#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h9a s SER 2 N 0.00 7.04 0.12 4.52 0.15 -1.26 -4.90 113.70 119.36 1h9a s SER 2 Ca 0.00 2.11 -0.30 0.00 0.70 0.00 0.00 55.95 58.46 1h9a s SER 2 Cb 0.00 -2.60 -0.06 0.00 -1.71 0.00 0.00 66.02 61.65 1h9a s SER 2 CO 0.00 -0.30 0.97 -0.70 1.20 0.00 0.00 173.24 174.41 1h9a s GLU 3 N -1.99 4.70 -0.31 5.44 2.12 -1.26 -4.65 118.70 122.75 1h9a s GLU 3 Ca 0.51 1.47 -0.13 0.00 0.36 0.00 0.00 54.97 57.18 1h9a s GLU 3 Cb -0.26 -3.37 -0.03 0.00 0.26 0.00 0.00 34.13 30.73 1h9a s GLU 3 CO 0.33 0.21 0.28 0.42 -0.54 0.00 0.00 175.26 175.96 1h9a s ILE 4 N -0.04 5.25 -0.41 -3.70 1.01 0.21 -5.05 121.20 118.46 1h9a s ILE 4 Ca 0.47 0.10 -0.16 0.00 0.00 0.00 0.00 60.65 61.05 1h9a s ILE 4 Cb -0.24 -3.68 0.02 0.00 0.01 0.00 0.00 42.46 38.57 1h9a s ILE 4 CO 0.30 0.08 0.38 -0.54 0.00 0.00 0.00 174.94 175.17 1h9a s LYS 5 N 1.86 3.06 0.07 2.79 1.02 -1.26 -4.64 119.74 122.65 1h9a s LYS 5 Ca 0.09 -0.85 -0.18 0.00 0.02 0.00 0.00 55.97 55.06 1h9a s LYS 5 Cb -0.16 -3.97 0.04 0.00 -0.52 0.00 0.00 37.83 33.22 1h9a s LYS 5 CO 0.11 -0.80 0.42 -0.08 -0.92 0.00 0.00 175.35 174.07 1h9a s THR 6 N 1.96 0.06 -0.17 2.17 -1.32 -1.13 -4.83 115.64 112.39 1h9a s THR 6 Ca 0.09 -0.47 0.00 0.00 -1.21 0.00 0.00 61.69 60.10 1h9a s THR 6 Cb -0.18 -1.03 0.03 0.00 -1.51 0.00 0.00 72.50 69.82 1h9a s THR 6 CO 0.12 -0.26 -0.11 -0.22 -2.21 0.00 0.00 174.62 171.94 1h9a s LEU 7 N -2.29 1.92 -0.14 9.08 0.20 -0.51 -2.32 118.68 124.63 1h9a s LEU 7 Ca -0.02 -0.69 -0.01 0.00 0.69 0.00 0.00 54.13 54.10 1h9a s LEU 7 Cb 0.00 -1.14 -0.02 0.00 -0.43 0.00 0.00 46.19 44.60 1h9a s LEU 7 CO -0.06 -0.12 -0.10 -0.69 -0.29 0.00 0.00 176.35 175.09 1h9a s VAL 8 N 1.48 3.31 -0.20 1.68 1.01 -0.61 -0.87 120.40 126.19 1h9a s VAL 8 Ca 0.01 -0.57 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1h9a s VAL 8 Cb -0.15 -2.41 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 1h9a s VAL 8 CO -0.09 0.51 -0.02 -0.89 0.00 0.00 0.00 175.10 174.62 1h9a s THR 9 N 0.36 3.75 -0.50 3.92 2.01 0.29 -0.72 115.64 124.75 1h9a s THR 9 Ca -0.09 -0.38 -0.13 0.00 0.31 0.00 0.00 61.69 61.40 1h9a s THR 9 Cb -0.15 -2.69 0.11 0.00 0.01 0.00 0.00 72.50 69.78 1h9a s THR 9 CO 0.05 0.43 0.41 -0.36 -0.69 0.00 0.00 174.62 174.46 1h9a s PHE 10 N 1.13 3.31 0.13 4.92 0.08 0.46 -0.49 117.98 127.53 1h9a s PHE 10 Ca 0.02 -1.43 -0.30 0.00 0.12 0.00 0.00 56.93 55.35 1h9a s PHE 10 Cb -0.14 -3.53 -0.07 0.00 -0.57 0.00 0.00 43.02 38.71 1h9a s PHE 10 CO 0.01 -0.96 1.09 -0.06 -0.10 0.00 0.00 175.22 175.19 1h9a s PHE 11 N 1.52 3.60 0.00 0.36 0.40 -0.11 -1.70 117.98 122.05 1h9a s PHE 11 Ca 0.04 1.58 0.00 0.00 -0.60 0.00 0.00 56.93 57.95 1h9a s PHE 11 Cb -0.27 -3.26 0.00 0.00 0.51 0.00 0.00 43.02 40.00 1h9a s PHE 11 CO 0.02 -0.57 0.00 0.41 0.70 0.00 0.00 175.22 175.79 1h9a n GLY 12 N 2.38 0.65 0.26 4.36 0.00 -0.42 -1.61 105.19 110.81 1h9a n GLY 12 Ca 0.04 -0.75 0.18 0.00 0.00 0.00 0.00 46.02 45.48 1h9a n GLY 12 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1h9a h GLY 13 N 0.00 0.00 -1.95 -0.02 0.00 -0.84 -0.34 103.07 99.92 1h9a h GLY 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1h9a h GLY 13 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 1h9a n THR 14 N -2.73 0.24 -1.05 4.70 -2.24 -1.26 -4.69 114.28 107.26 1h9a n THR 14 Ca -0.02 -0.62 -0.30 0.00 -2.27 0.00 0.00 64.05 60.84 1h9a n THR 14 Cb 0.08 1.23 0.16 0.00 -2.10 0.00 0.00 70.33 69.69 1h9a n THR 14 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1h9a s GLY 15 N -1.63 1.61 0.17 3.38 0.00 -0.14 -4.86 107.32 105.86 1h9a s GLY 15 Ca 0.31 -0.01 -0.14 0.00 0.00 0.00 0.00 44.72 44.88 1h9a s GLY 15 CO 0.28 0.51 1.80 -1.80 0.00 0.00 0.00 173.10 173.90 1h9a h ASP 16 N -1.76 0.66 -0.68 1.64 3.58 -1.95 -2.45 116.42 115.46 1h9a h ASP 16 Ca -0.51 -0.06 -0.08 0.00 0.42 0.00 0.00 57.03 56.80 1h9a h ASP 16 Cb 1.29 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 42.15 1h9a h ASP 16 CO 0.53 0.53 0.12 0.25 -2.88 0.00 0.00 179.24 177.79 1h9a h LEU 17 N 0.74 1.07 0.13 2.28 5.85 -1.93 -0.65 115.31 122.81 1h9a h LEU 17 Ca 0.20 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1h9a h LEU 17 Cb -0.01 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 40.74 1h9a h LEU 17 CO -0.04 1.06 -0.06 0.00 -0.34 0.00 0.00 178.44 179.06 1h9a h ALA 18 N 1.06 -0.17 0.00 1.25 0.00 -1.75 0.92 119.26 120.56 1h9a h ALA 18 Ca 0.21 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 1h9a h ALA 18 Cb 0.43 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1h9a h ALA 18 CO 0.01 -0.59 -0.55 1.57 0.00 0.00 0.00 179.25 179.69 1h9a h LYS 19 N -0.18 0.00 0.10 0.00 2.10 -1.38 -1.01 116.57 116.21 1h9a h LYS 19 Ca -0.02 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.31 1h9a h LYS 19 Cb 0.14 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.45 1h9a h LYS 19 CO 0.03 0.55 -1.66 0.00 -2.00 0.00 0.00 179.45 176.37 1h9a h ARG 20 N 0.00 0.22 0.00 0.07 3.08 -1.07 -3.43 114.38 113.25 1h9a h ARG 20 Ca -0.01 -0.38 0.00 0.00 0.07 0.00 0.00 59.98 59.67 1h9a h ARG 20 Cb 1.28 0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.47 1h9a h ARG 20 CO 0.07 1.05 -0.95 1.63 -1.07 0.00 0.00 179.97 180.70 1h9a n LYS 21 N -3.40 0.00 0.32 0.04 4.76 0.23 -4.78 118.16 115.32 1h9a n LYS 21 Ca -0.20 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.09 1h9a n LYS 21 Cb 1.05 -0.73 -0.08 0.00 -1.84 0.00 0.00 35.03 33.43 1h9a n LYS 21 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1h9a h LEU 22 N 0.00 -0.71 -0.66 -0.35 3.38 -0.92 -2.84 115.31 113.20 1h9a h LEU 22 Ca 0.00 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1h9a h LEU 22 Cb 0.95 0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 1h9a h LEU 22 CO 0.00 -0.36 0.41 1.88 0.09 0.00 0.00 178.44 180.46 1h9a h TYR 23 N -1.09 0.77 -0.23 1.13 0.05 -1.47 -1.83 116.97 114.31 1h9a h TYR 23 Ca -0.09 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.66 1h9a h TYR 23 Cb 0.69 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 1h9a h TYR 23 CO 0.00 0.45 -0.12 -1.35 -1.05 0.00 0.00 178.16 176.09 1h9a h PRO 24 N 0.81 0.37 -0.42 4.88 0.11 -1.82 -0.38 132.00 135.55 1h9a h PRO 24 Ca 0.26 -0.09 -0.06 0.00 0.11 0.00 0.00 66.00 66.22 1h9a h PRO 24 Cb 0.01 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 1h9a h PRO 24 CO -0.10 0.49 0.03 0.77 -0.21 0.00 0.00 178.00 178.99 1h9a h SER 25 N 0.35 0.70 -0.47 -2.05 0.02 -1.15 -1.70 113.55 109.25 1h9a h SER 25 Ca 0.07 -0.28 -0.11 0.00 -0.84 0.00 0.00 61.79 60.63 1h9a h SER 25 Cb 0.42 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 1h9a h SER 25 CO 0.02 0.81 -0.11 0.58 -1.14 0.00 0.00 176.83 177.00 1h9a h VAL 26 N 0.57 1.27 -0.79 2.27 2.07 -1.05 -2.70 116.25 117.87 1h9a h VAL 26 Ca 0.12 -1.24 0.03 0.00 0.82 0.00 0.00 66.70 66.43 1h9a h VAL 26 Cb 0.43 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 1h9a h VAL 26 CO 0.01 0.43 0.51 0.15 0.02 0.00 0.00 177.57 178.70 1h9a h PHE 27 N 0.85 0.96 -0.93 1.57 3.57 -0.86 -2.06 116.94 120.03 1h9a h PHE 27 Ca 0.13 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.71 1h9a h PHE 27 Cb 0.65 -0.32 -0.06 0.00 2.79 0.00 0.00 35.95 39.01 1h9a h PHE 27 CO 0.04 0.56 0.59 -0.91 -2.23 0.00 0.00 178.31 176.36 1h9a h ASN 28 N 1.00 0.97 0.32 0.41 4.21 -1.00 0.79 115.58 122.28 1h9a h ASN 28 Ca 0.31 0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.78 1h9a h ASN 28 Cb -0.01 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 36.98 1h9a h ASN 28 CO -0.10 0.64 -0.20 -0.07 -1.29 0.00 0.00 177.43 176.40 1h9a h LEU 29 N 1.11 0.00 0.09 1.61 3.38 -1.15 -1.61 115.31 118.74 1h9a h LEU 29 Ca 0.39 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.11 1h9a h LEU 29 Cb 0.10 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.87 1h9a h LEU 29 CO -0.15 0.20 -1.01 0.22 0.09 0.00 0.00 178.44 177.79 1h9a h TYR 30 N 0.00 0.85 -0.48 1.13 3.20 -0.53 -0.66 116.97 120.49 1h9a h TYR 30 Ca -0.00 -0.52 -0.01 0.00 3.14 0.00 0.00 58.73 61.34 1h9a h TYR 30 Cb 0.41 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1h9a h TYR 30 CO 0.00 1.37 0.27 0.87 -1.64 0.00 0.00 178.16 179.03 1h9a h LYS 31 N 0.09 0.65 -0.00 1.82 1.57 -0.50 -0.76 116.57 119.44 1h9a h LYS 31 Ca -0.15 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1h9a h LYS 31 Cb 1.71 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.89 1h9a h LYS 31 CO 0.19 0.48 -0.00 1.63 -0.57 0.00 0.00 179.45 181.18 1h9a n LYS 32 N -4.42 0.63 -0.80 3.15 5.02 -0.65 -4.92 118.16 116.18 1h9a n LYS 32 Ca 0.04 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1h9a n LYS 32 Cb 0.09 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 1h9a n LYS 32 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h9a n GLY 33 N 1.19 0.61 0.21 0.72 0.00 -0.29 -4.86 105.19 102.77 1h9a n GLY 33 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 1h9a n GLY 33 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1h9a h TYR 34 N 0.00 1.04 -3.80 1.61 0.05 -1.32 -3.42 116.97 111.13 1h9a h TYR 34 Ca 0.00 -0.48 -0.64 0.00 0.05 0.00 0.00 58.73 57.66 1h9a h TYR 34 Cb 0.00 -0.15 -0.18 0.00 1.01 0.00 0.00 36.73 37.41 1h9a h TYR 34 CO 0.00 1.31 -0.55 -0.51 -1.05 0.00 0.00 178.16 177.37 1h9a s LEU 35 N -8.37 3.88 0.00 3.88 1.43 -1.12 -0.62 118.68 117.75 1h9a s LEU 35 Ca -0.10 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 1h9a s LEU 35 Cb 0.08 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 44.23 1h9a s LEU 35 CO 0.90 -0.03 0.00 0.00 0.23 0.00 0.00 176.35 177.45 1h9a n GLN 36 N 4.93 0.00 -0.11 1.70 6.02 -1.26 -4.60 117.38 124.05 1h9a n GLN 36 Ca -0.15 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.62 1h9a n GLN 36 Cb 0.52 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.69 1h9a n GLN 36 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1h9a n LYS 37 N 0.00 0.50 -1.95 -1.09 5.02 -1.26 -4.79 118.16 114.59 1h9a n LYS 37 Ca 0.00 0.20 -0.42 0.00 -2.02 0.00 0.00 58.31 56.07 1h9a n LYS 37 Cb 0.00 -1.35 -0.00 0.00 -0.02 0.00 0.00 35.03 33.66 1h9a n LYS 37 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1h9a n HIS 38 N -3.85 3.07 -3.60 2.13 8.25 -1.26 -4.87 115.22 115.08 1h9a n HIS 38 Ca -0.44 -2.90 -0.16 0.00 -0.26 0.00 0.00 57.72 53.96 1h9a n HIS 38 Cb 0.84 -2.23 -0.07 0.00 1.12 0.00 0.00 29.99 29.65 1h9a n HIS 38 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 1h9a s PHE 39 N 1.51 -0.50 -0.04 4.41 -0.71 -1.26 -2.83 117.98 118.57 1h9a s PHE 39 Ca 0.47 0.84 -0.10 0.00 -1.04 0.00 0.00 56.93 57.10 1h9a s PHE 39 Cb 0.13 0.30 0.02 0.00 -1.21 0.00 0.00 43.02 42.26 1h9a s PHE 39 CO -0.05 -0.53 0.24 0.00 -1.34 0.00 0.00 175.22 173.53 1h9a s ALA 40 N -1.22 -0.58 -0.17 1.99 0.00 -0.98 -4.92 121.76 115.87 1h9a s ALA 40 Ca -0.12 0.32 0.01 0.00 0.00 0.00 0.00 51.96 52.17 1h9a s ALA 40 Cb -0.02 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.04 1h9a s ALA 40 CO 0.08 -0.19 -0.17 0.42 0.00 0.00 0.00 175.76 175.89 1h9a s ILE 41 N -0.83 1.88 -0.26 0.00 -1.09 -0.76 -1.57 121.20 118.57 1h9a s ILE 41 Ca -0.09 -0.86 -0.06 0.00 -2.23 0.00 0.00 60.65 57.40 1h9a s ILE 41 Cb -0.05 -1.74 -0.01 0.00 -1.58 0.00 0.00 42.46 39.09 1h9a s ILE 41 CO 0.02 0.48 0.05 -0.69 -1.23 0.00 0.00 174.94 173.57 1h9a s VAL 42 N 1.35 3.99 0.11 2.92 1.01 0.11 -1.91 120.40 127.98 1h9a s VAL 42 Ca 0.04 -0.45 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 1h9a s VAL 42 Cb -0.13 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 1h9a s VAL 42 CO -0.12 0.25 0.31 -0.83 