.00 0.00 68.15 68.41 1ea9 h THR 445 CO 0.15 0.26 0.26 -0.47 -0.25 0.00 0.00 175.52 175.47 1ea9 s TYR 446 N -5.45 2.33 0.00 4.73 5.04 0.16 -4.35 117.35 119.82 1ea9 s TYR 446 Ca -0.10 1.36 0.00 0.00 -2.44 0.00 0.00 57.07 55.89 1ea9 s TYR 446 Cb 0.16 -3.14 0.00 0.00 0.35 0.00 0.00 41.96 39.34 1ea9 s TYR 446 CO 0.79 -2.30 0.00 1.97 -1.34 0.00 0.00 175.55 174.68 1ea9 n PHE 447 N -3.83 -2.52 -0.49 4.97 1.16 -1.24 -4.64 117.46 110.87 1ea9 n PHE 447 Ca 0.08 0.00 0.06 0.00 -1.87 0.00 0.00 57.45 55.72 1ea9 n PHE 447 Cb 0.54 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.39 1ea9 n PHE 447 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1ea9 n GLY 448 N 5.00 -2.47 3.65 4.97 0.00 -1.21 -4.72 105.19 110.41 1ea9 n GLY 448 Ca 0.00 -1.34 -0.43 0.00 0.00 0.00 0.00 46.02 44.25 1ea9 n GLY 448 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ea9 s THR 449 N -2.85 4.68 0.49 2.61 -4.23 -0.61 -4.88 115.64 110.85 1ea9 s THR 449 Ca 0.00 1.80 -0.16 0.00 -1.18 0.00 0.00 61.69 62.14 1ea9 s THR 449 Cb 0.00 -4.28 -0.08 0.00 1.34 0.00 0.00 72.50 69.48 1ea9 s THR 449 CO 0.00 -0.24 0.95 -2.16 -0.54 0.00 0.00 174.62 172.63 1ea9 s PRO 450 N 3.22 3.96 -0.09 3.99 0.04 -1.21 -1.41 135.00 143.50 1ea9 s PRO 450 Ca 0.42 0.90 -0.04 0.00 0.04 0.00 0.00 61.00 62.31 1ea9 s PRO 450 Cb -0.14 -2.18 0.04 0.00 0.04 0.00 0.00 34.50 32.26 1ea9 s PRO 450 CO 0.09 -0.21 0.20 0.00 0.04 0.00 0.00 177.00 177.13 1ea9 s ILE 452 N 1.22 3.03 0.06 0.00 -1.09 0.23 -4.00 121.20 120.65 1ea9 s ILE 452 Ca -0.09 -1.31 -0.37 0.00 -2.23 0.00 0.00 60.65 56.65 1ea9 s ILE 452 Cb -0.11 -2.71 -0.17 0.00 -1.58 0.00 0.00 42.46 37.89 1ea9 s ILE 452 CO -0.07 -0.06 1.31 0.00 -1.23 0.00 0.00 174.94 174.88 1ea9 n TYR 453 N 4.64 1.38 -1.45 3.97 9.36 -1.26 -3.05 117.16 130.75 1ea9 n TYR 453 Ca -0.14 0.71 -0.45 0.00 3.32 0.00 0.00 57.90 61.34 1ea9 n TYR 453 Cb 0.44 -2.29 -0.02 0.00 -0.63 0.00 0.00 39.34 36.84 1ea9 n TYR 453 CO 0.00 0.00 0.00 2.48 0.22 0.00 0.00 176.86 179.56 1ea9 n TYR 454 N 2.45 -0.20 0.00 2.98 0.18 0.97 -0.87 117.16 122.68 1ea9 n TYR 454 Ca 0.19 0.80 0.00 0.00 1.88 0.00 0.00 57.90 60.77 1ea9 n TYR 454 Cb 0.17 -2.02 0.00 0.00 -0.38 0.00 0.00 39.34 37.11 1ea9 n TYR 454 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1ea9 n GLY 455 N 1.79 3.07 0.45 -7.48 0.00 -1.26 -4.85 105.19 96.91 1ea9 n GLY 455 Ca 0.14 0.00 0.27 0.00 0.00 0.00 0.00 46.02 46.43 1ea9 n GLY 455 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ea9 h ASP 456 N 0.00 0.27 0.00 1.61 3.45 -1.30 1.09 116.42 121.53 1ea9 h ASP 456 Ca 0.00 0.05 0.00 0.00 0.43 0.00 0.00 57.03 57.51 1ea9 h ASP 456 Cb 0.00 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 38.78 1ea9 h ASP 456 CO 0.00 0.05 0.00 -0.62 -1.57 0.00 0.00 179.24 177.10 1ea9 n GLU 457 N -4.46 0.48 0.00 3.56 4.71 -1.26 -2.89 120.64 120.78 1ea9 n GLU 457 Ca 0.25 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.40 1ea9 n GLU 457 Cb 1.01 -1.09 0.00 0.00 -1.01 0.00 0.00 31.44 30.35 1ea9 n GLU 457 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 177.13 178.55 1ea9 n VAL 458 N -0.23 0.00 -0.27 2.62 0.24 0.37 -3.16 118.33 117.90 1ea9 n VAL 458 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1ea9 n VAL 458 Cb 0.04 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.41 1ea9 n VAL 458 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ea9 n GLY 459 N 0.48 -2.16 3.00 7.63 0.00 -0.49 -4.29 105.19 109.36 1ea9 n GLY 459 Ca 0.00 -0.95 -0.29 0.00 0.00 0.00 0.00 46.02 44.78 1ea9 n GLY 459 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ea9 s LEU 460 N -0.18 1.58 -0.92 0.99 1.43 -1.26 -5.01 118.68 115.31 1ea9 s LEU 460 Ca 0.00 -0.44 -0.23 0.00 -1.03 0.00 0.00 54.13 52.43 1ea9 s LEU 460 Cb 0.00 -1.10 -0.15 0.00 0.03 0.00 0.00 46.19 44.98 1ea9 s LEU 460 CO 0.00 -0.06 1.91 0.47 0.23 0.00 0.00 176.35 178.90 1ea9 n ASP 461 N 4.75 2.62 0.00 2.29 8.00 -1.26 -4.63 116.55 128.31 1ea9 n ASP 461 Ca -0.16 -2.67 0.00 0.00 0.71 0.00 0.00 54.79 52.67 1ea9 n ASP 461 Cb 0.50 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.21 1ea9 n ASP 461 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ea9 n GLY 462 N 5.22 4.39 0.00 0.44 0.00 -1.26 -4.55 105.19 109.43 1ea9 n GLY 462 Ca 0.47 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1ea9 n GLY 462 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ea9 n GLY 463 N 0.00 2.48 2.56 -0.02 0.00 -1.26 -4.77 105.19 104.18 1ea9 n GLY 463 Ca 0.00 -1.89 -0.01 0.00 0.00 0.00 0.00 46.02 44.12 1ea9 n GLY 463 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ea9 n HIS 464 N 1.29 -3.45 -1.08 1.61 -0.00 -1.25 -3.72 115.22 108.61 1ea9 n HIS 464 Ca 0.00 1.52 -0.38 0.00 -0.00 0.00 0.00 57.72 