#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k9a s SER 7 N 0.00 4.81 0.26 0.00 1.04 -1.26 -4.93 113.70 113.63 1k9a s SER 7 Ca 0.00 2.28 -0.30 0.00 0.48 0.00 0.00 55.95 58.41 1k9a s SER 7 Cb 0.00 -2.58 -0.11 0.00 0.10 0.00 0.00 66.02 63.43 1k9a s SER 7 CO 0.00 -1.85 1.55 0.26 0.98 0.00 0.00 173.24 174.18 1k9a s TRP 8 N -1.91 2.87 0.57 5.02 0.51 -1.26 -4.96 118.94 119.78 1k9a s TRP 8 Ca 0.74 0.82 -0.17 0.00 -2.12 0.00 0.00 56.10 55.36 1k9a s TRP 8 Cb -0.27 -3.98 -0.05 0.00 -0.81 0.00 0.00 33.47 28.36 1k9a s TRP 8 CO 0.39 -3.32 1.07 -2.14 -0.51 0.00 0.00 176.95 172.44 1k9a s PRO 9 N -0.22 3.36 0.29 4.98 0.02 -1.26 -4.70 135.00 137.46 1k9a s PRO 9 Ca 0.63 1.33 -0.29 0.00 0.02 0.00 0.00 61.00 62.69 1k9a s PRO 9 Cb -0.46 -2.03 -0.14 0.00 0.02 0.00 0.00 34.50 31.90 1k9a s PRO 9 CO 0.44 -0.79 1.17 0.45 -0.33 0.00 0.00 177.00 177.94 1k9a n SER 10 N -1.72 1.96 0.00 2.53 2.88 -1.26 -1.76 113.62 116.24 1k9a n SER 10 Ca 0.10 1.18 0.00 0.00 -1.33 0.00 0.00 58.87 58.81 1k9a n SER 10 Cb 0.52 -1.36 0.00 0.00 -0.75 0.00 0.00 64.21 62.62 1k9a n SER 10 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1k9a n GLY 11 N 1.31 2.01 3.58 0.46 0.00 0.19 -4.99 105.19 107.75 1k9a n GLY 11 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1k9a n GLY 11 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1k9a n THR 12 N -2.00 3.32 -3.97 2.61 -1.04 -0.72 -4.57 114.28 107.91 1k9a n THR 12 Ca 0.00 -0.50 -0.35 0.00 -2.04 0.00 0.00 64.05 61.16 1k9a n THR 12 Cb 0.00 -1.03 -0.11 0.00 -1.82 0.00 0.00 70.33 67.38 1k9a n THR 12 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1k9a s GLU 13 N -2.57 3.86 -0.02 -2.82 2.12 -1.26 -1.00 118.70 117.01 1k9a s GLU 13 Ca 0.74 -0.39 0.03 0.00 0.36 0.00 0.00 54.97 55.70 1k9a s GLU 13 Cb -0.43 -3.23 -0.00 0.00 0.26 0.00 0.00 34.13 30.73 1k9a s GLU 13 CO 0.49 0.13 -0.11 0.00 -0.54 0.00 0.00 175.26 175.24 1k9a s ILE 15 N 0.03 5.43 0.02 0.00 2.07 0.58 -0.12 121.20 129.21 1k9a s ILE 15 Ca -0.01 -0.05 -0.30 0.00 -1.41 0.00 0.00 60.65 58.88 1k9a s ILE 15 Cb -0.08 -3.52 -0.04 0.00 0.13 0.00 0.00 42.46 38.96 1k9a s ILE 15 CO 0.00 0.38 0.99 0.00 -1.91 0.00 0.00 174.94 174.41 1k9a s ALA 16 N -1.27 3.19 -0.11 1.50 0.00 0.71 0.33 121.76 126.12 1k9a s ALA 16 Ca 0.25 0.57 0.15 0.00 0.00 0.00 0.00 51.96 52.93 1k9a s ALA 16 Cb -0.13 -3.34 -0.10 0.00 0.00 0.00 0.00 23.12 19.56 1k9a s ALA 16 CO 0.16 -0.22 1.01 0.87 0.00 0.00 0.00 175.76 177.57 1k9a h LYS 17 N 6.64 0.00 -4.31 0.00 1.57 0.02 -0.39 116.57 120.10 1k9a h LYS 17 Ca -0.41 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.11 1k9a h LYS 17 Cb 1.22 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.42 1k9a h LYS 17 CO 0.75 0.41 -0.36 0.71 -0.57 0.00 0.00 179.45 180.39 1k9a s TYR 18 N -2.89 1.07 0.24 -1.35 2.02 -1.23 -4.82 117.35 110.38 1k9a s TYR 18 Ca -0.01 -1.27 -0.29 0.00 -0.37 0.00 0.00 57.07 55.13 1k9a s TYR 18 Cb 0.08 -0.28 -0.09 0.00 -0.40 0.00 0.00 41.96 41.27 1k9a s TYR 18 CO 0.80 -0.91 0.91 -0.80 -1.57 0.00 0.00 175.55 173.97 1k9a s ASN 19 N -3.19 7.56 -0.17 2.29 0.01 -1.26 -3.56 114.94 116.62 1k9a s ASN 19 Ca 0.33 1.88 0.01 0.00 -0.71 0.00 0.00 52.86 54.37 1k9a s ASN 19 Cb 0.02 -2.58 0.02 0.00 0.41 0.00 0.00 41.25 39.12 1k9a s ASN 19 CO 0.17 0.14 -0.16 0.12 -1.51 0.00 0.00 177.10 175.85 1k9a s PHE 20 N -1.23 2.49 -0.98 2.20 5.36 -0.14 -4.94 117.98 120.73 1k9a s PHE 20 Ca 0.41 -1.47 0.24 0.00 -0.96 0.00 0.00 56.93 55.15 1k9a s PHE 20 Cb -0.25 -1.75 0.24 0.00 -0.34 0.00 0.00 43.02 40.92 1k9a s PHE 20 CO 0.30 -0.74 1.23 0.72 -1.46 0.00 0.00 175.22 175.26 1k9a n HIS 21 N 4.69 0.01 0.00 10.12 8.25 -1.26 -1.64 115.22 135.39 1k9a n HIS 21 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 1k9a n HIS 21 Cb 0.50 -0.18 0.00 0.00 1.12 0.00 0.00 29.99 31.43 1k9a n HIS 21 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1k9a n GLY 22 N 1.49 0.72 0.00 -1.41 0.00 -1.26 -4.78 105.19 99.95 1k9a n GLY 22 Ca 0.05 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.52 1k9a n GLY 22 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k9a n THR 23 N 1.06 0.00 -4.02 2.61 -2.24 -1.26 -5.08 114.28 105.35 1k9a n THR 23 Ca 0.00 -0.27 -0.13 0.00 -2.27 0.00 0.00 64.05 61.38 1k9a n THR 23 Cb 0.00 0.77 -0.03 0.00 -2.10 0.00 0.00 70.33 68.98 1k9a n THR 23 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k9a s ALA 24 N -1.30 0.36 0.05 6.98 0.00 -1.26 -5.06 121.76 121.54 1k9a s ALA 24 Ca 0.00 -1.31 -0.31 0.00 0.00 0.00 0.00 51.96 50.34 1k9a s ALA 24 Cb 0.00 1.04 -0.18 0.00 0.00 0.00 0.00 23.12 23.98 1k9a s ALA 24 CO 0.00 -0.84 1.43 0.93 0.00 0.00 0.00 175.76 177.28 1k9a h GLU 25 N 2.09 -0.90 -1.06 0.00 5.08 -2.01 -3.09 114.58 114.68 1k9a h GLU 25 Ca -0.29 0.06 0.30 0.00 -1.00 0.00 0.00 59.36 58.43 1k9a h GLU 25 Cb 1.24 0.21 -0.05 0.00 0.50 0.00 0.00 28.75 30.65 1k9a h GLU 25 CO 0.39 -0.58 0.75 -0.56 -1.00 0.00 0.00 179.01 178.01 1k9a h GLN 26 N -1.06 0.04 -6.72 2.33 3.07 -1.98 -3.43 115.11 107.36 1k9a h GLN 26 Ca -0.10 -0.00 -0.58 0.00 0.09 0.00 0.00 58.65 58.07 1k9a h GLN 26 Cb 0.75 -0.01 0.13 0.00 0.08 0.00 0.00 27.48 28.43 1k9a h GLN 26 CO 0.16 0.03 0.28 -0.25 0.09 0.00 0.00 178.83 179.14 1k9a n ASP 27 N -4.26 1.71 -4.26 0.06 9.92 -1.17 -0.71 116.55 117.84 1k9a n ASP 27 Ca 0.23 1.05 -0.42 0.00 -0.53 0.00 0.00 54.79 55.12 1k9a n ASP 27 Cb 1.09 -1.41 -0.08 0.00 -0.64 0.00 0.00 41.12 40.08 1k9a n ASP 27 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1k9a s LEU 28 N -1.03 5.55 1.14 0.64 2.96 0.21 -4.50 118.68 123.66 1k9a s LEU 28 Ca 0.63 -1.70 -0.12 0.00 -0.22 0.00 0.00 54.13 52.72 1k9a s LEU 28 Cb -0.53 -2.04 0.26 0.00 0.50 0.00 0.00 46.19 44.38 1k9a s LEU 28 CO 0.57 -0.65 1.01 -2.65 -1.32 0.00 0.00 176.35 173.30 1k9a n PRO 29 N 4.98 -2.15 0.00 0.98 -0.02 -1.26 -4.81 135.00 132.72 1k9a n PRO 29 Ca -0.10 -0.59 0.00 0.00 -2.02 0.00 0.00 63.50 60.79 1k9a n PRO 29 Cb 0.42 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1k9a n PRO 29 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1k9a n PHE 30 N -4.87 0.00 -4.31 6.00 1.16 -0.65 -4.99 117.46 109.81 1k9a n PHE 30 Ca 0.04 0.00 -0.26 0.00 -1.87 0.00 0.00 57.45 55.37 1k9a n PHE 30 Cb 0.54 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 38.32 1k9a n PHE 30 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1k9a n LYS 32 N -0.22 1.62 -0.33 0.00 4.81 -1.23 -0.69 118.16 122.11 1k9a n LYS 32 Ca -0.09 0.57 0.00 0.00 -0.87 0.00 0.00 58.31 57.92 1k9a n LYS 32 Cb 0.57 -2.03 0.00 0.00 0.02 0.00 0.00 35.03 33.58 1k9a n LYS 32 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1k9a n GLY 33 N 1.25 1.97 3.75 3.14 0.00 -0.16 -4.96 105.19 110.18 1k9a n GLY 33 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1k9a n GLY 33 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1k9a s ASP 34 N -3.46 4.62 -0.11 1.61 1.11 0.13 -4.65 116.67 115.91 1k9a s ASP 34 Ca 0.00 2.10 0.01 0.00 0.18 0.00 0.00 52.55 54.83 1k9a s ASP 34 Cb 0.00 -2.56 -0.02 0.00 1.07 0.00 0.00 42.92 41.41 1k9a s ASP 34 CO 0.00 -1.97 -0.14 -0.69 1.18 0.00 0.00 175.17 173.56 1k9a s VAL 35 N -2.32 3.01 -0.00 -1.27 1.01 -1.26 -0.21 120.40 119.36 1k9a s VAL 35 Ca 0.68 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 62.02 1k9a s VAL 35 Cb -0.23 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 1k9a s VAL 35 CO 0.45 0.54 -0.13 -0.76 0.00 0.00 0.00 175.10 175.20 1k9a s LEU 36 N 0.16 2.05 -0.23 3.92 1.43 0.82 -3.94 118.68 122.89 1k9a s LEU 36 Ca -0.07 -0.26 -0.13 0.00 -1.03 0.00 0.00 54.13 52.63 1k9a s LEU 36 Cb -0.15 -0.63 -0.05 0.00 0.03 0.00 0.00 46.19 45.39 1k9a s LEU 36 CO 0.05 0.13 0.26 -0.89 0.23 0.00 0.00 176.35 176.13 1k9a s THR 37 N -0.39 5.29 0.22 5.49 2.01 0.32 -1.25 115.64 127.33 1k9a s THR 37 Ca 0.04 0.39 -0.30 0.00 0.31 0.00 0.00 61.69 62.14 1k9a s THR 37 Cb -0.05 -3.60 -0.09 0.00 0.01 0.00 0.00 72.50 68.77 1k9a s THR 37 CO -0.00 0.29 1.17 -0.63 -0.69 0.00 0.00 174.62 174.76 1k9a s ILE 38 N 1.26 3.51 -0.24 1.82 -1.09 -0.17 -1.34 121.20 124.95 1k9a s ILE 38 Ca 0.12 1.36 -0.07 0.00 -2.23 0.00 0.00 60.65 59.83 1k9a s ILE 38 Cb -0.14 -3.87 -0.12 0.00 -1.58 0.00 0.00 42.46 36.75 1k9a s ILE 38 CO 0.06 0.26 -0.27 0.52 -1.23 0.00 0.00 174.94 174.28 1k9a n VAL 39 N 1.95 1.32 -3.62 2.92 0.31 0.19 0.56 118.33 121.97 1k9a n VAL 39 Ca 0.02 -0.40 -0.04 0.00 -0.01 0.00 0.00 64.34 63.91 1k9a n VAL 39 Cb 0.45 -1.64 -0.03 0.00 -0.91 0.00 0.00 33.84 31.71 1k9a n VAL 39 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1k9a s ALA 40 N -2.45 -2.08 -0.04 3.52 0.00 -0.96 -4.46 121.76 115.29 1k9a s ALA 40 Ca -0.33 1.75 -0.20 0.00 0.00 0.00 0.00 51.96 53.18 1k9a s ALA 40 Cb 0.11 -0.79 -0.05 0.00 0.00 0.00 0.00 23.12 22.39 1k9a s ALA 40 CO 0.46 -0.41 0.57 0.54 0.00 0.00 0.00 175.76 176.93 1k9a s VAL 41 N -1.63 4.99 0.60 0.00 0.11 -1.26 0.85 120.40 124.06 1k9a s VAL 41 Ca 0.08 1.19 -0.10 0.00 -2.93 0.00 0.00 61.98 60.21 1k9a s VAL 41 Cb -0.01 -3.91 0.15 0.00 -1.53 0.00 0.00 36.38 31.08 1k9a s VAL 41 CO -0.05 0.38 0.62 0.35 -3.33 0.00 0.00 175.10 173.07 1k9a n THR 42 N 3.03 0.00 0.18 5.04 -2.24 -0.61 -4.89 114.28 114.79 1k9a n THR 42 Ca -0.06 -0.34 0.09 0.00 -2.27 0.00 0.00 64.05 61.46 1k9a n THR 42 Cb 0.51 -1.34 0.61 0.00 -2.10 0.00 0.00 70.33 68.02 1k9a n THR 42 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1k9a h LYS 43 N 0.00 0.08 -5.37 -0.78 1.57 -1.98 -3.38 116.57 106.72 1k9a h LYS 43 Ca -0.22 -0.01 -0.63 0.00 -1.87 0.00 0.00 60.65 57.92 1k9a h LYS 43 Cb 0.65 -0.02 -0.14 0.00 0.08 0.00 0.00 32.23 32.80 1k9a h LYS 43 CO 0.15 0.06 0.04 0.34 -0.57 0.00 0.00 179.45 179.46 1k9a s ASP 44 N -6.87 6.40 0.66 0.86 -1.08 -1.26 -4.94 116.67 110.43 1k9a s ASP 44 Ca -0.06 0.20 0.38 0.00 -0.52 0.00 0.00 52.55 52.55 1k9a s ASP 44 Cb 0.18 -2.30 2.07 0.00 -1.46 0.00 0.00 42.92 41.41 1k9a s ASP 44 CO 0.69 -0.47 2.19 -0.65 0.52 0.00 0.00 175.17 177.45 1k9a h PRO 45 N 8.33 0.00 -0.00 4.34 0.11 -1.97 0.16 132.00 142.97 1k9a h PRO 45 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1k9a h PRO 45 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1k9a h PRO 45 CO 0.78 0.00 -0.03 0.09 -0.21 0.00 0.00 178.00 178.63 1k9a n ASN 46 N -3.10 0.03 -3.99 -2.05 3.02 -1.26 -4.81 115.26 103.11 1k9a n ASN 46 Ca -0.02 0.44 -0.19 0.00 -0.03 0.00 0.00 54.58 54.78 1k9a n ASN 46 Cb 0.20 -0.45 -0.15 0.00 -0.61 0.00 0.00 39.78 38.77 1k9a n ASN 46 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1k9a s TRP 47 N -2.99 0.77 0.39 3.10 0.52 0.04 -0.86 118.94 119.92 1k9a s TRP 47 Ca 0.14 -0.17 0.07 0.00 0.02 0.00 0.00 56.10 56.16 1k9a s TRP 47 Cb 0.19 -0.54 -0.08 0.00 -1.15 0.00 0.00 33.47 31.89 1k9a s TRP 47 CO 0.54 -0.06 0.00 0.71 0.02 0.00 0.00 176.95 178.16 1k9a s TYR 48 N 0.07 2.44 -0.18 -1.98 1.51 -0.71 -1.58 117.35 116.93 1k9a s TYR 48 Ca -0.01 -0.69 -0.07 0.00 -1.01 0.00 0.00 57.07 55.29 1k9a s TYR 48 Cb -0.06 -1.68 -0.04 0.00 -0.11 0.00 0.00 41.96 40.07 1k9a s TYR 48 CO -0.00 0.41 0.06 0.21 -1.11 0.00 0.00 175.55 175.12 1k9a s LYS 49 N -3.72 3.96 0.28 -0.62 2.20 0.25 -1.38 119.74 120.71 1k9a s LYS 49 Ca 0.35 -0.35 -0.08 0.00 -0.36 0.00 0.00 55.97 55.53 1k9a s LYS 49 Cb 0.09 -3.19 -0.00 0.00 -1.51 0.00 0.00 37.83 33.21 1k9a s LYS 49 CO 0.17 0.28 0.46 0.00 -0.36 0.00 0.00 175.35 175.90 1k9a s ALA 50 N 0.35 0.25 0.09 3.13 0.00 -0.42 0.55 121.76 125.71 1k9a s ALA 50 Ca 0.03 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.82 1k9a s ALA 50 Cb -0.12 1.12 -0.04 0.00 0.00 0.00 0.00 23.12 24.07 1k9a s ALA 50 CO 0.00 -0.81 -0.08 0.15 0.00 0.00 0.00 175.76 175.03 1k9a s LYS 51 N -3.60 0.81 0.60 0.00 1.02 -0.45 -1.41 119.74 116.71 1k9a s LYS 51 Ca 0.27 -1.24 0.08 0.00 0.02 0.00 0.00 55.97 55.10 1k9a s LYS 51 Cb 0.00 -0.30 0.10 0.00 -0.52 0.00 0.00 37.83 37.11 1k9a s LYS 51 CO 0.13 0.02 0.83 0.27 -0.92 0.00 0.00 175.35 175.68 1k9a n ASN 52 N 0.25 1.97 -2.11 2.83 6.94 -1.04 -0.52 115.26 123.57 1k9a n ASN 52 Ca -0.14 -2.46 -0.11 0.00 -0.02 0.00 0.00 54.58 51.85 1k9a n ASN 52 Cb 0.59 -0.46 -0.14 0.00 -2.36 0.00 0.00 39.78 37.42 1k9a n ASN 52 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 1k9a n LYS 53 N -2.35 1.74 0.00 -3.83 2.85 -1.25 -1.85 118.16 113.47 1k9a n LYS 53 Ca 0.16 -0.88 0.00 0.00 -1.05 0.00 0.00 58.31 56.54 1k9a n LYS 53 Cb 0.59 -1.95 0.00 0.00 -0.65 0.00 0.00 35.03 33.03 1k9a n LYS 53 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1k9a n VAL 54 N 2.62 0.00 0.00 0.58 0.31 -1.26 -5.03 118.33 115.54 1k9a n VAL 54 Ca 0.37 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.70 1k9a n VAL 54 Cb 0.76 0.06 0.00 0.00 -0.91 0.00 0.00 33.84 33.75 1k9a n VAL 54 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1k9a n GLY 55 N 0.00 0.66 3.74 2.92 0.00 -0.77 -5.08 105.19 106.66 1k9a n GLY 55 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1k9a n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k9a s ARG 56 N -0.72 4.34 0.03 1.61 0.52 -1.26 -4.82 118.95 118.65 1k9a s ARG 56 Ca 0.00 2.14 0.02 0.00 -0.52 0.00 0.00 55.73 57.37 1k9a s ARG 56 Cb 0.00 -3.17 -0.04 0.00 0.52 0.00 0.00 34.95 32.26 1k9a s ARG 56 CO 0.00 -0.33 0.02 -1.21 0.02 0.00 0.00 175.30 173.80 1k9a s GLU 57 N -0.04 2.78 -0.05 3.54 2.02 -1.26 -2.51 118.70 123.18 1k9a s GLU 57 Ca 0.59 -0.66 -0.31 0.00 0.02 0.00 0.00 54.97 54.61 1k9a s GLU 57 Cb -0.38 -2.67 0.13 0.00 0.10 0.00 0.00 34.13 31.30 1k9a s GLU 57 CO 0.39 0.60 1.35 0.20 0.02 0.00 0.00 175.26 177.82 1k9a s GLY 58 N -1.86 -0.38 0.02 -1.39 0.00 -0.50 -4.81 107.32 98.40 1k9a s GLY 58 Ca 0.23 0.64 -0.16 0.00 0.00 0.00 0.00 44.72 45.42 1k9a s GLY 58 CO 0.14 1.66 0.46 -0.42 0.00 0.00 0.00 173.10 174.94 1k9a s ILE 59 N -2.17 4.93 0.05 0.90 -1.09 0.11 -1.30 121.20 122.63 1k9a s ILE 59 Ca 0.19 0.97 0.02 0.00 -2.23 0.00 0.00 60.65 59.59 1k9a s ILE 59 Cb 0.05 -3.78 -0.03 0.00 -1.58 0.00 0.00 42.46 37.12 1k9a s ILE 59 CO -0.04 0.56 -0.06 0.27 -1.23 0.00 0.00 174.94 174.44 1k9a s ILE 60 N -1.04 0.47 -0.27 2.92 -4.36 -0.48 0.67 121.20 119.12 1k9a s ILE 60 Ca 0.26 -1.24 -0.22 0.00 -0.26 0.00 0.00 60.65 59.18 1k9a s ILE 60 Cb -0.18 -0.79 -0.01 0.00 1.25 0.00 0.00 42.46 42.73 1k9a s ILE 60 CO 0.15 -0.53 0.70 -2.16 0.24 0.00 0.00 174.94 173.34 1k9a s PRO 61 N -2.10 4.07 0.39 0.37 0.04 -1.26 -1.73 135.00 134.77 1k9a s PRO 61 Ca -0.06 0.59 0.20 0.00 0.04 0.00 0.00 61.00 61.77 1k9a s PRO 61 Cb -0.06 -3.67 1.16 0.00 0.04 0.00 0.00 34.50 31.97 1k9a s PRO 61 CO -0.01 -0.51 1.70 0.00 0.04 0.00 0.00 177.00 178.22 1k9a h ALA 62 N 7.94 2.25 0.00 8.56 0.00 -1.32 0.81 119.26 137.51 1k9a h ALA 62 Ca -0.26 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1k9a h ALA 62 Cb 1.11 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1k9a h ALA 62 CO 0.82 -0.78 -0.04 -0.91 0.00 0.00 0.00 179.25 178.34 1k9a h ASN 63 N 0.31 0.00 0.98 0.00 2.35 -1.93 -2.80 115.58 114.49 1k9a h ASN 63 Ca 0.69 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 56.26 1k9a h