0.00 0.00 0.00 175.10 174.71 1h9a s GLY 43 N 1.54 2.17 -0.04 4.51 0.00 -0.10 -0.40 107.32 115.01 1h9a s GLY 43 Ca 0.05 -0.71 -0.23 0.00 0.00 0.00 0.00 44.72 43.83 1h9a s GLY 43 CO 0.02 -0.66 0.50 -1.08 0.00 0.00 0.00 173.10 171.88 1h9a s THR 44 N -1.62 0.03 0.03 0.90 -1.32 -0.69 -2.25 115.64 110.73 1h9a s THR 44 Ca 0.38 -0.23 -0.25 0.00 -1.21 0.00 0.00 61.69 60.38 1h9a s THR 44 Cb -0.12 -0.81 0.09 0.00 -1.51 0.00 0.00 72.50 70.14 1h9a s THR 44 CO 0.26 -0.12 1.17 0.00 -2.21 0.00 0.00 174.62 173.72 1h9a n ALA 45 N 1.13 -3.24 0.05 11.08 0.00 -1.24 -1.05 120.51 127.24 1h9a n ALA 45 Ca -0.20 -0.83 -0.16 0.00 0.00 0.00 0.00 53.44 52.25 1h9a n ALA 45 Cb 0.56 0.26 -0.06 0.00 0.00 0.00 0.00 19.45 20.21 1h9a n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h9a h ARG 46 N 0.00 0.52 -6.17 0.00 3.08 -1.90 0.34 114.38 110.25 1h9a h ARG 46 Ca -0.22 -0.55 -0.73 0.00 0.07 0.00 0.00 59.98 58.55 1h9a h ARG 46 Cb 1.14 0.15 0.03 0.00 0.08 0.00 0.00 29.97 31.37 1h9a h ARG 46 CO 0.31 1.18 0.64 0.94 -1.07 0.00 0.00 179.97 181.98 1h9a n GLN 47 N -3.79 0.94 -2.52 0.04 7.27 -1.26 -4.44 117.38 113.63 1h9a n GLN 47 Ca -0.08 0.34 -0.41 0.00 0.07 0.00 0.00 57.00 56.93 1h9a n GLN 47 Cb 0.84 -1.98 -0.03 0.00 2.41 0.00 0.00 30.24 31.48 1h9a n GLN 47 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1h9a s ALA 48 N 2.06 2.70 0.15 1.69 0.00 -1.26 -4.57 121.76 122.53 1h9a s ALA 48 Ca 0.93 -1.47 0.08 0.00 0.00 0.00 0.00 51.96 51.50 1h9a s ALA 48 Cb -1.08 -4.31 -0.04 0.00 0.00 0.00 0.00 23.12 17.69 1h9a s ALA 48 CO 0.59 -3.39 -0.18 -0.51 0.00 0.00 0.00 175.76 172.28 1h9a s LEU 49 N 5.84 2.41 0.50 0.00 1.43 -1.26 -5.10 118.68 122.49 1h9a s LEU 49 Ca 0.39 -0.82 0.08 0.00 -1.03 0.00 0.00 54.13 52.75 1h9a s LEU 49 Cb -0.07 -0.80 0.04 0.00 0.03 0.00 0.00 46.19 45.39 1h9a s LEU 49 CO 0.11 -0.03 0.63 0.54 0.23 0.00 0.00 176.35 177.83 1h9a s ASN 50 N -2.49 5.25 0.29 2.29 2.20 -1.26 -4.65 114.94 116.58 1h9a s ASN 50 Ca 0.13 -0.72 0.03 0.00 -0.94 0.00 0.00 52.86 51.36 1h9a s ASN 50 Cb -0.06 -0.13 0.62 0.00 -2.00 0.00 0.00 41.25 39.67 1h9a s ASN 50 CO 0.06 -1.04 1.83 0.44 -2.94 0.00 0.00 177.10 175.45 1h9a h ASP 51 N 0.49 0.88 -0.32 3.54 3.32 -1.97 -2.03 116.42 120.33 1h9a h ASP 51 Ca -0.35 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.73 1h9a h ASP 51 Cb 1.28 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 1h9a h ASP 51 CO 0.46 0.44 0.12 0.44 -1.72 0.00 0.00 179.24 178.98 1h9a h ASP 52 N 0.92 0.45 -0.25 6.45 3.32 -1.95 -0.98 116.42 124.38 1h9a h ASP 52 Ca 0.51 -0.17 -0.08 0.00 0.02 0.00 0.00 57.03 57.31 1h9a h ASP 52 Cb 0.59 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 1h9a h ASP 52 CO -0.28 0.50 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.32 1h9a h GLU 53 N 0.37 0.63 -0.27 3.56 5.08 -1.85 -1.59 114.58 120.50 1h9a h GLU 53 Ca 0.11 -0.18 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 1h9a h GLU 53 Cb 0.19 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1h9a h GLU 53 CO -0.01 0.72 -0.32 0.35 -1.00 0.00 0.00 179.01 178.75 1h9a h PHE 54 N 0.59 0.84 -0.92 4.33 3.57 -1.23 -2.12 116.94 122.00 1h9a h PHE 54 Ca 0.11 -0.26 0.07 0.00 3.53 0.00 0.00 57.97 61.42 1h9a h PHE 54 Cb 0.50 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 39.00 1h9a h PHE 54 CO 0.02 1.01 0.60 0.87 -2.23 0.00 0.00 178.31 178.58 1h9a h LYS 55 N 0.43 1.00 -0.18 1.11 1.57 -0.88 -0.05 116.57 119.57 1h9a h LYS 55 Ca 0.04 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.65 1h9a h LYS 55 Cb 0.89 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 1h9a h LYS 55 CO 0.08 0.66 -0.36 0.37 -0.57 0.00 0.00 179.45 179.63 1h9a h GLN 56 N 1.03 0.39 -0.22 3.15 5.75 -1.12 0.14 115.11 124.23 1h9a h GLN 56 Ca 0.41 -0.17 -0.02 0.00 -0.15 0.00 0.00 58.65 58.71 1h9a h GLN 56 Cb 0.24 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.77 1h9a h GLN 56 CO -0.16 0.70 0.05 1.25 -2.65 0.00 0.00 178.83 178.02 1h9a h LEU 57 N 0.33 0.33 -0.64 -2.39 6.46 -0.39 -1.33 115.31 117.68 1h9a h LEU 57 Ca 0.04 -0.23 -0.05 0.00 -0.12 0.00 0.00 57.88 57.51 1h9a h LEU 57 Cb 0.79 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.60 1h9a h LEU 57 CO 0.06 0.48 0.20 0.58 -0.62 0.00 0.00 178.44 179.14 1h9a h VAL 58 N 0.17 1.25 -0.37 1.05 2.07 -0.80 -1.99 116.25 117.63 1h9a h VAL 58 Ca 0.07 -0.86 0.05 0.00 0.82 0.00 0.00 66.70 66.79 1h9a h VAL 58 Cb 0.27 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.59 1h9a h VAL 58 CO 0.00 0.33 0.08 -0.09 0.02 0.00 0.00 177.57 177.90 1h9a h ARG 59 N 0.92 0.19 0.00 1.57 2.43 -0.50 -0.96 114.38 118.04 1h9a h ARG 59 Ca 0.21 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 1h9a h ARG 59 Cb 0.30 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1h9a h ARG 59 CO -0.01 0.13 -0.29 -0.44 -1.51 0.00 0.00 179.97 177.85 1h9a h ASP 60 N 0.20 0.00 -0.15 -3.80 3.32 -1.07 -1.82 116.42 113.10 1h9a h ASP 60 Ca 0.17 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 57.01 1h9a h ASP 60 Cb 0.20 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.76 1h9a h ASP 60 CO -0.23 0.29 -0.71 -1.28 -1.72 0.00 0.00 179.24 175.60 1h9a h SER 61 N 0.00 0.92 -0.18 6.45 0.87 -0.50 -3.22 113.55 117.89 1h9a h SER 61 Ca -0.00 -0.57 0.00 0.00 -1.23 0.00 0.00 61.79 59.99 1h9a h SER 61 Cb 0.66 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 1h9a h SER 61 CO 0.04 1.36 0.00 2.30 -0.53 0.00 0.00 176.83 180.00 1h9a n ILE 62 N -3.95 0.22 -0.23 2.23 -5.35 -0.47 -4.53 119.36 107.28 1h9a n ILE 62 Ca -0.06 -0.48 0.01 0.00 -0.27 0.00 0.00 62.75 61.95 1h9a n ILE 62 Cb 0.71 0.80 0.10 0.00 -1.74 0.00 0.00 39.64 39.50 1h9a n ILE 62 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1h9a h LYS 63 N 3.40 0.03 0.00 6.28 3.64 -1.34 -0.13 116.57 128.45 1h9a h LYS 63 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1h9a h LYS 63 Cb 0.74 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1h9a h LYS 63 CO 0.00 0.02 0.00 -0.25 -2.27 0.00 0.00 179.45 176.95 1h9a n ASP 64 N -5.41 0.00 -0.27 4.20 9.92 -1.26 -2.59 116.55 121.14 1h9a n ASP 64 Ca 0.10 -0.30 0.05 0.00 -0.53 0.00 0.00 54.79 54.11 1h9a n ASP 64 Cb 0.38 -0.13 0.10 0.00 -0.64 0.00 0.00 41.12 40.83 1h9a n ASP 64 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1h9a n PHE 65 N -1.13 0.22 -3.55 1.24 3.01 -0.07 -5.02 117.46 112.17 1h9a n PHE 65 Ca 0.12 -0.69 -0.37 0.00 1.01 0.00 0.00 57.45 57.52 1h9a n PHE 65 Cb 0.10 -0.11 -0.06 0.00 -0.01 0.00 0.00 39.48 39.40 1h9a n PHE 65 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 1h9a s THR 66 N -1.76 5.22 0.09 4.37 2.01 -1.07 -4.93 115.64 119.57 1h9a s THR 66 Ca 0.19 0.66 0.00 0.00 0.31 0.00 0.00 61.69 62.85 1h9a s THR 66 Cb 0.15 -3.65 0.00 0.00 0.01 0.00 0.00 72.50 69.01 1h9a s THR 66 CO 0.05 0.48 0.00 0.47 -0.69 0.00 0.00 174.62 174.94 1h9a n ASP 67 N 2.72 0.69 -4.53 3.53 9.92 -1.26 -4.98 116.55 122.64 1h9a n ASP 67 Ca -0.13 0.13 -0.42 0.00 -0.53 0.00 0.00 54.79 53.84 1h9a n ASP 67 Cb 0.52 -0.18 -0.09 0.00 -0.64 0.00 0.00 41.12 40.74 1h9a n ASP 67 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1h9a s ASP 68 N -5.63 6.23 0.22 -2.24 2.15 -1.26 -4.95 116.67 111.19 1h9a s ASP 68 Ca 0.00 -0.30 -0.09 0.00 0.43 0.00 0.00 52.55 52.60 1h9a s ASP 68 Cb 0.00 -2.23 0.18 0.00 -0.30 0.00 0.00 42.92 40.57 1h9a s ASP 68 CO 0.00 -0.46 1.85 1.56 -0.17 0.00 0.00 175.17 177.95 1h9a h GLN 69 N 8.55 1.13 -0.93 4.34 4.20 -2.00 -2.29 115.11 128.12 1h9a h GLN 69 Ca -0.28 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.31 1h9a h GLN 69 Cb 1.13 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 28.63 1h9a h GLN 69 CO 0.75 0.81 0.54 0.00 -0.67 0.00 0.00 178.83 180.26 1h9a h ALA 70 N 1.26 1.18 -0.27 3.87 0.00 -2.00 -2.04 119.26 121.27 1h9a h ALA 70 Ca 0.29 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1h9a h ALA 70 Cb -0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 1h9a h ALA 70 CO -0.05 0.66 0.14 0.37 0.00 0.00 0.00 179.25 180.36 1h9a h GLN 71 N 1.28 0.38 -0.40 0.00 4.15 -1.85 -1.37 115.11 117.31 1h9a h GLN 71 Ca 0.33 -0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.73 1h9a h GLN 71 Cb -0.03 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.56 1h9a h GLN 71 CO -0.06 0.36 0.21 0.00 -1.93 0.00 0.00 178.83 177.41 1h9a h ALA 72 N 1.00 0.50 -0.31 3.38 0.00 -1.16 -2.44 119.26 120.23 1h9a h ALA 72 Ca 0.09 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1h9a h ALA 72 Cb 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1h9a h ALA 72 CO -0.01 -0.15 -0.21 0.93 0.00 0.00 0.00 179.25 179.81 1h9a h GLU 73 N 0.42 0.59 -0.33 0.00 4.39 -1.16 -0.99 114.58 117.50 1h9a h GLU 73 Ca 0.17 -0.21 -0.08 0.00 0.34 0.00 0.00 59.36 59.58 1h9a h GLU 73 Cb 0.07 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1h9a h GLU 73 CO -0.11 0.76 -0.12 0.00 -1.16 0.00 0.00 179.01 178.38 1h9a h ALA 74 N 1.25 1.19 0.17 3.43 0.00 -1.04 -2.30 119.26 121.96 1h9a h ALA 74 Ca 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1h9a h ALA 74 Cb 0.65 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1h9a h ALA 74 CO 0.05 0.52 -0.08 0.35 0.00 0.00 0.00 179.25 180.09 1h9a h PHE 75 N 0.52 -0.21 -0.60 0.00 3.57 -1.08 -3.22 116.94 115.92 1h9a h PHE 75 Ca 0.09 -0.00 0.17 0.00 3.53 0.00 0.00 57.97 61.76 1h9a h PHE 75 Cb 0.51 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 1h9a h PHE 75 CO 0.02 0.20 0.44 0.82 -2.23 0.00 0.00 178.31 177.56 1h9a h ILE 76 N -0.70 0.66 0.00 1.41 2.04 -1.09 0.51 117.51 120.33 1h9a h ILE 76 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1h9a h ILE 76 Cb 0.50 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1h9a h ILE 76 CO 0.04 0.00 0.00 1.21 0.00 0.00 0.00 178.15 179.40 1h9a n GLU 77 N -4.29 0.06 -0.03 2.37 4.07 -0.87 -1.92 120.64 120.03 1h9a n GLU 77 Ca 0.11 0.40 0.13 0.00 -0.06 0.00 0.00 57.16 57.74 1h9a n GLU 77 Cb 0.69 -1.65 0.45 0.00 -0.06 0.00 0.00 31.44 30.86 1h9a n GLU 77 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 1h9a n HIS 78 N -1.77 0.09 -3.95 4.31 8.25 0.17 -4.92 115.22 117.40 1h9a n HIS 78 Ca 0.02 -0.04 -0.33 0.00 -0.26 0.00 0.00 57.72 57.10 1h9a n HIS 78 Cb 0.13 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.19 1h9a n HIS 78 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1h9a s PHE 79 N -1.91 3.49 0.12 4.41 0.40 -0.81 -1.83 117.98 121.84 1h9a s PHE 79 Ca 0.36 0.32 -0.08 0.00 -0.60 0.00 0.00 56.93 56.92 1h9a s PHE 79 Cb 0.20 -1.80 -0.01 0.00 0.51 0.00 0.00 43.02 41.92 1h9a s PHE 79 CO 0.31 0.62 0.20 -1.54 0.70 0.00 0.00 175.22 175.51 1h9a s SER 80 N -1.92 0.12 0.05 1.36 1.04 -0.80 -4.91 113.70 108.64 1h9a s SER 80 Ca 0.27 -0.79 -0.02 0.00 0.48 0.00 0.00 55.95 55.89 1h9a s SER 80 Cb -0.12 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.33 1h9a s SER 80 CO 0.18 -0.78 0.02 -0.47 0.98 0.00 0.00 173.24 173.16 1h9a s TYR 81 N -3.91 0.40 -0.21 5.02 5.04 -1.26 -0.92 117.35 121.50 1h9a s TYR 81 Ca 0.11 -0.86 -0.09 0.00 -2.44 0.00 0.00 57.07 53.78 1h9a s TYR 81 Cb 0.05 -0.29 0.09 0.00 0.35 0.00 0.00 41.96 42.15 1h9a s TYR 81 CO -0.06 -0.37 0.48 0.50 -1.34 0.00 0.00 175.55 174.75 1h9a s ARG 82 N -3.43 0.42 0.33 4.97 6.06 -0.95 -4.66 118.95 121.69 1h9a s ARG 82 Ca 0.02 1.04 -0.28 0.00 -2.50 0.00 0.00 55.73 54.01 1h9a s ARG 82 Cb 0.04 0.28 -0.10 0.00 0.06 0.00 0.00 34.95 35.23 1h9a s ARG 82 CO -0.08 -0.20 1.24 0.00 -2.50 0.00 0.00 175.30 173.75 1h9a s ALA 83 N 2.18 3.41 -0.29 6.12 0.00 -1.26 -3.73 121.76 128.19 1h9a s ALA 83 Ca -0.06 1.13 -0.21 0.00 0.00 0.00 