58.86 1ea9 n HIS 464 Cb 0.00 -3.70 -0.03 0.00 -0.00 0.00 0.00 29.99 26.26 1ea9 n HIS 464 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 1ea9 n ASP 465 N 0.54 -0.75 -1.41 0.26 -0.08 -1.23 -0.48 116.55 113.40 1ea9 n ASP 465 Ca 0.01 0.87 -0.06 0.00 -1.51 0.00 0.00 54.79 54.10 1ea9 n ASP 465 Cb 0.03 -0.72 0.03 0.00 2.34 0.00 0.00 41.12 42.80 1ea9 n ASP 465 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1ea9 n PRO 466 N 0.85 1.28 0.12 -0.67 -0.04 -1.26 -4.99 135.00 130.28 1ea9 n PRO 466 Ca 0.14 -0.61 -0.11 0.00 -0.04 0.00 0.00 63.50 62.88 1ea9 n PRO 466 Cb 0.16 -1.24 -0.06 0.00 -0.04 0.00 0.00 33.50 32.32 1ea9 n PRO 466 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1ea9 h GLY 467 N 3.16 -1.14 -6.68 0.55 0.00 -0.86 -3.28 103.07 94.83 1ea9 h GLY 467 Ca 0.12 0.55 -0.62 0.00 0.00 0.00 0.00 47.33 47.39 1ea9 h GLY 467 CO 0.26 -0.34 2.34 0.00 0.00 0.00 0.00 176.54 178.80 1ea9 n ARG 469 N 7.13 0.81 -2.69 0.00 5.12 -1.24 -4.91 116.66 120.88 1ea9 n ARG 469 Ca 0.49 -2.15 -0.39 0.00 -1.93 0.00 0.00 57.85 53.87 1ea9 n ARG 469 Cb 0.42 -0.34 -0.06 0.00 -1.16 0.00 0.00 32.46 31.32 1ea9 n ARG 469 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1ea9 s LYS 470 N -1.20 4.73 -0.39 5.56 1.02 -1.26 -4.79 119.74 123.41 1ea9 s LYS 470 Ca 0.21 1.52 -0.28 0.00 0.02 0.00 0.00 55.97 57.44 1ea9 s LYS 470 Cb 0.31 -3.13 -0.03 0.00 -0.52 0.00 0.00 37.83 34.46 1ea9 s LYS 470 CO -0.09 0.38 1.95 0.00 -0.92 0.00 0.00 175.35 176.67 1ea9 n MET 472 N 8.70 0.00 -2.55 0.00 1.56 0.22 -4.84 117.12 120.21 1ea9 n MET 472 Ca 0.25 0.00 -0.38 0.00 -0.27 0.00 0.00 57.70 57.31 1ea9 n MET 472 Cb 0.48 -1.32 -0.04 0.00 2.15 0.00 0.00 33.22 34.49 1ea9 n MET 472 CO 0.00 0.00 0.00 -1.21 -0.73 0.00 0.00 175.97 174.03 1ea9 s GLU 473 N 4.26 4.33 0.00 2.12 0.41 -1.26 -4.81 118.70 123.75 1ea9 s GLU 473 Ca 1.01 1.57 0.01 0.00 -0.41 0.00 0.00 54.97 57.14 1ea9 s GLU 473 Cb -1.32 -2.73 0.01 0.00 -1.78 0.00 0.00 34.13 28.31 1ea9 s GLU 473 CO 0.64 -0.01 0.86 0.91 -0.49 0.00 0.00 175.26 177.17 1ea9 n TRP 474 N 0.32 0.02 -2.43 1.61 7.02 -1.26 -4.91 117.44 117.80 1ea9 n TRP 474 Ca 0.03 -0.34 -0.38 0.00 -1.02 0.00 0.00 57.50 55.79 1ea9 n TRP 474 Cb 0.48 -0.03 -0.03 0.00 -2.42 0.00 0.00 31.31 29.31 1ea9 n TRP 474 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1ea9 s ASP 475 N -0.70 6.24 0.00 -0.99 3.68 -1.26 -4.82 116.67 118.81 1ea9 s ASP 475 Ca 0.01 -1.74 0.00 0.00 2.13 0.00 0.00 52.55 52.95 1ea9 s ASP 475 Cb 0.01 -2.58 0.00 0.00 -1.45 0.00 0.00 42.92 38.90 1ea9 s ASP 475 CO 0.01 -1.77 0.32 -0.62 0.13 0.00 0.00 175.17 173.24 1ea9 n GLU 476 N 8.62 0.00 0.11 4.34 1.02 -1.26 -0.69 120.64 132.78 1ea9 n GLU 476 Ca 0.41 0.03 -0.20 0.00 -0.02 0.00 0.00 57.16 57.39 1ea9 n GLU 476 Cb 0.48 -1.53 -0.15 0.00 -0.02 0.00 0.00 31.44 30.22 1ea9 n GLU 476 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1ea9 h THR 477 N 0.00 1.28 0.00 2.62 1.35 -2.01 -3.28 112.91 112.87 1ea9 h THR 477 Ca 0.00 -2.82 0.00 0.00 -0.55 0.00 0.00 66.41 63.04 1ea9 h THR 477 Cb 0.07 2.91 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 1ea9 h THR 477 CO 0.00 0.84 -0.85 0.50 -0.25 0.00 0.00 175.52 175.76 1ea9 h LYS 478 N 0.10 0.00 -6.18 4.72 1.63 -1.32 -3.46 116.57 112.05 1ea9 h LYS 478 Ca -0.23 0.00 -0.64 0.00 -0.85 0.00 0.00 60.65 58.94 1ea9 h LYS 478 Cb 2.07 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 33.70 1ea9 h LYS 478 CO 0.22 0.00 1.17 0.72 -3.45 0.00 0.00 179.45 178.11 1ea9 n HIS 479 N -2.42 2.14 -1.26 1.91 8.25 -1.11 -4.81 115.22 117.94 1ea9 n HIS 479 Ca 0.01 0.09 -0.31 0.00 -0.26 0.00 0.00 57.72 57.25 1ea9 n HIS 479 Cb 0.50 -2.62 -0.07 0.00 1.12 0.00 0.00 29.99 28.92 1ea9 n HIS 479 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1ea9 n ASP 480 N 7.53 7.74 -0.13 0.41 8.00 -1.26 -4.72 116.55 134.12 1ea9 n ASP 480 Ca 0.27 -2.58 0.04 0.00 0.71 0.00 0.00 54.79 53.23 1ea9 n ASP 480 Cb 0.28 -1.51 0.08 0.00 -0.02 0.00 0.00 41.12 39.95 1ea9 n ASP 480 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1ea9 n LYS 481 N 3.16 -0.03 -0.36 -1.24 3.00 -1.26 0.14 118.16 121.57 1ea9 n LYS 481 Ca 0.68 0.55 0.02 0.00 -0.00 0.00 0.00 58.31 59.56 1ea9 n LYS 481 Cb 0.43 -0.86 0.09 0.00 0.00 0.00 0.00 35.03 34.68 1ea9 n LYS 481 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 1ea9 h ASP 482 N 0.00 -1.16 0.46 3.14 3.58 -1.96 0.26 116.42 120.75 1ea9 h ASP 482 Ca 0.20 0.30 -0.02 0.00 0.42 0.00 0.00 57.03 57.93 1ea9 h ASP 482 Cb 0.38 0.67 0.00 0.00 1.72 0.00 0.00 39.33 42.10 1ea9 h ASP 482 CO -0.36 -0.31 -0.22 0.25 -2.88 0.00 0.00 179.24 175.73 1ea9 h LEU 483 N -0.01 -0.53 -0.33 2.28 5.85 0.94 -2.75 115.31 120.77 1ea9 h LEU 483 Ca 0.40 -0.07 0.07 0.00 0.84 0.00 