ASN 63 Cb 1.80 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 40.15 1k9a h ASN 63 CO -0.42 0.04 -0.87 1.88 -1.65 0.00 0.00 177.43 176.41 1k9a h TYR 64 N 0.00 0.00 -1.66 1.19 -1.99 -1.23 -3.47 116.97 109.82 1k9a h TYR 64 Ca -0.00 0.00 -0.51 0.00 2.00 0.00 0.00 58.73 60.22 1k9a h TYR 64 Cb 0.11 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.79 1k9a h TYR 64 CO 0.00 0.87 -0.43 0.14 -0.00 0.00 0.00 178.16 178.74 1k9a s VAL 65 N -2.91 2.89 -0.02 -2.88 -7.23 -1.06 0.76 120.40 109.95 1k9a s VAL 65 Ca 0.01 -1.43 0.02 0.00 -1.81 0.00 0.00 61.98 58.77 1k9a s VAL 65 Cb 0.10 -3.04 0.00 0.00 0.56 0.00 0.00 36.38 34.00 1k9a s VAL 65 CO 0.80 -0.07 -0.07 -1.58 -0.31 0.00 0.00 175.10 173.87 1k9a s GLN 66 N -4.04 0.78 -0.15 4.82 0.74 0.15 -4.84 119.66 117.13 1k9a s GLN 66 Ca 0.44 -0.23 -0.29 0.00 0.05 0.00 0.00 55.36 55.32 1k9a s GLN 66 Cb -0.03 -0.75 -0.04 0.00 1.10 0.00 0.00 33.01 33.29 1k9a s GLN 66 CO 0.26 0.08 1.62 0.21 -0.55 0.00 0.00 175.29 176.91 1k9a s LYS 67 N 0.23 3.96 -0.46 1.67 2.20 -1.26 -0.31 119.74 125.78 1k9a s LYS 67 Ca -0.03 1.88 -0.24 0.00 -0.36 0.00 0.00 55.97 57.23 1k9a s LYS 67 Cb -0.08 -4.00 0.03 0.00 -1.51 0.00 0.00 37.83 32.26 1k9a s LYS 67 CO 0.00 -1.09 0.83 0.50 -0.36 0.00 0.00 175.35 175.23 1k9a s ARG 68 N 4.38 3.44 0.34 4.03 3.52 0.70 -4.02 118.95 131.33 1k9a s ARG 68 Ca 0.72 -0.04 0.03 0.00 -0.13 0.00 0.00 55.73 56.31 1k9a s ARG 68 Cb -0.28 -3.94 -0.05 0.00 -1.56 0.00 0.00 34.95 29.11 1k9a s ARG 68 CO 0.28 -1.17 0.07 -1.83 -0.81 0.00 0.00 175.30 171.85 1k9a s GLU 69 N 3.45 1.70 0.43 5.12 -1.05 -0.47 -4.64 118.70 123.25 1k9a s GLU 69 Ca 0.32 -1.97 -0.24 0.00 -0.15 0.00 0.00 54.97 52.93 1k9a s GLU 69 Cb -0.12 -0.78 -0.08 0.00 -0.44 0.00 0.00 34.13 32.71 1k9a s GLU 69 CO 0.24 -0.26 1.18 0.20 0.95 0.00 0.00 175.26 177.57 1k9a s GLY 70 N -3.51 2.83 -0.72 -3.83 0.00 -1.25 -4.85 107.32 95.99 1k9a s GLY 70 Ca 0.33 0.98 -0.07 0.00 0.00 0.00 0.00 44.72 45.96 1k9a s GLY 70 CO 0.15 1.47 0.58 0.14 0.00 0.00 0.00 173.10 175.44 1k9a s VAL 71 N -1.47 4.51 -0.79 1.40 1.01 -1.26 -5.02 120.40 118.78 1k9a s VAL 71 Ca 0.61 -2.80 -0.25 0.00 0.00 0.00 0.00 61.98 59.53 1k9a s VAL 71 Cb -0.30 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 1k9a s VAL 71 CO 0.38 -0.95 1.81 -0.54 0.00 0.00 0.00 175.10 175.80 1k9a s LYS 72 N -0.03 2.74 0.88 2.72 1.02 -1.26 -4.51 119.74 121.30 1k9a s LYS 72 Ca 0.18 -0.03 -0.16 0.00 0.02 0.00 0.00 55.97 55.97 1k9a s LYS 72 Cb -0.16 -4.77 -0.09 0.00 -0.52 0.00 0.00 37.83 32.30 1k9a s LYS 72 CO -0.06 -2.92 -0.23 0.00 -0.92 0.00 0.00 175.35 171.22 1k9a n ALA 73 N 12.63 -3.92 -3.60 5.17 0.00 -1.26 -5.01 120.51 124.53 1k9a n ALA 73 Ca 0.29 -0.52 -0.09 0.00 0.00 0.00 0.00 53.44 53.12 1k9a n ALA 73 Cb 0.49 -1.44 -0.02 0.00 0.00 0.00 0.00 19.45 18.48 1k9a n ALA 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k9a n GLY 74 N 2.62 2.74 0.03 0.00 0.00 -1.26 -5.02 105.19 104.30 1k9a n GLY 74 Ca 0.03 -1.57 0.15 0.00 0.00 0.00 0.00 46.02 44.64 1k9a n GLY 74 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1k9a n THR 75 N -0.33 0.00 -1.28 2.61 5.66 -1.26 -3.36 114.28 116.32 1k9a n THR 75 Ca 0.01 -0.02 0.07 0.00 -3.05 0.00 0.00 64.05 61.06 1k9a n THR 75 Cb 0.33 -0.41 0.09 0.00 -1.55 0.00 0.00 70.33 68.79 1k9a n THR 75 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1k9a n LYS 76 N -1.08 0.98 -3.34 1.09 5.02 -1.26 -5.01 118.16 114.56 1k9a n LYS 76 Ca 0.18 -2.05 -0.42 0.00 -2.02 0.00 0.00 58.31 54.00 1k9a n LYS 76 Cb 0.20 -1.18 -0.09 0.00 -0.02 0.00 0.00 35.03 33.94 1k9a n LYS 76 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1k9a s LEU 77 N -1.94 4.71 -0.07 -0.35 2.96 -1.21 0.60 118.68 123.37 1k9a s LEU 77 Ca 0.21 -0.51 -0.05 0.00 -0.22 0.00 0.00 54.13 53.56 1k9a s LEU 77 Cb 0.18 -2.38 0.02 0.00 0.50 0.00 0.00 46.19 44.51 1k9a s LEU 77 CO 0.02 -0.50 0.17 -0.55 -1.32 0.00 0.00 176.35 174.17 1k9a s SER 78 N 1.78 -0.17 0.00 3.68 0.15 -1.12 -4.89 113.70 113.13 1k9a s SER 78 Ca 0.12 0.35 0.28 0.00 0.70 0.00 0.00 55.95 57.40 1k9a s SER 78 Cb -0.17 0.32 0.98 0.00 -1.71 0.00 0.00 66.02 65.45 1k9a s SER 78 CO 0.13 -0.09 1.75 0.18 1.20 0.00 0.00 173.24 176.42 1k9a n LEU 79 N 3.33 0.17 -3.91 3.45 4.77 -1.26 -3.65 117.00 119.91 1k9a n LEU 79 Ca -0.16 0.33 -0.29 0.00 -0.03 0.00 0.00 56.01 55.85 1k9a n LEU 79 Cb 0.57 -0.41 -0.13 0.00 -2.33 0.00 0.00 43.42 41.11 1k9a n LEU 79 CO 0.19 0.04 -0.15 -0.04 -1.33 0.00 0.00 177.39 176.11 1k9a s MET 80 N -3.00 2.05 0.19 3.23 -1.94 -1.26 -4.96 119.30 113.61 1k9a s MET 80 Ca 0.13 -2.78 -0.15 0.00 -1.71 0.00 0.00 55.69 51.18 1k9a s MET 80 Cb 0.18 -3.24 0.17 0.00 2.01 0.00 0.00 34.83 33.96 1k9a s MET 80 CO 0.59 -1.17 1.64 -1.35 -0.01 0.00 0.00 175.02 174.72 1k9a h PRO 81 N 6.18 -0.01 -0.19 2.03 0.11 -1.98 -1.65 132.00 136.49 1k9a h PRO 81 Ca -0.00 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.16 1k9a h PRO 81 Cb 0.85 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 1k9a h PRO 81 CO 0.68 -0.01 0.16 0.11 -0.21 0.00 0.00 178.00 178.73 1k9a h TRP 82 N -0.01 0.00 -3.23 0.65 5.08 -1.93 -3.11 115.95 113.40 1k9a h TRP 82 Ca 0.26 0.00 -0.56 0.00 1.08 0.00 0.00 58.89 59.67 1k9a h TRP 82 Cb 0.40 0.00 0.19 0.00 -3.00 0.00 0.00 29.16 26.75 1k9a h TRP 82 CO -0.46 0.00 -0.44 0.34 -1.28 0.00 0.00 178.44 176.61 1k9a n PHE 83 N -4.23 -0.94 0.00 0.12 7.35 -0.62 -3.34 117.46 115.80 1k9a n PHE 83 Ca 0.02 0.33 0.00 0.00 -0.76 0.00 0.00 57.45 57.04 1k9a n PHE 83 Cb 0.29 -1.89 0.00 0.00 0.35 0.00 0.00 39.48 38.23 1k9a n PHE 83 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 1k9a n HIS 84 N -2.56 0.00 0.00 -5.13 8.25 -0.75 -4.63 115.22 110.40 1k9a n HIS 84 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 1k9a n HIS 84 Cb 0.50 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.61 1k9a n HIS 84 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1k9a n GLY 85 N 0.25 1.58 0.37 -1.41 0.00 -1.26 -3.78 105.19 100.95 1k9a n GLY 85 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1k9a n GLY 85 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1k9a n LYS 86 N 0.00 0.00 -1.58 1.61 0.00 -1.26 -4.11 118.16 112.81 1k9a n LYS 86 Ca 0.00 -0.71 -0.39 0.00 0.00 0.00 0.00 58.31 57.21 1k9a n LYS 86 Cb 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 35.03 34.59 1k9a n LYS 86 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1k9a s ILE 87 N 0.00 3.01 0.85 3.15 -1.09 -1.25 -4.90 121.20 120.97 1k9a s ILE 87 Ca 0.00 0.01 -0.15 0.00 -2.23 0.00 0.00 60.65 58.27 1k9a s ILE 87 Cb 0.00 -3.02 -0.06 0.00 -1.58 0.00 0.00 42.46 37.80 1k9a s ILE 87 CO 0.00 -0.02 0.07 0.41 -1.23 0.00 0.00 174.94 174.17 1k9a n THR 88 N 7.90 0.56 -0.01 2.92 -1.04 -1.26 -4.40 114.28 118.94 1k9a n THR 88 Ca 0.34 -0.37 -0.05 0.00 -2.04 0.00 0.00 64.05 61.93 1k9a n THR 88 Cb 0.51 -0.43 -0.03 0.00 -1.82 0.00 0.00 70.33 68.56 1k9a n THR 88 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1k9a h ARG 89 N -0.88 -0.18 -0.19 -2.82 -0.00 -1.94 0.52 114.38 108.89 1k9a h ARG 89 Ca -0.44 0.01 0.05 0.00 -0.50 0.00 0.00 59.98 59.11 1k9a h ARG 89 Cb 1.32 0.04 -0.01 0.00 0.00 0.00 0.00 29.97 31.33 1k9a h ARG 89 CO 0.35 -0.12 0.25 0.93 0.00 0.00 0.00 179.97 181.37 1k9a h GLU 90 N -0.18 0.00 0.18 0.04 5.08 -2.00 0.17 114.58 117.87 1k9a h GLU 90 Ca 0.01 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.06 1k9a h GLU 90 Cb 0.22 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.50 1k9a h GLU 90 CO -0.14 0.00 -1.35 1.96 -1.00 0.00 0.00 179.01 178.48 1k9a h GLN 91 N 0.00 0.54 -0.51 2.33 4.20 -1.53 -3.03 115.11 117.10 1k9a h GLN 91 Ca 0.09 -0.82 -0.04 0.00 0.06 0.00 0.00 58.65 57.93 1k9a h GLN 91 Cb 0.58 0.29 -0.02 0.00 0.30 0.00 0.00 27.48 28.63 1k9a h GLN 91 CO -0.00 1.38 0.14 0.00 -0.67 0.00 0.00 178.83 179.69 1k9a h ALA 92 N 0.28 1.30 0.13 3.87 0.00 0.29 -2.59 119.26 122.53 1k9a h ALA 92 Ca -0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1k9a h ALA 92 Cb 2.03 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1k9a h ALA 92 CO 0.25 0.50 -0.06 0.93 0.00 0.00 0.00 179.25 180.87 1k9a h GLU 93 N 0.75 -0.17 -0.82 0.00 5.08 -1.24 -3.12 114.58 115.06 1k9a h GLU 93 Ca 0.17 0.01 0.16 0.00 -1.00 0.00 0.00 59.36 58.70 1k9a h GLU 93 Cb 0.24 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.47 1k9a h GLU 93 CO -0.01 0.18 0.54 0.00 -1.00 0.00 0.00 179.01 178.72 1k9a h ARG 94 N -0.54 0.49 -0.06 2.33 3.08 -1.42 0.24 114.38 118.50 1k9a h ARG 94 Ca -0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1k9a h ARG 94 Cb 0.43 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1k9a h ARG 94 CO 0.03 0.32 0.00 1.28 -1.07 0.00 0.00 179.97 180.53 1k9a n LEU 95 N -4.51 0.06 -3.35 3.04 4.77 -0.99 -4.05 117.00 111.97 1k9a n LEU 95 Ca 0.16 -0.03 -0.24 0.00 -0.03 0.00 0.00 56.01 55.87 1k9a n LEU 95 Cb 0.54 -0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.50 1k9a n LEU 95 CO 0.31 0.02 -0.26 -0.76 -1.33 0.00 0.00 177.39 175.37 1k9a s LEU 96 N -0.84 0.87 -0.21 2.23 1.43 0.85 -4.98 118.68 118.02 1k9a s LEU 96 Ca 0.00 -2.57 -0.16 0.00 -1.03 0.00 0.00 54.13 50.38 1k9a s LEU 96 Cb 0.00 -0.10 -0.10 0.00 0.03 0.00 0.00 46.19 46.01 1k9a s LEU 96 CO 0.00 -0.20 -0.18 0.00 0.23 0.00 0.00 176.35 176.20 1k9a n TYR 97 N 3.31 0.45 -1.83 0.29 9.36 -1.26 -4.86 117.16 122.63 1k9a n TYR 97 Ca 0.22 0.20 -0.42 0.00 3.32 0.00 0.00 57.90 61.22 1k9a n TYR 97 Cb 0.46 -0.85 -0.03 0.00 -0.63 0.00 0.00 39.34 38.28 1k9a n TYR 97 CO 0.00 0.00 0.00 -2.14 0.22 0.00 0.00 176.86 174.94 1k9a s PRO 98 N -2.51 4.01 0.00 2.98 0.02 -1.26 -4.97 135.00 133.27 1k9a s PRO 98 Ca -0.29 2.31 0.00 0.00 0.02 0.00 0.00 61.00 63.04 1k9a s PRO 98 Cb 0.07 -4.11 0.00 0.00 0.02 0.00 0.00 34.50 30.48 1k9a s PRO 98 CO 0.44 -1.08 0.00 -2.30 -0.33 0.00 0.00 177.00 173.73 1k9a n PRO 99 N 7.55 3.21 -1.77 5.54 -0.02 -1.26 -5.03 135.00 143.21 1k9a n PRO 99 Ca 0.20 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.67 1k9a n PRO 99 Cb 0.42 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.90 1k9a n PRO 99 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1k9a n GLU 100 N 0.00 -1.01 0.00 -0.52 -0.58 -1.26 -4.90 120.64 112.37 1k9a n GLU 100 Ca 0.00 1.15 0.00 0.00 -0.42 0.00 0.00 57.16 57.89 1k9a n GLU 100 Cb 0.00 -1.99 0.00 0.00 -0.57 0.00 0.00 31.44 28.88 1k9a n GLU 100 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1k9a n THR 101 N 0.33 0.00 0.00 2.62 -2.24 -1.19 -4.27 114.28 109.53 1k9a n THR 101 Ca -0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1k9a n THR 101 Cb 0.11 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 1k9a n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k9a n GLY 102 N 0.00 3.09 3.53 3.38 0.00 -1.22 -4.92 105.19 109.04 1k9a n GLY 102 Ca 0.00 -0.51 -0.45 0.00 0.00 0.00 0.00 46.02 45.06 1k9a n GLY 102 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1k9a n LEU 103 N 0.00 0.96 -3.54 0.99 7.94 -1.24 -2.26 117.00 119.85 1k9a n LEU 103 Ca 0.00 1.12 -0.14 0.00 -1.11 0.00 0.00 56.01 55.89 1k9a n LEU 103 Cb 0.00 -1.20 -0.05 0.00 0.53 0.00 0.00 43.42 42.70 1k9a n LEU 103 CO 0.00 -1.94 0.61 0.72 -1.11 0.00 0.00 177.39 175.67 1k9a s PHE 104 N -1.12 -0.50 0.07 1.96 -0.12 -1.15 -2.64 117.98 114.48 1k9a s PHE 104 Ca 0.61 0.79 -0.10 0.00 -0.05 0.00 0.00 56.93 58.17 1k9a s PHE 104 Cb -0.73 0.45 0.01 0.00 -0.63 0.00 0.00 43.02 42.12 1k9a s PHE 104 CO 0.59 -0.50 0.22 -0.48 -0.05 0.00 0.00 175.22 175.00 1k9a s LEU 105 N -1.36 1.26 -0.28 -1.99 0.05 -0.71 -1.62 118.68 114.02 1k9a s LEU 105 Ca -0.05 -0.47 0.03 0.00 0.05 0.00 0.00 54.13 53.69 1k9a s LEU 105 Cb -0.00 1.11 0.08 0.00 -2.05 0.00 0.00 46.19 45.32 1k9a s LEU 105 CO 0.03 -0.66 -0.04 -0.69 -0.55 0.00 0.00 176.35 174.44 1k9a s VAL 106 N -3.24 2.01 0.00 1.48 1.01 -1.21 -0.47 120.40 119.98 1k9a s VAL 106 Ca 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 61.98 60.20 1k9a s VAL 106 Cb 0.02 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 34.11 1k9a s VAL 106 CO -0.08 -0.26 0.00 -2.11 0.00 0.00 0.00 175.10 172.65 1k9a n ARG 107 N 4.44 2.99 -3.85 2.72 1.85 -0.31 -1.81 116.66 122.69 1k9a n ARG 107 Ca -0.07 0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 56.65 1k9a n ARG 107 Cb 0.42 0.00 -0.14 0.00 -1.05 0.00 0.00 32.46 31.69 1k9a n ARG 107 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 177.63 175.62 1k9a s GLU 108 N 0.79 0.01 -0.78 2.89 2.12 -1.26 -3.85 118.70 118.63 1k9a s GLU 108 Ca 0.00 0.05 -0.23 0.00 0.36 0.00 0.00 54.97 55.15 1k9a s GLU 108 Cb 0.00 -0.04 -0.17 0.00 0.26 0.00 0.00 34.13 34.18 1k9a s GLU 108 CO 0.00 -0.03 2.40 0.45 -0.54 0.00 0.00 175.26 177.54 1k9a n SER 109 N 3.27 1.10 -0.08 -1.70 2.88 -0.77 -4.61 113.62 113.70 1k9a n SER 109 Ca -0.15 -0.82 -0.12 0.00 -1.33 0.00 0.00 58.87 56.45 1k9a n SER 109 Cb 0.58 -1.32 -0.15 0.00 -0.75 0.00 0.00 64.21 62.57 1k9a n SER 109 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1k9a n THR 110 N 7.77 1.49 -0.10 2.46 -1.04 -1.26 -2.42 114.28 121.18 1k9a n THR 110 Ca 0.51 -0.78 -0.12 0.00 -2.04 0.00 0.00 64.05 61.63 1k9a n THR 110 Cb 0.35 -0.86 0.01 0.00 -1.82 0.00 0.00 70.33 68.00 1k9a n THR 110 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1k9a h ASN 111 N 0.01 0.92 -2.15 8.00 4.21 -1.99 -3.32 115.58 121.26 1k9a h ASN 111 Ca -0.49 -0.42 -0.55 0.00 1.21 0.00 0.00 56.30 56.05 1k9a h ASN 111 Cb 2.12 -0.26 -0.41 0.00 -1.12 0.00 0.00 38.32 38.65 1k9a h ASN 111 CO 0.02 1.19 -0.87 -1.22 -1.29 0.00 0.00 177.43 175.26 1k9a n TYR 112 N -4.05 2.27 -0.85 1.19 4.02 -1.26 -5.11 117.16 113.38 1k9a n TYR 112 Ca -0.02 -3.92 -0.33 0.00 -0.01 0.00 0.00 57.90 53.62 1k9a n TYR 112 Cb 0.54 -0.46 -0.05 0.00 -0.02 0.00 0.00 39.34 39.35 1k9a n TYR 112 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1k9a n PRO 113 N 0.19 0.00 0.00 -0.72 -0.02 -1.02 -3.23 135.00 130.20 1k9a n PRO 113 Ca 0.28 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1k9a n PRO 113 Cb 0.50 -0.78 0.00 0.00 -0.02 0.00 0.00 33.50 33.20 1k9a n PRO 113 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k9a n GLY 114 N 1.42 1.55 0.00 -1.23 0.00 -1.24 -5.04 105.19 100.64 1k9a n GLY 114 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1k9a n GLY 114 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1k9a n ASP 115 N 0.00 0.20 -2.68 1.61 8.00 -1.20 -4.66 116.55 117.82 1k9a n ASP 115 Ca 0.00 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.35 1k9a n ASP 115 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.05 1k9a n ASP 115 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1k9a n TYR 116 N 0.00 -0.46 -3.76 1.24 4.02 -1.17 -1.85 117.16 115.18 1k9a n TYR 116 Ca 0.00 -1.98 -0.13 0.00 -0.01 0.00 0.00 57.90 55.79 1k9a n TYR 116 Cb 0.00 0.17 -0.11 0.00 -0.02 0.00 0.00 39.34 39.38 1k9a n TYR 116 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1k9a s THR 117 N -2.91 -0.00 -0.10 -0.72 2.01 -1.25 -1.52 115.64 111.14 1k9a s THR 