0.00 51.96 52.82 1h9a s ALA 83 Cb -0.10 -3.43 0.13 0.00 0.00 0.00 0.00 23.12 19.72 1h9a s ALA 83 CO -0.14 -0.52 1.01 -1.58 0.00 0.00 0.00 175.76 174.52 1h9a s HIS 84 N -1.19 -0.52 -0.25 0.00 5.04 0.12 -4.88 115.29 113.61 1h9a s HIS 84 Ca 0.50 1.16 -0.11 0.00 -1.54 0.00 0.00 55.06 55.06 1h9a s HIS 84 Cb -0.36 0.37 -0.05 0.00 0.04 0.00 0.00 32.58 32.57 1h9a s HIS 84 CO 0.48 -0.25 0.20 0.34 -2.34 0.00 0.00 174.74 173.17 1h9a s ASP 85 N 0.69 6.14 0.25 9.88 -1.08 -1.26 -3.38 116.67 127.89 1h9a s ASP 85 Ca -0.02 0.14 0.22 0.00 -0.52 0.00 0.00 52.55 52.37 1h9a s ASP 85 Cb -0.04 -2.13 0.97 0.00 -1.46 0.00 0.00 42.92 40.26 1h9a s ASP 85 CO -0.10 0.01 1.67 1.33 0.52 0.00 0.00 175.17 178.60 1h9a n VAL 86 N 4.50 0.91 1.05 1.11 0.24 -1.26 -2.25 118.33 122.63 1h9a n VAL 86 Ca -0.14 0.34 0.12 0.00 -2.04 0.00 0.00 64.34 62.62 1h9a n VAL 86 Cb 0.52 -1.27 0.16 0.00 -1.47 0.00 0.00 33.84 31.77 1h9a n VAL 86 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1h9a n THR 87 N -2.18 0.00 -3.34 3.34 -2.24 -1.26 -4.67 114.28 103.93 1h9a n THR 87 Ca 0.01 -0.05 -0.45 0.00 -2.27 0.00 0.00 64.05 61.29 1h9a n THR 87 Cb 0.18 0.57 -0.06 0.00 -2.10 0.00 0.00 70.33 68.92 1h9a n THR 87 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1h9a s ASP 88 N -2.84 6.16 0.16 3.42 2.15 -0.95 -4.97 116.67 119.79 1h9a s ASP 88 Ca 0.14 -1.64 -0.20 0.00 0.43 0.00 0.00 52.55 51.27 1h9a s ASP 88 Cb 0.18 -2.20 0.06 0.00 -0.30 0.00 0.00 42.92 40.66 1h9a s ASP 88 CO 0.69 -0.79 1.64 0.00 -0.17 0.00 0.00 175.17 176.55 1h9a h ALA 89 N 8.83 0.02 -0.78 3.66 0.00 -1.86 -1.96 119.26 127.17 1h9a h ALA 89 Ca -0.29 0.11 0.12 0.00 0.00 0.00 0.00 54.91 54.85 1h9a h ALA 89 Cb 1.10 0.45 -0.08 0.00 0.00 0.00 0.00 17.79 19.26 1h9a h ALA 89 CO 0.98 -0.59 0.39 0.00 0.00 0.00 0.00 179.25 180.04 1h9a h ALA 90 N 1.02 1.13 -0.05 0.00 0.00 -1.95 -0.59 119.26 118.81 1h9a h ALA 90 Ca 0.16 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1h9a h ALA 90 Cb 0.41 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1h9a h ALA 90 CO -0.41 -0.06 0.22 1.03 0.00 0.00 0.00 179.25 180.03 1h9a h SER 91 N 0.62 0.00 0.47 0.00 0.87 -1.68 -0.81 113.55 113.02 1h9a h SER 91 Ca 0.41 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.94 1h9a h SER 91 Cb 0.50 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1h9a h SER 91 CO -0.32 0.00 -0.12 1.88 -0.53 0.00 0.00 176.83 177.74 1h9a h TYR 92 N 0.00 0.00 -0.28 2.24 -1.99 -1.10 -2.35 116.97 113.49 1h9a h TYR 92 Ca 0.02 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.71 1h9a h TYR 92 Cb 0.47 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.18 1h9a h TYR 92 CO 0.00 0.12 -0.02 0.00 -0.00 0.00 0.00 178.16 178.26 1h9a h ALA 93 N 1.88 1.44 -0.32 3.88 0.00 -1.30 0.31 119.26 125.15 1h9a h ALA 93 Ca -0.00 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.54 1h9a h ALA 93 Cb 0.39 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1h9a h ALA 93 CO 0.02 0.40 -0.50 0.28 0.00 0.00 0.00 179.25 179.44 1h9a h VAL 94 N 0.42 1.27 -0.22 0.00 2.07 -1.60 -2.30 116.25 115.89 1h9a h VAL 94 Ca 0.09 -1.68 -0.18 0.00 0.82 0.00 0.00 66.70 65.74 1h9a h VAL 94 Cb 0.32 1.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1h9a h VAL 94 CO 0.01 0.55 -0.60 0.25 0.02 0.00 0.00 177.57 177.81 1h9a h LEU 95 N 0.70 0.82 -0.44 2.57 5.85 -1.43 -2.74 115.31 120.63 1h9a h LEU 95 Ca 0.03 -0.46 0.06 0.00 0.84 0.00 0.00 57.88 58.34 1h9a h LEU 95 Cb 1.11 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 1h9a h LEU 95 CO 0.12 1.23 0.15 0.50 -0.34 0.00 0.00 178.44 180.09 1h9a h LYS 96 N 0.54 0.31 -0.31 1.25 3.64 -0.89 -1.54 116.57 119.57 1h9a h LYS 96 Ca -0.00 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1h9a h LYS 96 Cb 1.19 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.91 1h9a h LYS 96 CO 0.12 0.20 0.13 1.49 -2.27 0.00 0.00 179.45 179.13 1h9a h GLU 97 N 0.32 0.27 -0.95 1.90 4.81 -1.35 -1.76 114.58 117.83 1h9a h GLU 97 Ca 0.21 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1h9a h GLU 97 Cb 0.21 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.48 1h9a h GLU 97 CO -0.22 0.18 0.59 0.00 -0.73 0.00 0.00 179.01 178.83 1h9a h ALA 98 N 1.18 1.20 -0.28 2.92 0.00 -1.13 -1.36 119.26 121.80 1h9a h ALA 98 Ca 0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1h9a h ALA 98 Cb 0.08 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1h9a h ALA 98 CO -0.12 0.64 0.12 0.82 0.00 0.00 0.00 179.25 180.71 1h9a h ILE 99 N 1.30 1.16 -0.23 0.00 2.04 -0.91 -1.76 117.51 119.10 1h9a h ILE 99 Ca 0.34 -0.48 -0.09 0.00 1.00 0.00 0.00 64.86 65.62 1h9a h ILE 99 Cb -0.09 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1h9a h ILE 99 CO -0.07 0.17 -0.26 -0.33 0.00 0.00 0.00 178.15 177.66 1h9a h GLU 100 N 0.31 0.44 -0.37 2.37 5.08 -1.06 -1.89 114.58 119.45 1h9a h GLU 100 Ca 0.09 -0.16 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 1h9a h GLU 100 Cb 0.15 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1h9a h GLU 100 CO -0.01 0.66 -0.05 0.93 -1.00 0.00 0.00 179.01 179.54 1h9a h GLU 101 N 0.39 0.69 -0.73 2.33 5.08 -1.05 -2.13 114.58 119.16 1h9a h GLU 101 Ca 0.06 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1h9a h GLU 101 Cb 0.66 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 1h9a h GLU 101 CO 0.05 0.82 0.42 0.00 -1.00 0.00 0.00 179.01 179.30 1h9a h ALA 102 N 0.85 0.93 -0.68 3.43 0.00 -1.14 -0.74 119.26 121.91 1h9a h ALA 102 Ca 0.10 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1h9a h ALA 102 Cb 0.54 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1h9a h ALA 102 CO 0.03 0.42 0.36 0.00 0.00 0.00 0.00 179.25 180.06 1h9a h ALA 103 N 1.21 1.35 0.27 0.00 0.00 -1.18 -1.91 119.26 119.00 1h9a h ALA 103 Ca 0.26 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1h9a h ALA 103 Cb 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1h9a h ALA 103 CO -0.04 0.52 -0.13 -0.44 0.00 0.00 0.00 179.25 179.16 1h9a h ASP 104 N 0.95 -0.31 -0.97 0.00 5.19 -0.82 0.37 116.42 120.84 1h9a h ASP 104 Ca 0.24 -0.22 0.18 0.00 -0.62 0.00 0.00 57.03 56.61 1h9a h ASP 104 Cb 0.05 0.08 -0.10 0.00 0.18 0.00 0.00 39.33 39.53 1h9a h ASP 104 CO -0.04 0.11 0.57 0.50 -3.12 0.00 0.00 179.24 177.26 1h9a h LYS 105 N -0.78 0.72 -0.24 3.56 3.64 -1.01 -2.26 116.57 120.19 1h9a h LYS 105 Ca -0.04 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1h9a h LYS 105 Cb 0.51 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1h9a h LYS 105 CO 0.06 0.47 0.00 1.19 -2.27 0.00 0.00 179.45 178.90 1h9a n PHE 106 N -4.79 0.31 -3.30 1.91 3.72 -0.73 -5.03 117.46 109.55 1h9a n PHE 106 Ca 0.22 -0.23 -0.10 0.00 -0.05 0.00 0.00 57.45 57.29 1h9a n PHE 106 Cb 0.53 -0.01 0.01 0.00 -0.94 0.00 0.00 39.48 39.08 1h9a n PHE 106 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1h9a n ASP 107 N 0.93 -6.80 -4.21 4.37 2.03 0.12 -4.36 116.55 108.62 1h9a n ASP 107 Ca 0.13 -0.42 -0.34 0.00 0.52 0.00 0.00 54.79 54.68 1h9a n ASP 107 Cb 0.45 -4.29 -0.15 0.00 -0.72 0.00 0.00 41.12 36.41 1h9a n ASP 107 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1h9a s ILE 108 N -3.08 2.68 -0.73 5.18 1.01 -0.40 -4.88 121.20 120.99 1h9a s ILE 108 Ca 0.09 -0.73 -0.18 0.00 0.00 0.00 0.00 60.65 59.82 1h9a s ILE 108 Cb -0.02 -2.18 0.13 0.00 0.01 0.00 0.00 42.46 40.40 1h9a s ILE 108 CO 0.79 0.49 0.85 -1.81 0.00 0.00 0.00 174.94 175.26 1h9a s ASP 109 N 1.35 6.40 1.34 3.58 1.11 -1.26 -4.82 116.67 124.38 1h9a s ASP 109 Ca 0.05 -1.78 0.00 0.00 0.18 0.00 0.00 52.55 51.00 1h9a s ASP 109 Cb -0.14 -2.32 0.00 0.00 1.07 0.00 0.00 42.92 41.53 1h9a s ASP 109 CO -0.08 -1.04 0.00 0.61 1.18 0.00 0.00 175.17 175.84 1h9a n GLY 110 N 5.12 2.09 3.66 0.21 0.00 -1.26 -4.45 105.19 110.56 1h9a n GLY 110 Ca 0.04 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.37 1h9a n GLY 110 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h9a n ASN 111 N 5.08 -4.26 -4.84 1.61 4.13 -1.17 -4.47 115.26 111.33 1h9a n ASN 111 Ca 0.00 -0.94 -0.37 0.00 1.68 0.00 0.00 54.58 54.95 1h9a n ASN 111 Cb 0.00 -3.70 -0.06 0.00 -1.54 0.00 0.00 39.78 34.47 1h9a n ASN 111 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1h9a s ARG 112 N -5.83 3.66 -0.10 3.52 0.52 -0.53 -1.42 118.95 118.77 1h9a s ARG 112 Ca 0.34 -0.12 0.02 0.00 -0.52 0.00 0.00 55.73 55.46 1h9a s ARG 112 Cb -0.11 -3.25 0.01 0.00 0.52 0.00 0.00 34.95 32.12 1h9a s ARG 112 CO 0.84 0.65 -0.17 0.42 0.02 0.00 0.00 175.30 177.06 1h9a s ILE 113 N -0.67 1.59 -0.21 1.52 1.01 -0.05 -1.33 121.20 123.06 1h9a s ILE 113 Ca 0.14 -0.72 -0.04 0.00 0.00 0.00 0.00 60.65 60.04 1h9a s ILE 113 Cb -0.12 -1.42 -0.01 0.00 0.01 0.00 0.00 42.46 40.92 1h9a s ILE 113 CO 0.03 0.46 -0.05 -0.36 0.00 0.00 0.00 174.94 175.02 1h9a s PHE 114 N 0.75 2.95 -0.24 3.97 0.08 -0.07 -0.55 117.98 124.88 1h9a s PHE 114 Ca -0.11 -0.89 -0.07 0.00 0.12 0.00 0.00 56.93 55.98 1h9a s PHE 114 Cb -0.16 -2.08 -0.03 0.00 -0.57 0.00 0.00 43.02 40.18 1h9a s PHE 114 CO 0.02 -0.50 0.06 -0.47 -0.10 0.00 0.00 175.22 174.23 1h9a s TYR 115 N 1.35 3.09 -0.91 0.36 6.14 0.35 -1.10 117.35 126.64 1h9a s TYR 115 Ca 0.04 -0.38 -0.14 0.00 0.64 0.00 0.00 57.07 57.23 1h9a s TYR 115 Cb -0.14 -2.20 0.21 0.00 0.42 0.00 0.00 41.96 40.25 1h9a s TYR 115 CO -0.02 -0.30 0.91 -1.64 0.64 0.00 0.00 175.55 175.14 1h9a s MET 116 N 1.42 3.73 -0.92 4.97 -1.94 -0.68 -0.93 119.30 124.94 1h9a s MET 116 Ca 0.05 -2.48 -0.01 0.00 -1.71 0.00 0.00 55.69 51.53 1h9a s MET 116 Cb -0.15 -4.56 0.34 0.00 2.01 0.00 0.00 34.83 32.48 1h9a s MET 116 CO 0.03 -1.38 1.92 0.45 -0.01 0.00 0.00 175.02 176.03 1h9a n SER 117 N 4.24 7.39 -3.75 3.03 2.88 -0.64 -3.72 113.62 123.05 1h9a n SER 117 Ca 0.18 -3.77 -0.23 0.00 -1.33 0.00 0.00 58.87 53.72 1h9a n SER 117 Cb 0.46 -1.10 -0.06 0.00 -0.75 0.00 0.00 64.21 62.76 1h9a n SER 117 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1h9a n VAL 118 N -0.33 0.00 -2.02 2.46 0.24 -1.26 -4.33 118.33 113.09 1h9a n VAL 118 Ca 0.51 -2.00 -0.40 0.00 -2.04 0.00 0.00 64.34 60.40 1h9a n VAL 118 Cb 0.25 0.61 -0.01 0.00 -1.47 0.00 0.00 33.84 33.22 1h9a n VAL 118 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1h9a s ALA 119 N -2.86 3.40 0.44 2.33 0.00 -1.26 -4.91 121.76 118.90 1h9a s ALA 119 Ca 0.11 1.31 0.22 0.00 0.00 0.00 0.00 51.96 53.61 1h9a s ALA 119 Cb 0.01 -3.51 1.20 0.00 0.00 0.00 0.00 23.12 20.81 1h9a s ALA 119 CO 0.08 -0.81 1.81 -1.35 0.00 0.00 0.00 175.76 175.49 1h9a h PRO 120 N 2.99 0.30 0.00 0.00 0.11 -1.94 -1.50 132.00 131.95 1h9a h PRO 120 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1h9a h PRO 120 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1h9a h PRO 120 CO 0.64 0.20 0.00 0.07 -0.21 0.00 0.00 178.00 178.69 1h9a h ARG 121 N 0.31 0.00 0.00 1.05 0.11 -1.99 -2.10 114.38 111.76 1h9a h ARG 121 Ca 0.54 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.62 1h9a h ARG 121 Cb 1.54 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.62 1h9a h ARG 121 CO -0.20 0.00 -0.89 1.19 0.10 0.00 0.00 179.97 180.17 1h9a n PHE 122 N -2.61 0.65 -0.25 4.08 3.72 -0.56 -4.55 117.46 117.94 1h9a n PHE 122 Ca -0.01 0.19 -0.07 0.00 -0.05 0.00 0.00 57.45 57.51 1h9a n PHE 122 Cb 0.09 -0.73 -0.02 0.00 -0.94 0.00 0.00 39.48 37.88 1h9a n PHE 122 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 1h9a h PHE 123 N 0.00 -1.25 -0.44 1.38 0.04 -1.51 -0.30 116.94 114.87 1h9a h PHE 123 Ca 0.00 0.09 -0.09 0.00 2.80 0.00 0.00 57.97 60.77 1h9a h PHE 123 Cb 0.85 0.64 -0.01 0.00 2.20 0.00 0.00 35.95 39.63 1h9a h PHE 123 CO 0.00 -0.41 -0.06 0.78 -0.60 0.00 0.00 178.31 178.02 1h9a h GLY 124 N -0.17 0.88 0.42 -1.45 0.00 -1.80 -3.01 103.07 97.94 1h9a h GLY 124 Ca 0.21 -0.69 0.03 0.00 0.00 0.00 0.00 47.33 46.87 1h9a h GLY 124 CO -0.75 0.64 -0.28 -0.84 0.00 0.00 0.00 176.54 175.31 1h9a h THR 125 N 0.65 0.38 -0.33 4.70 2.02 -1.59 -2.21 112.91 116.53 1h9a h THR 125 Ca 0.12 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.34 1h9a h THR 125 Cb 0.58 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 67.32 1h9a h THR 125 CO 0.03 0.00 0.07 0.40 0.37 0.00 0.00 175.52 176.39 1h9a h ILE 126 N -0.44 0.84 -0.54 3.11 2.04 -1.11 -2.34 117.51 119.06 1h9a h ILE 126 Ca 0.05 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 65.87 1h9a h ILE 126 Cb 0.51 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1h9a h ILE 126 CO -0.22 0.03 0.34 0.00 0.00 0.00 0.00 178.15 178.31 1h9a h ALA 127 N 1.24 0.69 -0.75 1.87 0.00 -1.38 -1.26 119.26 119.67 1h9a h ALA 127 Ca 0.15 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1h9a h ALA 127 Cb 0.17 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1h9a h ALA 127 CO -0.20 0.08 0.31 0.87 0.00 0.00 0.00 179.25 180.31 1h9a h LYS 128 N 0.69 1.11 -0.06 0.00 1.57 -1.12 -2.58 116.57 116.18 1h9a h LYS 128 Ca 0.21 -0.19 -0.14 0.00 -1.87 0.00 0.00 60.65 58.66 1h9a h LYS 128 Cb -0.03 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 1h9a h LYS 128 CO -0.07 0.89 -0.60 1.88 -0.57 0.00 0.00 179.45 180.99 1h9a h TYR 129 N 1.09 0.25 -0.94 -1.35 0.05 -1.12 -1.43 116.97 113.52 1h9a h TYR 129 Ca 0.25 -0.10 0.04 0.00 0.05 0.00 0.00 58.73 58.98 1h9a h TYR 129 Cb 0.19 -0.05 -0.06 0.00 1.01 0.00 0.00 36.73 37.83 1h9a h TYR 129 CO 0.02 0.74 0.61 -0.07 -1.05 0.00 0.00 178.16 178.41 1h9a h LEU 130 N 0.15 1.00 0.29 3.88 3.38 -0.84 0.11 115.31 123.29 1h9a h LEU 130 Ca -0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1h9a h LEU 130 Cb 1.09 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1h9a h LEU 130 CO 0.09 0.68 -0.14 0.50 0.09 0.00 0.00 178.44 179.66 1h9a h LYS 131 N 1.16 -0.38 -0.62 1.13 1.63 -1.32 -0.53 116.57 117.64 1h9a h LYS 131 Ca 0.38 0.03 0.01 0.00 -0.85 0.00 0.00 60.65 60.22 1h9a h LYS 131 Cb 0.04 0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.73 1h9a h LYS 131 CO -0.12 -0.25 0.41 0.66 -3.45 0.00 0.00 179.45 176.69 1h9a h SER 132 N -1.01 0.68 -0.17 4.20 4.64 -1.21 -2.47 113.55 118.23 1h9a h SER 132 Ca -0.04 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1h9a h SER 132 Cb 0.30 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1h9a h SER 132 CO 0.07 0.49 0.00 -0.62 -0.87 0.00 0.00 176.83 175.90 1h9a n GLU 133 N -4.45 1.78 -2.75 4.77 -0.58 0.38 -4.98 120.64 114.81 1h9a n GLU 133 Ca 0.06 -1.16 -0.11 0.00 -0.42 0.00 0.00 57.16 55.53 1h9a n GLU 133 Cb 0.07 -1.41 0.02 0.00 -0.57 0.00 0.00 31.44 29.55 1h9a n GLU 133 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1h9a n GLY 134 N 1.16 0.12 0.08 0.62 0.00 -0.93 -4.87 105.19 101.37 1h9a n GLY 134 Ca 0.16 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 46.01 1h9a n GLY 134 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1h9a h LEU 135 N -0.88 0.00 -9.77 0.99 4.07 -1.35 -3.47 115.31 104.90 1h9a h LEU 135 Ca -0.27 -0.16 -0.52 0.00 0.08 0.00 0.00 57.88 57.02 1h9a h LEU 135 Cb 1.18 0.00 0.03 0.00 1.08 0.00 0.00 40.66 42.95 1h9a h LEU 135 CO 0.28 0.08 0.56 -0.76 -1.08 0.00 0.00 178.44 177.52 1h9a s LEU 136 N -4.51 4.48 0.44 1.67 1.43 -1.22 -5.00 118.68 115.97 1h9a s LEU 136 Ca 0.06 2.38 -0.23 0.00 -1.03 0.00 0.00 54.13 55.30 1h9a s LEU 136 Cb 0.12 -3.63 -0.08 0.00 0.03 0.00 0.00 46.19 42.64 1h9a s LEU 136 CO 0.72 -0.34 1.15 0.00 0.23 0.00 0.00 176.35 178.11 1h9a s ALA 137 N -0.72 3.02 -1.89 4.21 0.00 -1.26 -4.93 121.76 120.19 1h9a s ALA 137 Ca 0.49 0.91 0.25 0.00 0.00 0.00 0.00 51.96 53.60 1h9a s ALA 137 Cb -0.35 -3.37 0.38 0.00 0.00 0.00 0.00 23.12 19.79 1h9a s ALA 137 CO 0.42 -0.58 1.33 -0.25 0.00 0.00 0.00 175.76 176.69 1h9a n ASP 138 N -0.35 1.52 -4.31 0.00 8.00 -1.26 -4.88 116.55 115.26 1h9a n ASP 138 Ca 0.07 -1.20 -0.25 0.00 0.71 0.00 0.00 54.79 54.11 1h9a n ASP 138 Cb 0.48 0.31 -0.13 0.00 -0.02 0.00 0.00 41.12 41.76 1h9a n ASP 138 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1h9a s THR 139 N -2.49 1.85 0.00 -3.53 2.01 -1.26 -5.06 115.64 107.16 1h9a s THR 139 Ca 0.21 -1.61 0.00 0.00 0.31 0.00 0.00 61.69 60.60 1h9a s THR 139 Cb 0.19 -1.68 0.00 0.00 0.01 0.00 0.00 72.50 71.02 1h9a s THR 139 CO 0.55 -0.03 0.00 0.61 -0.69 0.00 0.00 174.62 175.06 1h9a n GLY 140 N 1.01 0.58 3.99 4.40 0.00 -1.26 -3.21 105.19 110.69 1h9a n GLY 140 Ca -0.19 -0.78 -0.18 0.00 0.00 0.00 0.00 46.02 44.87 1h9a n GLY 140 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1h9a s TYR 141 N 0.00 2.87 -0.09 1.61 -0.85 -1.26 -4.74 117.35 114.89 1h9a s TYR 141 Ca 0.00 -0.37 -0.03 0.00 -0.52 0.00 0.00 57.07 56.15 1h9a s TYR 141 Cb 0.00 -2.26 0.05 0.00 0.38 0.00 0.00 41.96 40.12 1h9a s TYR 141 CO 0.00 -0.29 0.12 -0.80 -1.52 0.00 0.00 175.55 173.06 1h9a s ASN 142 N -4.28 1.15 -0.01 -0.18 0.01 -1.26 -1.45 114.94 108.93 1h9a s ASN 142 Ca 0.52 0.08 0.04 0.00 -0.71 0.00 0.00 52.86 52.78 1h9a s ASN 142 Cb -0.09 0.08 -0.01 0.00 0.41 0.00 0.00 41.25 41.64 1h9a s ASN 142 CO 0.32 -0.27 -0.12 -0.13 -1.51 0.00 0.00 177.10 175.39 1h9a s ARG 143 N 2.23 0.98 -0.14 -0.60 0.52 -0.44 -4.84 118.95 116.67 1h9a s ARG 143 Ca 0.04 -0.46 -0.00 0.00 -0.52 0.00 0.00 55.73 54.79 1h9a s ARG 143 Cb -0.13 -0.95 -0.01 0.00 0.52 0.00 0.00 34.95 34.38 1h9a s ARG 143 CO -0.06 0.26 -0.13 -1.17 0.02 0.00 0.00 175.30 174.22 1h9a s LEU 144 N -0.35 2.70 -0.34 2.53 2.96 -0.41 -0.89 118.68 124.87 1h9a s LEU 144 Ca 0.04 -0.35 -0.08 0.00 -0.22 0.00 0.00 54.13 53.53 1h9a s LEU 144 Cb -0.05 -1.61 0.03 0.00 0.50 0.00 0.00 46.19 45.06 1h9a s LEU 144 CO -0.00 0.15 0.13 -0.04 -1.32 0.00 0.00 176.35 175.26 1h9a s MET 145 N 0.46 2.80 -0.25 1.98 -1.94 -0.26 -0.35 119.30 121.74 1h9a s MET 145 Ca -0.09 -1.07 -0.11 0.00 -1.71 0.00 0.00 55.69 52.71 1h9a s MET 145 Cb -0.16 -3.51 -0.05 0.00 2.01 0.00 0.00 34.83 33.12 1h9a s MET 145 CO 0.05 -0.62 0.16 0.42 -0.01 0.00 0.00 175.02 175.02 1h9a s ILE 146 N 1.47 5.32 0.93 2.53 1.09 -0.81 -1.69 121.20 130.05 1h9a s ILE 146 Ca 0.00 0.17 -0.13 0.00 -1.10 0.00 0.00 60.65 59.60 1h9a s ILE 146 Cb -0.19 -3.49 0.15 0.00 -1.06 0.00 0.00 42.46 37.87 1h9a s ILE 146 CO 0.04 0.32 1.14 -1.61 -0.10 0.00 0.00 174.94 174.73 1h9a s GLU 147 N 1.22 0.96 0.48 2.79 0.41 -1.24 -1.08 118.70 122.23 1h9a s GLU 147 Ca 0.07 0.28 -0.17 0.00 -0.41 0.00 0.00 54.97 54.74 1h9a s GLU 147 Cb -0.14 -1.82 -0.09 0.00 -1.78 0.00 0.00 34.13 30.30 1h9a s GLU 147 CO 0.06 -2.32 0.95 -1.59 -0.49 0.00 0.00 175.26 171.88 1h9a s LYS 148 N -5.27 4.02 0.45 1.61 -2.85 -1.26 -4.46 119.74 111.97 1h9a s LYS 148 Ca 0.64 0.96 0.00 0.00 -1.00 0.00 0.00 55.97 56.58 1h9a s LYS 148 Cb -0.15 -2.17 -0.00 0.00 -2.06 0.00 0.00 37.83 33.45 1h9a s LYS 148 CO 0.54 -0.18 0.67 -1.25 0.10 0.00 0.00 175.35 175.23 1h9a s PRO 149 N -3.78 3.07 -1.06 1.78 0.04 -1.26 -4.87 135.00 128.93 1h9a s PRO 149 Ca 0.59 -0.49 -0.06 0.00 0.04 0.00 0.00 61.00 61.08 1h9a s PRO 149 Cb -0.10 -2.56 0.27 0.00 0.04 0.00 0.00 34.50 32.15 1h9a s PRO 149 CO 0.26 -0.26 1.08 0.34 0.04 0.00 0.00 177.00 178.45 1h9a n PHE 150 N -2.07 4.68 0.00 0.56 7.35 -1.26 -4.97 117.46 121.75 1h9a n PHE 150 Ca 0.01 -3.83 0.00 0.00 -0.76 0.00 0.00 57.45 52.88 1h9a n PHE 150 Cb 0.58 -1.50 0.00 0.00 0.35 0.00 0.00 39.48 38.90 1h9a n PHE 150 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1h9a n GLY 151 N 2.40 -0.19 0.00 7.13 0.00 -1.26 -4.68 105.19 108.59 1h9a n GLY 151 Ca 0.24 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1h9a n GLY 151 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h9a n THR 152 N -0.12 0.33 -3.70 2.61 -2.24 -1.26 -4.91 114.28 105.00 1h9a n THR 152 Ca 0.00 -0.37 0.01 0.00 -2.27 0.00 0.00 64.05 61.42 1h9a n THR 152 Cb 0.00 0.94 -0.00 0.00 -2.10 0.00 0.00 70.33 69.17 1h9a n THR 152 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1h9a s SER 153 N -0.33 -0.05 0.16 3.42 1.04 -1.26 -5.00 113.70 111.68 1h9a s SER 153 Ca 0.00 -0.18 -0.13 0.00 0.48 0.00 0.00 55.95 56.12 1h9a s SER 153 Cb 0.00 0.19 0.05 0.00 0.10 0.00 0.00 66.02 66.36 1h9a s SER 153 CO 0.00 -0.35 1.70 0.22 0.98 0.00 0.00 173.24 175.78 1h9a h TYR 154 N 2.00 0.87 0.16 5.02 3.20 -1.94 -2.10 116.97 124.17 1h9a h TYR 154 Ca -0.29 -0.08 0.01 0.00 3.14 0.00 0.00 58.73 61.51 1h9a h TYR 154 Cb 1.20 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 39.19 1h9a h TYR 154 CO 0.55 0.73 -0.23 -0.44 -1.64 0.00 0.00 178.16 177.13 1h9a h ASP 155 N 0.75 -0.64 -0.64 -2.11 3.32 -1.97 0.43 116.42 115.56 1h9a h ASP 155 Ca 0.18 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.23 1h9a h ASP 155 Cb 0.26 0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.02 1h9a h ASP 155 CO -0.01 -0.33 0.15 0.71 -1.72 0.00 0.00 179.24 178.04 1h9a h THR 156 N -0.45 1.26 -0.66 0.35 1.35 -1.94 -0.76 112.91 112.06 1h9a h THR 156 Ca 0.02 -0.95 -0.06 0.00 -0.55 0.00 0.00 66.41 64.87 1h9a h THR 156 Cb 0.45 0.64 -0.03 0.00 -1.73 0.00 0.00 68.15 67.49 1h9a h THR 156 CO -0.10 0.36 0.17 0.00 -0.25 0.00 0.00 175.52 175.70 1h9a h ALA 157 N 1.05 1.07 -0.53 6.62 0.00 -1.15 0.22 119.26 126.54 1h9a h ALA 157 Ca 0.20 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1h9a h ALA 157 Cb 0.37 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1h9a h ALA 157 CO 0.00 0.62 0.07 0.00 0.00 0.00 0.00 179.25 179.95 1h9a h ALA 158 N 1.20 1.12 -0.11 0.00 0.00 0.21 0.21 119.26 121.90 1h9a h ALA 158 Ca 0.21 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1h9a h ALA 158 Cb 0.32 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1h9a h ALA 158 CO -0.00 0.57 -0.01 1.49 0.00 0.00 0.00 179.25 181.30 1h9a h GLU 159 N 0.81 0.20 -0.34 0.00 4.81 -0.46 -1.62 114.58 117.98 1h9a h GLU 159 Ca 0.17 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 59.33 1h9a h GLU 159 Cb 0.38 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1h9a h GLU 159 CO 0.01 0.48 0.21 1.25 -0.73 0.00 0.00 179.01 180.23 1h9a h LEU 160 N -0.11 0.35 -0.62 1.64 5.85 -0.74 -1.24 115.31 120.45 1h9a h LEU 160 Ca 0.03 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.80 1h9a h LEU 160 Cb 0.40 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 1h9a h LEU 160 CO 0.01 0.26 0.34 -0.61 -0.34 0.00 0.00 178.44 178.10 1h9a h GLN 161 N 0.43 0.63 -0.43 1.25 5.75 -0.89 0.11 115.11 121.96 1h9a h GLN 161 Ca 0.13 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.60 1h9a h GLN 161 Cb -0.03 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.36 1h9a h GLN 161 CO -0.04 0.41 0.27 -0.97 -2.65 0.00 0.00 178.83 175.85 1h9a h ASN 162 N 0.65 0.47 -0.71 -0.69 -0.73 -0.82 0.71 115.58 114.46 1h9a h ASN 162 Ca 0.27 -0.01 -0.06 0.00 1.87 0.00 0.00 56.30 58.37 1h9a h ASN 162 Cb 0.15 -0.11 -0.03 0.00 0.27 0.00 0.00 38.32 38.60 1h9a h ASN 162 CO -0.17 0.34 0.21 0.44 -0.37 0.00 0.00 177.43 177.88 1h9a h ASP 163 N 0.56 1.05 -0.26 1.15 3.32 -0.49 -2.86 116.42 118.88 1h9a h ASP 163 Ca 0.16 -0.21 -0.09 0.00 0.02 0.00 0.00 57.03 56.91 1h9a h ASP 163 Cb -0.05 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.21 1h9a h ASP 163 CO -0.05 0.99 -0.13 -0.07 -1.72 0.00 0.00 179.24 178.26 1h9a h LEU 164 N 1.06 0.67 0.00 1.55 3.38 -0.29 -2.75 115.31 118.93 1h9a h LEU 164 Ca 0.23 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1h9a h LEU 164 Cb 0.32 