0.00 57.88 59.12 1ea9 h LEU 483 Cb 0.65 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.74 1ea9 h LEU 483 CO -0.98 -0.23 -0.39 0.15 -0.34 0.00 0.00 178.44 176.65 1ea9 h PHE 484 N -0.83 -1.12 -0.59 1.25 3.57 -1.02 -0.01 116.94 118.18 1ea9 h PHE 484 Ca -0.06 0.06 0.12 0.00 3.53 0.00 0.00 57.97 61.62 1ea9 h PHE 484 Cb 0.56 0.54 -0.11 0.00 2.79 0.00 0.00 35.95 39.74 1ea9 h PHE 484 CO -0.00 -0.43 -0.06 0.00 -2.23 0.00 0.00 178.31 175.59 1ea9 h ALA 485 N 0.45 0.51 -0.67 2.41 0.00 -0.62 0.47 119.26 121.82 1ea9 h ALA 485 Ca 0.13 0.20 0.13 0.00 0.00 0.00 0.00 54.91 55.38 1ea9 h ALA 485 Cb 0.58 0.37 -0.10 0.00 0.00 0.00 0.00 17.79 18.64 1ea9 h ALA 485 CO -0.51 -0.41 0.15 0.35 0.00 0.00 0.00 179.25 178.82 1ea9 h PHE 486 N 0.07 0.23 -0.36 0.00 3.57 -0.75 0.54 116.94 120.24 1ea9 h PHE 486 Ca 0.30 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.87 1ea9 h PHE 486 Cb 0.48 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.19 1ea9 h PHE 486 CO -0.41 -0.06 0.16 1.88 -2.23 0.00 0.00 178.31 177.65 1ea9 h TYR 487 N 0.26 0.29 0.00 0.41 -1.99 0.14 -1.40 116.97 114.69 1ea9 h TYR 487 Ca 0.36 0.02 0.02 0.00 2.00 0.00 0.00 58.73 61.13 1ea9 h TYR 487 Cb 0.57 -0.08 -0.03 0.00 2.00 0.00 0.00 36.73 39.19 1ea9 h TYR 487 CO -0.26 0.14 -0.17 1.96 -0.00 0.00 0.00 178.16 179.83 1ea9 h GLN 488 N 0.33 -0.27 0.00 4.88 4.20 0.59 -3.16 115.11 121.68 1ea9 h GLN 488 Ca 0.16 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1ea9 h GLN 488 Cb 0.09 0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.93 1ea9 h GLN 488 CO -0.13 -0.18 0.00 2.41 -0.67 0.00 0.00 178.83 180.26 1ea9 n THR 489 N -5.30 0.00 0.00 -0.54 -1.04 -0.01 -2.77 114.28 104.63 1ea9 n THR 489 Ca -0.05 1.42 0.00 0.00 -2.04 0.00 0.00 64.05 63.38 1ea9 n THR 489 Cb 0.22 -2.14 0.00 0.00 -1.82 0.00 0.00 70.33 66.59 1ea9 n THR 489 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1ea9 n VAL 490 N -2.27 0.00 -0.35 12.58 0.31 -0.57 -0.27 118.33 127.76 1ea9 n VAL 490 Ca 0.00 0.27 -0.06 0.00 -0.01 0.00 0.00 64.34 64.55 1ea9 n VAL 490 Cb 0.00 -0.38 -0.02 0.00 -0.91 0.00 0.00 33.84 32.53 1ea9 n VAL 490 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1ea9 h ILE 491 N 0.00 0.02 -1.51 2.52 2.04 -1.55 0.29 117.51 119.33 1ea9 h ILE 491 Ca 0.00 0.00 0.44 0.00 1.00 0.00 0.00 64.86 66.30 1ea9 h ILE 491 Cb 0.00 0.02 -0.06 0.00 -0.74 0.00 0.00 36.82 36.04 1ea9 h ILE 491 CO 0.00 0.00 1.32 0.54 0.00 0.00 0.00 178.15 180.01 1ea9 n ARG 492 N -5.39 0.01 -0.04 2.37 5.12 0.63 0.13 116.66 119.49 1ea9 n ARG 492 Ca 0.06 1.04 -0.17 0.00 -1.93 0.00 0.00 57.85 56.85 1ea9 n ARG 492 Cb 0.34 -2.50 -0.13 0.00 -1.16 0.00 0.00 32.46 29.01 1ea9 n ARG 492 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 1ea9 h LEU 493 N 0.00 0.13 0.50 0.55 4.07 -0.35 -3.24 115.31 116.97 1ea9 h LEU 493 Ca 0.72 -0.92 -0.02 0.00 0.08 0.00 0.00 57.88 57.74 1ea9 h LEU 493 Cb 3.35 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 45.04 1ea9 h LEU 493 CO -0.01 1.18 -0.42 -0.09 -1.08 0.00 0.00 178.44 178.02 1ea9 h ARG 494 N -0.82 -0.87 -1.34 1.13 2.43 0.12 -0.26 114.38 114.78 1ea9 h ARG 494 Ca -0.09 0.06 0.42 0.00 -0.81 0.00 0.00 59.98 59.56 1ea9 h ARG 494 Cb 1.23 0.20 -0.11 0.00 -0.42 0.00 0.00 29.97 30.86 1ea9 h ARG 494 CO 0.01 -0.58 0.89 1.96 -1.51 0.00 0.00 179.97 180.74 1ea9 h GLN 495 N -0.90 0.11 0.00 0.20 4.20 -1.43 -2.48 115.11 114.81 1ea9 h GLN 495 Ca -0.06 -0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.57 1ea9 h GLN 495 Cb 0.76 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 1ea9 h GLN 495 CO -0.01 0.07 -0.35 0.00 -0.67 0.00 0.00 178.83 177.87 1ea9 h ALA 496 N 1.52 0.07 -2.87 3.87 0.00 -1.40 -3.45 119.26 116.99 1ea9 h ALA 496 Ca 0.78 -0.69 -0.68 0.00 0.00 0.00 0.00 54.91 54.32 1ea9 h ALA 496 Cb 2.53 0.20 -0.23 0.00 0.00 0.00 0.00 17.79 20.29 1ea9 h ALA 496 CO -0.32 0.20 -0.56 -1.01 0.00 0.00 0.00 179.25 177.56 1ea9 s HIS 497 N -2.26 3.18 0.20 0.00 3.76 -0.17 -4.98 115.29 115.01 1ea9 s HIS 497 Ca -0.21 -0.59 -0.14 0.00 -0.15 0.00 0.00 55.06 53.97 1ea9 s HIS 497 Cb -0.01 -2.35 0.21 0.00 1.11 0.00 0.00 32.58 31.54 1ea9 s HIS 497 CO 0.67 -0.46 1.65 0.00 -0.85 0.00 0.00 174.74 175.75 1ea9 h ALA 498 N 8.35 0.43 -0.49 -1.40 0.00 -1.88 -2.78 119.26 121.48 1ea9 h ALA 498 Ca -0.32 0.20 0.10 0.00 0.00 0.00 0.00 54.91 54.89 1ea9 h ALA 498 Cb 1.14 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 19.21 1ea9 h ALA 498 CO 0.62 -0.42 -0.11 0.00 0.00 0.00 0.00 179.25 179.33 1ea9 n ALA 499 N -2.86 0.13 0.69 0.00 0.00 -1.26 0.39 120.51 117.59 1ea9 n ALA 499 Ca 0.06 0.54 0.06 0.00 0.00 0.00 0.00 53.44 54.11 1ea9 n ALA 499 Cb 0.30 -0.33 0.35 0.00 0.00 0.00 0.00 19.45 19.77 1ea9 n ALA 499 