117 Ca 0.26 0.01 -0.04 0.00 0.31 0.00 0.00 61.69 62.24 1k9a s THR 117 Cb 0.01 -0.45 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 1k9a s THR 117 CO 0.19 0.00 0.04 -0.22 -0.69 0.00 0.00 174.62 173.94 1k9a s LEU 118 N 0.28 3.79 -0.01 4.42 0.20 0.13 -1.16 118.68 126.32 1k9a s LEU 118 Ca -0.01 0.21 0.05 0.00 0.69 0.00 0.00 54.13 55.07 1k9a s LEU 118 Cb -0.03 -1.89 -0.01 0.00 -0.43 0.00 0.00 46.19 43.83 1k9a s LEU 118 CO -0.01 0.36 -0.15 0.00 -0.29 0.00 0.00 176.35 176.26 1k9a s VAL 120 N -0.34 0.07 -0.48 0.00 1.01 -0.60 -1.74 120.40 118.32 1k9a s VAL 120 Ca 0.06 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.24 1k9a s VAL 120 Cb -0.06 -0.38 0.05 0.00 0.00 0.00 0.00 36.38 35.99 1k9a s VAL 120 CO -0.01 -0.34 0.55 -0.55 0.00 0.00 0.00 175.10 174.76 1k9a s SER 121 N -1.18 6.21 0.91 3.32 0.15 -1.08 -0.68 113.70 121.34 1k9a s SER 121 Ca -0.13 -0.94 -0.11 0.00 0.70 0.00 0.00 55.95 55.48 1k9a s SER 121 Cb -0.07 -2.26 0.20 0.00 -1.71 0.00 0.00 66.02 62.18 1k9a s SER 121 CO 0.01 -0.79 1.24 0.00 1.20 0.00 0.00 173.24 174.90 1k9a h GLU 123 N -1.36 0.00 0.00 0.00 9.09 -1.94 -3.37 114.58 117.01 1k9a h GLU 123 Ca -0.40 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.01 1k9a h GLU 123 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.33 1k9a h GLU 123 CO 0.33 0.00 0.00 0.41 0.05 0.00 0.00 179.01 179.80 1k9a n GLY 124 N -1.77 1.87 2.27 1.06 0.00 -1.26 -4.68 105.19 102.67 1k9a n GLY 124 Ca 0.28 -0.21 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 1k9a n GLY 124 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1k9a n LYS 125 N 0.00 -3.72 -4.29 1.61 2.85 -1.26 -4.91 118.16 108.43 1k9a n LYS 125 Ca 0.00 -0.98 -0.34 0.00 -1.05 0.00 0.00 58.31 55.93 1k9a n LYS 125 Cb 0.00 -1.33 -0.13 0.00 -0.65 0.00 0.00 35.03 32.92 1k9a n LYS 125 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1k9a s VAL 126 N -1.77 3.69 -0.14 0.58 1.01 -1.26 -1.31 120.40 121.21 1k9a s VAL 126 Ca 0.45 -0.42 -0.09 0.00 0.00 0.00 0.00 61.98 61.93 1k9a s VAL 126 Cb -0.08 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 1k9a s VAL 126 CO 0.38 0.47 0.17 -1.61 0.00 0.00 0.00 175.10 174.51 1k9a s GLU 127 N 0.72 3.78 -0.36 2.72 0.41 0.15 -4.94 118.70 121.17 1k9a s GLU 127 Ca -0.02 -0.09 -0.08 0.00 -0.41 0.00 0.00 54.97 54.36 1k9a s GLU 127 Cb -0.15 -3.28 0.04 0.00 -1.78 0.00 0.00 34.13 28.96 1k9a s GLU 127 CO 0.02 0.58 0.17 -1.01 -0.49 0.00 0.00 175.26 174.52 1k9a s HIS 128 N -0.47 3.27 -0.22 1.61 3.76 -1.26 -1.56 115.29 120.41 1k9a s HIS 128 Ca 0.14 -1.30 -0.07 0.00 -0.15 0.00 0.00 55.06 53.68 1k9a s HIS 128 Cb -0.12 -2.45 -0.03 0.00 1.11 0.00 0.00 32.58 31.09 1k9a s HIS 128 CO 0.03 -0.72 0.05 0.71 -0.85 0.00 0.00 174.74 173.96 1k9a s TYR 129 N 1.45 3.11 -0.06 1.40 1.51 0.92 -4.98 117.35 120.69 1k9a s TYR 129 Ca 0.00 -0.31 -0.29 0.00 -1.01 0.00 0.00 57.07 55.46 1k9a s TYR 129 Cb -0.20 -2.17 -0.02 0.00 -0.11 0.00 0.00 41.96 39.46 1k9a s TYR 129 CO 0.04 -0.21 0.98 0.50 -1.11 0.00 0.00 175.55 175.75 1k9a s ARG 130 N 1.20 4.48 -0.04 -0.62 3.52 -1.26 0.20 118.95 126.42 1k9a s ARG 130 Ca 0.04 1.37 -0.07 0.00 -0.13 0.00 0.00 55.73 56.94 1k9a s ARG 130 Cb -0.14 -3.51 -0.04 0.00 -1.56 0.00 0.00 34.95 29.70 1k9a s ARG 130 CO 0.03 -0.19 0.22 0.42 -0.81 0.00 0.00 175.30 174.97 1k9a s ILE 131 N 1.55 5.37 -0.16 4.11 1.01 -0.58 -4.57 121.20 127.93 1k9a s ILE 131 Ca 0.49 0.21 0.00 0.00 0.00 0.00 0.00 60.65 61.35 1k9a s ILE 131 Cb -0.19 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.76 1k9a s ILE 131 CO 0.22 0.48 -0.15 -0.04 0.00 0.00 0.00 174.94 175.44 1k9a s MET 132 N -1.44 3.18 -0.15 2.79 -1.94 0.19 -3.04 119.30 118.88 1k9a s MET 132 Ca 0.22 -0.76 -0.08 0.00 -1.71 0.00 0.00 55.69 53.37 1k9a s MET 132 Cb -0.13 -2.64 -0.04 0.00 2.01 0.00 0.00 34.83 34.03 1k9a s MET 132 CO 0.12 -0.04 0.11 -0.47 -0.01 0.00 0.00 175.02 174.73 1k9a s TYR 133 N 0.95 3.45 -0.29 -0.03 6.14 -1.26 -1.66 117.35 124.64 1k9a s TYR 133 Ca -0.03 0.36 -0.29 0.00 0.64 0.00 0.00 57.07 57.76 1k9a s TYR 133 Cb -0.15 -2.02 0.19 0.00 0.42 0.00 0.00 41.96 40.41 1k9a s TYR 133 CO -0.02 0.48 1.37 -1.58 0.64 0.00 0.00 175.55 176.44 1k9a s HIS 134 N -0.36 -0.03 -1.30 4.97 2.46 -0.79 -4.80 115.29 115.44 1k9a s HIS 134 Ca 0.11 0.06 0.00 0.00 0.47 0.00 0.00 55.06 55.69 1k9a s HIS 134 Cb -0.12 0.50 0.00 0.00 -0.13 0.00 0.00 32.58 32.83 1k9a s HIS 134 CO 0.01 -0.03 0.00 0.00 -2.47 0.00 0.00 174.74 172.25 1k9a n ALA 135 N 0.61 -0.35 -2.79 1.58 0.00 -1.26 0.46 120.51 118.77 1k9a n ALA 135 Ca -0.01 0.18 -0.17 0.00 0.00 0.00 0.00 53.44 53.44 1k9a n ALA 135 Cb 0.59 -1.41 0.02 0.00 0.00 0.00 0.00 19.45 18.65 1k9a n ALA 135 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1k9a n SER 136 N -0.83 -4.99 -4.09 0.00 7.64 -1.26 -4.99 113.62 105.10 1k9a n SER 136 Ca -0.14 -0.20 -0.14 0.00 1.01 0.00 0.00 58.87 59.40 1k9a n SER 136 Cb 0.47 -3.86 -0.11 0.00 -1.01 0.00 0.00 64.21 59.70 1k9a n SER 136 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1k9a s LYS 137 N -5.36 0.62 -0.04 1.43 -0.14 0.17 -4.46 119.74 111.96 1k9a s LYS 137 Ca 0.21 -0.83 0.03 0.00 -1.36 0.00 0.00 55.97 54.01 1k9a s LYS 137 Cb -0.09 -0.42 -0.03 0.00 -1.68 0.00 0.00 37.83 35.60 1k9a s LYS 137 CO 0.26 0.08 -0.10 -0.51 -0.76 0.00 0.00 175.35 174.32 1k9a s LEU 138 N -1.69 3.02 -0.13 3.17 1.43 0.81 -1.89 118.68 123.40 1k9a s LEU 138 Ca -0.07 -0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 52.60 1k9a s LEU 138 Cb -0.09 -1.68 0.12 0.00 0.03 0.00 0.00 46.19 44.56 1k9a s LEU 138 CO 0.01 0.33 0.94 -0.55 0.23 0.00 0.00 176.35 177.31 1k9a s SER 139 N -1.00 -0.41 -0.04 2.29 0.15 -0.67 -0.88 113.70 113.14 1k9a s SER 139 Ca 0.14 0.39 0.00 0.00 0.70 0.00 0.00 55.95 57.18 1k9a s SER 139 Cb -0.11 0.34 -0.03 0.00 -1.71 0.00 0.00 66.02 64.52 1k9a s SER 139 CO 0.03 -0.41 -0.04 -0.38 1.20 0.00 0.00 173.24 173.64 1k9a n ILE 140 N 0.62 0.24 -0.87 6.45 5.41 -1.26 0.53 119.36 130.48 1k9a n ILE 140 Ca -0.11 -0.09 0.08 0.00 1.00 0.00 0.00 62.75 63.63 1k9a n ILE 140 Cb 0.58 -0.75 0.39 0.00 -0.71 0.00 0.00 39.64 39.15 1k9a n ILE 140 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1k9a n ASP 141 N -2.68 5.46 -3.92 4.38 5.75 -1.26 -4.92 116.55 119.35 1k9a n ASP 141 Ca -0.07 -2.87 -0.32 0.00 -0.01 0.00 0.00 54.79 51.52 1k9a n ASP 141 Cb 0.58 -0.66 -0.06 0.00 -1.03 0.00 0.00 41.12 39.95 1k9a n ASP 141 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1k9a n GLU 142 N 0.61 -1.15 0.00 0.11 1.02 -1.26 -4.54 120.64 115.43 1k9a n GLU 142 Ca 0.27 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 1k9a n GLU 142 Cb 1.13 -4.31 0.00 0.00 -0.02 0.00 0.00 31.44 28.24 1k9a n GLU 142 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1k9a n GLU 143 N -3.49 0.02 -4.39 3.49 1.02 -1.26 -5.06 120.64 110.98 1k9a n GLU 143 Ca 0.09 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.89 1k9a n GLU 143 Cb 0.42 -0.55 -0.13 0.00 -0.02 0.00 0.00 31.44 31.16 1k9a n GLU 143 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1k9a s VAL 144 N -1.10 3.56 -0.02 2.62 1.01 -1.26 -5.11 120.40 120.09 1k9a s VAL 144 Ca 0.00 -0.47 0.08 0.00 0.00 0.00 0.00 61.98 61.59 1k9a s VAL 144 Cb 0.00 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 1k9a s VAL 144 CO 0.00 0.48 -0.25 -0.31 0.00 0.00 0.00 175.10 175.02 1k9a s TYR 145 N 0.63 2.25 0.19 5.22 1.51 -1.26 -4.40 117.35 121.50 1k9a s TYR 145 Ca -0.04 -0.44 0.06 0.00 -1.01 0.00 0.00 57.07 55.64 1k9a s TYR 145 Cb -0.15 -1.45 -0.05 0.00 -0.11 0.00 0.00 41.96 40.21 1k9a s TYR 145 CO 0.03 -0.05 -0.11 -0.06 -1.11 0.00 0.00 175.55 174.24 1k9a s PHE 146 N -0.55 1.57 -0.08 2.71 0.40 -0.06 -4.89 117.98 117.08 1k9a s PHE 146 Ca 0.09 -0.68 -0.02 0.00 -0.60 0.00 0.00 56.93 55.72 1k9a s PHE 146 Cb -0.10 -0.78 -0.01 0.00 0.51 0.00 0.00 43.02 42.64 1k9a s PHE 146 CO -0.01 0.23 0.09 0.93 0.70 0.00 0.00 175.22 177.16 1k9a h GLU 147 N 2.60 -0.07 -5.98 0.44 4.39 -1.88 0.23 114.58 114.31 1k9a h GLU 147 Ca -0.38 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 58.75 1k9a h GLU 147 Cb 1.21 0.02 -0.10 0.00 -0.10 0.00 0.00 28.75 29.77 1k9a h GLU 147 CO 0.63 -0.05 -0.59 0.54 -1.16 0.00 0.00 179.01 178.38 1k9a s ASN 148 N -5.06 4.23 0.11 1.42 4.22 -1.26 -4.07 114.94 114.53 1k9a s ASN 148 Ca -0.01 -1.02 0.10 0.00 -2.14 0.00 0.00 52.86 49.79 1k9a s ASN 148 Cb 0.00 -0.53 0.48 0.00 1.28 0.00 0.00 41.25 42.49 1k9a s ASN 148 CO 0.03 -0.30 1.30 0.18 -2.04 0.00 0.00 177.10 176.26 1k9a n LEU 149 N -1.01 0.21 0.07 3.54 4.77 0.08 -2.91 117.00 121.75 1k9a n LEU 149 Ca -0.04 0.59 -0.07 0.00 -0.03 0.00 0.00 56.01 56.46 1k9a n LEU 149 Cb 0.63 -0.60 -0.05 0.00 -2.33 0.00 0.00 43.42 41.07 1k9a n LEU 149 CO 0.44 -0.61 0.23 0.24 -1.33 0.00 0.00 177.39 176.36 1k9a h MET 150 N 0.00 -0.27 -1.08 3.23 2.86 -1.89 -2.42 114.93 115.37 1k9a h MET 150 Ca 0.00 0.02 0.29 0.00 -2.06 0.00 0.00 59.70 57.95 1k9a h MET 150 Cb 0.05 0.06 -0.07 0.00 0.06 0.00 0.00 31.60 31.70 1k9a h MET 150 CO 0.00 -0.01 0.73 1.96 1.06 0.00 0.00 176.91 180.65 1k9a h GLN 151 N -1.02 0.21 0.19 1.72 4.20 -1.46 0.41 115.11 119.37 1k9a h GLN 151 Ca -0.03 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1k9a h GLN 151 Cb 0.38 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1k9a h GLN 151 CO 0.05 0.14 -0.09 1.25 -0.67 0.00 0.00 178.83 179.50 1k9a h LEU 152 N 0.21 -0.22 -1.42 1.46 6.46 -1.55 -2.32 115.31 117.94 1k9a h LEU 152 Ca 0.57 0.01 0.23 0.00 -0.12 0.00 0.00 57.88 58.56 1k9a h LEU 152 Cb 1.80 0.06 -0.08 0.00 -0.73 0.00 0.00 40.66 41.70 1k9a h LEU 152 CO -0.17 -0.12 0.63 0.58 -0.62 0.00 0.00 178.44 178.75 1k9a h VAL 153 N -0.34 0.62 0.00 1.05 2.07 -0.78 0.82 116.25 119.68 1k9a h VAL 153 Ca -0.03 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 1k9a h VAL 153 Cb 0.20 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.12 1k9a h VAL 153 CO 0.04 0.08 -0.10 -0.08 0.02 0.00 0.00 177.57 177.53 1k9a h GLU 154 N 0.43 0.00 0.03 1.57 4.57 -0.22 -2.21 114.58 118.75 1k9a h GLU 154 Ca 0.53 0.00 -0.28 0.00 -1.18 0.00 0.00 59.36 58.43 1k9a h GLU 154 Cb 1.29 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.85 1k9a h GLU 154 CO -0.24 0.10 -1.53 1.25 -1.18 0.00 0.00 179.01 177.41 1k9a h HIS 155 N 0.00 0.11 -0.51 0.92 2.76 0.12 -3.31 115.15 115.24 1k9a h HIS 155 Ca -0.00 -0.08 -0.09 0.00 -2.20 0.00 0.00 60.37 58.00 1k9a h HIS 155 Cb 0.40 -0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.30 1k9a h HIS 155 CO 0.00 1.12 0.11 0.66 -1.30 0.00 0.00 177.93 178.53 1k9a n TYR 156 N -3.22 1.76 -0.00 5.26 4.02 -0.54 -2.84 117.16 121.60 1k9a n TYR 156 Ca -0.14 -0.77 0.00 0.00 -0.01 0.00 0.00 57.90 56.98 1k9a n TYR 156 Cb 1.02 -0.50 -0.01 0.00 -0.02 0.00 0.00 39.34 39.83 1k9a n TYR 156 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1k9a n THR 157 N 0.20 0.04 1.06 -0.72 -1.04 -0.92 0.12 114.28 113.02 1k9a n THR 157 Ca 0.27 -0.05 0.11 0.00 -2.04 0.00 0.00 64.05 62.34 1k9a n THR 157 Cb 1.07 -0.06 0.08 0.00 -1.82 0.00 0.00 70.33 69.60 1k9a n THR 157 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1k9a n THR 158 N -1.75 0.00 -3.16 12.58 -1.04 -1.22 -4.44 114.28 115.26 1k9a n THR 158 Ca -0.01 -0.19 0.05 0.00 -2.04 0.00 0.00 64.05 61.85 1k9a n THR 158 Cb 0.23 1.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.71 1k9a n THR 158 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1k9a s ASP 159 N -2.56 -0.02 0.48 8.00 3.68 -1.13 -5.01 116.67 120.10 1k9a s ASP 159 Ca 0.18 0.03 0.24 0.00 2.13 0.00 0.00 52.55 55.13 1k9a s ASP 159 Cb 0.18 1.02 1.29 0.00 -1.45 0.00 0.00 42.92 43.97 1k9a s ASP 159 CO 0.60 -0.00 1.69 0.00 0.13 0.00 0.00 175.17 177.58 1k9a h ALA 160 N 7.41 1.19 -4.87 3.66 0.00 -1.81 -3.38 119.26 121.46 1k9a h ALA 160 Ca -0.12 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.54 1k9a h ALA 160 Cb 1.15 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.78 1k9a h ALA 160 CO -0.07 -0.19 -0.37 -3.47 0.00 0.00 0.00 179.25 175.16 1k9a n ASP 161 N -2.48 -0.96 0.00 0.00 -0.08 -1.26 0.10 116.55 111.87 1k9a n ASP 161 Ca -0.02 -0.40 0.00 0.00 -1.51 0.00 0.00 54.79 52.87 1k9a n ASP 161 Cb 0.26 -0.86 0.00 0.00 2.34 0.00 0.00 41.12 42.86 1k9a n ASP 161 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1k9a n GLY 162 N -0.66 1.09 3.96 0.27 0.00 -1.26 -5.05 105.19 103.54 1k9a n GLY 162 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 1k9a n GLY 162 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k9a s LEU 163 N 0.00 2.87 0.20 0.99 1.43 0.29 -4.97 118.68 119.48 1k9a s LEU 163 Ca 0.00 -0.07 -0.16 0.00 -1.03 0.00 0.00 54.13 52.87 1k9a s LEU 163 Cb 0.00 -2.19 0.19 0.00 0.03 0.00 0.00 46.19 44.22 1k9a s LEU 163 CO 0.00 -2.16 1.61 0.00 0.23 0.00 0.00 176.35 176.03 1k9a s THR 165 N -6.15 0.00 1.16 0.00 -1.32 -1.26 -4.98 115.64 103.09 1k9a s THR 165 Ca -0.14 -0.92 -0.17 0.00 -1.21 0.00 0.00 61.69 59.25 1k9a s THR 165 Cb 0.18 -1.97 0.26 0.00 -1.51 0.00 0.00 72.50 69.46 1k9a s THR 165 CO 0.72 0.00 1.09 0.00 -2.21 0.00 0.00 174.62 174.22 1k9a s ARG 166 N -3.80 -0.85 0.14 7.08 1.70 -1.26 -4.59 118.95 117.37 1k9a s ARG 166 Ca 0.11 0.16 -0.06 0.00 -0.47 0.00 0.00 55.73 55.47 1k9a s ARG 166 Cb -0.05 -1.62 -0.06 0.00 -0.57 0.00 0.00 34.95 32.65 1k9a s ARG 166 CO 0.06 -3.51 0.39 -0.51 -1.08 0.00 0.00 175.30 170.65 1k9a s LEU 167 N -6.88 4.26 0.00 -1.89 1.43 0.34 -4.55 118.68 111.39 1k9a s LEU 167 Ca 0.69 0.64 0.00 0.00 -1.03 0.00 0.00 54.13 54.43 1k9a s LEU 167 Cb -0.13 -3.32 0.00 0.00 0.03 0.00 0.00 46.19 42.77 1k9a s LEU 167 CO 0.57 0.05 0.00 -0.38 0.23 0.00 0.00 176.35 176.82 1k9a n ILE 168 N 0.14 0.00 -2.75 -0.59 5.41 -0.96 -4.55 119.36 116.07 1k9a n ILE 168 Ca -0.03 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.30 1k9a n ILE 168 Cb 0.52 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.42 1k9a n ILE 168 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1k9a s LYS 169 N 0.56 4.35 0.77 0.38 1.02 -1.23 -4.95 119.74 120.64 1k9a s LYS 169 Ca 0.00 1.27 -0.12 0.00 0.02 0.00 0.00 55.97 57.13 1k9a s LYS 169 Cb 0.00 -3.57 0.06 0.00 -0.52 0.00 0.00 37.83 33.80 1k9a s LYS 169 CO 0.00 -0.38 1.13 -2.14 -0.92 0.00 0.00 175.35 173.03 1k9a s PRO 170 N 2.30 2.07 -0.88 -1.68 0.02 -1.26 -2.92 135.00 132.65 1k9a s PRO 170 Ca 0.44 1.41 0.01 0.00 0.02 0.00 0.00 61.00 62.88 1k9a s PRO 170 Cb -0.17 -1.86 0.33 0.00 0.02 0.00 0.00 34.50 32.82 1k9a s PRO 170 CO 0.14 -1.82 1.56 1.17 -0.33 0.00 0.00 177.00 177.72 1k9a n LYS 171 N -3.29 4.71 -1.49 5.54 3.00 -0.64 -4.75 118.16 121.23 1k9a n LYS 171 Ca 0.11 -4.70 -0.52 0.00 -0.00 0.00 0.00 58.31 53.19 1k9a n LYS 171 Cb 0.52 -2.39 -0.05 0.00 0.00 0.00 0.00 35.03 33.10 1k9a n LYS 171 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1k9a n VAL 172 N -0.13 0.91 -3.45 3.15 0.31 -1.26 -4.55 118.33 113.30 1k9a n VAL 172 Ca 0.42 -0.23 -0.43 0.00 -0.01 0.00 0.00 64.34 64.09 1k9a n VAL 172 Cb 0.30 -0.27 -0.06 0.00 -0.91 0.00 0.00 33.84 32.90 1k9a n VAL 