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1h9a h LEU 164 CO -0.00 0.83 0.00 -0.62 0.09 0.00 0.00 178.44 178.73 1h9a n GLU 165 N -4.17 0.50 -0.03 1.13 1.02 0.20 -1.74 120.64 117.55 1h9a n GLU 165 Ca 0.01 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.99 1h9a n GLU 165 Cb 0.36 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 30.26 1h9a n GLU 165 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1h9a h ASN 166 N 0.00 0.94 0.00 1.62 2.35 -1.51 -3.37 115.58 115.61 1h9a h ASN 166 Ca 0.00 -0.58 0.00 0.00 -0.55 0.00 0.00 56.30 55.17 1h9a h ASN 166 Cb 0.00 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.10 1h9a h ASN 166 CO 0.00 1.38 -0.76 0.00 -1.65 0.00 0.00 177.43 176.40 1h9a n ALA 167 N -2.59 2.70 -2.35 -0.83 0.00 -0.97 -5.03 120.51 111.43 1h9a n ALA 167 Ca -0.06 -0.20 -0.12 0.00 0.00 0.00 0.00 53.44 53.06 1h9a n ALA 167 Cb 0.71 -0.27 -0.10 0.00 0.00 0.00 0.00 19.45 19.79 1h9a n ALA 167 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1h9a s PHE 168 N -2.04 0.87 0.31 0.00 0.40 -0.71 -5.01 117.98 111.80 1h9a s PHE 168 Ca 0.01 -0.80 -0.01 0.00 -0.60 0.00 0.00 56.93 55.53 1h9a s PHE 168 Cb 0.05 -0.50 -0.04 0.00 0.51 0.00 0.00 43.02 43.04 1h9a s PHE 168 CO 0.31 -0.11 0.52 -0.51 0.70 0.00 0.00 175.22 176.13 1h9a s ASP 169 N -2.68 6.34 0.40 1.36 1.01 -1.26 -4.11 116.67 117.73 1h9a s ASP 169 Ca 0.07 0.48 0.11 0.00 0.71 0.00 0.00 52.55 53.92 1h9a s ASP 169 Cb 0.01 -2.05 0.91 0.00 1.01 0.00 0.00 42.92 42.81 1h9a s ASP 169 CO -0.03 -0.23 1.96 -0.78 0.21 0.00 0.00 175.17 176.30 1h9a h ASP 170 N 1.15 0.50 0.26 0.27 3.58 -1.96 -0.07 116.42 120.15 1h9a h ASP 170 Ca -0.49 0.01 0.00 0.00 0.42 0.00 0.00 57.03 56.97 1h9a h ASP 170 Cb 1.21 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.17 1h9a h ASP 170 CO 0.63 0.30 0.00 -0.46 -2.88 0.00 0.00 179.24 176.83 1h9a n ASN 171 N -4.48 0.00 -0.51 2.28 0.23 -1.26 -1.38 115.26 110.14 1h9a n ASN 171 Ca 0.11 0.40 0.10 0.00 -0.53 0.00 0.00 54.58 54.66 1h9a n ASN 171 Cb 0.34 -0.44 0.01 0.00 -2.08 0.00 0.00 39.78 37.62 1h9a n ASN 171 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1h9a n GLN 172 N -1.44 1.52 -3.46 -3.83 6.02 -0.04 -4.92 117.38 111.23 1h9a n GLN 172 Ca 0.03 -1.07 -0.37 0.00 -0.01 0.00 0.00 57.00 55.57 1h9a n GLN 172 Cb 0.09 -1.38 -0.07 0.00 1.02 0.00 0.00 30.24 29.89 1h9a n GLN 172 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1h9a s LEU 173 N -2.16 4.18 -0.48 1.08 1.43 -0.48 -1.29 118.68 120.96 1h9a s LEU 173 Ca 0.18 0.48 0.04 0.00 -1.03 0.00 0.00 54.13 53.79 1h9a s LEU 173 Cb 0.16 -2.43 0.13 0.00 0.03 0.00 0.00 46.19 44.07 1h9a s LEU 173 CO 0.45 -0.00 0.23 -0.36 0.23 0.00 0.00 176.35 176.89 1h9a s PHE 174 N 0.99 3.02 -0.11 0.29 0.40 0.53 -4.98 117.98 118.12 1h9a s PHE 174 Ca 0.17 -3.00 -0.30 0.00 -0.60 0.00 0.00 56.93 53.21 1h9a s PHE 174 Cb -0.14 -2.65 -0.02 0.00 0.51 0.00 0.00 43.02 40.71 1h9a s PHE 174 CO 0.06 -0.78 1.24 1.03 0.70 0.00 0.00 175.22 177.48 1h9a s ARG 175 N 0.00 4.29 0.11 0.44 0.52 -1.26 -1.93 118.95 121.12 1h9a s ARG 175 Ca 0.16 1.68 -0.30 0.00 -0.52 0.00 0.00 55.73 56.75 1h9a s ARG 175 Cb -0.25 -3.66 -0.07 0.00 0.52 0.00 0.00 34.95 31.50 1h9a s ARG 175 CO -0.01 -0.57 1.20 0.42 0.02 0.00 0.00 175.30 176.35 1h9a s ILE 176 N 2.83 3.87 -0.36 1.52 -1.09 -0.24 -4.63 121.20 123.10 1h9a s ILE 176 Ca 0.56 1.42 0.05 0.00 -2.23 0.00 0.00 60.65 60.44 1h9a s ILE 176 Cb -0.23 -3.91 0.17 0.00 -1.58 0.00 0.00 42.46 36.91 1h9a s ILE 176 CO 0.19 0.15 0.50 -0.62 -1.23 0.00 0.00 174.94 173.93 1h9a s ASP 177 N 0.71 -0.36 0.66 3.58 -1.08 -1.26 -4.41 116.67 114.52 1h9a s ASP 177 Ca 0.57 -0.78 0.35 0.00 -0.52 0.00 0.00 52.55 52.16 1h9a s ASP 177 Cb -0.31 1.39 1.91 0.00 -1.46 0.00 0.00 42.92 44.46 1h9a s ASP 177 CO 0.32 -0.25 2.09 1.12 0.52 0.00 0.00 175.17 178.96 1h9a h HIS 178 N 7.42 0.00 -0.16 -5.34 2.07 -1.95 -1.00 115.15 116.19 1h9a h HIS 178 Ca 0.01 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.41 1h9a h HIS 178 Cb 1.13 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.10 1h9a h HIS 178 CO 0.24 0.00 -0.44 1.88 -3.07 0.00 0.00 177.93 176.54 1h9a h TYR 179 N 0.00 0.45 0.00 6.12 -1.99 -1.97 -2.59 116.97 116.99 1h9a h TYR 179 Ca 0.01 -0.13 0.00 0.00 2.00 0.00 0.00 58.73 60.61 1h9a h TYR 179 Cb 0.43 -0.09 0.00 0.00 2.00 0.00 0.00 36.73 39.07 1h9a h TYR 179 CO 0.00 0.75 0.00 -0.07 -0.00 0.00 0.00 178.16 178.84 1h9a h LEU 180 N 0.31 0.00 -1.18 3.88 3.38 -1.50 -2.72 115.31 117.47 1h9a h LEU 180 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1h9a h LEU 180 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1h9a h LEU 180 CO 0.07 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.21 1h9a n GLY 181 N 0.42 0.46 3.69 0.83 0.00 -0.98 -4.77 105.19 104.83 1h9a n GLY 181 Ca 0.02 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 1h9a n GLY 181 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h9a s LYS 182 N -1.65 4.38 0.27 1.61 1.02 -1.03 -4.38 119.74 119.96 1h9a s LYS 182 Ca 0.27 0.99 -0.03 0.00 0.02 0.00 0.00 55.97 57.22 1h9a s LYS 182 Cb 0.14 -3.51 0.57 0.00 -0.52 0.00 0.00 37.83 34.52 1h9a s LYS 182 CO 0.20 -0.13 1.61 1.49 -0.92 0.00 0.00 175.35 177.60 1h9a h GLU 183 N 7.05 0.07 -0.11 1.68 4.57 -1.89 -1.01 114.58 124.92 1h9a h GLU 183 Ca -0.35 -0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 57.74 1h9a h GLU 183 Cb 1.17 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.73 1h9a h GLU 183 CO 0.79 0.04 -0.29 0.52 -1.18 0.00 0.00 179.01 178.89 1h9a h MET 184 N 0.07 0.21 -0.12 1.92 2.86 -1.94 -2.37 114.93 115.57 1h9a h MET 184 Ca 0.50 -0.08 -0.06 0.00 -2.06 0.00 0.00 59.70 58.00 1h9a h MET 184 Cb 0.94 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.57 1h9a h MET 184 CO -0.79 0.49 -0.19 0.28 1.06 0.00 0.00 176.91 177.76 1h9a h VAL 185 N 0.19 1.20 0.00 -2.22 2.07 -1.49 -1.16 116.25 114.83 1h9a h VAL 185 Ca 0.03 -0.92 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1h9a h VAL 185 Cb 0.62 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 1h9a h VAL 185 CO 0.05 0.28 0.00 0.00 0.02 0.00 0.00 177.57 177.91 1h9a n GLN 186 N -4.23 0.20 0.09 1.57 6.02 -0.90 -3.06 117.38 117.06 1h9a n GLN 186 Ca -0.01 0.02 0.12 0.00 -0.01 0.00 0.00 57.00 57.12 1h9a n GLN 186 Cb 0.31 -1.50 0.27 0.00 1.02 0.00 0.00 30.24 30.33 1h9a n GLN 186 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 1h9a h ASN 187 N 0.00 0.00 0.29 1.08 2.35 -1.05 -3.37 115.58 114.88 1h9a h ASN 187 Ca 0.00 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 1h9a h ASN 187 Cb 0.38 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 1h9a h ASN 187 CO 0.00 0.06 -0.20 0.40 -1.65 0.00 0.00 177.43 176.03 1h9a h ILE 188 N 0.00 0.57 -0.34 2.81 2.04 -1.59 -0.78 117.51 120.22 1h9a h ILE 188 Ca 0.00 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 1h9a h ILE 188 Cb 0.76 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 1h9a h ILE 188 CO 0.00 0.00 0.12 0.00 0.00 0.00 0.00 178.15 178.27 1h9a h ALA 189 N 0.19 1.59 -0.22 1.87 0.00 -1.80 -1.08 119.26 119.80 1h9a h ALA 189 Ca -0.02 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1h9a h ALA 189 Cb 0.42 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1h9a h ALA 189 CO 0.01 0.32 -0.06 0.00 0.00 0.00 0.00 179.25 179.52 1h9a h ALA 190 N 1.66 0.30 -0.34 0.00 0.00 -1.64 -1.42 119.26 117.83 1h9a h ALA 190 Ca 0.12 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1h9a h ALA 190 Cb 0.12 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1h9a h ALA 190 CO -0.01 0.10 0.11 -0.07 0.00 0.00 0.00 179.25 179.38 1h9a h LEU 191 N 0.15 0.49 0.24 0.00 3.38 -0.77 -0.37 115.31 118.43 1h9a h LEU 191 Ca 0.05 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1h9a h LEU 191 Cb 0.53 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1h9a h LEU 191 CO 0.02 0.56 -0.12 -0.09 0.09 0.00 0.00 178.44 178.90 1h9a h ARG 192 N 0.39 -0.32 0.00 1.13 2.43 -1.21 -3.24 114.38 113.56 1h9a h ARG 192 Ca 0.11 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1h9a h ARG 192 Cb 0.24 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1h9a h ARG 192 CO -0.00 -0.21 -0.06 0.74 -1.51 0.00 0.00 179.97 178.92 1h9a h PHE 193 N -0.41 0.00 -0.00 2.20 0.04 -1.37 -2.82 116.94 114.58 1h9a h PHE 193 Ca -0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1h9a h PHE 193 Cb 0.25 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.40 1h9a h PHE 193 CO 0.12 0.06 -0.24 0.41 -0.60 0.00 0.00 178.31 178.06 1h9a n GLY 194 N 0.45 -1.32 2.81 -1.45 0.00 -0.15 -4.70 105.19 100.83 1h9a n GLY 194 Ca 0.02 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 1h9a n GLY 194 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h9a s ASN 195 N -2.94 3.52 0.46 1.61 0.01 -1.21 -5.03 114.94 111.36 1h9a s ASN 195 Ca 0.14 -1.16 0.24 0.00 -0.71 0.00 0.00 52.86 51.37 1h9a s ASN 195 Cb 0.18 -0.87 1.26 0.00 0.41 0.00 0.00 41.25 42.23 1h9a s ASN 195 CO 0.60 -0.31 1.83 -0.65 -1.51 0.00 0.00 177.10 177.05 1h9a h PRO 196 N 8.10 0.24 0.00 -0.60 0.11 -1.84 -0.18 132.00 137.83 1h9a h PRO 196 Ca -0.16 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.88 1h9a h PRO 196 Cb 1.08 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1h9a h PRO 196 CO 0.40 0.16 -0.26 -0.84 -0.21 0.00 0.00 178.00 177.24 1h9a h ILE 197 N 0.25 0.94 0.08 4.15 3.07 -1.96 -1.46 117.51 122.57 1h9a h ILE 197 Ca 0.52 -0.99 -0.35 0.00 1.55 0.00 0.00 64.86 65.60 1h9a h ILE 197 Cb 1.58 1.57 -0.03 0.00 -0.27 0.00 0.00 36.82 39.67 1h9a h ILE 197 CO -0.15 0.26 -1.93 0.49 -1.05 0.00 0.00 178.15 175.76 1h9a n PHE 198 N -3.87 1.02 -0.12 0.16 3.72 -0.27 -3.74 117.46 114.36 1h9a n PHE 198 Ca -0.02 0.26 -0.04 0.00 -0.05 0.00 0.00 57.45 57.60 1h9a n PHE 198 Cb 0.35 -1.13 0.03 0.00 -0.94 0.00 0.00 39.48 37.79 1h9a n PHE 198 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 1h9a h ASP 199 N -0.20 -0.18 0.81 4.37 3.58 -0.84 -1.15 116.42 122.81 1h9a h ASP 199 Ca -0.44 0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.09 1h9a h ASP 199 Cb 1.85 0.17 -0.00 0.00 1.72 0.00 0.00 39.33 43.07 1h9a h ASP 199 CO -0.02 -0.05 -0.07 0.00 -2.88 0.00 0.00 179.24 176.22 1h9a h ALA 200 N 1.36 1.04 -0.02 -0.78 0.00 -1.46 -2.93 119.26 116.47 1h9a h ALA 200 Ca 0.20 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1h9a h ALA 200 Cb 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1h9a h ALA 200 CO -0.34 0.08 -0.14 0.00 0.00 0.00 0.00 179.25 178.85 1h9a n ALA 201 N -2.14 2.79 -1.51 0.00 0.00 -0.54 -4.71 120.51 114.40 1h9a n ALA 201 Ca -0.00 -0.65 -0.40 0.00 0.00 0.00 0.00 53.44 52.39 1h9a n ALA 201 Cb 0.30 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 18.89 1h9a n ALA 201 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1h9a n TRP 202 N 0.81 2.81 -3.83 0.00 -0.00 -0.55 -4.14 117.44 112.54 1h9a n TRP 202 Ca 0.13 -3.04 -0.06 0.00 -0.00 0.00 0.00 57.50 54.53 1h9a n TRP 202 Cb 0.54 -2.48 0.01 0.00 -0.00 0.00 0.00 31.31 29.38 1h9a n TRP 202 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1h9a s ASN 203 N 2.40 -0.04 0.60 5.87 2.20 -1.26 -5.01 114.94 119.70 1h9a s ASN 203 Ca 0.61 -0.85 0.30 0.00 -0.94 0.00 0.00 52.86 51.98 1h9a s ASN 203 Cb 0.16 0.67 1.68 0.00 -2.00 0.00 0.00 41.25 41.76 1h9a s ASN 203 CO -0.07 -1.32 2.08 0.07 -2.94 0.00 0.00 177.10 174.93 1h9a h LYS 204 N 2.00 0.00 0.00 3.55 2.10 -0.71 -0.95 116.57 122.56 1h9a h LYS 204 Ca -0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 1h9a h LYS 204 Cb 1.