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ea9 n LEU 500 N -4.78 0.00 0.06 0.00 4.77 -1.05 -2.04 117.00 113.97 1ea9 n LEU 500 Ca 0.08 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1ea9 n LEU 500 Cb 0.26 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1ea9 n LEU 500 CO -0.06 -0.11 -0.08 0.54 -1.33 0.00 0.00 177.39 176.35 1ea9 n ARG 501 N -1.20 0.00 -2.76 3.23 1.74 1.26 -3.70 116.66 115.23 1ea9 n ARG 501 Ca 0.07 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.84 1ea9 n ARG 501 Cb 0.09 -0.32 -0.02 0.00 -1.02 0.00 0.00 32.46 31.19 1ea9 n ARG 501 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ea9 n THR 502 N -3.33 3.77 -3.94 0.55 -2.24 0.37 -4.60 114.28 104.87 1ea9 n THR 502 Ca 0.00 -5.54 -0.10 0.00 -2.27 0.00 0.00 64.05 56.14 1ea9 n THR 502 Cb 0.08 -1.41 -0.11 0.00 -2.10 0.00 0.00 70.33 66.78 1ea9 n THR 502 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ea9 s GLY 503 N -2.84 0.16 0.86 3.38 0.00 -0.87 -4.38 107.32 103.63 1ea9 s GLY 503 Ca 0.47 -0.38 -0.12 0.00 0.00 0.00 0.00 44.72 44.68 1ea9 s GLY 503 CO -0.16 -0.46 1.07 2.41 0.00 0.00 0.00 173.10 175.96 1ea9 n THR 504 N 1.82 1.02 -3.86 0.90 -1.04 -1.05 -4.58 114.28 107.49 1ea9 n THR 504 Ca -0.22 -0.13 -0.27 0.00 -2.04 0.00 0.00 64.05 61.39 1ea9 n THR 504 Cb 0.56 -1.04 -0.17 0.00 -1.82 0.00 0.00 70.33 67.86 1ea9 n THR 504 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1ea9 s PHE 505 N -2.34 1.36 -0.02 -1.42 5.36 -1.26 -2.84 117.98 116.81 1ea9 s PHE 505 Ca 0.69 -0.77 0.05 0.00 -0.96 0.00 0.00 56.93 55.94 1ea9 s PHE 505 Cb -0.26 -1.16 -0.01 0.00 -0.34 0.00 0.00 43.02 41.25 1ea9 s PHE 505 CO 0.56 -0.53 -0.19 0.15 -1.46 0.00 0.00 175.22 173.75 1ea9 s LYS 506 N 1.75 1.64 -0.85 10.12 1.02 -0.64 -4.98 119.74 127.79 1ea9 s LYS 506 Ca 0.03 -0.66 -0.20 0.00 0.02 0.00 0.00 55.97 55.16 1ea9 s LYS 506 Cb -0.14 -1.52 0.11 0.00 -0.52 0.00 0.00 37.83 35.76 1ea9 s LYS 506 CO -0.07 0.36 1.09 -0.06 -0.92 0.00 0.00 175.35 175.74 1ea9 s PHE 507 N -0.29 2.96 0.48 3.18 0.08 -1.26 -1.27 117.98 121.87 1ea9 s PHE 507 Ca 0.04 -1.12 0.17 0.00 0.12 0.00 0.00 56.93 56.13 1ea9 s PHE 507 Cb -0.09 -4.30 1.18 0.00 -0.57 0.00 0.00 43.02 39.25 1ea9 s PHE 507 CO 0.00 -1.55 2.05 -0.07 -0.10 0.00 0.00 175.22 175.55 1ea9 h LEU 508 N 10.78 0.16 -7.51 -0.37 4.07 -1.19 -3.43 115.31 117.82 1ea9 h LEU 508 Ca 0.03 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.88 1ea9 h LEU 508 Cb 1.04 -0.03 -0.18 0.00 1.08 0.00 0.00 40.66 42.56 1ea9 h LEU 508 CO 1.14 0.11 -0.25 0.42 -1.08 0.00 0.00 178.44 178.79 1ea9 s THR 509 N -5.20 0.07 0.00 0.22 -4.23 -0.86 -4.98 115.64 100.66 1ea9 s THR 509 Ca -0.06 -0.55 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 1ea9 s THR 509 Cb 0.18 -0.78 0.00 0.00 1.34 0.00 0.00 72.50 73.25 1ea9 s THR 509 CO 0.72 -0.30 0.00 0.00 -0.54 0.00 0.00 174.62 174.49 1ea9 n ALA 510 N 0.93 0.00 -1.77 3.99 0.00 -1.26 -3.80 120.51 118.60 1ea9 n ALA 510 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.86 1ea9 n ALA 510 Cb 0.58 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.99 1ea9 n ALA 510 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1ea9 s GLU 511 N 0.00 4.24 0.07 0.00 8.01 -0.80 -4.39 118.70 125.83 1ea9 s GLU 511 Ca 0.00 1.73 -0.20 0.00 0.01 0.00 0.00 54.97 56.50 1ea9 s GLU 511 Cb 0.00 -2.76 -0.08 0.00 -4.31 0.00 0.00 34.13 26.98 1ea9 s GLU 511 CO 0.00 -0.13 1.33 0.87 0.01 0.00 0.00 175.26 177.35 1ea9 h LYS 512 N 2.89 -0.34 -0.89 1.61 1.57 -1.84 -1.71 116.57 117.86 1ea9 h LYS 512 Ca -0.48 0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.23 1ea9 h LYS 512 Cb 1.22 0.08 -0.06 0.00 0.08 0.00 0.00 32.23 33.55 1ea9 h LYS 512 CO 0.64 -0.23 0.12 0.09 -0.57 0.00 0.00 179.45 179.50 1ea9 n ASN 513 N -4.29 3.23 -4.80 0.86 3.02 -1.26 -4.67 115.26 107.35 1ea9 n ASN 513 Ca -0.04 -2.55 -0.22 0.00 -0.03 0.00 0.00 54.58 51.75 1ea9 n ASN 513 Cb 0.23 -0.61 -0.05 0.00 -0.61 0.00 0.00 39.78 38.74 1ea9 n ASN 513 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ea9 s SER 514 N -0.22 5.17 -0.05 6.41 0.15 -0.64 -5.03 113.70 119.50 1ea9 s SER 514 Ca 0.25 -0.48 0.07 0.00 0.70 0.00 0.00 55.95 56.48 1ea9 s SER 514 Cb 0.20 -1.05 0.10 0.00 -1.71 0.00 0.00 66.02 63.56 1ea9 s SER 514 CO 0.06 -0.20 0.97 0.54 1.20 0.00 0.00 173.24 175.81 1ea9 n ARG 515 N -1.22 1.26 -4.60 5.44 1.74 -1.26 -1.70 116.66 116.32 1ea9 n ARG 515 Ca -0.04 -1.60 -0.34 0.00 -0.77 0.00 0.00 57.85 55.09 1ea9 n ARG 515 Cb 0.59 -0.98 -0.11 0.00 -1.02 0.00 0.00 32.46 30.94 1ea9 n ARG 515 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1ea9 s GLN 516 N -1.27 2.81 0.20 5.56 1.11 -1.26 0.39 119.66 127.20 1ea9 s GLN 516 Ca 0.11 -0.54 0.07 0.00 0.01 0.00 0.00 55.36 55.02 