172 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 1k9a s MET 173 N -0.44 2.95 0.45 5.55 1.75 -1.18 -4.98 119.30 123.40 1k9a s MET 173 Ca 0.77 -2.07 -0.14 0.00 -1.25 0.00 0.00 55.69 52.99 1k9a s MET 173 Cb -1.03 -4.14 -0.12 0.00 2.84 0.00 0.00 34.83 32.39 1k9a s MET 173 CO 0.55 -1.25 -0.17 0.39 -0.65 0.00 0.00 175.02 173.89 1k9a n GLU 174 N 4.50 0.00 -1.46 4.11 1.02 -1.26 -3.58 120.64 123.97 1k9a n GLU 174 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1k9a n GLU 174 Cb 0.42 -0.79 0.00 0.00 -0.02 0.00 0.00 31.44 31.05 1k9a n GLU 174 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1k9a n GLY 175 N 2.08 0.50 3.33 0.62 0.00 -1.26 -5.05 105.19 105.41 1k9a n GLY 175 Ca 0.05 -0.87 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 1k9a n GLY 175 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1k9a s THR 176 N -2.00 2.56 -0.25 2.61 -1.32 -1.23 -4.67 115.64 111.33 1k9a s THR 176 Ca 0.00 -0.87 -0.10 0.00 -1.21 0.00 0.00 61.69 59.51 1k9a s THR 176 Cb 0.00 -2.00 -0.04 0.00 -1.51 0.00 0.00 72.50 68.95 1k9a s THR 176 CO 0.00 0.56 0.14 0.54 -2.21 0.00 0.00 174.62 173.65 1k9a s VAL 177 N -0.06 5.06 -0.46 5.08 0.11 0.20 -4.97 120.40 125.35 1k9a s VAL 177 Ca -0.05 0.08 -0.27 0.00 -2.93 0.00 0.00 61.98 58.81 1k9a s VAL 177 Cb -0.14 -3.37 -0.05 0.00 -1.53 0.00 0.00 36.38 31.29 1k9a s VAL 177 CO 0.04 0.32 2.21 0.00 -3.33 0.00 0.00 175.10 174.35 1k9a s ALA 178 N 1.35 2.02 0.29 1.54 0.00 -1.26 -2.80 121.76 122.90 1k9a s ALA 178 Ca 0.07 0.01 0.03 0.00 0.00 0.00 0.00 51.96 52.06 1k9a s ALA 178 Cb -0.15 -4.27 0.62 0.00 0.00 0.00 0.00 23.12 19.33 1k9a s ALA 178 CO 0.06 -3.94 1.80 0.00 0.00 0.00 0.00 175.76 173.69 1k9a h ALA 179 N 17.34 1.55 -0.95 0.00 0.00 -1.93 -0.71 119.26 134.56 1k9a h ALA 179 Ca -0.28 0.05 0.13 0.00 0.00 0.00 0.00 54.91 54.81 1k9a h ALA 179 Cb 1.23 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.80 1k9a h ALA 179 CO 1.13 0.09 0.60 0.37 0.00 0.00 0.00 179.25 181.44 1k9a h GLN 180 N 0.87 0.82 0.69 0.00 4.15 -1.89 -0.54 115.11 119.21 1k9a h GLN 180 Ca 0.53 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.86 1k9a h GLN 180 Cb 0.66 -0.19 0.01 0.00 0.21 0.00 0.00 27.48 28.18 1k9a h GLN 180 CO -0.32 0.55 -0.33 -0.44 -1.93 0.00 0.00 178.83 176.36 1k9a h ASP 181 N 0.85 -0.78 -0.96 -0.69 3.32 -1.52 -2.39 116.42 114.25 1k9a h ASP 181 Ca 0.47 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.65 1k9a h ASP 181 Cb 0.59 0.20 -0.13 0.00 0.22 0.00 0.00 39.33 40.22 1k9a h ASP 181 CO -0.24 -0.49 -0.55 -0.33 -1.72 0.00 0.00 179.24 175.91 1k9a h GLU 182 N -1.06 -0.02 -0.21 3.56 4.39 -1.14 0.58 114.58 120.69 1k9a h GLU 182 Ca -0.09 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.66 1k9a h GLU 182 Cb 0.71 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.31 1k9a h GLU 182 CO 0.15 -0.01 -0.12 0.74 -1.16 0.00 0.00 179.01 178.61 1k9a h PHE 183 N -0.02 -0.28 0.02 4.33 -1.00 -1.16 0.75 116.94 119.57 1k9a h PHE 183 Ca 0.19 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.99 1k9a h PHE 183 Cb 0.45 0.16 0.00 0.00 3.61 0.00 0.00 35.95 40.17 1k9a h PHE 183 CO -0.98 -0.18 -0.01 -0.92 -1.61 0.00 0.00 178.31 174.61 1k9a h TYR 184 N -0.10 -0.02 -0.24 -0.55 3.20 -0.68 -0.18 116.97 118.39 1k9a h TYR 184 Ca 0.12 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.06 1k9a h TYR 184 Cb 0.28 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 1k9a h TYR 184 CO -0.28 0.16 0.18 -0.09 -1.64 0.00 0.00 178.16 176.50 1k9a h ARG 185 N -0.21 0.00 -0.01 1.82 9.65 0.45 -0.62 114.38 125.47 1k9a h ARG 185 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1k9a h ARG 185 Cb 0.20 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.78 1k9a h ARG 185 CO 0.00 0.00 -0.00 0.43 2.80 0.00 0.00 179.97 183.20 1k9a n SER 186 N -4.38 0.82 0.00 -3.80 7.64 0.26 -4.78 113.62 109.38 1k9a n SER 186 Ca 0.03 -1.27 0.00 0.00 1.01 0.00 0.00 58.87 58.64 1k9a n SER 186 Cb 0.33 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 1k9a n SER 186 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1k9a n GLY 187 N 1.10 0.47 0.84 0.23 0.00 -0.24 -1.36 105.19 106.22 1k9a n GLY 187 Ca 0.21 -0.57 0.07 0.00 0.00 0.00 0.00 46.02 45.73 1k9a n GLY 187 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1k9a n TRP 188 N -2.94 0.65 -3.34 1.61 7.02 -0.14 -4.83 117.44 115.47 1k9a n TRP 188 Ca 0.00 -0.54 -0.38 0.00 -1.02 0.00 0.00 57.50 55.56 1k9a n TRP 188 Cb 0.00 -0.06 -0.06 0.00 -2.42 0.00 0.00 31.31 28.77 1k9a n TRP 188 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1k9a s ALA 189 N -1.22 3.51 -0.05 6.99 0.00 -1.19 0.60 121.76 130.40 1k9a s ALA 189 Ca 0.31 -0.18 0.05 0.00 0.00 0.00 0.00 51.96 52.14 1k9a s ALA 189 Cb 0.18 -2.61 -0.01 0.00 0.00 0.00 0.00 23.12 20.68 1k9a s ALA 189 CO 0.19 0.10 -0.20 -1.17 0.00 0.00 0.00 175.76 174.68 1k9a s LEU 190 N 0.25 1.96 0.08 0.00 2.96 -0.82 -4.84 118.68 118.28 1k9a s LEU 190 Ca 0.26 -0.41 -0.31 0.00 -0.22 0.00 0.00 54.13 53.46 1k9a s LEU 190 Cb -0.16 -1.10 -0.09 0.00 0.50 0.00 0.00 46.19 45.34 1k9a s LEU 190 CO 0.11 0.18 1.71 0.54 -1.32 0.00 0.00 176.35 177.57 1k9a s ASN 191 N -0.01 6.55 0.00 3.68 4.22 -1.26 -4.72 114.94 123.40 1k9a s ASN 191 Ca -0.04 2.56 0.07 0.00 -2.14 0.00 0.00 52.86 53.30 1k9a s ASN 191 Cb -0.12 -2.56 0.32 0.00 1.28 0.00 0.00 41.25 40.17 1k9a s ASN 191 CO 0.03 -0.92 1.10 0.80 -2.04 0.00 0.00 177.10 176.06 1k9a n MET 192 N 5.73 0.07 -0.07 3.55 0.00 -1.26 -3.31 117.12 121.83 1k9a n MET 192 Ca 0.16 0.26 -0.09 0.00 -0.00 0.00 0.00 57.70 58.03 1k9a n MET 192 Cb 0.40 -1.50 -0.06 0.00 0.00 0.00 0.00 33.22 32.06 1k9a n MET 192 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 1k9a h LYS 193 N 0.00 0.00 -0.83 2.12 3.64 -2.05 -3.35 116.57 116.10 1k9a h LYS 193 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1k9a h LYS 193 Cb 0.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1k9a h LYS 193 CO 0.00 0.44 0.00 0.39 -2.27 0.00 0.00 179.45 178.01 1k9a n GLU 194 N -4.62 0.86 -3.84 1.90 4.71 -1.21 -4.25 120.64 114.19 1k9a n GLU 194 Ca -0.11 0.00 -0.29 0.00 -0.01 0.00 0.00 57.16 56.75 1k9a n GLU 194 Cb 0.33 -1.41 -0.13 0.00 -1.01 0.00 0.00 31.44 29.21 1k9a n GLU 194 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1k9a s LEU 195 N -0.03 3.78 -0.41 -4.62 1.98 -1.25 -3.60 118.68 114.53 1k9a s LEU 195 Ca 0.00 -3.10 -0.29 0.00 -2.89 0.00 0.00 54.13 47.85 1k9a s LEU 195 Cb 0.00 -1.39 0.02 0.00 0.66 0.00 0.00 46.19 45.48 1k9a s LEU 195 CO 0.00 -0.20 1.26 -0.54 -1.89 0.00 0.00 176.35 174.98 1k9a s LYS 196 N -0.36 3.73 0.11 1.98 3.01 -1.25 -4.95 119.74 122.01 1k9a s LYS 196 Ca 0.20 0.86 -0.31 0.00 -1.01 0.00 0.00 55.97 55.71 1k9a s LYS 196 Cb -0.19 -3.93 -0.08 0.00 -1.01 0.00 0.00 37.83 32.62 1k9a s LYS 196 CO -0.05 -1.37 1.37 -0.51 0.51 0.00 0.00 175.35 175.30 1k9a s LEU 197 N 4.75 4.37 0.00 3.17 1.43 -1.26 -3.01 118.68 128.13 1k9a s LEU 197 Ca 0.54 2.29 0.00 0.00 -1.03 0.00 0.00 54.13 55.93 1k9a s LEU 197 Cb -0.11 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.52 1k9a s LEU 197 CO 0.29 -0.63 0.00 0.18 0.23 0.00 0.00 176.35 176.42 1k9a n LEU 198 N 3.94 0.00 -4.24 1.79 4.77 -1.14 -4.99 117.00 117.12 1k9a n LEU 198 Ca 0.11 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.71 1k9a n LEU 198 Cb 0.43 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1k9a n LEU 198 CO 0.58 -0.01 -0.64 0.00 -1.33 0.00 0.00 177.39 175.99 1k9a n GLN 199 N -0.02 0.08 -3.06 3.23 10.64 -1.26 -4.39 117.38 122.60 1k9a n GLN 199 Ca 0.00 0.04 -0.40 0.00 -1.83 0.00 0.00 57.00 54.81 1k9a n GLN 199 Cb 0.00 -1.18 -0.05 0.00 -0.86 0.00 0.00 30.24 28.15 1k9a n GLN 199 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 1k9a s THR 200 N -1.97 5.04 -0.17 -0.39 2.01 -1.26 -1.83 115.64 117.07 1k9a s THR 200 Ca 0.55 1.42 -0.19 0.00 0.31 0.00 0.00 61.69 63.77 1k9a s THR 200 Cb -0.40 -4.03 -0.22 0.00 0.01 0.00 0.00 72.50 67.86 1k9a s THR 200 CO 0.68 0.27 0.36 0.40 -0.69 0.00 0.00 174.62 175.63 1k9a h ILE 201 N 4.72 0.99 -3.80 1.82 2.04 0.47 -3.48 117.51 120.28 1k9a h ILE 201 Ca -0.41 -2.26 -0.10 0.00 1.00 0.00 0.00 64.86 63.09 1k9a h ILE 201 Cb 1.20 2.47 -0.09 0.00 -0.74 0.00 0.00 36.82 39.65 1k9a h ILE 201 CO 0.75 0.49 -0.17 -0.83 0.00 0.00 0.00 178.15 178.38 1k9a s GLY 202 N -4.90 0.75 0.00 5.37 0.00 -1.00 -4.98 107.32 102.55 1k9a s GLY 202 Ca -0.25 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 43.42 1k9a s GLY 202 CO 0.66 -0.75 0.00 0.28 0.00 0.00 0.00 173.10 173.29 1k9a n LYS 203 N -0.39 0.00 -0.38 2.90 4.76 -1.26 -2.20 118.16 121.58 1k9a n LYS 203 Ca -0.01 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.48 1k9a n LYS 203 Cb 0.62 -0.71 -0.01 0.00 -1.84 0.00 0.00 35.03 33.09 1k9a n LYS 203 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1k9a n GLY 204 N 2.71 -0.59 0.03 0.72 0.00 -1.26 -3.42 105.19 103.39 1k9a n GLY 204 Ca 0.00 -0.40 0.12 0.00 0.00 0.00 0.00 46.02 45.74 1k9a n GLY 204 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1k9a n GLU 205 N -1.55 0.17 0.00 1.61 0.00 -1.26 -4.35 120.64 115.26 1k9a n GLU 205 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 57.16 57.20 1k9a n GLU 205 Cb 0.17 -1.59 0.00 0.00 0.00 0.00 0.00 31.44 30.02 1k9a n GLU 205 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1k9a n PHE 206 N -1.83 0.00 0.00 4.31 3.01 -1.26 -4.90 117.46 116.79 1k9a n PHE 206 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.50 1k9a n PHE 206 Cb 0.39 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.86 1k9a n PHE 206 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1k9a n GLY 207 N 0.53 2.23 3.95 1.37 0.00 -1.22 0.14 105.19 112.20 1k9a n GLY 207 Ca 0.00 -0.45 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 1k9a n GLY 207 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1k9a s ASP 208 N 0.00 5.48 -0.18 1.61 1.01 -1.17 -4.13 116.67 119.29 1k9a s ASP 208 Ca 0.00 0.24 -0.06 0.00 0.71 0.00 0.00 52.55 53.43 1k9a s ASP 208 Cb 0.00 -1.25 0.08 0.00 1.01 0.00 0.00 42.92 42.76 1k9a s ASP 208 CO 0.00 -1.01 0.37 -0.69 0.21 0.00 0.00 175.17 174.05 1k9a s VAL 209 N -2.76 -0.57 0.18 -1.27 1.01 -0.94 -1.41 120.40 114.65 1k9a s VAL 209 Ca 0.54 0.20 0.06 0.00 0.00 0.00 0.00 61.98 62.78 1k9a s VAL 209 Cb -0.10 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 1k9a s VAL 209 CO 0.40 0.08 0.09 -0.04 0.00 0.00 0.00 175.10 175.63 1k9a s MET 210 N 2.55 2.71 0.75 2.72 -1.94 -1.10 0.11 119.30 125.10 1k9a s MET 210 Ca -0.00 -1.00 -0.12 0.00 -1.71 0.00 0.00 55.69 52.85 1k9a s MET 210 Cb -0.12 -2.52 0.17 0.00 2.01 0.00 0.00 34.83 34.37 1k9a s MET 210 CO -0.11 0.46 1.01 -0.11 -0.01 0.00 0.00 175.02 176.26 1k9a n LEU 211 N -0.41 0.00 -3.65 -0.03 7.94 -0.76 -1.27 117.00 118.83 1k9a n LEU 211 Ca -0.09 -1.13 -0.02 0.00 -1.11 0.00 0.00 56.01 53.66 1k9a n LEU 211 Cb 0.55 -0.77 -0.07 0.00 0.53 0.00 0.00 43.42 43.66 1k9a n LEU 211 CO 0.42 -1.22 1.15 -0.83 -1.11 0.00 0.00 177.39 175.80 1k9a s GLY 212 N -5.21 0.39 -0.81 -3.96 0.00 -0.39 -2.88 107.32 94.47 1k9a s GLY 212 Ca 0.58 3.57 -0.12 0.00 0.00 0.00 0.00 44.72 48.75 1k9a s GLY 212 CO 0.40 2.03 0.73 0.51 0.00 0.00 0.00 173.10 176.77 1k9a s ASP 213 N 0.13 6.52 -0.27 1.64 3.84 -1.16 -1.10 116.67 126.26 1k9a s ASP 213 Ca 0.06 -2.79 -0.12 0.00 -0.00 0.00 0.00 52.55 49.70 1k9a s ASP 213 Cb -0.05 -2.14 -0.05 0.00 -1.38 0.00 0.00 42.92 39.30 1k9a s ASP 213 CO -0.15 -0.52 0.25 -0.47 -0.00 0.00 0.00 175.17 174.28 1k9a s TYR 214 N 0.02 3.24 -1.51 2.11 5.04 0.52 -3.89 117.35 122.88 1k9a s TYR 214 Ca 0.19 0.24 -0.11 0.00 -2.44 0.00 0.00 57.07 54.95 1k9a s TYR 214 Cb -0.12 -2.43 0.08 0.00 0.35 0.00 0.00 41.96 39.83 1k9a s TYR 214 CO -0.08 -0.16 0.82 -2.13 -1.34 0.00 0.00 175.55 172.67 1k9a n ARG 215 N 5.05 -4.65 -1.45 4.97 0.63 -1.24 -2.56 116.66 117.42 1k9a n ARG 215 Ca -0.12 0.53 0.00 0.00 -0.92 0.00 0.00 57.85 57.34 1k9a n ARG 215 Cb 0.52 -5.23 0.00 0.00 0.45 0.00 0.00 32.46 28.20 1k9a n ARG 215 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1k9a n GLY 216 N -1.65 0.49 3.58 5.14 0.00 -1.26 -5.06 105.19 106.42 1k9a n GLY 216 Ca -0.06 -0.88 -0.08 0.00 0.00 0.00 0.00 46.02 45.00 1k9a n GLY 216 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k9a s ASN 217 N -2.90 -0.37 1.03 1.61 4.22 -1.06 -5.13 114.94 112.34 1k9a s ASN 217 Ca 0.00 -0.16 -0.12 0.00 -2.14 0.00 0.00 52.86 50.44 1k9a s ASN 217 Cb 0.00 0.51 0.21 0.00 1.28 0.00 0.00 41.25 43.24 1k9a s ASN 217 CO 0.00 -0.87 1.08 -0.54 -2.04 0.00 0.00 177.10 174.73 1k9a s LYS 218 N -3.43 0.17 -0.29 3.55 1.02 -1.25 -0.35 119.74 119.16 1k9a s LYS 218 Ca 0.06 1.02 -0.32 0.00 0.02 0.00 0.00 55.97 56.75 1k9a s LYS 218 Cb -0.02 -1.67 0.18 0.00 -0.52 0.00 0.00 37.83 35.81 1k9a s LYS 218 CO -0.06 -3.05 1.37 0.54 -0.92 0.00 0.00 175.35 173.24 1k9a s VAL 219 N -2.64 0.00 0.10 3.17 0.11 -0.26 -4.52 120.40 116.36 1k9a s VAL 219 Ca 0.67 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.75 1k9a s VAL 219 Cb -0.22 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.59 1k9a s VAL 219 CO 0.61 0.00 0.08 0.00 -3.33 0.00 0.00 175.10 172.46 1k9a s ALA 220 N -1.37 3.53 -0.41 1.54 0.00 -0.84 -1.26 121.76 122.95 1k9a s ALA 220 Ca 0.10 -1.08 0.02 0.00 0.00 0.00 0.00 51.96 51.00 1k9a s ALA 220 Cb -0.01 -1.38 0.14 0.00 0.00 0.00 0.00 23.12 21.87 1k9a s ALA 220 CO -0.06 0.68 0.24 0.08 0.00 0.00 0.00 175.76 176.70 1k9a s VAL 221 N -1.47 0.88 0.43 0.00 1.01 -0.39 -1.85 120.40 119.01 1k9a s VAL 221 Ca 0.29 -2.29 -0.18 0.00 0.00 0.00 0.00 61.98 59.79 1k9a s VAL 221 Cb -0.12 -1.62 -0.10 0.00 0.00 0.00 0.00 36.38 34.54 1k9a s VAL 221 CO 0.22 -0.96 0.91 -0.75 0.00 0.00 0.00 175.10 174.52 1k9a s LYS 222 N 0.55 4.10 0.06 2.72 2.20 -0.65 -2.70 119.74 126.02 1k9a s LYS 222 Ca 0.19 0.97 0.08 0.00 -0.36 0.00 0.00 55.97 56.85 1k9a s LYS 222 Cb -0.21 -2.22 -0.03 0.00 -1.51 0.00 0.00 37.83 33.86 1k9a s LYS 222 CO -0.02 -0.06 -0.21 0.00 -0.36 0.00 0.00 175.35 174.70 1k9a s ILE 224 N -0.92 3.91 1.15 0.00 1.01 -1.26 -3.03 121.20 122.06 1k9a s ILE 224 Ca 0.08 -1.11 -0.17 0.00 0.00 0.00 0.00 60.65 59.45 1k9a s ILE 224 Cb -0.09 -3.22 0.26 0.00 0.01 0.00 0.00 42.46 39.42 1k9a s ILE 224 CO 0.03 -0.20 1.10 -0.54 0.00 0.00 0.00 174.94 175.32 1k9a s LYS 225 N 1.42 -0.79 -0.67 2.79 1.02 0.38 -4.32 119.74 119.57 1k9a s LYS 225 Ca -0.01 0.13 -0.05 0.00 0.02 0.00 0.00 55.97 56.06 1k9a s LYS 225 Cb -0.20 -1.63 0.01 0.00 -0.52 0.00 0.00 37.83 35.49 1k9a s LYS 225 CO 0.03 -3.46 0.46 -1.71 -0.92 0.00 0.00 175.35 169.75 1k9a n ASN 226 N -4.62 -3.46 -3.12 2.83 2.85 -1.26 -4.92 115.26 103.56 1k9a n ASN 226 Ca 0.10 -0.78 -0.20 0.00 -0.11 0.00 0.00 54.58 53.59 1k9a n ASN 226 Cb 0.59 -1.18 -0.05 0.00 1.24 0.00 0.00 39.78 40.38 1k9a n ASN 226 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1k9a n ASP 227 N -1.75 -0.82 -0.34 1.20 2.03 -1.26 -5.00 116.55 110.61 1k9a n ASP 227 Ca -0.22 -2.75 0.05 0.00 0.52 0.00 0.00 54.79 52.39 1k9a n ASP 227 Cb 0.50 0.02 0.20 0.00 -0.72 0.00 0.00 41.12 41.12 1k9a n ASP 227 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1k9a h ALA 228 N 4.44 1.37 -0.02 -1.67 0.00 -1.92 -2.67 119.26 118.78 1k9a h ALA 228 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1k9a h ALA 228 Cb 0.93 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1k9a h ALA 228 CO 0.38 0.23 -0.30 0.25 0.00 0.00 0.00 179.25 179.81 1k9a n THR 229 N -4.64 0.00 -0.81 0.00 -2.24 -1.26 -0.74 114.28 104.59 1k9a n THR 229 Ca 0.16 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1k9a n THR 229 Cb 0.29 1.