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 1h9a h LYS 204 CO 0.36 0.00 0.00 -0.44 -2.00 0.00 0.00 179.45 177.37 1h9a h ASP 205 N 0.00 0.00 0.00 7.07 3.32 -1.90 -3.37 116.42 121.55 1h9a h ASP 205 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1h9a h ASP 205 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1h9a h ASP 205 CO -0.00 0.00 -0.83 -1.22 -1.72 0.00 0.00 179.24 175.46 1h9a n TYR 206 N -2.39 0.00 -3.25 4.55 4.01 -0.86 -4.94 117.16 114.28 1h9a n TYR 206 Ca 0.04 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.39 1h9a n TYR 206 Cb 0.36 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.34 1h9a n TYR 206 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1h9a s ILE 207 N -1.83 4.98 -0.17 -0.72 1.01 -0.42 -0.50 121.20 123.55 1h9a s ILE 207 Ca 0.00 1.15 -0.11 0.00 0.00 0.00 0.00 60.65 61.69 1h9a s ILE 207 Cb 0.00 -3.89 -0.22 0.00 0.01 0.00 0.00 42.46 38.36 1h9a s ILE 207 CO 0.00 0.41 0.21 1.17 0.00 0.00 0.00 174.94 176.73 1h9a n LYS 208 N 2.85 0.68 -3.49 2.79 4.81 0.11 -4.64 118.16 121.26 1h9a n LYS 208 Ca -0.07 0.35 -0.10 0.00 -0.87 0.00 0.00 58.31 57.61 1h9a n LYS 208 Cb 0.51 -1.69 -0.03 0.00 0.02 0.00 0.00 35.03 33.85 1h9a n LYS 208 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1h9a s ASN 209 N -6.97 -0.44 -0.06 3.14 2.20 -1.16 -4.23 114.94 107.43 1h9a s ASN 209 Ca -0.27 0.09 0.06 0.00 -0.94 0.00 0.00 52.86 51.80 1h9a s ASN 209 Cb 0.07 0.44 -0.01 0.00 -2.00 0.00 0.00 41.25 39.75 1h9a s ASN 209 CO 0.68 -0.68 -0.24 -0.69 -2.94 0.00 0.00 177.10 173.22 1h9a s VAL 210 N -2.96 2.15 -0.07 3.54 1.01 -0.93 -1.64 120.40 121.50 1h9a s VAL 210 Ca 0.02 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 61.01 1h9a s VAL 210 Cb -0.01 -1.78 0.00 0.00 0.00 0.00 0.00 36.38 34.59 1h9a s VAL 210 CO -0.08 0.57 -0.20 -1.10 0.00 0.00 0.00 175.10 174.30 1h9a s GLN 211 N -0.21 2.35 -0.15 2.72 -0.21 0.46 -0.19 119.66 124.43 1h9a s GLN 211 Ca -0.02 -0.70 0.01 0.00 0.02 0.00 0.00 55.36 54.66 1h9a s GLN 211 Cb -0.13 -1.89 0.02 0.00 1.00 0.00 0.00 33.01 32.01 1h9a s GLN 211 CO 0.03 0.18 -0.16 0.08 -2.12 0.00 0.00 175.29 173.31 1h9a s VAL 212 N 0.29 1.71 -0.08 1.09 1.01 0.15 -0.70 120.40 123.87 1h9a s VAL 212 Ca -0.12 -0.72 0.04 0.00 0.00 0.00 0.00 61.98 61.17 1h9a s VAL 212 Cb -0.15 -1.58 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 1h9a s VAL 212 CO 0.05 0.48 -0.22 -0.89 0.00 0.00 0.00 175.10 174.53 1h9a s THR 213 N 1.39 2.28 -0.52 3.92 2.01 -0.34 -1.40 115.64 122.98 1h9a s THR 213 Ca 0.04 -0.96 0.05 0.00 0.31 0.00 0.00 61.69 61.13 1h9a s THR 213 Cb -0.13 -1.87 0.19 0.00 0.01 0.00 0.00 72.50 70.70 1h9a s THR 213 CO -0.11 0.56 0.45 0.18 -0.69 0.00 0.00 174.62 175.02 1h9a n LEU 214 N 3.20 1.03 -4.90 4.42 4.32 -0.42 -1.13 117.00 123.52 1h9a n LEU 214 Ca -0.18 -4.77 -0.30 0.00 -0.02 0.00 0.00 56.01 50.74 1h9a n LEU 214 Cb 0.52 0.07 -0.04 0.00 -1.62 0.00 0.00 43.42 42.35 1h9a n LEU 214 CO 0.27 1.88 0.10 -0.94 -1.22 0.00 0.00 177.39 177.49 1h9a s SER 215 N -0.82 6.48 0.06 -1.43 1.04 0.52 -3.11 113.70 116.44 1h9a s SER 215 Ca 0.32 0.64 0.02 0.00 0.48 0.00 0.00 55.95 57.41 1h9a s SER 215 Cb 0.05 -2.11 -0.03 0.00 0.10 0.00 0.00 66.02 64.03 1h9a s SER 215 CO -0.16 -0.05 -0.07 -1.61 0.98 0.00 0.00 173.24 172.33 1h9a s GLU 216 N -3.03 0.60 -0.11 4.02 2.02 -0.90 -1.59 118.70 119.73 1h9a s GLU 216 Ca 0.42 -0.91 0.20 0.00 0.02 0.00 0.00 54.97 54.70 1h9a s GLU 216 Cb -0.11 -0.25 -0.30 0.00 0.10 0.00 0.00 34.13 33.57 1h9a s GLU 216 CO 0.26 0.03 0.30 1.33 0.02 0.00 0.00 175.26 177.19 1h9a n VAL 217 N 1.05 0.62 -1.35 2.63 0.24 -1.26 -0.83 118.33 119.43 1h9a n VAL 217 Ca -0.20 -0.66 -0.29 0.00 -2.04 0.00 0.00 64.34 61.15 1h9a n VAL 217 Cb 0.56 -0.21 0.13 0.00 -1.47 0.00 0.00 33.84 32.86 1h9a n VAL 217 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1h9a s LEU 218 N -4.95 2.22 0.00 1.34 1.43 -1.26 -3.73 118.68 113.73 1h9a s LEU 218 Ca -0.09 1.31 0.00 0.00 -1.03 0.00 0.00 54.13 54.32 1h9a s LEU 218 Cb 0.10 -3.74 0.00 0.00 0.03 0.00 0.00 46.19 42.59 1h9a s LEU 218 CO 0.87 -2.51 0.00 0.61 0.23 0.00 0.00 176.35 175.56 1h9a n GLY 219 N -1.56 3.09 0.28 -3.19 0.00 -1.26 -1.18 105.19 101.37 1h9a n GLY 219 Ca 0.07 -2.09 0.14 0.00 0.00 0.00 0.00 46.02 44.14 1h9a n GLY 219 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1h9a h VAL 220 N 0.13 0.51 0.00 1.61 3.04 -1.98 -3.48 116.25 116.08 1h9a h VAL 220 Ca 0.00 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 1h9a h VAL 220 Cb 0.00 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 30.46 1h9a h VAL 220 CO 0.00 0.06 0.00 -0.62 -1.01 0.00 0.00 177.57 176.00 1h9a n GLU 221 N -3.70 0.00 0.00 4.17 -0.58 -1.26 -1.93 120.64 117.34 1h9a n GLU 221 Ca -0.02 0.00 0.14 0.00 -0.42 0.00 0.00 57.16 56.86 1h9a n GLU 221 Cb 0.16 0.00 0.65 0.00 -0.57 0.00 0.00 31.44 31.68 1h9a n GLU 221 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1h9a n GLU 222 N 14.00 0.77 -0.28 3.49 -0.58 -1.26 -4.15 120.64 132.64 1h9a n GLU 222 Ca 0.00 -0.24 0.02 0.00 -0.42 0.00 0.00 57.16 56.52 1h9a n GLU 222 Cb 0.00 -1.50 0.13 0.00 -0.57 0.00 0.00 31.44 29.50 1h9a n GLU 222 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1h9a n ARG 223 N -0.91 2.20 -0.34 3.49 5.12 -0.81 -4.48 116.66 120.94 1h9a n ARG 223 Ca 0.16 -1.00 0.08 0.00 -1.93 0.00 0.00 57.85 55.15 1h9a n ARG 223 Cb 0.26 -1.70 0.24 0.00 -1.16 0.00 0.00 32.46 30.10 1h9a n ARG 223 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1h9a h ALA 224 N 2.72 1.45 -0.89 7.54 0.00 -1.72 -0.59 119.26 127.76 1h9a h ALA 224 Ca 0.00 0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.12 1h9a h ALA 224 Cb 0.92 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.47 1h9a h ALA 224 CO 0.15 0.09 0.47 0.78 0.00 0.00 0.00 179.25 180.74 1h9a h GLY 225 N 0.85 1.50 0.00 0.00 0.00 -1.86 -1.84 103.07 101.72 1h9a h GLY 225 Ca 0.49 -0.27 -0.14 0.00 0.00 0.00 0.00 47.33 47.41 1h9a h GLY 225 CO -0.30 -0.08 -0.97 -1.82 0.00 0.00 0.00 176.54 173.37 1h9a h TYR 226 N 0.63 0.00 -0.72 5.60 3.20 -1.78 -3.42 116.97 120.48 1h9a h TYR 226 Ca 0.51 0.00 0.16 0.00 3.14 0.00 0.00 58.73 62.53 1h9a h TYR 226 Cb 0.77 0.00 -0.11 0.00 1.54 0.00 0.00 36.73 38.93 1h9a h TYR 226 CO -0.08 0.92 0.13 -0.92 -1.64 0.00 0.00 178.16 176.57 1h9a h TYR 227 N -1.00 0.18 -0.73 -3.82 3.20 -1.07 -2.27 116.97 111.47 1h9a h TYR 227 Ca -0.22 0.04 0.21 0.00 3.14 0.00 0.00 58.73 61.91 1h9a h TYR 227 Cb 0.99 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 39.27 1h9a h TYR 227 CO -0.02 -0.12 0.52 0.22 -1.64 0.00 0.00 178.16 177.12 1h9a h ASP 228 N 0.22 0.00 0.61 -2.11 3.58 -1.57 0.13 116.42 117.28 1h9a h ASP 228 Ca 0.40 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.85 1h9a h ASP 228 Cb 0.69 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.74 1h9a h ASP 228 CO -0.53 0.00 -1.20 0.41 -2.88 0.00 0.00 179.24 175.04 1h9a n THR 229 N -4.32 0.34 -0.09 2.25 -1.04 -0.87 -4.61 114.28 105.94 1h9a n THR 229 Ca 0.14 -0.43 -0.11 0.00 -2.04 0.00 0.00 64.05 61.62 1h9a n THR 229 Cb 0.80 -0.09 -0.04 0.00 -1.82 0.00 0.00 70.33 69.18 1h9a n THR 229 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1h9a n ALA 230 N -2.07 0.79 -0.06 2.41 0.00 0.15 -5.03 120.51 116.70 1h9a n ALA 230 Ca -0.00 -0.72 0.01 0.00 0.00 0.00 0.00 53.44 52.73 1h9a n ALA 230 Cb 0.51 0.01 -0.00 0.00 0.00 0.00 0.00 19.45 19.97 1h9a n ALA 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h9a n GLY 231 N 1.48 -1.58 0.25 0.00 0.00 0.21 -3.17 105.19 102.38 1h9a n GLY 231 Ca -0.17 -1.51 0.05 0.00 0.00 0.00 0.00 46.02 44.39 1h9a n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h9a h ALA 232 N -0.06 1.73 0.16 4.61 0.00 -1.46 -0.81 119.26 123.43 1h9a h ALA 232 Ca -0.00 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.81 1h9a h ALA 232 Cb 0.06 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1h9a h ALA 232 CO 0.00 0.21 -0.25 1.25 0.00 0.00 0.00 179.25 180.46 1h9a h LEU 233 N 0.15 -0.68 0.06 0.00 5.85 -1.81 -0.03 115.31 118.85 1h9a h LEU 233 Ca 0.04 0.07 -0.30 0.00 0.84 0.00 0.00 57.88 58.53 1h9a h LEU 233 Cb 0.19 0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 1h9a h LEU 233 CO 0.01 -0.34 -1.66 -0.07 -0.34 0.00 0.00 178.44 176.04 1h9a h LEU 234 N -0.47 0.20 -0.45 2.25 4.07 -1.48 -1.06 115.31 118.37 1h9a h LEU 234 Ca 0.02 -0.37 -0.18 0.00 0.08 0.00 0.00 57.88 57.44 1h9a h LEU 234 Cb 0.48 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 1h9a h LEU 234 CO -0.11 1.32 -0.71 -0.78 -1.08 0.00 0.00 178.44 177.07 1h9a h ASP 235 N 0.04 0.42 0.00 -0.43 3.58 -1.19 -3.41 116.42 115.43 1h9a h ASP 235 Ca -0.28 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 56.90 1h9a h ASP 235 Cb 2.00 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 42.93 1h9a h ASP 235 CO 0.11 1.00 -0.84 0.23 -2.88 0.00 0.00 179.24 176.86 1h9a n MET 236 N -3.83 1.27 0.04 0.28 2.81 -0.13 -4.79 117.12 112.76 1h9a n MET 236 Ca -0.04 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.82 1h9a n MET 236 Cb 0.69 -0.92 -0.02 0.00 -0.71 0.00 0.00 33.22 32.26 1h9a n MET 236 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1h9a h ILE 237 N 0.00 0.04 -0.87 2.02 1.08 -1.14 -1.81 117.51 116.82 1h9a h ILE 237 Ca 0.00 -0.86 0.19 0.00 -0.39 0.00 0.00 64.86 63.79 1h9a h ILE 237 Cb 0.84 0.07 -0.11 0.00 -3.07 0.00 0.00 36.82 34.55 1h9a h ILE 237 CO 0.00 0.01 0.40 -0.61 -0.69 0.00 0.00 178.15 177.27 1h9a h GLN 238 N -1.05 0.47 0.00 2.37 -0.00 -1.41 -1.75 115.11 113.73 1h9a h GLN 238 Ca -0.02 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 1h9a h GLN 238 Cb 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 27.48 27.56 1h9a h GLN 238 CO 0.04 0.31 0.00 0.27 0.00 0.00 0.00 178.83 179.45 1h9a n ASN 239 N -4.98 0.00 0.31 -0.69 0.23 -1.26 -4.38 115.26 104.49 1h9a n ASN 239 Ca 0.20 0.09 -0.16 0.00 -0.53 0.00 0.00 54.58 54.18 1h9a n ASN 239 Cb 0.56 -0.30 -0.08 0.00 -2.08 0.00 0.00 39.78 37.88 1h9a n ASN 239 CO 0.00 0.00 0.00 0.45 -0.93 0.00 0.00 177.26 176.78 1h9a h HIS 240 N 0.00 -0.71 -0.12 -2.53 3.86 -1.70 -2.64 115.15 111.31 1h9a h HIS 240 Ca 0.00 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1h9a h HIS 240 Cb 0.00 0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.70 1h9a h HIS 240 CO 0.00 -0.40 0.08 1.15 0.86 0.00 0.00 177.93 179.61 1h9a h THR 241 N -0.86 1.04 -0.82 2.45 2.02 -1.32 -2.10 112.91 113.32 1h9a h THR 241 Ca -0.08 -0.08 0.04 0.00 0.77 0.00 0.00 66.41 67.06 1h9a h THR 241 Cb 0.62 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.86 1h9a h THR 241 CO 0.13 0.04 0.52 0.24 0.37 0.00 0.00 175.52 176.81 1h9a h MET 242 N 0.15 0.95 -0.06 6.66 2.86 -1.37 -1.06 114.93 123.06 1h9a h MET 242 Ca 0.04 -0.06 -0.13 0.00 -2.06 0.00 0.00 59.70 57.49 1h9a h MET 242 Cb -0.01 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.42 1h9a h MET 242 CO -0.01 0.63 -0.55 1.96 1.06 0.00 0.00 176.91 180.00 1h9a h GLN 243 N 0.98 0.18 -0.33 1.72 1.08 -1.31 -1.43 115.11 116.00 1h9a h GLN 243 Ca 0.34 -0.11 -0.09 0.00 -1.45 0.00 0.00 58.65 57.34 1h9a h GLN 243 Cb 0.07 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.50 1h9a h GLN 243 CO -0.14 0.69 -0.14 0.82 -0.95 0.00 0.00 178.83 179.11 1h9a h ILE 244 N 0.14 1.29 -0.63 2.54 2.04 -0.92 -2.61 117.51 119.35 1h9a h ILE 244 Ca -0.00 -1.23 0.05 0.00 1.00 0.00 0.00 64.86 64.68 1h9a h ILE 244 Cb 1.02 1.39 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 1h9a h ILE 244 CO 0.08 0.40 0.42 0.58 0.00 0.00 0.00 178.15 179.63 1h9a h VAL 245 N 0.45 1.04 -0.79 1.67 2.07 -0.98 -1.37 116.25 