1ea9 s GLN 516 Cb 0.10 -2.62 -0.05 0.00 -1.01 0.00 0.00 33.01 29.43 1ea9 s GLN 516 CO 0.01 0.64 -0.14 0.42 0.01 0.00 0.00 175.29 176.23 1ea9 s ILE 517 N -0.74 1.69 -0.29 1.08 1.09 0.27 -4.45 121.20 119.85 1ea9 s ILE 517 Ca 0.11 -2.20 0.06 0.00 -1.10 0.00 0.00 60.65 57.52 1ea9 s ILE 517 Cb -0.11 -2.05 0.20 0.00 -1.06 0.00 0.00 42.46 39.44 1ea9 s ILE 517 CO 0.02 -0.59 0.59 0.00 -0.10 0.00 0.00 174.94 174.86 1ea9 s ALA 518 N -3.00 -2.41 0.32 9.38 0.00 -1.25 -2.00 121.76 122.80 1ea9 s ALA 518 Ca 0.22 1.08 0.10 0.00 0.00 0.00 0.00 51.96 53.36 1ea9 s ALA 518 Cb -0.00 -2.54 -0.06 0.00 0.00 0.00 0.00 23.12 20.52 1ea9 s ALA 518 CO 0.07 -1.82 -0.11 1.52 0.00 0.00 0.00 175.76 175.41 1ea9 s TYR 519 N 2.83 2.40 -0.03 0.00 -0.85 -0.03 -0.59 117.35 121.09 1ea9 s TYR 519 Ca 0.10 -0.41 0.03 0.00 -0.52 0.00 0.00 57.07 56.27 1ea9 s TYR 519 Cb -0.10 -1.24 0.00 0.00 0.38 0.00 0.00 41.96 41.00 1ea9 s TYR 519 CO -0.26 0.62 -0.12 -1.17 -1.52 0.00 0.00 175.55 173.10 1ea9 s LEU 520 N -3.59 1.81 0.01 -3.49 0.20 -0.39 -0.36 118.68 112.87 1ea9 s LEU 520 Ca 0.32 -0.25 0.06 0.00 0.69 0.00 0.00 54.13 54.95 1ea9 s LEU 520 Cb -0.01 -0.71 -0.02 0.00 -0.43 0.00 0.00 46.19 45.02 1ea9 s LEU 520 CO 0.17 0.09 -0.17 -0.13 -0.29 0.00 0.00 176.35 176.02 1ea9 s ARG 521 N 0.18 1.29 -0.14 1.98 0.52 0.21 -1.62 118.95 121.37 1ea9 s ARG 521 Ca -0.04 -0.71 -0.15 0.00 -0.52 0.00 0.00 55.73 54.31 1ea9 s ARG 521 Cb -0.10 -1.29 0.04 0.00 0.52 0.00 0.00 34.95 34.11 1ea9 s ARG 521 CO 0.01 0.34 0.41 -1.83 0.02 0.00 0.00 175.30 174.26 1ea9 s GLU 522 N -0.71 0.53 0.00 3.54 1.03 -1.13 -1.91 118.70 120.05 1ea9 s GLU 522 Ca 0.06 0.47 0.00 0.00 0.03 0.00 0.00 54.97 55.53 1ea9 s GLU 522 Cb -0.07 0.26 0.00 0.00 -0.80 0.00 0.00 34.13 33.51 1ea9 s GLU 522 CO 0.00 -0.08 0.00 -0.40 -1.33 0.00 0.00 175.26 173.45 1ea9 n ASP 523 N 2.58 1.70 -1.93 0.83 5.68 -0.47 -2.53 116.55 122.41 1ea9 n ASP 523 Ca -0.14 -0.40 -0.17 0.00 -0.50 0.00 0.00 54.79 53.58 1ea9 n ASP 523 Cb 0.57 0.00 0.02 0.00 -1.14 0.00 0.00 41.12 40.57 1ea9 n ASP 523 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1ea9 n ASP 524 N -0.52 6.41 0.00 -1.12 -0.08 -1.26 -3.81 116.55 116.17 1ea9 n ASP 524 Ca 0.00 -3.04 0.00 0.00 -1.51 0.00 0.00 54.79 50.24 1ea9 n ASP 524 Cb 0.00 -1.08 0.00 0.00 2.34 0.00 0.00 41.12 42.38 1ea9 n ASP 524 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ea9 n GLN 525 N 0.48 0.00 -3.65 -0.67 -0.00 -1.26 -5.16 117.38 107.13 1ea9 n GLN 525 Ca 0.31 0.00 -0.03 0.00 -0.00 0.00 0.00 57.00 57.27 1ea9 n GLN 525 Cb 0.58 0.00 -0.07 0.00 -0.00 0.00 0.00 30.24 30.75 1ea9 n GLN 525 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1ea9 s ASP 526 N 0.00 -0.09 -0.24 2.61 -0.00 -1.25 -5.07 116.67 112.63 1ea9 s ASP 526 Ca 0.00 0.16 -0.04 0.00 -0.00 0.00 0.00 52.55 52.67 1ea9 s ASP 526 Cb 0.00 0.16 0.09 0.00 -0.00 0.00 0.00 42.92 43.16 1ea9 s ASP 526 CO 0.00 -0.04 0.12 -0.89 -0.00 0.00 0.00 175.17 174.37 1ea9 s THR 527 N -0.11 -0.09 0.06 -1.27 2.01 -1.26 -1.37 115.64 113.60 1ea9 s THR 527 Ca 0.07 -0.52 0.07 0.00 0.31 0.00 0.00 61.69 61.62 1ea9 s THR 527 Cb -0.04 -0.82 -0.03 0.00 0.01 0.00 0.00 72.50 71.62 1ea9 s THR 527 CO -0.14 -0.55 -0.19 -0.51 -0.69 0.00 0.00 174.62 172.55 1ea9 s ILE 528 N 2.13 1.54 -0.41 1.82 -1.16 -0.80 -1.20 121.20 123.12 1ea9 s ILE 528 Ca 0.06 -1.23 0.03 0.00 -0.51 0.00 0.00 60.65 59.00 1ea9 s ILE 528 Cb -0.16 -1.36 0.11 0.00 0.61 0.00 0.00 42.46 41.66 1ea9 s ILE 528 CO -0.26 0.09 0.14 -1.48 -2.81 0.00 0.00 174.94 170.62 1ea9 s LEU 529 N -1.35 4.72 0.34 8.50 2.34 -0.20 -0.62 118.68 132.42 1ea9 s LEU 529 Ca 0.06 -2.40 -0.29 0.00 0.06 0.00 0.00 54.13 51.56 1ea9 s LEU 529 Cb -0.09 -1.66 -0.11 0.00 -0.56 0.00 0.00 46.19 43.77 1ea9 s LEU 529 CO 0.02 -0.36 1.46 -0.69 -1.06 0.00 0.00 176.35 175.72 1ea9 s VAL 530 N 0.57 2.24 -0.13 1.48 1.01 0.52 -3.40 120.40 122.69 1ea9 s VAL 530 Ca 0.13 0.24 -0.01 0.00 0.00 0.00 0.00 61.98 62.33 1ea9 s VAL 530 Cb -0.21 -3.15 0.04 0.00 0.00 0.00 0.00 36.38 33.05 1ea9 s VAL 530 CO -0.05 0.05 -0.03 -0.69 0.00 0.00 0.00 175.10 174.38 1ea9 s VAL 531 N -0.87 0.76 0.25 2.92 1.01 -1.26 -0.85 120.40 122.37 1ea9 s VAL 531 Ca 0.54 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 62.24 1ea9 s VAL 531 Cb -0.45 -0.