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 1k9a n THR 229 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k9a n ALA 230 N 0.25 0.00 -0.05 6.98 0.00 -1.01 -4.81 120.51 121.87 1k9a n ALA 230 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.48 1k9a n ALA 230 Cb 0.48 -0.67 -0.02 0.00 0.00 0.00 0.00 19.45 19.24 1k9a n ALA 230 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1k9a h GLN 231 N 0.99 -0.03 -0.99 0.00 4.20 -1.93 0.25 115.11 117.62 1k9a h GLN 231 Ca 0.00 0.00 0.15 0.00 0.06 0.00 0.00 58.65 58.86 1k9a h GLN 231 Cb 0.19 0.01 -0.09 0.00 0.30 0.00 0.00 27.48 27.88 1k9a h GLN 231 CO 0.00 -0.02 0.60 0.00 -0.67 0.00 0.00 178.83 178.75 1k9a h ALA 232 N 1.19 1.55 -0.40 3.87 0.00 -1.93 0.40 119.26 123.94 1k9a h ALA 232 Ca 0.11 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1k9a h ALA 232 Cb 0.20 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1k9a h ALA 232 CO -0.25 0.09 0.03 0.35 0.00 0.00 0.00 179.25 179.47 1k9a h PHE 233 N 0.87 0.74 0.27 0.00 3.57 -1.17 -2.41 116.94 118.82 1k9a h PHE 233 Ca 0.52 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.89 1k9a h PHE 233 Cb 0.66 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.20 1k9a h PHE 233 CO -0.01 0.74 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.61 1k9a h LEU 234 N 0.53 -0.31 -0.82 0.59 3.38 0.73 -0.71 115.31 118.70 1k9a h LEU 234 Ca 0.12 -0.19 0.15 0.00 0.09 0.00 0.00 57.88 58.04 1k9a h LEU 234 Cb 0.43 0.08 -0.15 0.00 0.09 0.00 0.00 40.66 41.11 1k9a h LEU 234 CO 0.01 0.17 -0.29 0.00 0.09 0.00 0.00 178.44 178.43 1k9a h ALA 235 N -0.61 0.30 -0.10 1.53 0.00 -0.35 0.91 119.26 120.94 1k9a h ALA 235 Ca -0.04 0.27 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 1k9a h ALA 235 Cb 0.49 0.78 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1k9a h ALA 235 CO 0.06 -0.53 -0.48 1.49 0.00 0.00 0.00 179.25 179.79 1k9a h GLU 236 N -0.04 0.25 0.02 0.00 4.81 -1.48 -2.43 114.58 115.70 1k9a h GLU 236 Ca 0.35 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.35 1k9a h GLU 236 Cb 0.60 0.01 0.01 0.00 0.63 0.00 0.00 28.75 29.99 1k9a h GLU 236 CO -0.85 0.68 -0.37 0.00 -0.73 0.00 0.00 179.01 177.74 1k9a h ALA 237 N 1.30 0.02 -0.43 2.92 0.00 0.83 -2.50 119.26 121.40 1k9a h ALA 237 Ca 0.01 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.45 1k9a h ALA 237 Cb 0.93 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 1k9a h ALA 237 CO 0.08 0.17 0.18 0.66 0.00 0.00 0.00 179.25 180.33 1k9a h SER 238 N -0.45 0.23 -0.49 0.00 4.64 0.67 -2.38 113.55 115.77 1k9a h SER 238 Ca -0.05 0.04 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1k9a h SER 238 Cb 1.14 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.21 1k9a h SER 238 CO 0.07 0.17 0.30 0.58 -0.87 0.00 0.00 176.83 177.09 1k9a h VAL 239 N 0.37 1.15 0.00 0.95 2.07 -1.52 -2.18 116.25 117.09 1k9a h VAL 239 Ca 0.19 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1k9a h VAL 239 Cb 0.14 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1k9a h VAL 239 CO -0.17 0.15 0.00 -0.03 0.02 0.00 0.00 177.57 177.54 1k9a h MET 240 N 0.66 0.00 -0.08 1.57 -1.53 -0.96 0.15 114.93 114.75 1k9a h MET 240 Ca 0.18 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.44 1k9a h MET 240 Cb -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.02 1k9a h MET 240 CO -0.03 0.00 0.00 0.25 0.14 0.00 0.00 176.91 177.27 1k9a n THR 241 N -2.36 0.09 0.08 -0.77 -2.24 -0.82 -3.43 114.28 104.83 1k9a n THR 241 Ca -0.01 -0.18 0.01 0.00 -2.27 0.00 0.00 64.05 61.60 1k9a n THR 241 Cb 0.08 0.07 -0.01 0.00 -2.10 0.00 0.00 70.33 68.37 1k9a n THR 241 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k9a n GLN 242 N -0.21 6.42 -4.02 -0.78 6.02 0.51 -3.90 117.38 121.41 1k9a n GLN 242 Ca 0.16 -0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.79 1k9a n GLN 242 Cb 0.22 -0.58 -0.07 0.00 1.02 0.00 0.00 30.24 30.83 1k9a n GLN 242 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1k9a s LEU 243 N -2.08 4.15 -0.29 1.08 1.43 -1.15 -5.07 118.68 116.75 1k9a s LEU 243 Ca 0.01 0.35 0.01 0.00 -1.03 0.00 0.00 54.13 53.47 1k9a s LEU 243 Cb 0.01 -2.07 0.19 0.00 0.03 0.00 0.00 46.19 44.35 1k9a s LEU 243 CO 0.07 0.38 0.65 -0.60 0.23 0.00 0.00 176.35 177.07 1k9a s ARG 244 N -1.13 0.52 -0.28 1.70 3.52 -1.26 -4.82 118.95 117.19 1k9a s ARG 244 Ca 0.16 0.67 -0.19 0.00 -0.13 0.00 0.00 55.73 56.24 1k9a s ARG 244 Cb -0.12 0.34 0.11 0.00 -1.56 0.00 0.00 34.95 33.72 1k9a s ARG 244 CO 0.06 -0.81 0.86 -1.58 -0.81 0.00 0.00 175.30 173.02 1k9a s HIS 245 N 2.86 -0.74 0.25 5.12 2.46 -1.26 -5.04 115.29 118.94 1k9a s HIS 245 Ca 0.14 1.56 0.00 0.00 0.47 0.00 0.00 55.06 57.24 1k9a s HIS 245 Cb -0.11 0.43 0.00 0.00 -0.13 0.00 0.00 32.58 32.77 1k9a s HIS 245 CO -0.23 -0.36 0.66 0.43 -2.47 0.00 0.00 174.74 172.77 1k9a n SER 246 N 3.46 0.00 -1.24 9.88 7.64 -1.26 0.19 113.62 132.30 1k9a n SER 246 Ca -0.17 0.19 -0.03 0.00 1.01 0.00 0.00 58.87 59.87 1k9a n SER 246 Cb 0.57 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.90 1k9a n SER 246 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1k9a n ASN 247 N -1.53 2.48 -3.78 6.43 3.02 -1.26 -4.87 115.26 115.75 1k9a n ASN 247 Ca 0.00 -3.51 -0.15 0.00 -0.03 0.00 0.00 54.58 50.89 1k9a n ASN 247 Cb 0.66 -0.45 -0.16 0.00 -0.61 0.00 0.00 39.78 39.23 1k9a n ASN 247 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1k9a s LEU 248 N -2.97 1.15 -0.04 3.41 1.43 0.13 -0.60 118.68 121.19 1k9a s LEU 248 Ca 0.40 0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 53.23 1k9a s LEU 248 Cb 0.38 -0.07 -0.09 0.00 0.03 0.00 0.00 46.19 46.44 1k9a s LEU 248 CO -0.05 -0.12 2.02 0.52 0.23 0.00 0.00 176.35 178.95 1k9a n VAL 249 N 4.10 0.65 -2.52 -1.59 0.31 -0.68 -4.60 118.33 114.00 1k9a n VAL 249 Ca -0.27 -0.20 -0.42 0.00 -0.01 0.00 0.00 64.34 63.44 1k9a n VAL 249 Cb 0.51 -2.28 -0.03 0.00 -0.91 0.00 0.00 33.84 31.13 1k9a n VAL 249 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1k9a s GLN 250 N 4.83 4.47 -0.02 5.55 2.00 -1.26 -4.92 119.66 130.31 1k9a s GLN 250 Ca 0.92 1.66 -0.30 0.00 -2.00 0.00 0.00 55.36 55.64 1k9a s GLN 250 Cb -0.47 -3.38 -0.03 0.00 0.80 0.00 0.00 33.01 29.93 1k9a s GLN 250 CO 0.43 -0.19 1.12 -1.17 -0.50 0.00 0.00 175.29 174.98 1k9a s LEU 251 N 1.03 4.31 0.00 3.68 2.96 -1.26 -2.18 118.68 127.23 1k9a s LEU 251 Ca 0.56 1.78 0.20 0.00 -0.22 0.00 0.00 54.13 56.46 1k9a s LEU 251 Cb -0.27 -3.57 -0.21 0.00 0.50 0.00 0.00 46.19 42.65 1k9a s LEU 251 CO 0.29 -0.47 0.59 0.18 -1.32 0.00 0.00 176.35 175.63 1k9a n LEU 252 N 4.59 0.37 0.00 -0.68 4.77 0.52 -4.95 117.00 121.62 1k9a n LEU 252 Ca 0.09 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 1k9a n LEU 252 Cb 0.48 0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1k9a n LEU 252 CO 0.54 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1k9a n GLY 253 N 1.37 1.55 3.41 -0.72 0.00 -0.85 -4.96 105.19 104.99 1k9a n GLY 253 Ca -0.10 -1.02 -0.27 0.00 0.00 0.00 0.00 46.02 44.64 1k9a n GLY 253 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k9a s VAL 254 N -2.00 2.30 -0.10 1.61 0.11 0.20 -1.19 120.40 121.33 1k9a s VAL 254 Ca 0.00 -2.01 0.01 0.00 -2.93 0.00 0.00 61.98 57.04 1k9a s VAL 254 Cb 0.00 -2.09 0.02 0.00 -1.53 0.00 0.00 36.38 32.78 1k9a s VAL 254 CO 0.00 -0.13 -0.10 -0.63 -3.33 0.00 0.00 175.10 170.91 1k9a s ILE 255 N -1.68 1.12 -0.60 7.04 1.01 -0.37 -1.94 121.20 125.77 1k9a s ILE 255 Ca 0.20 -0.39 0.04 0.00 0.00 0.00 0.00 60.65 60.51 1k9a s ILE 255 Cb -0.08 -1.09 0.16 0.00 0.01 0.00 0.00 42.46 41.47 1k9a s ILE 255 CO 0.09 0.37 0.42 -0.69 0.00 0.00 0.00 174.94 175.14 1k9a s VAL 256 N 1.33 2.17 0.44 2.92 1.01 -1.26 -1.54 120.40 125.46 1k9a s VAL 256 Ca -0.02 -3.71 -0.25 0.00 0.00 0.00 0.00 61.98 58.00 1k9a s VAL 256 Cb -0.14 -2.44 -0.08 0.00 0.00 0.00 0.00 36.38 33.72 1k9a s VAL 256 CO -0.04 -1.04 1.40 -1.61 0.00 0.00 0.00 175.10 173.81 1k9a s GLU 257 N -0.89 3.73 0.52 2.72 2.02 -0.78 -4.89 118.70 121.12 1k9a s GLU 257 Ca 0.26 2.36 0.25 0.00 0.02 0.00 0.00 54.97 57.86 1k9a s GLU 257 Cb -0.05 -2.67 1.44 0.00 0.10 0.00 0.00 34.13 32.95 1k9a s GLU 257 CO -0.15 -0.76 2.09 1.05 0.02 0.00 0.00 175.26 177.51 1k9a h GLU 258 N 2.37 0.00 -0.15 1.61 9.09 -1.99 -1.52 114.58 123.99 1k9a h GLU 258 Ca -0.51 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 58.81 1k9a h GLU 258 Cb 1.26 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.35 1k9a h GLU 258 CO 0.61 0.11 -0.30 0.87 0.05 0.00 0.00 179.01 180.35 1k9a h LYS 259 N 0.00 0.29 0.00 1.06 1.57 -1.96 -3.47 116.57 114.06 1k9a h LYS 259 Ca -0.00 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1k9a h LYS 259 Cb 0.27 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1k9a h LYS 259 CO 0.01 0.57 0.00 0.41 -0.57 0.00 0.00 179.45 179.88 1k9a n GLY 260 N -0.41 1.08 3.79 3.86 0.00 -0.57 -3.09 105.19 109.85 1k9a n GLY 260 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1k9a n GLY 260 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1k9a s GLY 261 N -1.37 2.82 -0.26 -0.02 0.00 -1.23 -4.51 107.32 102.76 1k9a s GLY 261 Ca 0.00 0.26 0.01 0.00 0.00 0.00 0.00 44.72 44.99 1k9a s GLY 261 CO 0.00 0.72 -0.03 1.08 0.00 0.00 0.00 173.10 174.87 1k9a s LEU 262 N -1.27 2.86 0.13 0.66 1.43 -1.26 -1.87 118.68 119.36 1k9a s LEU 262 Ca 0.35 -1.35 0.10 0.00 -1.03 0.00 0.00 54.13 52.20 1k9a s LEU 262 Cb -0.21 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.74 1k9a s LEU 262 CO 0.24 -0.27 -0.24 -0.31 0.23 0.00 0.00 176.35 176.00 1k9a s TYR 263 N 1.33 2.11 -0.13 0.29 4.12 -0.59 -4.43 117.35 120.06 1k9a s TYR 263 Ca -0.03 -0.40 0.00 0.00 0.02 0.00 0.00 57.07 56.67 1k9a s TYR 263 Cb -0.19 -1.13 0.02 0.00 -1.52 0.00 0.00 41.96 39.15 1k9a s TYR 263 CO -0.08 0.32 -0.12 0.42 0.02 0.00 0.00 175.55 176.11 1k9a s ILE 264 N -1.26 1.38 -0.32 2.71 1.01 -0.86 -1.24 121.20 122.62 1k9a s ILE 264 Ca 0.13 -0.53 -0.12 0.00 0.00 0.00 0.00 60.65 60.13 1k9a s ILE 264 Cb -0.09 -1.32 -0.02 0.00 0.01 0.00 0.00 42.46 41.04 1k9a s ILE 264 CO 0.06 0.43 0.21 -0.69 0.00 0.00 0.00 174.94 174.95 1k9a s VAL 265 N 1.44 5.08 0.40 2.92 1.01 -0.33 -1.64 120.40 129.29 1k9a s VAL 265 Ca 0.02 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.78 1k9a s VAL 265 Cb -0.13 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 32.67 1k9a s VAL 265 CO -0.08 0.04 0.06 0.35 0.00 0.00 0.00 175.10 175.47 1k9a n THR 266 N 5.06 0.00 -2.00 3.92 -2.24 -0.77 0.20 114.28 118.45 1k9a n THR 266 Ca -0.13 -1.83 -0.32 0.00 -2.27 0.00 0.00 64.05 59.51 1k9a n THR 266 Cb 0.50 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1k9a n THR 266 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1k9a s GLU 267 N -3.48 3.52 -0.26 -0.78 -1.05 -0.93 -1.99 118.70 113.73 1k9a s GLU 267 Ca 0.05 0.93 -0.25 0.00 -0.15 0.00 0.00 54.97 55.54 1k9a s GLU 267 Cb -0.00 -2.07 0.00 0.00 -0.44 0.00 0.00 34.13 31.62 1k9a s GLU 267 CO 0.03 -0.63 0.87 -0.47 0.95 0.00 0.00 175.26 176.02 1k9a s TYR 268 N -2.87 3.28 -1.09 4.83 5.04 -1.26 -4.15 117.35 121.13 1k9a s TYR 268 Ca 0.58 1.12 -0.08 0.00 -2.44 0.00 0.00 57.07 56.25 1k9a s TYR 268 Cb -0.12 -3.18 0.28 0.00 0.35 0.00 0.00 41.96 39.29 1k9a s TYR 268 CO 0.45 -0.48 1.11 -1.33 -1.34 0.00 0.00 175.55 173.95 1k9a n MET 269 N 6.18 3.52 0.28 4.97 2.81 -1.26 -4.80 117.12 128.82 1k9a n MET 269 Ca 0.07 -4.47 0.07 0.00 -1.81 0.00 0.00 57.70 51.56 1k9a n MET 269 Cb 0.47 -2.53 0.38 0.00 -0.71 0.00 0.00 33.22 30.84 1k9a n MET 269 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1k9a h ALA 270 N 6.45 1.54 -0.30 3.04 0.00 -1.87 -2.93 119.26 125.19 1k9a h ALA 270 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1k9a h ALA 270 Cb 0.84 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 1k9a h ALA 270 CO 1.03 -0.54 -0.00 1.63 0.00 0.00 0.00 179.25 181.37 1k9a n LYS 271 N -2.48 2.57 0.00 0.00 5.02 -0.24 -4.91 118.16 118.12 1k9a n LYS 271 Ca -0.01 -2.93 0.00 0.00 -2.02 0.00 0.00 58.31 53.35 1k9a n LYS 271 Cb 0.61 -1.84 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1k9a n LYS 271 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k9a n GLY 272 N -0.72 -1.26 3.87 0.72 0.00 -1.11 -4.65 105.19 102.04 1k9a n GLY 272 Ca 0.26 -1.19 -0.30 0.00 0.00 0.00 0.00 46.02 44.78 1k9a n GLY 272 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k9a s SER 273 N -4.00 5.28 0.05 1.61 1.04 -1.26 -0.96 113.70 115.46 1k9a s SER 273 Ca 0.00 1.17 -0.19 0.00 0.48 0.00 0.00 55.95 57.41 1k9a s SER 273 Cb 0.00 -1.95 -0.14 0.00 0.10 0.00 0.00 66.02 64.03 1k9a s SER 273 CO 0.00 -1.45 1.34 0.25 0.98 0.00 0.00 173.24 174.35 1k9a h LEU 274 N -0.73 0.48 -0.95 2.42 7.12 -0.80 -2.61 115.31 120.24 1k9a h LEU 274 Ca -0.45 -0.51 0.22 0.00 0.13 0.00 0.00 57.88 57.27 1k9a h LEU 274 Cb 1.26 -0.14 -0.12 0.00 -0.53 0.00 0.00 40.66 41.13 1k9a h LEU 274 CO 0.63 0.89 0.51 0.58 -0.13 0.00 0.00 178.44 180.92 1k9a h VAL 275 N 0.08 0.57 0.17 1.05 2.07 -1.30 -0.72 116.25 118.18 1k9a h VAL 275 Ca 0.02 -0.19 -0.28 0.00 0.82 0.00 0.00 66.70 67.07 1k9a h VAL 275 Cb 0.78 -0.04 0.03 0.00 -1.52 0.00 0.00 31.29 30.54 1k9a h VAL 275 CO 0.05 0.10 -1.21 0.44 0.02 0.00 0.00 177.57 176.97 1k9a h ASP 276 N 0.55 0.77 -0.57 0.57 3.32 -1.86 -3.21 116.42 116.00 1k9a h ASP 276 Ca 0.58 -0.88 0.08 0.00 0.02 0.00 0.00 57.03 56.83 1k9a h ASP 276 Cb 1.05 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.32 1k9a h ASP 276 CO -0.46 1.59 0.38 0.22 -1.72 0.00 0.00 179.24 179.25 1k9a h TYR 277 N 0.07 0.48 0.00 4.55 3.20 -0.92 1.51 116.97 125.86 1k9a h TYR 277 Ca -0.20 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.68 1k9a h TYR 277 Cb 1.93 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 40.04 1k9a h TYR 277 CO 0.14 0.25 0.00 -0.07 -1.64 0.00 0.00 178.16 176.84 1k9a h LEU 278 N 0.47 0.00 0.00 2.82 3.38 -1.20 -2.43 115.31 118.34 1k9a h LEU 278 Ca 0.26 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.91 1k9a h LEU 278 Cb 0.40 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 1k9a h LEU 278 CO -0.07 0.00 -2.13 0.54 0.09 0.00 0.00 178.44 176.86 1k9a n ARG 279 N -2.35 0.47 0.09 1.13 1.74 0.13 -4.23 116.66 113.64 1k9a n ARG 279 Ca 0.03 0.14 0.07 0.00 -0.77 0.00 0.00 57.85 57.33 1k9a n ARG 279 Cb 0.31 -1.34 0.53 0.00 -1.02 0.00 0.00 32.46 30.94 1k9a n ARG 279 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1k9a h