118.33 1h9a h VAL 245 Ca 0.08 -0.23 0.06 0.00 0.82 0.00 0.00 66.70 67.42 1h9a h VAL 245 Cb 0.66 0.30 -0.06 0.00 -1.52 0.00 0.00 31.29 30.67 1h9a h VAL 245 CO 0.04 0.12 0.48 1.23 0.02 0.00 0.00 177.57 179.47 1h9a h GLY 246 N 0.68 1.18 1.07 2.17 0.00 -0.87 0.61 103.07 107.90 1h9a h GLY 246 Ca 0.27 -0.35 -0.08 0.00 0.00 0.00 0.00 47.33 47.17 1h9a h GLY 246 CO -0.08 0.25 0.13 1.49 0.00 0.00 0.00 176.54 178.33 1h9a h TRP 247 N 0.89 1.19 -0.31 5.60 4.06 -1.15 -2.49 115.95 123.74 1h9a h TRP 247 Ca 0.34 -0.16 -0.16 0.00 2.06 0.00 0.00 58.89 60.97 1h9a h TRP 247 Cb 0.14 -0.33 -0.00 0.00 -1.00 0.00 0.00 29.16 27.97 1h9a h TRP 247 CO -0.04 0.98 -0.43 -0.07 -3.56 0.00 0.00 178.44 175.31 1h9a h LEU 248 N 1.05 0.92 0.00 -4.49 3.38 -1.00 -3.34 115.31 111.83 1h9a h LEU 248 Ca 0.21 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1h9a h LEU 248 Cb 0.42 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1h9a h LEU 248 CO 0.01 1.24 -0.58 0.00 0.09 0.00 0.00 178.44 179.20 1h9a n ALA 249 N -2.54 3.53 -1.17 1.53 0.00 0.12 -4.98 120.51 116.99 1h9a n ALA 249 Ca -0.04 -0.36 -0.35 0.00 0.00 0.00 0.00 53.44 52.70 1h9a n ALA 249 Cb 0.57 -1.10 0.09 0.00 0.00 0.00 0.00 19.45 19.01 1h9a n ALA 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h9a n MET 250 N -1.61 0.22 -1.85 0.00 0.00 -0.94 -4.72 117.12 108.22 1h9a n MET 250 Ca 0.05 0.13 -0.29 0.00 0.00 0.00 0.00 57.70 57.58 1h9a n MET 250 Cb 0.35 -2.01 0.13 0.00 0.00 0.00 0.00 33.22 31.69 1h9a n MET 250 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 1h9a s GLU 251 N -3.25 1.39 -0.19 3.17 0.41 -0.86 -4.96 118.70 114.40 1h9a s GLU 251 Ca 0.67 -0.03 -0.29 0.00 -0.41 0.00 0.00 54.97 54.90 1h9a s GLU 251 Cb -0.31 -1.90 0.00 0.00 -1.78 0.00 0.00 34.13 30.14 1h9a s GLU 251 CO 0.57 -1.97 1.04 0.21 -0.49 0.00 0.00 175.26 174.62 1h9a s LYS 252 N -5.64 4.30 0.75 1.61 2.20 -1.26 -4.79 119.74 116.92 1h9a s LYS 252 Ca 0.66 1.38 -0.11 0.00 -0.36 0.00 0.00 55.97 57.54 1h9a s LYS 252 Cb -0.09 -3.62 0.05 0.00 -1.51 0.00 0.00 37.83 32.66 1h9a s LYS 252 CO 0.51 -0.55 1.09 -1.25 -0.36 0.00 0.00 175.35 174.79 1h9a s PRO 253 N 2.88 2.40 0.28 4.03 0.04 -1.26 -4.96 135.00 138.41 1h9a s PRO 253 Ca 0.46 1.14 0.11 0.00 0.04 0.00 0.00 61.00 62.74 1h9a s PRO 253 Cb -0.16 -1.92 0.40 0.00 0.04 0.00 0.00 34.50 32.86 1h9a s PRO 253 CO 0.10 -1.53 1.64 0.93 0.04 0.00 0.00 177.00 178.17 1h9a h GLU 254 N -1.01 0.00 -3.21 4.56 5.08 -1.95 -3.46 114.58 114.59 1h9a h GLU 254 Ca -0.44 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 57.95 1h9a h GLU 254 Cb 1.23 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.42 1h9a h GLU 254 CO 0.52 0.59 0.12 -1.54 -1.00 0.00 0.00 179.01 177.70 1h9a s SER 255 N -6.86 -0.19 -0.33 1.42 1.04 -1.26 -5.05 113.70 102.48 1h9a s SER 255 Ca -0.01 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.68 1h9a s SER 255 Cb 0.13 0.69 0.31 0.00 0.10 0.00 0.00 66.02 67.25 1h9a s SER 255 CO 0.76 -1.30 1.82 0.33 0.98 0.00 0.00 173.24 175.84 1h9a n PHE 256 N -0.44 1.82 -3.33 5.02 7.35 -1.26 -4.37 117.46 122.25 1h9a n PHE 256 Ca -0.03 -1.81 -0.33 0.00 -0.76 0.00 0.00 57.45 54.52 1h9a n PHE 256 Cb 0.60 -0.89 -0.06 0.00 0.35 0.00 0.00 39.48 39.48 1h9a n PHE 256 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1h9a s THR 257 N -2.42 4.85 0.34 -2.13 -4.23 -1.26 -4.91 115.64 105.87 1h9a s THR 257 Ca 0.35 0.68 0.10 0.00 -1.18 0.00 0.00 61.69 61.65 1h9a s THR 257 Cb 0.29 -3.65 0.33 0.00 1.34 0.00 0.00 72.50 70.80 1h9a s THR 257 CO 0.02 -0.02 1.78 -2.24 -0.54 0.00 0.00 174.62 173.62 1h9a h ASP 258 N 2.74 0.66 -0.47 3.99 3.04 -1.95 0.36 116.42 124.79 1h9a h ASP 258 Ca -0.47 0.10 -0.03 0.00 -3.24 0.00 0.00 57.03 53.38 1h9a h ASP 258 Cb 1.18 -0.02 -0.02 0.00 -1.04 0.00 0.00 39.33 39.43 1h9a h ASP 258 CO 0.67 0.20 0.17 0.50 -2.04 0.00 0.00 179.24 178.74 1h9a h LYS 259 N 0.62 0.71 -0.09 4.15 3.64 -1.96 -1.18 116.57 122.46 1h9a h LYS 259 Ca 0.58 -0.14 -0.19 0.00 -1.27 0.00 0.00 60.65 59.64 1h9a h LYS 259 Cb 1.11 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1h9a h LYS 259 CO -0.36 0.65 -0.73 -0.44 -2.27 0.00 0.00 179.45 176.30 1h9a h ASP 260 N 0.61 0.56 -0.51 4.20 3.32 -1.44 -2.29 116.42 120.88 1h9a h ASP 260 Ca 0.15 -0.37 -0.03 0.00 0.02 0.00 0.00 57.03 56.81 1h9a h ASP 260 Cb 0.22 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 1h9a h ASP 260 CO -0.01 1.12 0.20 0.40 -1.72 0.00 0.00 179.24 179.23 1h9a h ILE 261 N 0.32 1.22 -0.60 0.35 2.04 -0.85 -1.45 117.51 118.54 1h9a h ILE 261 Ca -0.03 -0.67 -0.07 0.00 1.00 0.00 0.00 64.86 65.08 1h9a h ILE 261 Cb 1.32 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 1h9a h ILE 261 CO 0.13 0.25 0.09 0.03 0.00 0.00 0.00 178.15 178.65 1h9a h ARG 262 N 0.69 0.97 -0.41 2.37 3.08 -1.17 -0.54 114.38 119.37 1h9a h ARG 262 Ca 0.17 -0.25 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 1h9a h ARG 262 Cb 0.20 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1h9a h ARG 262 CO -0.01 0.90 -0.04 0.00 -1.07 0.00 0.00 179.97 179.75 1h9a h ALA 263 N 1.17 1.16 -0.10 0.04 0.00 -1.12 0.85 119.26 121.26 1h9a h ALA 263 Ca 0.18 -0.26 -0.19 0.00 0.00 0.00 0.00 54.91 54.64 1h9a h ALA 263 Cb 0.41 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1h9a h ALA 263 CO 0.01 0.54 -0.73 0.00 0.00 0.00 0.00 179.25 179.08 1h9a h ALA 264 N 1.32 0.55 -0.28 0.00 0.00 -0.81 -2.37 119.26 117.67 1h9a h ALA 264 Ca 0.12 -0.60 -0.13 0.00 0.00 0.00 0.00 54.91 54.31 1h9a h ALA 264 Cb 0.46 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1h9a h ALA 264 CO 0.02 0.74 -0.32 0.87 0.00 0.00 0.00 179.25 180.56 1h9a h LYS 265 N 0.34 0.71 0.00 0.00 1.57 -0.83 -2.27 116.57 116.10 1h9a h LYS 265 Ca -0.03 -0.39 -0.04 0.00 -1.87 0.00 0.00 60.65 58.31 1h9a h LYS 265 Cb 1.31 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.63 1h9a h LYS 265 CO 0.13 1.01 -0.21 -0.91 -0.57 0.00 0.00 179.45 178.90 1h9a h ASN 266 N 0.45 0.00 -0.86 0.86 2.35 -0.81 -1.01 115.58 116.56 1h9a h ASN 266 Ca 0.04 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 1h9a h ASN 266 Cb 0.90 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.23 1h9a h ASN 266 CO 0.08 0.21 0.49 0.00 -1.65 0.00 0.00 177.43 176.56 1h9a h ALA 267 N 1.79 1.23 0.23 -0.83 0.00 -1.37 -0.15 119.26 120.16 1h9a h ALA 267 Ca -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1h9a h ALA 267 Cb 0.40 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1h9a h ALA 267 CO 0.03 0.63 -0.11 0.00 0.00 0.00 0.00 179.25 179.80 1h9a h ALA 268 N 1.33 -0.31 -1.00 0.00 0.00 -1.36 -3.13 119.26 114.79 1h9a h ALA 268 Ca 0.31 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.20 1h9a h ALA 268 Cb 0.00 0.12 -0.10 0.00 0.00 0.00 0.00 17.79 17.81 1h9a h ALA 268 CO -0.05 -0.39 0.61 0.74 0.00 0.00 0.00 179.25 180.16 1h9a h PHE 269 N -0.87 1.06 0.00 0.00 0.04 -1.10 0.82 116.94 116.89 1h9a h PHE 269 Ca -0.03 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1h9a h PHE 269 Cb 0.51 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 38.34 1h9a h PHE 269 CO 0.06 0.25 0.00 -0.91 -0.60 0.00 0.00 178.31 177.11 1h9a h ASN 270 N 0.77 0.00 -0.10 2.17 2.35 -1.07 -2.63 115.58 117.07 1h9a h ASN 270 Ca 0.57 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.32 1h9a h ASN 270 Cb 0.89 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.26 1h9a h ASN 270 CO -0.37 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.41 1h9a n ALA 271 N -1.89 2.45 -1.95 -0.83 0.00 0.25 -4.96 120.51 113.59 1h9a n ALA 271 Ca 0.02 -0.75 -0.41 0.00 0.00 0.00 0.00 53.44 52.30 1h9a n ALA 271 Cb 0.27 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 1h9a n ALA 271 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1h9a s LEU 272 N -1.89 4.41 -0.12 0.00 2.96 -0.99 -0.06 118.68 122.99 1h9a s LEU 272 Ca 0.30 2.49 -0.27 0.00 -0.22 0.00 0.00 54.13 56.42 1h9a s LEU 272 Cb 0.20 -3.62 -0.02 0.00 0.50 0.00 0.00 46.19 43.26 1h9a s LEU 272 CO 0.30 -0.56 0.91 -0.75 -1.32 0.00 0.00 176.35 174.93 1h9a s LYS 273 N -0.38 4.38 -0.14 1.98 2.20 -0.50 -4.93 119.74 122.34 1h9a s LYS 273 Ca 0.56 1.20 -0.19 0.00 -0.36 0.00 0.00 55.97 57.18 1h9a s LYS 273 Cb -0.38 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.36 1h9a s LYS 273 CO 0.41 -0.28 0.53 0.42 -0.36 0.00 0.00 175.35 176.07 1h9a s ILE 274 N 1.93 5.13 0.22 5.43 -1.09 -1.26 -4.80 121.20 126.77 1h9a s ILE 274 Ca 0.43 1.03 -0.15 0.00 -2.23 0.00 0.00 60.65 59.74 1h9a s ILE 274 Cb -0.18 -3.86 -0.08 0.00 -1.58 0.00 0.00 42.46 36.76 1h9a s ILE 274 CO 0.16 0.26 0.64 -0.31 -1.23 0.00 0.00 174.94 174.46 1h9a s TYR 275 N 1.05 3.53 0.61 3.97 2.02 -1.26 -5.11 117.35 122.15 1h9a s TYR 275 Ca 0.27 1.15 0.07 0.00 -0.37 0.00 0.00 57.07 58.19 1h9a s TYR 275 Cb -0.16 -2.46 0.09 0.00 -0.40 0.00 0.00 41.96 39.04 1h9a s TYR 275 CO 0.11 0.30 0.83 0.16 -1.57 0.00 0.00 175.55 175.38 1h9a s ASP 276 N -1.95 4.93 0.22 2.29 1.47 -1.26 -4.78 116.67 117.60 1h9a s ASP 276 Ca 0.45 -0.71 -0.08 0.00 1.18 0.00 0.00 52.55 53.38 1h9a s ASP 276 Cb -0.14 0.19 0.36 0.00 -0.34 0.00 0.00 42.92 42.99 1h9a s ASP 276 CO 0.20 -1.45 1.70 -0.08 0.68 0.00 0.00 175.17 176.21 1h9a h GLU 277 N 0.02 0.26 -0.22 2.11 4.81 -1.99 -0.42 114.58 119.14 1h9a h GLU 277 Ca -0.32 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1h9a h GLU 277 Cb 1.28 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 1h9a h GLU 277 CO 0.41 0.17 0.14 0.00 -0.73 0.00 0.00 179.01 179.00 1h9a h ALA 278 N 1.54 0.28 -0.15 2.92 0.00 -1.96 -2.70 119.26 119.19 1h9a h ALA 278 Ca 0.36 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.17 1h9a h ALA 278 Cb 0.56 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1h9a h ALA 278 CO -0.45 -0.23 -0.22 0.93 0.00 0.00 0.00 179.25 179.28 1h9a h GLU 279 N 0.29 0.26 -0.55 0.00 5.08 -1.74 -2.35 114.58 115.56 1h9a h GLU 279 Ca 0.08 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1h9a h GLU 279 Cb -0.01 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1h9a h GLU 279 CO -0.02 0.48 0.13 0.28 -1.00 0.00 0.00 179.01 178.88 1h9a h VAL 280 N 0.24 1.25 -0.05 3.13 2.07 -0.88 0.26 116.25 122.26 1h9a h VAL 280 Ca 0.04 -0.89 -0.08 0.00 0.82 0.00 0.00 66.70 66.58 1h9a h VAL 280 Cb 0.53 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1h9a h VAL 280 CO 0.04 0.33 -0.36 0.78 0.02 0.00 0.00 177.57 178.37 1h9a h ASN 281 N 0.79 0.11 0.57 0.57 2.35 -1.20 -1.43 115.58 117.33 1h9a h ASN 281 Ca 0.17 -0.04 -0.28 0.00 -0.55 0.00 0.00 56.30 55.60 1h9a h ASN 281 Cb 0.35 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 1h9a h ASN 281 CO 0.00 0.46 -1.44 0.50 -1.65 0.00 0.00 177.43 175.31 1h9a h LYS 282 N 0.09 0.17 -0.00 0.81 3.64 -0.96 -3.40 116.57 116.92 1h9a h LYS 282 Ca 0.01 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1h9a h LYS 282 Cb 0.68 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1h9a h LYS 282 CO 0.05 1.02 -0.38 0.66 -2.27 0.00 0.00 179.45 178.52 1h9a n TYR 283 N -3.38 0.00 -4.29 1.91 4.01 0.87 -5.00 117.16 111.27 1h9a n TYR 283 Ca -0.13 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.41 1h9a n TYR 283 Cb 1.02 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.94 1h9a n TYR 283 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1h9a s PHE 284 N -1.77 1.64 -0.03 -0.72 0.40 -0.54 -0.99 117.98 115.97 1h9a s PHE 284 Ca 0.07 -0.50 0.01 0.00 -0.60 0.00 0.00 56.93 55.90 1h9a s PHE 284 Cb 0.09 -0.84 0.02 0.00 0.51 0.00 0.00 43.02 42.80 1h9a s PHE 284 CO 0.37 0.25 -0.02 0.08 0.70 0.00 0.00 175.22 176.60 1h9a s VAL 285 