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 1ea9 s VAL 531 CO 0.57 0.17 0.06 -0.04 0.00 0.00 0.00 175.10 175.86 1ea9 s MET 532 N 1.80 1.38 -0.30 2.72 -1.94 -0.85 -3.61 119.30 118.50 1ea9 s MET 532 Ca 0.03 -1.73 -0.14 0.00 -1.71 0.00 0.00 55.69 52.14 1ea9 s MET 532 Cb -0.14 -0.40 0.15 0.00 2.01 0.00 0.00 34.83 36.46 1ea9 s MET 532 CO -0.07 -0.22 0.89 0.54 -0.01 0.00 0.00 175.02 176.14 1ea9 s ASN 533 N -3.31 -0.75 0.35 3.03 2.20 -1.13 0.97 114.94 116.30 1ea9 s ASN 533 Ca 0.34 1.03 0.09 0.00 -0.94 0.00 0.00 52.86 53.39 1ea9 s ASN 533 Cb 0.07 1.83 0.66 0.00 -2.00 0.00 0.00 41.25 41.82 1ea9 s ASN 533 CO 0.12 -0.14 1.82 0.78 -2.94 0.00 0.00 177.10 176.73 1ea9 h ASN 534 N 7.60 0.17 -0.73 3.54 4.21 -0.37 -3.33 115.58 126.67 1ea9 h ASN 534 Ca -0.17 -0.05 -0.52 0.00 1.21 0.00 0.00 56.30 56.77 1ea9 h ASN 534 Cb 1.11 -0.05 0.07 0.00 -1.12 0.00 0.00 38.32 38.33 1ea9 h ASN 534 CO 0.09 0.46 -0.25 -0.67 -1.29 0.00 0.00 177.43 175.78 1ea9 n ASP 535 N -4.15 -0.62 0.00 5.81 4.64 -1.24 -4.57 116.55 116.42 1ea9 n ASP 535 Ca -0.01 0.83 0.10 0.00 -1.38 0.00 0.00 54.79 54.33 1ea9 n ASP 535 Cb 0.37 -0.69 0.58 0.00 -1.04 0.00 0.00 41.12 40.35 1ea9 n ASP 535 CO 0.00 0.00 0.00 1.17 -0.82 0.00 0.00 177.20 177.55 1ea9 n LYS 536 N 0.85 0.91 -2.17 -0.67 4.81 -1.26 -2.72 118.16 117.91 1ea9 n LYS 536 Ca 0.14 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.57 1ea9 n LYS 536 Cb 0.14 -1.33 0.05 0.00 0.02 0.00 0.00 35.03 33.90 1ea9 n LYS 536 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ea9 n ALA 537 N -0.83 2.77 -0.76 3.14 0.00 -1.26 -4.80 120.51 118.77 1ea9 n ALA 537 Ca 0.15 -2.73 0.00 0.00 0.00 0.00 0.00 53.44 50.86 1ea9 n ALA 537 Cb 0.07 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 18.76 1ea9 n ALA 537 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ea9 n GLY 538 N -0.25 2.57 0.00 0.00 0.00 -1.25 -4.63 105.19 101.64 1ea9 n GLY 538 Ca 0.10 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1ea9 n GLY 538 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ea9 n HIS 539 N 13.92 0.00 0.00 1.61 -0.00 -1.22 -4.83 115.22 124.69 1ea9 n HIS 539 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1ea9 n HIS 539 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1ea9 n HIS 539 CO 0.00 0.00 0.00 2.41 0.46 0.00 0.00 176.34 179.21 1ea9 n THR 540 N 0.00 0.00 -1.83 3.57 -1.04 -1.23 -4.95 114.28 108.80 1ea9 n THR 540 Ca 0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.62 1ea9 n THR 540 Cb 0.00 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 68.53 1ea9 n THR 540 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1ea9 s LEU 541 N 0.00 4.02 -0.48 -4.42 1.43 0.13 -4.47 118.68 114.89 1ea9 s LEU 541 Ca 0.00 2.83 0.03 0.00 -1.03 0.00 0.00 54.13 55.95 1ea9 s LEU 541 Cb 0.00 -4.06 0.14 0.00 0.03 0.00 0.00 46.19 42.30 1ea9 s LEU 541 CO 0.00 -1.29 0.28 -0.89 0.23 0.00 0.00 176.35 174.68 1ea9 s THR 542 N -1.25 1.68 -0.00 5.49 2.01 -1.26 0.20 115.64 122.50 1ea9 s THR 542 Ca 0.65 -2.89 -0.00 0.00 0.31 0.00 0.00 61.69 59.76 1ea9 s THR 542 Cb -0.42 -2.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.90 1ea9 s THR 542 CO 0.52 -0.92 0.07 -1.48 -0.69 0.00 0.00 174.62 172.12 1ea9 s LEU 543 N 0.01 3.86 0.43 4.42 2.34 -0.63 -4.90 118.68 124.21 1ea9 s LEU 543 Ca 0.20 0.12 -0.26 0.00 0.06 0.00 0.00 54.13 54.26 1ea9 s LEU 543 Cb -0.20 -2.26 -0.08 0.00 -0.56 0.00 0.00 46.19 43.09 1ea9 s LEU 543 CO -0.03 0.27 1.37 -2.84 -1.06 0.00 0.00 176.35 174.06 1ea9 s PRO 544 N -1.74 3.80 0.28 1.48 0.02 -1.26 -2.30 135.00 135.28 1ea9 s PRO 544 Ca 0.23 2.31 0.01 0.00 0.02 0.00 0.00 61.00 63.56 1ea9 s PRO 544 Cb -0.12 -2.70 -0.00 0.00 0.02 0.00 0.00 34.50 31.70 1ea9 s PRO 544 CO 0.14 -0.68 0.35 1.33 -0.33 0.00 0.00 177.00 177.81 1ea9 n VAL 545 N -0.06 0.00 -2.67 3.83 0.24 -1.25 -4.89 118.33 113.53 1ea9 n VAL 545 Ca 0.04 -1.59 -0.28 0.00 -2.04 0.00 0.00 64.34 60.48 1ea9 n VAL 545 Cb 0.43 0.92 -0.00 0.00 -1.47 0.00 0.00 33.84 33.71 1ea9 n VAL 545 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1ea9 s ARG 546 N -2.77 3.56 -0.13 7.34 1.81 -1.26 -4.93 118.95 122.58 1ea9 s ARG 546 Ca 0.26 0.22 -0.05 0.00 -1.72 0.00 0.00 55.73 54.44 1ea9 s ARG 546 Cb -0.00 -2.38 -0.06 0.00 -0.45 0.00 0.00 34.95 32.06 1ea9 s ARG 546 CO 0.19 -0.18 -0.15 0.72 -0.68 0.00 0.00 175.30 175.19 1ea9 n HIS 547 N -2.16 0.00 -0.29 -0.53 8.25 -1.26 -4.68 115.22 114.56 1ea9 n HIS 547 Ca 0.01 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 57.65 1ea9 n HIS 547 Cb 0.55 -0.46 0.47 0.00 1.12 0.00 0.00 29.99 31.67 1ea9 n HIS 547 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ea9 h ALA 548 N -0.34 2.11 -2.78 -1.41 0.00 -2.03 -3.41 119.26 111.39 1ea9 h ALA 548 Ca -0.31 0.04 -0.52 0.00 0.00 0.00 0.00 54.91 54.11 1ea9 h ALA 548 Cb 1.32 -0.03 0.10 0.00 0.00 0.00 0.00 17.79 19.18 1ea9 h ALA 548 CO -0.16 -0.44 0.46 1.14 0.00 0.00 0.00 179.25 180.26 1ea9 s GLN 549 N -5.53 3.08 0.00 0.00 1.03 -1.26 -4.99 119.66 111.99 1ea9 s GLN 549 Ca -0.09 1.78 0.00 0.00 0.04 0.00 0.00 55.36 57.09 1ea9 s GLN 549 Cb 0.24 -1.96 0.00 0.00 0.03 0.00 0.00 33.01 31.32 1ea9 s GLN 549 CO 0.79 -1.11 0.42 