SER 280 N -0.28 0.26 -3.56 0.55 4.64 0.18 -3.33 113.55 112.00 1k9a h SER 280 Ca -0.47 -0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.25 1k9a h SER 280 Cb 1.60 -0.06 -0.39 0.00 -0.31 0.00 0.00 62.40 63.24 1k9a h SER 280 CO -0.16 0.18 -0.78 -0.13 -0.87 0.00 0.00 176.83 175.07 1k9a s ARG 281 N -5.30 1.43 0.00 4.77 0.52 -0.92 -5.07 118.95 114.38 1k9a s ARG 281 Ca -0.07 -0.90 0.00 0.00 -0.52 0.00 0.00 55.73 54.24 1k9a s ARG 281 Cb 0.18 -2.50 0.00 0.00 0.52 0.00 0.00 34.95 33.14 1k9a s ARG 281 CO 0.71 -0.62 0.00 0.41 0.02 0.00 0.00 175.30 175.82 1k9a n GLY 282 N 4.74 1.08 0.39 -3.53 0.00 -1.25 -4.35 105.19 102.27 1k9a n GLY 282 Ca -0.11 -1.77 0.21 0.00 0.00 0.00 0.00 46.02 44.35 1k9a n GLY 282 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1k9a h ARG 283 N 0.00 0.00 0.00 1.61 3.08 -1.87 -0.25 114.38 116.95 1k9a h ARG 283 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1k9a h ARG 283 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1k9a h ARG 283 CO 0.00 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.77 1k9a n SER 284 N -4.16 0.00 -0.03 7.04 3.41 -1.26 -4.14 113.62 114.47 1k9a n SER 284 Ca 0.09 0.30 -0.06 0.00 -0.26 0.00 0.00 58.87 58.94 1k9a n SER 284 Cb 0.61 -0.43 -0.02 0.00 -0.26 0.00 0.00 64.21 64.11 1k9a n SER 284 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1k9a n VAL 285 N -1.43 0.36 -2.47 -3.33 0.31 -0.24 -4.95 118.33 106.57 1k9a n VAL 285 Ca 0.09 -0.10 -0.40 0.00 -0.01 0.00 0.00 64.34 63.91 1k9a n VAL 285 Cb 0.29 -1.34 -0.03 0.00 -0.91 0.00 0.00 33.84 31.85 1k9a n VAL 285 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1k9a s LEU 286 N -6.07 3.21 0.47 7.52 1.43 -0.43 -5.00 118.68 119.82 1k9a s LEU 286 Ca -0.09 -0.44 -0.22 0.00 -1.03 0.00 0.00 54.13 52.35 1k9a s LEU 286 Cb 0.03 -2.56 -0.07 0.00 0.03 0.00 0.00 46.19 43.62 1k9a s LEU 286 CO 0.12 -1.90 1.17 -0.83 0.23 0.00 0.00 176.35 175.15 1k9a s GLY 287 N 4.52 2.77 0.30 -3.19 0.00 -1.26 -4.82 107.32 105.64 1k9a s GLY 287 Ca 0.41 0.95 0.06 0.00 0.00 0.00 0.00 44.72 46.13 1k9a s GLY 287 CO 0.13 1.40 1.71 -1.33 0.00 0.00 0.00 173.10 175.01 1k9a h GLY 288 N 1.91 1.67 0.58 0.20 0.00 -1.94 0.55 103.07 106.03 1k9a h GLY 288 Ca -0.50 -0.23 0.07 0.00 0.00 0.00 0.00 47.33 46.67 1k9a h GLY 288 CO 0.60 -0.24 0.28 -1.80 0.00 0.00 0.00 176.54 175.38 1k9a h ASP 289 N 0.49 0.37 -0.83 0.19 -0.00 -1.91 -0.98 116.42 113.76 1k9a h ASP 289 Ca 0.58 0.05 0.06 0.00 -0.00 0.00 0.00 57.03 57.72 1k9a h ASP 289 Cb 1.09 -0.01 -0.06 0.00 -0.00 0.00 0.00 39.33 40.34 1k9a h ASP 289 CO -0.49 0.24 0.51 0.00 -0.00 0.00 0.00 179.24 179.50 1k9a h LEU 291 N 0.95 0.00 -0.10 0.00 3.38 -0.75 -1.93 115.31 116.85 1k9a h LEU 291 Ca 0.36 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.12 1k9a h LEU 291 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1k9a h LEU 291 CO -0.17 0.03 -0.75 0.25 0.09 0.00 0.00 178.44 177.89 1k9a h LEU 292 N 0.00 0.83 -0.49 1.67 5.85 -0.60 -2.38 115.31 120.20 1k9a h LEU 292 Ca -0.00 -0.66 0.01 0.00 0.84 0.00 0.00 57.88 58.07 1k9a h LEU 292 Cb 0.06 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1k9a h LEU 292 CO 0.00 1.37 0.31 0.11 -0.34 0.00 0.00 178.44 179.89 1k9a h LYS 293 N 0.36 0.61 -0.78 1.25 1.79 -0.86 0.29 116.57 119.23 1k9a h LYS 293 Ca -0.07 -0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.33 1k9a h LYS 293 Cb 1.40 -0.14 -0.04 0.00 -1.58 0.00 0.00 32.23 31.87 1k9a h LYS 293 CO 0.15 0.40 0.34 0.74 -1.08 0.00 0.00 179.45 180.00 1k9a h PHE 294 N 0.63 1.16 -0.59 -1.35 0.05 -1.45 0.58 116.94 115.96 1k9a h PHE 294 Ca 0.18 -0.07 -0.05 0.00 3.82 0.00 0.00 57.97 61.85 1k9a h PHE 294 Cb -0.04 -0.35 -0.03 0.00 2.00 0.00 0.00 35.95 37.53 1k9a h PHE 294 CO -0.05 0.86 0.15 0.77 -0.18 0.00 0.00 178.31 179.86 1k9a h SER 295 N 1.13 0.86 -0.04 2.17 0.02 -0.78 -1.92 113.55 114.99 1k9a h SER 295 Ca 0.26 -0.16 -0.09 0.00 -0.84 0.00 0.00 61.79 60.97 1k9a h SER 295 Cb 0.17 -0.23 0.01 0.00 0.14 0.00 0.00 62.40 62.49 1k9a h SER 295 CO -0.03 0.83 -0.31 -0.07 -1.14 0.00 0.00 176.83 176.11 1k9a h LEU 296 N 0.88 0.34 -0.22 5.07 3.38 0.32 -2.50 115.31 122.58 1k9a h LEU 296 Ca 0.19 -0.70 0.04 0.00 0.09 0.00 0.00 57.88 57.51 1k9a h LEU 296 Cb 0.31 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 40.89 1k9a h LEU 296 CO -0.00 0.99 -0.49 0.44 0.09 0.00 0.00 178.44 179.47 1k9a h ASP 297 N -0.28 -1.57 0.68 -0.43 3.32 0.28 -1.27 116.42 117.15 1k9a h ASP 297 Ca -0.03 0.20 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 1k9a h ASP 297 Cb 1.00 0.64 -0.01 0.00 0.22 0.00 0.00 39.33 41.18 1k9a h ASP 297 CO 0.06 -0.44 -0.48 0.58 -1.72 0.00 0.00 179.24 177.25 1k9a h VAL 298 N -0.49 0.05 -0.98 -1.35 2.07 -1.44 -2.78 116.25 111.33 1k9a h VAL 298 Ca 0.07 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.78 1k9a h VAL 298 Cb 0.64 0.05 -0.18 0.00 -1.52 0.00 0.00 31.29 30.28 1k9a h VAL 298 CO -0.47 0.00 -0.29 0.00 0.02 0.00 0.00 177.57 176.83 1k9a h GLU 300 N -0.00 0.19 -0.78 0.00 5.08 -1.08 0.43 114.58 118.41 1k9a h GLU 300 Ca 0.43 -0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.91 1k9a h GLU 300 Cb 0.68 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.80 1k9a h GLU 300 CO -1.00 0.13 0.39 0.00 -1.00 0.00 0.00 179.01 177.52 1k9a h ALA 301 N 1.30 1.13 -0.16 3.43 0.00 0.48 0.18 119.26 125.62 1k9a h ALA 301 Ca 0.19 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 1k9a h ALA 301 Cb 0.23 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1k9a h ALA 301 CO -0.25 -0.08 -0.32 0.52 0.00 0.00 0.00 179.25 179.11 1k9a h MET 302 N 0.60 0.31 -0.26 0.00 2.86 0.54 -2.66 114.93 116.32 1k9a h MET 302 Ca 0.41 -0.13 0.02 0.00 -2.06 0.00 0.00 59.70 57.94 1k9a h MET 302 Cb 0.52 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 1k9a h MET 302 CO -0.33 0.60 0.12 1.49 1.06 0.00 0.00 176.91 179.86 1k9a h GLU 303 N 0.27 0.26 -0.35 1.72 4.81 0.10 -2.28 114.58 119.11 1k9a h GLU 303 Ca 0.04 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.32 1k9a h GLU 303 Cb 0.71 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.96 1k9a h GLU 303 CO 0.05 0.17 -0.11 -0.92 -0.73 0.00 0.00 179.01 177.48 1k9a h TYR 304 N 0.27 -0.24 -0.00 0.92 3.20 -1.03 0.70 116.97 120.79 1k9a h TYR 304 Ca 0.11 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.03 1k9a h TYR 304 Cb 0.04 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1k9a h TYR 304 CO -0.10 -0.18 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.08 1k9a h LEU 305 N -0.03 -0.28 -0.56 2.82 3.38 -1.15 0.61 115.31 120.10 1k9a h LEU 305 Ca 0.17 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1k9a h LEU 305 Cb 0.29 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1k9a h LEU 305 CO -0.37 -0.14 0.34 -0.08 0.09 0.00 0.00 178.44 178.27 1k9a h GLU 306 N -0.17 0.76 0.00 1.13 4.81 -0.99 0.37 114.58 120.49 1k9a h GLU 306 Ca 0.04 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1k9a h GLU 306 Cb 0.22 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1k9a h GLU 306 CO -0.10 0.55 0.00 0.78 -0.73 0.00 0.00 179.01 179.51 1k9a h GLY 307 N 0.76 0.00 -0.45 1.92 0.00 0.10 -1.11 103.07 104.29 1k9a h GLY 307 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1k9a h GLY 307 CO -0.04 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.20 1k9a n ASN 308 N -2.37 2.59 -3.57 0.19 3.02 0.15 -4.99 115.26 110.28 1k9a n ASN 308 Ca -0.01 -2.60 -0.23 0.00 -0.03 0.00 0.00 54.58 51.71 1k9a n ASN 308 Cb 0.10 -0.29 0.08 0.00 -0.61 0.00 0.00 39.78 39.06 1k9a n ASN 308 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1k9a n ASN 309 N -0.73 -5.83 -4.25 6.41 5.03 -0.18 -5.01 115.26 110.70 1k9a n ASN 309 Ca 0.12 -0.55 -0.29 0.00 0.87 0.00 0.00 54.58 54.72 1k9a n ASN 309 Cb 0.54 -5.04 -0.16 0.00 -1.02 0.00 0.00 39.78 34.09 1k9a n ASN 309 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1k9a s PHE 310 N -3.32 2.16 -0.21 3.10 2.99 0.11 -3.00 117.98 119.81 1k9a s PHE 310 Ca 0.51 -0.53 -0.03 0.00 0.00 0.00 0.00 56.93 56.88 1k9a s PHE 310 Cb -0.23 -1.41 -0.01 0.00 0.00 0.00 0.00 43.02 41.38 1k9a s PHE 310 CO 0.73 -0.12 -0.06 0.14 -0.00 0.00 0.00 175.22 175.91 1k9a s VAL 311 N -0.32 3.26 0.05 -0.44 -7.23 -0.43 -3.66 120.40 111.63 1k9a s VAL 311 Ca 0.03 -0.54 -0.30 0.00 -1.81 0.00 0.00 61.98 59.36 1k9a s VAL 311 Cb -0.11 -2.47 -0.18 0.00 0.56 0.00 0.00 36.38 34.18 1k9a s VAL 311 CO 0.01 0.44 1.46 -0.74 -0.31 0.00 0.00 175.10 175.96 1k9a h HIS 312 N 7.94 -0.74 0.00 2.82 2.76 -1.89 -2.48 115.15 123.56 1k9a h HIS 312 Ca -0.40 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 57.75 1k9a h HIS 312 Cb 1.16 0.25 0.00 0.00 1.55 0.00 0.00 27.41 30.37 1k9a h HIS 312 CO 0.57 -0.42 0.00 0.54 -1.30 0.00 0.00 177.93 177.32 1k9a n ARG 313 N -5.39 0.00 -2.44 5.26 1.74 -1.26 -2.95 116.66 111.62 1k9a n ARG 313 Ca -0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 1k9a n ARG 313 Cb 0.34 -1.47 0.05 0.00 -1.02 0.00 0.00 32.46 30.36 1k9a n ARG 313 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1k9a n ASP 314 N 0.00 0.99 -4.66 0.55 2.03 -1.26 -4.66 116.55 109.53 1k9a n ASP 314 Ca 0.00 -2.04 -0.42 0.00 0.52 0.00 0.00 54.79 52.85 1k9a n ASP 314 Cb 0.00 -0.27 -0.03 0.00 -0.72 0.00 0.00 41.12 40.10 1k9a n ASP 314 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1k9a s LEU 315 N -2.81 4.27 0.18 -2.67 2.96 -1.26 -4.78 118.68 114.57 1k9a s LEU 315 Ca 0.25 2.01 -0.20 0.00 -0.22 0.00 0.00 54.13 55.97 1k9a s LEU 315 Cb 0.34 -3.54 0.05 0.00 0.50 0.00 0.00 46.19 43.54 1k9a s LEU 315 CO -0.08 -0.83 0.56 0.00 -1.32 0.00 0.00 176.35 174.68 1k9a s ALA 316 N 3.61 -1.27 -0.04 5.97 0.00 -1.26 -4.78 121.76 123.99 1k9a s ALA 316 Ca 0.65 0.12 0.31 0.00 0.00 0.00 0.00 51.96 53.03 1k9a s ALA 316 Cb -0.29 0.84 1.39 0.00 0.00 0.00 0.00 23.12 25.07 1k9a s ALA 316 CO 0.23 -0.79 1.91 0.00 0.00 0.00 0.00 175.76 177.12 1k9a h ALA 317 N 2.11 1.00 -0.01 0.00 0.00 -1.93 -1.04 119.26 119.39 1k9a h ALA 317 Ca -0.31 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.43 1k9a h ALA 317 Cb 1.28 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 1k9a h ALA 317 CO 0.38 0.00 -0.76 0.07 0.00 0.00 0.00 179.25 178.93 1k9a h ARG 318 N 0.00 0.12 -1.07 0.00 0.11 -1.95 -0.15 114.38 111.45 1k9a h ARG 318 Ca 0.00 -0.12 -0.42 0.00 0.10 0.00 0.00 59.98 59.54 1k9a h ARG 318 Cb 0.31 0.03 -0.23 0.00 1.11 0.00 0.00 29.97 31.19 1k9a h ARG 318 CO 0.00 0.83 0.54 0.09 0.10 0.00 0.00 179.97 181.53 1k9a n ASN 319 N -3.70 4.53 -4.06 0.08 3.02 -0.40 -4.73 115.26 110.00 1k9a n ASN 319 Ca -0.02 -3.27 -0.16 0.00 -0.03 0.00 0.00 54.58 51.10 1k9a n ASN 319 Cb 0.73 -0.83 -0.13 0.00 -0.61 0.00 0.00 39.78 38.95 1k9a n ASN 319 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1k9a s VAL 320 N -2.78 0.70 0.26 2.41 1.01 -1.21 -0.80 120.40 119.99 1k9a s VAL 320 Ca 0.44 -0.81 0.12 0.00 0.00 0.00 0.00 61.98 61.73 1k9a s VAL 320 Cb 0.37 -0.67 -0.05 0.00 0.00 0.00 0.00 36.38 36.02 1k9a s VAL 320 CO 0.06 -0.11 -0.20 -0.76 0.00 0.00 0.00 175.10 174.09 1k9a s LEU 321 N -1.01 2.57 -0.08 3.92 1.02 0.62 -0.92 118.68 124.80 1k9a s LEU 321 Ca -0.03 -0.99 0.04 0.00 0.02 0.00 0.00 54.13 53.18 1k9a s LEU 321 Cb -0.07 -1.13 -0.00 0.00 0.02 0.00 0.00 46.19 45.01 1k9a s LEU 321 CO 0.01 0.06 -0.22 -0.69 0.02 0.00 0.00 176.35 175.52 1k9a s VAL 322 N -2.33 1.89 0.77 -1.59 1.01 -0.13 -0.33 120.40 119.69 1k9a s VAL 322 Ca 0.28 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 1k9a s VAL 322 Cb -0.06 -1.63 0.16 0.00 0.00 0.00 0.00 36.38 34.85 1k9a s VAL 322 CO 0.14 0.52 1.05 -1.54 0.00 0.00 0.00 175.10 175.27 1k9a n SER 323 N 3.44 0.95 -0.25 3.32 3.41 0.40 -1.08 113.62 123.81 1k9a n SER 323 Ca -0.19 -1.91 -0.03 0.00 -0.26 0.00 0.00 58.87 56.48 1k9a n SER 323 Cb 0.53 -0.72 0.14 0.00 -0.26 0.00 0.00 64.21 63.90 1k9a n SER 323 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1k9a h GLU 324 N 0.00 1.08 -0.93 4.33 3.07 -1.89 -1.22 114.58 119.02 1k9a h GLU 324 Ca -0.34 -0.15 -0.01 0.00 -0.50 0.00 0.00 59.36 58.35 1k9a h GLU 324 Cb 1.16 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.87 1k9a h GLU 324 CO 0.33 0.83 0.01 -0.25 -1.40 0.00 0.00 179.01 178.53 1k9a n ASP 325 N -4.32 2.03 -1.93 1.42 8.00 -1.26 -4.84 116.55 115.65 1k9a n ASP 325 Ca 0.07 -2.19 -0.19 0.00 0.71 0.00 0.00 54.79 53.19 1k9a n ASP 325 Cb 0.14 -0.54 -0.04 0.00 -0.02 0.00 0.00 41.12 40.66 1k9a n ASP 325 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1k9a n ASN 326 N 0.13 -5.47 -4.73 -2.24 3.02 -0.46 -4.98 115.26 100.53 1k9a n ASN 326 Ca 0.06 0.17 -0.38 0.00 -0.03 0.00 0.00 54.58 54.40 1k9a n ASN 326 Cb 0.46 -4.57 -0.06 0.00 -0.61 0.00 0.00 39.78 35.00 1k9a n ASN 326 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1k9a s VAL 327 N -2.87 5.17 0.16 2.41 1.01 -1.26 -4.78 120.40 120.25 1k9a s VAL 327 Ca 0.00 0.96 -0.17 0.00 0.00 0.00 0.00 61.98 62.77 1k9a s VAL 327 Cb 0.00 -3.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.49 1k9a s VAL 327 CO 0.00 0.34 0.61 0.00 0.00 0.00 0.00 175.10 176.06 1k9a s ALA 328 N 0.51 3.52 -0.08 5.51 0.00 -1.26 -0.46 121.76 129.50 1k9a s ALA 328 Ca 0.26 -0.01 -0.04 0.00 0.00 0.00 0.00 51.96 52.18 1k9a s ALA 328 Cb -0.15 -2.64 0.04 0.00 0.00 0.00 0.00 23.12 20.37 1k9a s ALA 328 CO 0.11 0.40 0.18 0.15 0.00 0.00 0.00 175.76 176.60 1k9a s LYS 329 N -1.86 0.11 0.75 0.00 1.02 0.55 -4.67 119.74 115.64 1k9a s LYS 329 Ca 0.39 0.48 -0.13 0.00 0.02 0.00 0.00 55.97 56.73 1k9a s LYS 329 Cb -0.16 -0.17 0.05 0.00 -0.52 0.00 0.00 37.83 37.03 1k9a s LYS 329 CO 0.20 -0.21 1.14 0.08 -0.92 0.00 0.00 175.35 175.65 1k9a s VAL 330 N 1.54 2.75 0.00 3.17 1.01 0.23 -0.27 120.40 128.82 1k9a s VAL 330 Ca -0.06 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.23 1k9a s VAL 330 Cb -0.11 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1k9a s VAL 330 CO -0.07 -0.25 0.00 -0.24 0.00 0.00 0.00 175.10 174.54 1k9a n SER 331 N -3.09 0.00 -3.17 3.32 2.88 0.02 -1.68 113.62 111.90 1k9a n SER 331 Ca 0.11 -0.79 -0.12 0.00 -1.33 0.00 0.00 58.87 56.74 1k9a n SER 331 Cb 0.52 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.99 1k9a n SER 331 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1k9a n ASP 332 N -1.72 -7.05 -1.39 -3.46 9.92 -1.26 -4.81 116.55 106.78 1k9a n ASP 332 Ca 0.00 -0.02 0.10 0.00 -0.53 0.00 0.00 54.79 54.34 1k9a n ASP 332 Cb 0.00 -4.22 0.32 0.00 -0.64 0.00 0.00 41.12 36.58 1k9a n ASP 332 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1k9a n PHE 333 N -1.18 1.15 -0.26 1.24 3.01 -1.26 -4.49 117.46 115.66 1k9a n PHE 333 Ca -0.02 -0.51 0.06 0.00 1.01 0.00 0.00 57.45 57.99 1k9a n PHE 333 Cb 0.55 -0.11 0.17 0.00 -0.01 0.00 0.00 39.48 40.08 1k9a n PHE 333 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1k9a h GLY 334 N 4.41 0.89 1.79 1.37 0.00 -1.91 0.25 103.07 109.86 1k9a h GLY 334 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1k9a h GLY 334 CO 0.10 -0.30 -0.16 1.41 0.00 0.00 0.00 176.54 177.59 1k9a h LEU 335 N 0.11 0.00 -9.31 3.11 3.38 -1.81 -3.39 115.31 107.40 1k9a h LEU 335 Ca 0.43 -0.05 -0.54 0.00 0.09 0.00 0.00 57.88 57.81 1k9a h LEU 335 Cb 0.76 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.53 1k9a h LEU 335 CO -0.67 0.02 1.27 0.41 0.09 0.00 0.00 178.44 179.56 1k9a n THR 336 N -2.34 0.72 -3.67 0.22 -1.04 0.86 -4.77 114.28 104.26 1k9a n THR 336 Ca 0.05 -0.18 -0.13 0.00 -2.04 0.00 0.00 64.05 61.75 1k9a n THR 336 Cb 0.45 -2.34 -0.06 0.00 -1.82 0.00 0.00 70.33 66.55 1k9a n THR 336 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1k9a s LYS 337 N 4.69 0.91 0.99 -2.82 1.02 -0.93 -4.93 119.74 118.67 1k9a s LYS 337 Ca 0.91 -0.35 -0.12 0.00 0.02 0.00 0.00 55.97 56.43 1k9a s LYS 337 Cb -0.43 0.41 0.13 0.00 -0.52 0.00 0.00 37.83 37.42 1k9a s LYS 337 CO 0.42 -0.31 0.80 -1.91 -0.92 0.00 0.00 175.35 173.42 1k9a n GLU 338 N 0.55 -0.84 -4.75 1.68 2.13 -1.26 -1.31 120.64 116.84 1k9a n GLU 338 Ca -0.19 -0.19 -0.31 0.00 0.66 0.00 0.00 57.16 57.13 1k9a n GLU 338 Cb 0.60 -2.12 -0.13 0.00 0.27 0.00 0.00 31.44 30.05 1k9a n GLU 338 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1k9a s ALA 339 N -2.49 2.55 0.00 4.31 0.00 -1.16 -4.73 121.76 120.23 1k9a s ALA 339 Ca 0.63 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 51.43 1k9a s ALA 339 Cb -0.22 -0.74 0.00 0.00 0.00 0.00 0.00 23.12 22.17 1k9a s ALA 339 CO 0.63 0.56 0.00 -2.30 0.00 0.00 0.00 175.76 174.65 1k9a n PRO 349 N 1.73 0.00 0.00 0.00 -0.02 -1.26 -5.08 135.00 130.37 1k9a n PRO 349 Ca -0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 1k9a n PRO 349 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 1k9a n PRO 349 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1k9a n VAL 350 N 0.00 0.00 0.64 -1.45 0.31 -1.26 -4.87 118.33 111.70 1k9a n VAL 350 Ca 0.00 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.44 1k9a n VAL 350 Cb 0.00 -0.11 0.44 0.00 -0.91 0.00 0.00 33.84 33.26 1k9a n VAL 350 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1k9a n LYS 351 N -1.55 0.07 0.00 5.55 5.02 -1.26 -2.81 118.16 123.17 1k9a n LYS 351 Ca 0.00 0.20 0.11 0.00 -2.02 0.00 0.00 58.31 56.61 1k9a n LYS 351 Cb 0.00 -1.60 0.03 0.00 -0.02 0.00 0.00 35.03 33.43 1k9a n LYS 351 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1k9a n TRP 352 N -1.72 0.00 -3.56 2.13 8.01 -1.26 -4.96 117.44 116.07 1k9a n TRP 352 Ca 0.05 0.00 -0.32 0.00 -1.31 0.00 0.00 57.50 55.92 1k9a n TRP 352 Cb 0.26 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 29.51 1k9a n TRP 352 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.69 177.67 1k9a s THR 353 N -2.31 5.07 0.53 -0.99 2.01 -1.12 -3.71 115.64 115.12 1k9a s THR 353 Ca 0.21 0.24 -0.17 0.00 0.31 0.00 0.00 61.69 62.28 1k9a s THR 353 Cb 0.18 -3.62 -0.07 0.00 0.01 0.00 0.00 72.50 69.00 1k9a s THR 353 CO 0.48 0.01 1.01 0.00 -0.69 0.00 0.00 174.62 175.43 1k9a s ALA 354 N -1.70 2.95 0.12 7.40 0.00 -1.26 -4.89 121.76 124.37 1k9a s ALA 354 Ca 0.43 0.30 -0.32 0.00 0.00 0.00 0.00 51.96 52.36 1k9a s ALA 354 Cb -0.12 -3.17 -0.11 0.00 0.00 0.00 0.00 23.12 19.73 1k9a s ALA 354 CO 0.23 -0.39 1.57 -1.35 0.00 0.00 0.00 175.76 175.82 1k9a h PRO 355 N 0.90 -0.59 0.00 0.00 0.11 -1.97 -1.60 132.00 128.85 1k9a h PRO 355 Ca -0.47 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1k9a h PRO 355 Cb 1.20 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1k9a h PRO 355 CO 0.60 -0.39 0.00 1.05 -0.21 0.00 0.00 178.00 179.05 1k9a h GLU 356 N -0.61 0.00 0.16 1.05 -0.00 -1.91 -2.87 114.58 110.40 1k9a h GLU 356 Ca 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.39 1k9a h GLU 356 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.44 1k9a h GLU 356 CO -0.36 0.00 -0.08 0.00 -0.00 0.00 0.00 179.01 178.57 1k9a h ALA 357 N 2.03 -0.22 -0.14 1.06 0.00 -1.49 -2.77 119.26 117.74 1k9a h ALA 357 Ca 0.00 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.73 1k9a h ALA 357 Cb 0.28 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1k9a h ALA 357 CO 0.00 -0.30 -0.14 -0.07 0.00 0.00 0.00 179.25 178.73 1k9a h LEU 358 N -0.85 -0.45 0.00 0.00 3.38 -1.27 -3.06 115.31 113.06 1k9a h LEU 358 Ca -0.02 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1k9a h LEU 358 Cb 0.52 0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1k9a h LEU 358 CO 0.04 -0.19 0.00 0.54 0.09 0.00 0.00 178.44 178.92 1k9a n ARG 359 N -5.29 0.00 -1.89 1.13 1.74 -1.09 -4.38 116.66 106.88 1k9a n ARG 359 Ca -0.03 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.69 1k9a n ARG 359 Cb 0.21 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.62 1k9a n ARG 359 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1k9a s GLU 360 N 0.00 2.44 0.00 5.56 0.41 -1.04 -4.79 118.70 121.28 1k9a s GLU 360 Ca 0.00 0.78 -0.05 0.00 -0.41 0.00 0.00 54.97 55.29 1k9a s GLU 360 Cb 0.00 -4.49 -0.06 0.00 -1.78 0.00 0.00 34.13 27.80 1k9a s GLU 360 CO 0.00 -2.98 0.72 1.63 -0.49 0.00 0.00 175.26 174.14 1k9a n LYS 361 N 9.11 0.00 -3.69 1.61 5.02 -1.15 -4.20 118.16 124.86 1k9a n LYS 361 Ca 0.27 -0.36 -0.38 0.00 -2.02 0.00 0.00 58.31 55.82 1k9a n LYS 361 Cb 0.52 -1.64 -0.11 0.00 -0.02 0.00 0.00 35.03 33.79 1k9a n LYS 361 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1k9a s LYS 362 N 3.81 2.26 -0.43 1.97 -2.85 -1.26 -5.05 119.74 118.19 1k9a s LYS 362 Ca 0.11 -1.72 -0.19 0.00 -1.00 0.00 0.00 55.97 53.17 1k9a s LYS 362 Cb 0.02 -3.69 0.02 0.00 -2.06 0.00 0.00 37.83 32.13 1k9a s LYS 362 CO 0.06 -1.06 0.54 -0.06 0.10 0.00 0.00 175.35 174.93 1k9a s PHE 363 N 1.26 3.12 0.48 1.78 0.40 -1.26 -4.49 117.98 119.27 1k9a s PHE 363 Ca 0.06 -0.21 0.06 0.00 -0.60 0.00 0.00 56.93 56.24 1k9a s PHE 363 Cb -0.24 -3.13 0.00 0.00 0.51 0.00 0.00 43.02 40.16 1k9a s PHE 363 CO -0.02 -0.79 0.33 -1.54 0.70 0.00 0.00 175.22 173.90 1k9a s SER 364 N 1.91 4.65 0.58 1.36 1.04 -1.26 -4.88 113.70 117.10 1k9a s SER 364 Ca 0.18 -1.11 0.30 0.00 0.48 0.00 0.00 55.95 55.79 1k9a s SER 364 Cb -0.15 -0.01 1.77 0.00 0.10 0.00 0.00 66.02 67.72 1k9a s SER 364 CO 0.16 -0.86 2.22 0.74 0.98 0.00 0.00 173.24 176.48 1k9a h THR 365 N 1.00 0.50 -0.38 2.02 2.02 -1.96 -1.70 112.91 114.41 1k9a h THR 365 Ca -0.39 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 66.63 1k9a h THR 365 Cb 1.28 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 68.76 1k9a h THR 365 CO 0.61 0.03 0.17 0.11 0.37 0.00 0.00 175.52 176.81 1k9a h LYS 366 N 0.00 0.55 -0.82 6.66 1.79 -1.93 -1.62 116.57 121.20 1k9a h LYS 366 Ca -0.00 -0.09 0.16 0.00 -2.18 0.00 0.00 60.65 58.54 1k9a h LYS 366 Cb 0.08 -0.10 -0.06 0.00 -1.58 0.00 0.00 32.23 30.58 1k9a h LYS 366 CO 0.00 0.51 0.54 0.66 -1.08 0.00 0.00 179.45 180.09 1k9a h SER 367 N 0.47 0.46 0.32 0.86 4.64 -1.65 0.60 113.55 119.25 1k9a h SER 367 Ca 0.13 0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.35 1k9a h SER 367 Cb 0.15 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1k9a h SER 367 CO -0.01 0.23 -0.53 0.44 -0.87 0.00 0.00 176.83 176.09 1k9a h ASP 368 N 0.49 0.25 -0.39 4.97 5.19 -1.33 -2.19 116.42 123.42 1k9a h ASP 368 Ca 0.41 -0.13 -0.01 0.00 -0.62 0.00 0.00 57.03 56.68 1k9a h ASP 368 Cb 0.89 -0.07 -0.02 0.00 0.18 0.00 0.00 39.33 40.31 1k9a h ASP 368 CO -0.16 0.74 0.19 0.58 -3.12 0.00 0.00 179.24 177.47 1k9a h VAL 369 N 0.18 1.17 -0.40 -1.35 2.07 0.94 0.36 116.25 119.22 1k9a h VAL 369 Ca 0.00 -0.48 0.05 0.00 0.82 0.00 0.00 66.70 67.10 1k9a h VAL 369 Cb 0.99 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 1k9a h VAL 369 CO 0.08 0.18 0.13 -0.25 0.02 0.00 0.00 177.57 177.73 1k9a h TRP 370 N 0.48 0.23 -0.86 1.57 2.91 -0.94 -0.45 115.95 118.90 1k9a h TRP 370 Ca 0.13 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.15 1k9a h TRP 370 Cb 0.12 -0.04 -0.04 0.00 -0.51 0.00 0.00 29.16 28.68 1k9a h TRP 370 CO -0.01 0.08 0.46 0.77 -1.03 0.00 0.00 178.44 178.71 1k9a h SER 371 N 0.28 1.08 -4.22 2.65 0.02 -0.89 -3.28 113.55 109.20 1k9a h SER 371 Ca 0.18 -0.10 -0.51 0.00 -0.84 0.00 0.00 61.79 60.53 1k9a h SER 371 Cb 0.18 -0.27 0.10 0.00 0.14 0.00 0.00 62.40 62.54 1k9a h SER 371 CO -0.20 0.87 0.37 0.12 -1.14 0.00 0.00 176.83 176.85 1k9a s PHE 372 N -5.78 2.72 0.00 3.45 5.36 0.12 -2.00 117.98 121.85 1k9a s PHE 372 Ca -0.12 1.54 0.00 0.00 -0.96 0.00 0.00 56.93 57.38 1k9a s PHE 372 Cb 0.17 -3.11 0.00 0.00 -0.34 0.00 0.00 43.02 39.74 1k9a s PHE 372 CO 0.82 -1.56 0.00 0.41 -1.46 0.00 0.00 175.22 173.44 1k9a n GLY 373 N -0.74 2.27 0.35 13.12 0.00 -1.26 -4.47 105.19 114.46 1k9a n GLY 373 Ca 0.10 -0.44 0.04 0.00 0.00 0.00 0.00 46.02 45.72 1k9a n GLY 373 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1k9a h ILE 374 N 0.00 1.10 -0.07 -0.61 2.04 -1.56 1.60 117.51 120.00 1k9a h ILE 374 Ca 0.00 -0.30 -0.13 0.00 1.00 0.00 0.00 64.86 65.43 1k9a h ILE 374 Cb 0.00 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 1k9a h ILE 374 CO 0.00 0.16 -0.53 0.25 0.00 0.00 0.00 178.15 178.03 1k9a h LEU 375 N 0.88 0.23 -0.54 1.44 6.46 -1.62 -1.96 115.31 120.19 1k9a h LEU 375 Ca 0.30 -0.12 -0.13 0.00 -0.12 0.00 0.00 57.88 57.81 1k9a h LEU 375 Cb 0.08 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 1k9a h LEU 375 CO -0.09 0.72 -0.26 -0.07 -0.62 0.00 0.00 178.44 178.12 1k9a h LEU 376 N 0.16 0.93 -0.49 2.25 3.38 -0.15 -0.53 115.31 120.86 1k9a h LEU 376 Ca 0.00 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.63 1k9a h LEU 376 Cb 0.99 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 1k9a h LEU 376 CO 0.08 1.13 0.30 -0.25 0.09 0.00 0.00 178.44 179.79 1k9a h TRP 377 N 0.77 0.56 -0.22 1.13 7.01 0.22 0.08 115.95 125.50 1k9a h TRP 377 Ca 0.09 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.14 1k9a h TRP 377 Cb 0.82 -0.18 -0.03 0.00 -2.10 0.00 0.00 29.16 27.67 1k9a h TRP 377 CO 0.05 0.33 0.06 0.93 -2.79 0.00 0.00 178.44 177.02 1k9a h GLU 378 N 0.60 0.15 -0.82 2.65 5.08 -0.92 0.66 114.58 121.98 1k9a h GLU 378 Ca 0.19 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.59 1k9a h GLU 378 Cb -0.01 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.16 1k9a h GLU 378 CO -0.08 0.10 0.51 0.82 -1.00 0.00 0.00 179.01 179.36 1k9a h ILE 379 N 0.15 1.09 -0.01 3.13 2.04 -0.36 -0.50 117.51 123.04 1k9a h ILE 379 Ca 0.10 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1k9a h ILE 379 Cb 0.09 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.19 1k9a h ILE 379 CO -0.12 0.18 -0.14 -1.22 0.00 0.00 0.00 178.15 176.84 1k9a n TYR 380 N -4.61 0.00 -0.03 1.37 4.02 -0.05 -3.37 117.16 114.49 1k9a n TYR 380 Ca 0.10 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 58.07 1k9a n TYR 380 Cb 0.12 -0.06 0.18 0.00 -0.02 0.00 0.00 39.34 39.56 1k9a n TYR 380 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1k9a n SER 381 N -0.19 3.08 -3.95 7.72 2.88 0.23 -4.41 113.62 118.97 1k9a n SER 381 Ca 0.15 -1.92 -0.28 0.00 -1.33 0.00 0.00 58.87 55.50 1k9a n SER 381 Cb 0.36 -0.25 -0.00 0.00 -0.75 0.00 0.00 64.21 63.57 1k9a n SER 381 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1k9a n PHE 382 N 0.93 -1.84 -0.03 0.66 3.01 -0.28 -1.98 117.46 117.93 1k9a n PHE 382 Ca 0.15 0.80 0.00 0.00 1.01 0.00 0.00 57.45 59.41 1k9a n PHE 382 Cb 0.48 -3.76 0.00 0.00 -0.01 0.00 0.00 39.48 36.19 1k9a n PHE 382 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1k9a n GLY 383 N -1.74 0.82 3.62 1.37 0.00 -0.74 -4.11 105.19 104.41 1k9a n GLY 383 Ca -0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 1k9a n GLY 383 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1k9a n ARG 384 N -2.00 1.54 -2.67 1.61 0.63 -0.84 -4.88 116.66 110.05 1k9a n ARG 384 Ca 0.00 0.54 -0.43 0.00 -0.92 0.00 0.00 57.85 57.05 1k9a n ARG 384 Cb 0.00 -2.00 -0.02 0.00 0.45 0.00 0.00 32.46 30.89 1k9a n ARG 384 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1k9a s VAL 385 N -1.12 4.73 0.25 5.15 1.01 -1.26 -4.73 120.40 124.43 1k9a s VAL 385 Ca 0.59 2.03 -0.27 0.00 0.00 0.00 0.00 61.98 64.33 1k9a s VAL 385 Cb -0.64 -4.31 -0.16 0.00 0.00 0.00 0.00 36.38 31.27 1k9a s VAL 385 CO 0.60 -0.08 0.50 -2.65 0.00 0.00 0.00 175.10 173.46 1k9a n PRO 386 N 5.62 0.14 -2.96 2.72 -0.02 -1.26 -3.53 135.00 135.70 1k9a n PRO 386 Ca 0.10 0.05 -0.02 0.00 -2.02 0.00 0.00 63.50 61.61 1k9a n PRO 386 Cb 0.47 -1.09 0.01 0.00 -0.02 0.00 0.00 33.50 32.87 1k9a n PRO 386 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1k9a n TYR 387 N -0.17 -2.66 -0.17 6.00 4.02 -1.26 -4.94 117.16 117.97 1k9a n TYR 387 Ca 0.16 1.00 -0.08 0.00 -0.01 0.00 0.00 57.90 58.97 1k9a n TYR 387 Cb 0.29 -3.92 -0.03 0.00 -0.02 0.00 0.00 39.34 35.65 1k9a n TYR 387 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1k9a h PRO 388 N 0.17 -0.24 -2.12 -0.72 0.11 -1.98 -3.23 132.00 124.00 1k9a h PRO 388 Ca -0.10 0.02 -0.58 0.00 0.11 0.00 0.00 66.00 65.44 1k9a h PRO 388 Cb 1.05 0.05 -0.41 0.00 0.11 0.00 0.00 31.00 31.81 1k9a h PRO 388 CO 0.30 -0.16 -0.81 0.54 -0.21 0.00 0.00 178.00 177.66 1k9a n ARG 389 N -5.42 1.74 -3.64 1.05 5.12 -1.26 -5.02 116.66 109.24 1k9a n ARG 389 Ca 0.02 -4.05 -0.27 0.00 -1.93 0.00 0.00 57.85 51.62 1k9a n ARG 389 Cb 0.35 -1.81 -0.17 0.00 -1.16 0.00 0.00 32.46 29.67 1k9a n ARG 389 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1k9a s ILE 390 N -1.91 0.06 -0.25 0.55 1.01 -1.22 -5.09 121.20 114.35 1k9a s ILE 390 Ca 0.38 -0.29 -0.14 0.00 0.00 0.00 0.00 60.65 60.60 1k9a s ILE 390 Cb 0.16 -0.70 -0.07 0.00 0.01 0.00 0.00 42.46 41.85 1k9a s ILE 390 CO -0.05 -0.29 0.84 -2.65 0.00 0.00 0.00 174.94 172.79 1k9a n PRO 391 N 5.22 0.00 0.00 2.79 -0.02 -1.26 -4.70 135.00 137.03 1k9a n PRO 391 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1k9a n PRO 391 Cb 0.48 -0.54 0.00 0.00 -0.02 0.00 0.00 33.50 33.43 1k9a n PRO 391 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1k9a n LEU 392 N 3.11 0.00 -1.00 2.45 -0.00 -1.26 -1.17 117.00 119.13 1k9a n LEU 392 Ca 0.21 0.00 0.01 0.00 -0.00 0.00 0.00 56.01 56.24 1k9a n LEU 392 Cb -0.00 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.42 1k9a n LEU 392 CO 0.32 0.00 0.17 1.17 -0.00 0.00 0.00 177.39 179.05 1k9a n LYS 393 N -0.52 0.00 -0.15 1.47 4.81 -1.26 -4.77 118.16 117.74 1k9a n LYS 393 Ca 0.00 -1.42 0.00 0.00 -0.87 0.00 0.00 58.31 56.02 1k9a n LYS 393 Cb 0.00 -0.18 0.00 0.00 0.02 0.00 0.00 35.03 34.87 1k9a n LYS 393 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1k9a n ASP 394 N 0.23 0.00 -0.13 3.14 5.75 -0.32 -4.86 116.55 120.37 1k9a n ASP 394 Ca 0.01 -1.28 -0.10 0.00 -0.01 0.00 0.00 54.79 53.41 1k9a n ASP 394 Cb 0.90 -0.06 -0.02 0.00 -1.03 0.00 0.00 41.12 40.92 1k9a n ASP 394 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1k9a h VAL 395 N 4.16 1.25 -0.52 2.12 2.07 -1.86 -3.05 116.25 120.42 1k9a h VAL 395 Ca 0.00 -0.92 0.07 0.00 0.82 0.00 0.00 66.70 66.68 1k9a h VAL 395 Cb 1.11 1.11 -0.06 0.00 -1.52 0.00 0.00 31.29 31.93 1k9a h VAL 395 CO 0.00 0.31 0.19 0.58 0.02 0.00 0.00 177.57 178.67 1k9a h VAL 396 N 0.48 0.83 0.57 2.57 2.07 -1.92 -1.93 116.25 