0.91 -2.54 0.00 0.00 175.29 173.77 1ea9 n TRP 550 N -1.49 0.00 0.00 9.60 5.03 -1.26 -4.96 117.44 124.35 1ea9 n TRP 550 Ca 0.13 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.66 1ea9 n TRP 550 Cb 0.50 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.78 1ea9 n TRP 550 CO 0.00 0.00 0.00 2.41 -0.03 0.00 0.00 177.69 180.07 1ea9 n THR 551 N -0.65 0.00 -3.54 -0.99 -1.04 -1.26 -4.59 114.28 102.21 1ea9 n THR 551 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 1ea9 n THR 551 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 1ea9 n THR 551 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1ea9 s HIS 552 N 1.99 -0.47 -0.02 -1.42 3.76 -1.24 -1.34 115.29 116.54 1ea9 s HIS 552 Ca 0.00 0.72 -0.05 0.00 -0.15 0.00 0.00 55.06 55.57 1ea9 s HIS 552 Cb 0.00 0.46 0.00 0.00 1.11 0.00 0.00 32.58 34.15 1ea9 s HIS 552 CO 0.00 -0.50 0.12 -0.51 -0.85 0.00 0.00 174.74 173.00 1ea9 s LEU 553 N -1.45 1.61 0.86 0.89 1.02 -0.75 -4.62 118.68 116.24 1ea9 s LEU 553 Ca -0.04 -0.05 -0.12 0.00 0.02 0.00 0.00 54.13 53.94 1ea9 s LEU 553 Cb -0.00 0.52 0.14 0.00 0.02 0.00 0.00 46.19 46.87 1ea9 s LEU 553 CO 0.02 -0.23 1.21 0.86 0.02 0.00 0.00 176.35 178.23 1ea9 s TRP 554 N -0.81 2.09 0.00 0.29 -0.00 -1.26 -1.40 118.94 117.85 1ea9 s TRP 554 Ca -0.09 0.37 0.00 0.00 -0.00 0.00 0.00 56.10 56.38 1ea9 s TRP 554 Cb -0.05 -3.72 0.00 0.00 -0.00 0.00 0.00 33.47 29.70 1ea9 s TRP 554 CO 0.01 -2.17 0.00 1.04 -0.00 0.00 0.00 176.95 175.83 1ea9 n GLN 555 N -3.44 1.89 0.00 5.86 1.13 -1.26 -4.19 117.38 117.36 1ea9 n GLN 555 Ca 0.12 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.18 1ea9 n GLN 555 Cb 0.60 -0.94 0.00 0.00 0.11 0.00 0.00 30.24 30.01 1ea9 n GLN 555 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1ea9 n ASP 556 N -2.08 0.00 0.00 1.08 9.92 -1.26 -4.07 116.55 120.14 1ea9 n ASP 556 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1ea9 n ASP 556 Cb 0.44 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.92 1ea9 n ASP 556 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1ea9 n ASP 557 N -0.72 0.00 -4.64 -2.24 2.03 -1.26 -5.14 116.55 104.57 1ea9 n ASP 557 Ca 0.00 0.00 -0.49 0.00 0.52 0.00 0.00 54.79 54.82 1ea9 n ASP 557 Cb 0.00 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.35 1ea9 n ASP 557 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1ea9 n VAL 558 N 0.00 0.09 -4.28 5.18 0.31 -1.26 -4.61 118.33 113.76 1ea9 n VAL 558 Ca 0.00 -0.02 -0.17 0.00 -0.01 0.00 0.00 64.34 64.14 1ea9 n VAL 558 Cb 0.00 -1.28 -0.10 0.00 -0.91 0.00 0.00 33.84 31.54 1ea9 n VAL 558 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1ea9 s LEU 559 N 1.32 2.49 0.05 7.52 2.96 -1.26 -4.99 118.68 126.76 1ea9 s LEU 559 Ca 0.84 -0.93 -0.26 0.00 -0.22 0.00 0.00 54.13 53.56 1ea9 s LEU 559 Cb -0.82 -0.56 -0.17 0.00 0.50 0.00 0.00 46.19 45.14 1ea9 s LEU 559 CO 0.45 -0.19 1.55 0.71 -1.32 0.00 0.00 176.35 177.55 1ea9 h THR 560 N 3.01 0.84 -6.28 3.68 1.35 -1.95 -3.43 112.91 110.13 1ea9 h THR 560 Ca -0.39 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 1ea9 h THR 560 Cb 1.20 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 1ea9 h THR 560 CO 0.57 0.06 0.00 0.00 -0.25 0.00 0.00 175.52 175.91 1ea9 n ALA 561 N -2.29 -0.97 -1.77 6.62 0.00 -1.26 -4.78 120.51 116.06 1ea9 n ALA 561 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.94 1ea9 n ALA 561 Cb 0.18 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.64 1ea9 n ALA 561 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ea9 s ALA 562 N -4.08 3.39 0.00 0.00 0.00 -1.26 -4.38 121.76 115.43 1ea9 s ALA 562 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.50 1ea9 s ALA 562 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1ea9 s ALA 562 CO 0.00 -1.17 0.00 0.72 0.00 0.00 0.00 175.76 175.31 1ea9 n HIS 563 N 0.07 0.00 0.00 0.00 8.25 -1.26 -4.82 115.22 117.45 1ea9 n HIS 563 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 1ea9 n HIS 563 Cb 0.40 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.51 1ea9 n HIS 563 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ea9 n GLY 564 N 0.00 2.26 0.00 -1.41 0.00 -1.26 -4.76 105.19 100.02 1ea9 n GLY 564 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1ea9 n GLY 564 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1ea9 n GLN 565 N 12.59 0.00 0.00 1.61 -0.06 -1.26 -4.78 117.38 125.49 1ea9 n GLN 565 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1ea9 n GLN 565 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1ea9 n GLN 565 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 1ea9 n LEU 566 N 0.00 0.00 -2.55 1.69 4.77 -1.26 -4.99 117.00 114.66 1ea9 n LEU 566 Ca 0.00 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.79 