118.91 1k9a h VAL 396 Ca 0.11 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 1k9a h VAL 396 Cb 0.41 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1k9a h VAL 396 CO 0.01 0.07 -0.46 -0.65 0.02 0.00 0.00 177.57 176.56 1k9a h PRO 397 N 0.37 -0.97 -0.40 1.57 0.11 -1.90 -1.31 132.00 129.48 1k9a h PRO 397 Ca 0.25 0.07 0.04 0.00 0.11 0.00 0.00 66.00 66.47 1k9a h PRO 397 Cb 0.27 0.22 -0.04 0.00 0.11 0.00 0.00 31.00 31.56 1k9a h PRO 397 CO -0.25 -0.64 0.16 0.00 -0.21 0.00 0.00 178.00 177.05 1k9a h ARG 398 N -1.00 0.32 -0.46 1.05 3.08 -1.49 -1.53 114.38 114.36 1k9a h ARG 398 Ca -0.07 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 59.99 1k9a h ARG 398 Cb 0.84 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.78 1k9a h ARG 398 CO 0.00 0.21 0.24 0.28 -1.07 0.00 0.00 179.97 179.63 1k9a h VAL 399 N 0.33 0.99 0.00 2.04 2.07 -1.34 0.37 116.25 120.71 1k9a h VAL 399 Ca 0.18 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1k9a h VAL 399 Cb 0.14 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1k9a h VAL 399 CO -0.17 0.09 0.00 -0.33 0.02 0.00 0.00 177.57 177.18 1k9a h GLU 400 N 0.48 0.00 0.00 1.57 5.08 -0.83 0.21 114.58 121.09 1k9a h GLU 400 Ca 0.19 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.43 1k9a h GLU 400 Cb 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1k9a h GLU 400 CO -0.13 0.00 -1.08 0.87 -1.00 0.00 0.00 179.01 177.67 1k9a h LYS 401 N 0.00 0.00 0.00 2.33 1.57 0.56 -3.48 116.57 117.56 1k9a h LYS 401 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1k9a h LYS 401 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1k9a h LYS 401 CO 0.00 0.29 0.00 0.41 -0.57 0.00 0.00 179.45 179.58 1k9a n GLY 402 N 1.31 1.00 3.73 3.86 0.00 0.93 -5.08 105.19 110.94 1k9a n GLY 402 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1k9a n GLY 402 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1k9a s TYR 403 N -1.49 3.05 -0.03 1.61 5.04 0.35 -4.93 117.35 120.95 1k9a s TYR 403 Ca 0.00 0.74 0.04 0.00 -2.44 0.00 0.00 57.07 55.42 1k9a s TYR 403 Cb 0.00 -3.89 -0.01 0.00 0.35 0.00 0.00 41.96 38.41 1k9a s TYR 403 CO 0.00 -3.19 -0.15 0.15 -1.34 0.00 0.00 175.55 171.01 1k9a s LYS 404 N 0.73 1.40 0.28 4.97 1.02 -1.26 -4.51 119.74 122.38 1k9a s LYS 404 Ca 0.67 -0.54 -0.05 0.00 0.02 0.00 0.00 55.97 56.08 1k9a s LYS 404 Cb -0.43 -1.29 0.07 0.00 -0.52 0.00 0.00 37.83 35.66 1k9a s LYS 404 CO 0.34 0.27 0.19 -1.33 -0.92 0.00 0.00 175.35 173.90 1k9a n MET 405 N 2.95 -2.29 -4.33 1.68 2.81 -1.26 -5.03 117.12 111.65 1k9a n MET 405 Ca -0.16 -0.31 -0.28 0.00 -1.81 0.00 0.00 57.70 55.14 1k9a n MET 405 Cb 0.54 -0.37 -0.11 0.00 -0.71 0.00 0.00 33.22 32.57 1k9a n MET 405 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1k9a s ASP 406 N -2.19 3.86 0.13 7.83 1.01 -1.26 -5.08 116.67 120.97 1k9a s ASP 406 Ca 0.14 -0.64 -0.31 0.00 0.71 0.00 0.00 52.55 52.44 1k9a s ASP 406 Cb -0.02 -0.51 -0.10 0.00 1.01 0.00 0.00 42.92 43.29 1k9a s ASP 406 CO 0.11 0.14 1.80 0.00 0.21 0.00 0.00 175.17 177.44 1k9a s ALA 407 N -1.42 3.78 1.15 5.23 0.00 -1.26 -4.96 121.76 124.28 1k9a s ALA 407 Ca 0.20 1.45 -0.17 0.00 0.00 0.00 0.00 51.96 53.44 1k9a s ALA 407 Cb -0.09 -3.75 0.20 0.00 0.00 0.00 0.00 23.12 19.48 1k9a s ALA 407 CO 0.11 -1.18 0.38 -2.30 0.00 0.00 0.00 175.76 172.78 1k9a n PRO 408 N 5.45 -2.63 -2.32 0.00 -0.02 -1.26 -4.87 135.00 129.35 1k9a n PRO 408 Ca 0.17 -0.77 -0.41 0.00 -2.02 0.00 0.00 63.50 60.48 1k9a n PRO 408 Cb 0.38 -1.68 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 1k9a n PRO 408 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1k9a s ASP 409 N -2.18 7.05 -0.92 2.55 1.01 -1.26 -2.97 116.67 119.96 1k9a s ASP 409 Ca 0.51 2.42 0.00 0.00 0.71 0.00 0.00 52.55 56.19 1k9a s ASP 409 Cb -0.10 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.19 1k9a s ASP 409 CO 0.50 -0.33 0.00 0.61 0.21 0.00 0.00 175.17 176.17 1k9a n GLY 410 N 1.25 0.87 3.65 0.21 0.00 -1.26 -4.94 105.19 104.97 1k9a n GLY 410 Ca 0.00 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 1k9a n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k9a n PRO 412 N 6.87 2.29 -0.32 0.00 -0.02 -1.26 -4.84 135.00 137.72 1k9a n PRO 412 Ca 0.15 0.83 0.08 0.00 -2.02 0.00 0.00 63.50 62.54 1k9a n PRO 412 Cb 0.45 -2.63 0.25 0.00 -0.02 0.00 0.00 33.50 31.54 1k9a n PRO 412 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1k9a h PRO 413 N 6.82 0.68 -0.66 0.52 0.11 -1.93 -1.26 132.00 136.27 1k9a h PRO 413 Ca -0.45 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.67 1k9a h PRO 413 Cb 1.25 -0.15 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 1k9a h PRO 413 CO 0.91 0.45 0.36 0.00 -0.21 0.00 0.00 178.00 179.51 1k9a h ALA 414 N 1.58 0.88 -0.53 -0.75 0.00 -1.88 0.16 119.26 118.70 1k9a h ALA 414 Ca 0.49 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.35 1k9a h ALA 414 Cb 0.69 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1k9a h ALA 414 CO -0.36 0.03 0.03 0.28 0.00 0.00 0.00 179.25 179.24 1k9a h VAL 415 N 0.67 1.25 -0.12 0.00 2.07 -1.58 -2.23 116.25 116.31 1k9a h VAL 415 Ca 0.30 -1.02 -0.08 0.00 0.82 0.00 0.00 66.70 66.71 1k9a h VAL 415 Cb 0.19 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1k9a h VAL 415 CO -0.19 0.37 -0.31 0.22 0.02 0.00 0.00 177.57 177.68 1k9a h TYR 416 N 0.83 0.26 -0.11 1.57 3.20 -0.38 -1.68 116.97 120.65 1k9a h TYR 416 Ca 0.16 -0.05 -0.07 0.00 3.14 0.00 0.00 58.73 61.91 1k9a h TYR 416 Cb 0.45 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 1k9a h TYR 416 CO 0.03 0.52 -0.24 -0.44 -1.64 0.00 0.00 178.16 176.39 1k9a h ASP 417 N 0.20 0.19 0.44 -2.11 3.32 -0.15 -1.98 116.42 116.34 1k9a h ASP 417 Ca 0.03 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 1k9a h ASP 417 Cb 0.65 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1k9a h ASP 417 CO 0.05 0.44 -0.21 0.58 -1.72 0.00 0.00 179.24 178.37 1k9a h VAL 418 N 0.18 0.55 -0.55 -1.35 2.07 -0.95 -0.20 116.25 116.00 1k9a h VAL 418 Ca 0.03 -0.25 0.09 0.00 0.82 0.00 0.00 66.70 67.39 1k9a h VAL 418 Cb 0.52 0.66 -0.10 0.00 -1.52 0.00 0.00 31.29 30.85 1k9a h VAL 418 CO 0.04 0.04 -0.40 0.24 0.02 0.00 0.00 177.57 177.51 1k9a h MET 419 N -0.74 -0.22 -0.33 1.57 2.86 -1.16 0.39 114.93 117.30 1k9a h MET 419 Ca -0.06 0.02 0.08 0.00 -2.06 0.00 0.00 59.70 57.67 1k9a h MET 419 Cb 0.53 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 1k9a h MET 419 CO 0.10 -0.15 0.23 0.87 1.06 0.00 0.00 176.91 179.02 1k9a h LYS 420 N -0.23 0.08 -0.03 1.72 1.57 -1.23 0.43 116.57 118.88 1k9a h LYS 420 Ca 0.19 -0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.85 1k9a h LYS 420 Cb 0.56 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 1k9a h LYS 420 CO -0.66 0.05 -0.51 -0.97 -0.57 0.00 0.00 179.45 176.80 1k9a h ASN 421 N 0.09 0.09 1.55 0.86 -1.24 0.16 -2.46 115.58 114.62 1k9a h ASN 421 Ca 0.15 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.12 1k9a h ASN 421 Cb 0.50 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.52 1k9a h ASN 421 CO -0.01 0.58 0.00 0.00 -1.29 0.00 0.00 177.43 176.71 1k9a n TRP 423 N -2.91 2.92 -3.44 0.00 8.01 -0.93 -4.01 117.44 117.08 1k9a n TRP 423 Ca 0.03 -2.38 -0.42 0.00 -1.31 0.00 0.00 57.50 53.42 1k9a n TRP 423 Cb 0.43 -1.19 -0.10 0.00 -2.01 0.00 0.00 31.31 28.44 1k9a n TRP 423 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.69 175.67 1k9a s HIS 424 N -4.13 3.22 0.28 -5.99 3.76 -1.26 -4.96 115.29 106.21 1k9a s HIS 424 Ca 0.49 -0.43 -0.02 0.00 -0.15 0.00 0.00 55.06 54.95 1k9a s HIS 424 Cb 0.38 -2.64 0.60 0.00 1.11 0.00 0.00 32.58 32.03 1k9a s HIS 424 CO -0.34 -0.56 1.45 1.28 -0.85 0.00 0.00 174.74 175.71 1k9a n LEU 425 N 5.25 -0.19 -4.55 0.89 7.99 -1.26 -3.69 117.00 121.44 1k9a n LEU 425 Ca -0.10 1.58 -0.39 0.00 -0.01 0.00 0.00 56.01 57.08 1k9a n LEU 425 Cb 0.48 -0.54 -0.03 0.00 -0.11 0.00 0.00 43.42 43.22 1k9a n LEU 425 CO 0.41 -1.57 1.41 -0.62 -1.51 0.00 0.00 177.39 175.51 1k9a s ASP 426 N -5.09 5.68 0.03 -1.43 2.15 -1.26 -4.90 116.67 111.85 1k9a s ASP 426 Ca -0.13 -0.11 -0.07 0.00 0.43 0.00 0.00 52.55 52.68 1k9a s ASP 426 Cb 0.26 -2.55 -0.02 0.00 -0.30 0.00 0.00 42.92 40.32 1k9a s ASP 426 CO 0.72 -2.14 0.63 0.00 -0.17 0.00 0.00 175.17 174.21 1k9a n ALA 427 N 11.26 -0.14 -0.37 3.66 0.00 -1.24 0.02 120.51 133.70 1k9a n ALA 427 Ca 0.15 0.19 -0.01 0.00 0.00 0.00 0.00 53.44 53.76 1k9a n ALA 427 Cb 0.51 0.12 0.04 0.00 0.00 0.00 0.00 19.45 20.11 1k9a n ALA 427 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k9a h ALA 428 N -0.18 0.14 0.00 0.00 0.00 -1.90 0.38 119.26 117.69 1k9a h ALA 428 Ca 0.03 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1k9a h ALA 428 Cb 0.09 1.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1k9a h ALA 428 CO -0.20 -0.63 0.16 2.41 0.00 0.00 0.00 179.25 180.99 1k9a n THR 429 N -5.47 0.91 -2.64 0.00 -1.04 0.10 -4.63 114.28 101.51 1k9a n THR 429 Ca 0.10 0.71 -0.35 0.00 -2.04 0.00 0.00 64.05 62.46 1k9a n THR 429 Cb 0.40 -1.71 -0.05 0.00 -1.82 0.00 0.00 70.33 67.15 1k9a n THR 429 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1k9a s ARG 430 N -3.32 4.10 1.03 -2.82 0.52 0.13 -4.94 118.95 113.65 1k9a s ARG 430 Ca -0.02 1.35 -0.13 0.00 -0.52 0.00 0.00 55.73 56.41 1k9a s ARG 430 Cb 0.04 -2.33 0.20 0.00 0.52 0.00 0.00 34.95 33.39 1k9a s ARG 430 CO 0.13 -0.17 1.09 -1.25 0.02 0.00 0.00 175.30 175.12 1k9a s PRO 431 N -2.87 0.21 0.39 3.54 0.04 -1.26 -5.05 135.00 130.00 1k9a s PRO 431 Ca 0.61 0.50 0.03 0.00 0.04 0.00 0.00 61.00 62.18 1k9a s PRO 431 Cb -0.17 -1.71 -0.01 0.00 0.04 0.00 0.00 34.50 32.65 1k9a s PRO 431 CO 0.21 -2.88 0.57 0.95 0.04 0.00 0.00 177.00 175.90 1k9a s THR 432 N -2.93 4.13 0.38 1.26 -4.23 -1.26 -4.91 115.64 108.08 1k9a s THR 432 Ca 0.66 -0.71 0.31 0.00 -1.18 0.00 0.00 61.69 60.77 1k9a s THR 432 Cb -0.19 -3.49 0.33 0.00 1.34 0.00 0.00 72.50 70.50 1k9a s THR 432 CO 0.58 -0.27 2.09 -0.26 -0.54 0.00 0.00 174.62 176.22 1k9a h PHE 433 N 0.64 0.00 -0.26 3.99 -1.00 -1.94 -1.55 116.94 116.82 1k9a h PHE 433 Ca -0.46 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.24 1k9a h PHE 433 Cb 1.25 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.81 1k9a h PHE 433 CO 0.44 0.09 -0.13 1.25 -1.61 0.00 0.00 178.31 178.35 1k9a h LEU 434 N 0.00 0.55 -0.59 1.54 6.46 -1.93 0.47 115.31 121.81 1k9a h LEU 434 Ca -0.00 -0.41 0.02 0.00 -0.12 0.00 0.00 57.88 57.37 1k9a h LEU 434 Cb 0.34 -0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 40.08 1k9a h LEU 434 CO 0.01 0.84 0.37 1.56 -0.62 0.00 0.00 178.44 180.60 1k9a h GLN 435 N 0.27 0.71 0.02 1.25 4.20 -1.70 -1.13 115.11 118.73 1k9a h GLN 435 Ca 0.06 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.74 1k9a h GLN 435 Cb 0.63 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1k9a h GLN 435 CO 0.04 0.47 -0.08 -0.07 -0.67 0.00 0.00 178.83 178.52 1k9a h LEU 436 N 0.73 -0.22 -0.65 1.46 3.38 -1.11 0.14 115.31 119.05 1k9a h LEU 436 Ca 0.23 0.03 0.13 0.00 0.09 0.00 0.00 57.88 58.36 1k9a h LEU 436 Cb -0.01 0.09 -0.09 0.00 0.09 0.00 0.00 40.66 40.74 1k9a h LEU 436 CO -0.08 -0.12 0.15 -0.09 0.09 0.00 0.00 178.44 178.39 1k9a h ARG 437 N -0.15 0.27 -0.46 1.13 2.43 -0.43 0.36 114.38 117.53 1k9a h ARG 437 Ca 0.02 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1k9a h ARG 437 Cb 0.17 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 1k9a h ARG 437 CO -0.06 0.18 0.16 0.93 -1.51 0.00 0.00 179.97 179.66 1k9a h GLU 438 N 0.27 0.70 -0.74 0.20 4.39 -0.73 -1.53 114.58 117.14 1k9a h GLU 438 Ca 0.35 -0.14 0.04 0.00 0.34 0.00 0.00 59.36 59.94 1k9a h GLU 438 Cb 0.54 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.04 1k9a h GLU 438 CO -0.43 0.66 0.49 1.96 -1.16 0.00 0.00 179.01 180.52 1k9a h GLN 439 N 0.60 0.87 0.08 2.33 4.20 0.80 -1.61 115.11 122.38 1k9a h GLN 439 Ca 0.15 -0.05 -0.26 0.00 0.06 0.00 0.00 58.65 58.54 1k9a h GLN 439 Cb 0.23 -0.20 0.01 0.00 0.30 0.00 0.00 27.48 27.83 1k9a h GLN 439 CO -0.01 0.57 -1.14 -0.07 -0.67 0.00 0.00 178.83 177.52 1k9a h LEU 440 N 0.90 0.58 -0.73 1.46 3.38 -0.67 -2.95 115.31 117.27 1k9a h LEU 440 Ca 0.30 -0.54 -0.13 0.00 0.09 0.00 0.00 57.88 57.60 1k9a h LEU 440 Cb 0.07 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1k9a h LEU 440 CO -0.09 1.38 -0.38 -0.33 0.09 0.00 0.00 178.44 179.11 1k9a h GLU 441 N 0.18 0.52 -0.24 1.13 5.08 -1.07 0.78 114.58 120.96 1k9a h GLU 441 Ca -0.13 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 58.01 1k9a h GLU 441 Cb 1.81 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.03 1k9a h GLU 441 CO 0.20 0.82 0.04 1.25 -1.00 0.00 0.00 179.01 180.33 1k9a h HIS 442 N 0.43 0.07 -0.29 4.33 2.76 -1.34 0.50 115.15 121.61 1k9a h HIS 442 Ca 0.04 0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.25 1k9a h HIS 442 Cb 0.87 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.80 1k9a h HIS 442 CO 0.03 0.02 0.12 0.82 -1.30 0.00 0.00 177.93 177.62 1k9a h ILE 443 N 0.14 0.95 -0.72 6.26 2.04 -1.26 -2.18 117.51 122.74 1k9a h ILE 443 Ca 0.11 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 1k9a h ILE 443 Cb 0.11 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 1k9a h ILE 443 CO -0.15 0.05 0.43 -0.09 0.00 0.00 0.00 178.15 178.39 1k9a h ARG 444 N 0.27 0.99 -0.47 2.37 2.43 0.07 0.41 114.38 120.44 1k9a h ARG 444 Ca 0.13 -0.10 -0.05 0.00 -0.81 0.00 0.00 59.98 59.15 1k9a h ARG 444 Cb 0.07 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 1k9a h ARG 444 CO -0.11 0.71 0.09 1.15 -1.51 0.00 0.00 179.97 180.30 1k9a h THR 445 N 0.99 1.24 -0.01 0.20 2.02 0.22 -3.04 112.91 114.53 1k9a h THR 445 Ca 0.26 -0.87 0.00 0.00 0.77 0.00 0.00 66.41 66.57 1k9a h THR 445 Cb -0.02 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1k9a h THR 445 CO -0.05 0.31 -0.24 1.41 0.37 0.00 0.00 175.52 177.32 1k9a n HIS 446 N -4.47 0.00 -2.70 3.16 8.25 -0.84 -4.95 115.22 113.67 1k9a n HIS 446 Ca 0.01 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.30 1k9a n HIS 446 Cb 0.23 -0.08 0.02 0.00 1.12 0.00 0.00 29.99 31.28 1k9a n HIS 446 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1k9a n GLU 447 N -0.35 -3.12 0.00 -0.41 1.02 0.13 -4.84 120.64 113.07 1k9a n GLU 447 Ca 0.13 0.72 0.02 0.00 -0.02 0.00 0.00 57.16 58.01 1k9a n GLU 447 Cb 0.38 -5.14 0.11 0.00 -0.02 0.00 0.00 31.44 26.76 1k9a n GLU 447 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1k9a n LEU 448 N -2.93 0.00 -0.04 -4.62 4.77 -0.39 -1.48 117.00 112.31 1k9a n LEU 448 Ca -0.12 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.84 1k9a n LEU 448 Cb 0.61 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.62 1k9a n LEU 448 CO 0.33 0.00 -0.77 0.00 -1.33 0.00 0.00 177.39 175.62 1k9a n HIS 449 N -0.74 0.00 1.88 -1.77 1.44 -1.26 -4.62 115.22 110.15 1k9a n HIS 449 Ca 0.03 0.00 0.16 0.00 -2.01 0.00 0.00 57.72 55.89 1k9a n HIS 449 Cb 0.01 -0.42 0.84 0.00 0.12 0.00 0.00 29.99 30.55 1k9a n HIS 449 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81