1ea9 n LEU 566 Cb 0.00 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1ea9 n LEU 566 CO 0.00 0.00 0.05 0.35 -1.33 0.00 0.00 177.39 176.46 1ea9 n THR 567 N 0.00 1.76 0.00 -5.08 -2.24 -1.26 -3.81 114.28 103.65 1ea9 n THR 567 Ca 0.00 -4.07 0.00 0.00 -2.27 0.00 0.00 64.05 57.71 1ea9 n THR 567 Cb 0.00 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 67.85 1ea9 n THR 567 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1ea9 n VAL 568 N -0.31 0.00 -3.13 2.28 0.31 -0.97 -1.61 118.33 114.89 1ea9 n VAL 568 Ca 0.26 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 64.20 1ea9 n VAL 568 Cb 0.74 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.61 1ea9 n VAL 568 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1ea9 s LYS 569 N 0.00 4.37 -0.17 5.55 2.20 -1.26 -1.73 119.74 128.70 1ea9 s LYS 569 Ca 0.00 0.88 -0.05 0.00 -0.36 0.00 0.00 55.97 56.44 1ea9 s LYS 569 Cb 0.00 -3.31 0.06 0.00 -1.51 0.00 0.00 37.83 33.08 1ea9 s LYS 569 CO 0.00 0.45 0.11 -0.51 -0.36 0.00 0.00 175.35 175.04 1ea9 s LEU 570 N -0.55 0.27 0.00 5.43 1.43 0.53 -4.96 118.68 120.83 1ea9 s LEU 570 Ca 0.33 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.90 1ea9 s LEU 570 Cb -0.20 -0.15 0.00 0.00 0.03 0.00 0.00 46.19 45.87 1ea9 s LEU 570 CO 0.20 -0.34 0.48 -2.65 0.23 0.00 0.00 176.35 174.27 1ea9 n PRO 571 N 5.29 0.77 -1.17 1.29 -0.02 -1.26 0.23 135.00 140.12 1ea9 n PRO 571 Ca -0.07 0.00 -0.52 0.00 -2.02 0.00 0.00 63.50 60.89 1ea9 n PRO 571 Cb 0.49 -1.32 -0.10 0.00 -0.02 0.00 0.00 33.50 32.55 1ea9 n PRO 571 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ea9 n ALA 572 N 0.23 -0.20 -1.00 3.55 0.00 -1.26 -4.62 120.51 117.21 1ea9 n ALA 572 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1ea9 n ALA 572 Cb 0.24 -1.71 0.00 0.00 0.00 0.00 0.00 19.45 17.98 1ea9 n ALA 572 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ea9 n TYR 573 N 5.46 -1.82 -1.48 0.00 4.01 -1.26 -3.46 117.16 118.61 1ea9 n TYR 573 Ca 0.40 0.00 -0.56 0.00 -0.16 0.00 0.00 57.90 57.58 1ea9 n TYR 573 Cb -0.04 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 38.90 1ea9 n TYR 573 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ea9 n GLY 574 N 3.58 0.39 3.84 2.72 0.00 -1.26 0.46 105.19 114.91 1ea9 n GLY 574 Ca 0.00 0.99 -0.28 0.00 0.00 0.00 0.00 46.02 46.73 1ea9 n GLY 574 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ea9 n PHE 575 N 7.64 -2.41 -2.16 1.61 3.01 -1.10 -4.78 117.46 119.26 1ea9 n PHE 575 Ca 0.41 0.93 -0.29 0.00 1.01 0.00 0.00 57.45 59.50 1ea9 n PHE 575 Cb 0.11 -4.23 0.01 0.00 -0.01 0.00 0.00 39.48 35.35 1ea9 n PHE 575 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ea9 s ALA 576 N -3.33 3.20 0.00 4.37 0.00 0.17 -4.88 121.76 121.30 1ea9 s ALA 576 Ca 0.61 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.29 1ea9 s ALA 576 Cb -0.30 -2.88 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1ea9 s ALA 576 CO 0.81 -0.61 0.13 1.33 0.00 0.00 0.00 175.76 177.43 1ea9 n VAL 577 N -2.59 0.00 -1.31 0.00 0.24 -1.26 -2.85 118.33 110.57 1ea9 n VAL 577 Ca 0.04 -0.27 -0.50 0.00 -2.04 0.00 0.00 64.34 61.57 1ea9 n VAL 577 Cb 0.55 1.23 -0.13 0.00 -1.47 0.00 0.00 33.84 34.02 1ea9 n VAL 577 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1ea9 n LEU 578 N -0.27 0.54 0.00 1.34 4.77 -1.24 -4.03 117.00 118.11 1ea9 n LEU 578 Ca 0.00 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 1ea9 n LEU 578 Cb 0.06 -0.88 0.00 0.00 -2.33 0.00 0.00 43.42 40.27 1ea9 n LEU 578 CO 0.00 -0.72 0.00 2.29 -1.33 0.00 0.00 177.39 177.63 1ea9 n LYS 579 N 7.66 3.10 0.00 3.23 -0.00 -1.26 -4.38 118.16 126.51 1ea9 n LYS 579 Ca 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.89 1ea9 n LYS 579 Cb -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.02 1ea9 n LYS 579 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ea9 n ALA 580 N -3.00 0.00 -3.78 0.58 0.00 -1.22 -4.25 120.51 108.84 1ea9 n ALA 580 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 1ea9 n ALA 580 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.28 1ea9 n ALA 580 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ea9 s SER 581 N 0.00 1.75 -0.44 0.00 1.04 -0.49 -1.03 113.70 114.52 1ea9 s SER 581 Ca 0.00 -0.19 -0.42 0.00 0.48 0.00 0.00 55.95 55.82 1ea9 s SER 581 Cb 0.00 -0.63 -0.17 0.00 0.10 0.00 0.00 66.02 65.32 1ea9 s SER 581 CO 0.00 -0.13 2.02 -1.54 0.98 0.00 0.00 173.24 174.57 1ea9 n SER 582 N 4.82 1.33 -0.12 7.02 3.41 -0.34 -1.82 113.62 127.93 1ea9 n SER 582 Ca -0.13 0.75 0.16 0.00 -0.26 0.00 0.00 58.87 59.39 1ea9 n SER 582 Cb 0.50 -1.01 0.85 0.00 -0.26 0.00 0.00 64.21 64.29 1ea9 n SER 582 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21