N -2.06 0.28 -0.02 -0.44 1.01 0.87 -4.70 120.40 115.35 1h9a s VAL 285 Ca 0.12 -0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.17 1h9a s VAL 285 Cb -0.05 -0.34 -0.02 0.00 0.00 0.00 0.00 36.38 35.96 1h9a s VAL 285 CO 0.05 0.16 -0.22 0.00 0.00 0.00 0.00 175.10 175.08 1h9a s ARG 286 N 0.83 2.18 0.26 2.72 1.70 -1.26 -1.57 118.95 123.81 1h9a s ARG 286 Ca -0.09 -0.89 -0.06 0.00 -0.47 0.00 0.00 55.73 54.22 1h9a s ARG 286 Cb -0.12 -2.13 -0.01 0.00 -0.57 0.00 0.00 34.95 32.11 1h9a s ARG 286 CO -0.01 0.57 0.38 0.00 -1.08 0.00 0.00 175.30 175.16 1h9a s ALA 287 N -0.68 0.47 -0.04 7.88 0.00 -0.80 -0.74 121.76 127.85 1h9a s ALA 287 Ca 0.11 -1.30 -0.03 0.00 0.00 0.00 0.00 51.96 50.74 1h9a s ALA 287 Cb -0.10 1.19 0.02 0.00 0.00 0.00 0.00 23.12 24.23 1h9a s ALA 287 CO 0.00 -0.76 0.09 -1.14 0.00 0.00 0.00 175.76 173.95 1h9a s GLN 288 N -3.80 0.08 0.17 0.00 0.74 -0.16 -0.70 119.66 115.99 1h9a s GLN 288 Ca 0.30 0.18 -0.30 0.00 0.05 0.00 0.00 55.36 55.59 1h9a s GLN 288 Cb 0.02 -0.03 -0.08 0.00 1.10 0.00 0.00 33.01 34.01 1h9a s GLN 288 CO 0.13 -0.06 1.20 1.52 -0.55 0.00 0.00 175.29 177.53 1h9a s TYR 289 N 0.40 3.43 0.00 1.67 -0.85 -1.26 -2.97 117.35 117.77 1h9a s TYR 289 Ca -0.03 1.39 0.00 0.00 -0.52 0.00 0.00 57.07 57.91 1h9a s TYR 289 Cb -0.04 -3.43 0.00 0.00 0.38 0.00 0.00 41.96 38.86 1h9a s TYR 289 CO -0.02 -1.24 0.00 0.41 -1.52 0.00 0.00 175.55 173.18 1h9a n GLY 290 N 2.37 1.61 3.76 5.49 0.00 0.34 -0.91 105.19 117.85 1h9a n GLY 290 Ca 0.05 -1.99 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 1h9a n GLY 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h9a s ALA 291 N -2.22 2.37 0.06 4.61 0.00 -1.26 -3.74 121.76 121.57 1h9a s ALA 291 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 51.96 52.60 1h9a s ALA 291 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1h9a s ALA 291 CO 0.00 -1.44 0.00 0.41 0.00 0.00 0.00 175.76 174.73 1h9a n GLY 292 N -0.26 1.74 1.89 0.00 0.00 0.16 -2.56 105.19 106.16 1h9a n GLY 292 Ca 0.11 -2.04 -0.02 0.00 0.00 0.00 0.00 46.02 44.07 1h9a n GLY 292 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h9a n ASP 293 N -0.79 4.87 0.00 1.61 8.00 -1.26 -4.87 116.55 124.10 1h9a n ASP 293 Ca 0.00 -3.04 0.00 0.00 0.71 0.00 0.00 54.79 52.46 1h9a n ASP 293 Cb 0.00 -0.71 0.00 0.00 -0.02 0.00 0.00 41.12 40.39 1h9a n ASP 293 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1h9a n SER 294 N 0.10 0.12 -0.00 -2.24 3.41 -1.26 -5.09 113.62 108.66 1h9a n SER 294 Ca 0.34 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.97 1h9a n SER 294 Cb 1.26 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 65.18 1h9a n SER 294 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1h9a n ALA 295 N -3.00 2.12 1.32 7.33 0.00 -1.26 -4.57 120.51 122.44 1h9a n ALA 295 Ca 0.00 -0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.47 1h9a n ALA 295 Cb 0.00 -0.09 0.69 0.00 0.00 0.00 0.00 19.45 20.05 1h9a n ALA 295 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1h9a n ASP 296 N -1.71 0.09 -3.92 0.00 8.00 -1.26 -3.92 116.55 113.83 1h9a n ASP 296 Ca -0.01 -0.08 -0.41 0.00 0.71 0.00 0.00 54.79 55.00 1h9a n ASP 296 Cb 0.18 -0.28 -0.00 0.00 -0.02 0.00 0.00 41.12 41.00 1h9a n ASP 296 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1h9a n PHE 297 N -1.29 2.45 -2.44 1.24 3.01 -1.26 -5.02 117.46 114.15 1h9a n PHE 297 Ca 0.12 -2.80 -0.32 0.00 1.01 0.00 0.00 57.45 55.47 1h9a n PHE 297 Cb 0.27 -1.16 -0.03 0.00 -0.01 0.00 0.00 39.48 38.55 1h9a n PHE 297 CO 0.00 0.00 0.00 -1.59 1.01 0.00 0.00 176.76 176.18 1h9a s LYS 298 N -2.75 3.89 0.87 -1.08 -2.85 -1.25 0.37 119.74 116.93 1h9a s LYS 298 Ca 0.32 0.85 -0.11 0.00 -1.00 0.00 0.00 55.97 56.03 1h9a s LYS 298 Cb 0.06 -2.18 0.12 0.00 -2.06 0.00 0.00 37.83 33.78 1h9a s LYS 298 CO 0.09 -0.25 1.17 -2.14 0.10 0.00 0.00 175.35 174.32 1h9a s PRO 299 N -4.12 1.25 0.32 1.78 0.02 -1.26 -4.71 135.00 128.29 1h9a s PRO 299 Ca 0.57 1.65 0.01 0.00 0.02 0.00 0.00 61.00 63.25 1h9a s PRO 299 Cb -0.10 -1.74 0.57 0.00 0.02 0.00 0.00 34.50 33.24 1h9a s PRO 299 CO 0.33 -2.48 1.96 -0.92 -0.33 0.00 0.00 177.00 175.57 1h9a h TYR 300 N -1.48 0.93 0.00 6.54 3.20 -1.29 -1.77 116.97 123.10 1h9a h TYR 300 Ca -0.44 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.45 1h9a h TYR 300 Cb 1.28 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.24 1h9a h TYR 300 CO 0.49 0.54 0.00 -0.07 -1.64 0.00 0.00 178.16 177.48 1h9a h LEU 301 N 0.96 0.00 -2.28 2.82 3.38 -1.92 -2.36 115.31 115.91 1h9a h LEU 301 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1h9a h LEU 301 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1h9a h LEU 301 CO -0.09 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.82 1h9a n GLU 302 N -2.77 2.45 -2.48 1.13 1.02 -0.67 -4.63 120.64 114.69 1h9a n GLU 302 Ca 0.01 -2.24 -0.32 0.00 -0.02 0.00 0.00 57.16 54.59 1h9a n GLU 302 Cb 0.26 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.14 1h9a n GLU 302 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1h9a s GLU 303 N -1.27 3.96 0.29 3.49 0.41 -0.89 -4.93 118.70 119.75 1h9a s GLU 303 Ca 0.41 0.92 -0.30 0.00 -0.41 0.00 0.00 54.97 55.60 1h9a s GLU 303 Cb 0.22 -2.17 -0.11 0.00 -1.78 0.00 0.00 34.13 30.30 1h9a s GLU 303 CO 0.30 -0.22 1.51 -1.17 -0.49 0.00 0.00 175.26 175.19 1h9a s LEU 304 N -3.96 4.36 -1.17 1.80 2.96 -1.26 -2.39 118.68 119.01 1h9a s LEU 304 Ca 0.58 2.86 0.00 0.00 -0.22 0.00 0.00 54.13 57.35 1h9a s LEU 304 Cb -0.10 -3.64 0.00 0.00 0.50 0.00 0.00 46.19 42.95 1h9a s LEU 304 CO 0.30 -0.82 0.00 0.47 -1.32 0.00 0.00 176.35 174.98 1h9a n ASP 305 N 1.91 -4.72 -4.60 3.68 8.00 -1.26 -4.69 116.55 114.86 1h9a n ASP 305 Ca 0.06 0.27 -0.38 0.00 0.71 0.00 0.00 54.79 55.45 1h9a n ASP 305 Cb 0.39 -3.20 -0.10 0.00 -0.02 0.00 0.00 41.12 38.19 1h9a n ASP 305 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1h9a s VAL 306 N -2.28 5.27 0.11 2.53 1.01 -1.01 -4.78 120.40 121.26 1h9a s VAL 306 Ca 0.00 0.31 -0.31 0.00 0.00 0.00 0.00 61.98 61.98 1h9a s VAL 306 Cb 0.00 -3.59 -0.10 0.00 0.00 0.00 0.00 36.38 32.69 1h9a s VAL 306 CO 0.00 0.23 1.84 -2.84 0.00 0.00 0.00 175.10 174.32 1h9a s PRO 307 N 1.79 4.14 0.05 2.72 0.02 -1.26 -4.84 135.00 137.62 1h9a s PRO 307 Ca 0.10 2.59 0.02 0.00 0.02 0.00 0.00 61.00 63.73 1h9a s PRO 307 Cb -0.16 -3.64 0.12 0.00 0.02 0.00 0.00 34.50 30.84 1h9a s PRO 307 CO 0.10 -0.85 0.91 0.00 -0.33 0.00 0.00 177.00 176.84 1h9a n ALA 308 N 5.83 0.67 -1.25 -1.55 0.00 -1.26 -0.07 120.51 122.88 1h9a n ALA 308 Ca 0.18 0.02 -0.00 0.00 0.00 0.00 0.00 53.44 53.64 1h9a n ALA 308 Cb 0.38 -0.70 0.22 0.00 0.00 0.00 0.00 19.45 19.35 1h9a n ALA 308 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1h9a n ASP 309 N -1.45 3.12 -4.71 0.00 5.75 -1.26 -5.01 116.55 112.99 1h9a n ASP 309 Ca -0.00 -3.45 -0.42 0.00 -0.01 0.00 0.00 54.79 50.90 1h9a n ASP 309 Cb 0.18 -0.61 -0.03 0.00 -1.03 0.00 0.00 41.12 39.63 1h9a n ASP 309 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1h9a s SER 310 N -2.22 7.26 -0.30 -1.12 0.15 0.90 -4.92 113.70 113.45 1h9a s SER 310 Ca 0.44 1.75 0.08 0.00 0.70 0.00 0.00 55.95 58.92 1h9a s SER 310 Cb 0.38 -2.57 0.47 0.00 -1.71 0.00 0.00 66.02 62.59 1h9a s SER 310 CO 0.04 -0.36 1.36 0.29 1.20 0.00 0.00 173.24 175.78 1h9a n LYS 311 N 4.12 2.30 -2.38 5.44 5.02 -1.26 -4.98 118.16 126.41 1h9a n LYS 311 Ca 0.07 -3.50 -0.39 0.00 -2.02 0.00 0.00 58.31 52.48 1h9a n LYS 311 Cb 0.49 -1.92 -0.03 0.00 -0.02 0.00 0.00 35.03 33.55 1h9a n LYS 311 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1h9a s ASN 312 N -2.98 6.80 -0.23 4.39 3.04 -1.26 -5.01 114.94 119.68 1h9a s ASN 312 Ca 0.46 2.29 -0.20 0.00 0.04 0.00 0.00 52.86 55.45 1h9a s ASN 312 Cb 0.41 -2.61 -0.02 0.00 -1.54 0.00 0.00 41.25 37.48 1h9a s ASN 312 CO -0.01 -0.48 0.60 0.54 -3.04 0.00 0.00 177.10 174.71 1h9a s ASN 313 N -1.09 6.59 -0.01 -4.21 2.20 -1.26 -4.61 114.94 112.54 1h9a s ASN 313 Ca 0.53 0.71 0.19 0.00 -0.94 0.00 0.00 52.86 53.36 1h9a s ASN 313 Cb -0.30 -2.33 0.57 0.00 -2.00 0.00 0.00 41.25 37.19 1h9a s ASN 313 CO 0.38 -0.31 1.48 0.35 -2.94 0.00 0.00 177.10 176.06 1h9a n THR 314 N 4.98 1.10 -3.63 0.54 -2.24 0.13 -1.18 114.28 113.97 1h9a n THR 314 Ca -0.02 -1.03 -0.14 0.00 -2.27 0.00 0.00 64.05 60.59 1h9a n THR 314 Cb 0.49 0.45 -0.07 0.00 -2.10 0.00 0.00 70.33 69.11 1h9a n THR 314 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1h9a s PHE 315 N -1.11 -0.79 -0.03 4.78 2.19 -1.13 -0.49 117.98 121.40 1h9a s PHE 315 Ca 0.43 1.92 -0.02 0.00 0.33 0.00 0.00 56.93 59.58 1h9a s PHE 315 Cb 0.23 0.27 0.01 0.00 -1.31 0.00 0.00 43.02 42.22 1h9a s PHE 315 CO 0.28 -0.38 0.08 0.42 1.83 0.00 0.00 175.22 177.45 1h9a s ILE 316 N 0.38 -0.01 -0.03 3.12 -1.09 -0.27 -1.90 121.20 121.40 1h9a s ILE 316 Ca -0.00 0.04 -0.03 0.00 -2.23 0.00 0.00 60.65 58.43 1h9a s ILE 316 Cb -0.05 -0.12 0.01 0.00 -1.58 0.00 0.00 42.46 40.72 1h9a s ILE 316 CO 0.01 0.02 0.09 0.00 -1.23 0.00 0.00 174.94 173.82 1h9a s ALA 317 N 0.27 -0.20 0.10 9.38 0.00 -0.61 -1.38 121.76 129.32 1h9a s ALA 317 Ca -0.02 0.27 -0.26 0.00 0.00 0.00 0.00 51.96 51.95 1h9a s ALA 317 Cb -0.03 -0.16 0.08 0.00 0.00 0.00 0.00 23.12 23.00 1h9a s ALA 317 CO -0.01 -0.05 0.86 0.20 0.00 0.00 0.00 175.76 176.77 1h9a s GLY 318 N 0.15 -0.37 -0.15 0.00 0.00 -0.42 -0.09 107.32 106.44 1h9a s GLY 318 Ca -0.01 0.50 -0.04 0.00 0.00 0.00 0.00 44.72 45.17 1h9a s GLY 318 CO -0.00 0.15 -0.01 1.85 0.00 0.00 0.00 173.10 175.09 1h9a s GLU 319 N -3.33 3.64 -0.01 2.90 2.12 -0.16 -1.30 118.70 122.57 1h9a s GLU 319 Ca 0.08 -0.46 0.01 0.00 0.36 0.00 0.00 54.97 54.95 1h9a s GLU 319 Cb -0.02 -2.96 -0.04 0.00 0.26 0.00 0.00 34.13 31.37 1h9a s GLU 319 CO -0.04 0.32 0.01 -0.51 -0.54 0.00 0.00 175.26 174.50 1h9a s LEU 320 N 0.17 3.57 -0.06 2.70 1.02 0.98 -4.91 118.68 122.16 1h9a s LEU 320 Ca 0.00 0.02 0.02 0.00 0.02 0.00 0.00 54.13 54.19 1h9a s LEU 320 Cb -0.13 -2.04 0.02 0.00 0.02 0.00 0.00 46.19 44.06 1h9a s LEU 320 CO 0.02 0.29 -0.09 -1.10 0.02 0.00 0.00 176.35 175.48 1h9a s GLN 321 N -1.54 1.41 -0.16 1.70 -0.21 -1.26 -1.77 119.66 117.83 1h9a s GLN 321 Ca 0.20 -0.31 -0.03 0.00 0.02 0.00 0.00 55.36 55.23 1h9a s GLN 321 Cb -0.12 -1.22 -0.02 0.00 1.00 0.00 0.00 33.01 32.65 1h9a s GLN 321 CO 0.10 -0.02 -0.04 -0.06 -2.12 0.00 0.00 175.29 173.15 1h9a s PHE 322 N 0.78 3.00 -1.29 0.91 0.08 -1.26 -1.41 117.98 118.78 1h9a s PHE 322 Ca -0.13 -0.38 -0.06 0.00 0.12 0.00 0.00 56.93 56.49 1h9a s PHE 322 Cb -0.15 -1.97 0.14 0.00 -0.57 0.00 0.00 43.02 40.48 1h9a s PHE 322 CO 0.02 -0.10 2.25 -3.47 -0.10 0.00 0.00 175.22 173.83 1h9a n ASP 323 N 3.66 7.53 -4.23 1.36 2.03 0.92 -4.38 116.55 123.44 1h9a n ASP 323 Ca -0.17 -3.18 -0.23 0.00 0.52 0.00 0.00 54.79 51.72 1h9a n ASP 323 Cb 0.52 -1.36 -0.13 0.00 -0.72 0.00 0.00 41.12 39.43 1h9a n ASP 323 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1h9a s LEU 324 N -1.99 2.21 0.31 -2.67 1.43 -1.26 -4.85 118.68 111.85 1h9a s LEU 324 Ca 0.50 -0.56 0.05 0.00 -1.03 0.00 0.00 54.13 53.10 1h9a s LEU 324 Cb 0.17 -0.84 0.69 0.00 0.03 0.00 0.00 46.19 46.24 1h9a s LEU 324 CO -0.08 0.09 1.82 -0.65 0.23 0.00 0.00 176.35 177.76 1h9a h PRO 325 N 4.64 0.81 0.00 1.29 0.11 -1.99 -0.93 132.00 135.93 1h9a h PRO 325 Ca -0.42 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1h9a h PRO 325 Cb 1.17 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1h9a h PRO 325 CO 0.42 0.54 0.00 0.07 -0.21 0.00 0.00 178.00 178.82 1h9a h ARG 326 N 0.84 0.00 -0.15 1.05 0.11 -1.96 -3.14 114.38 111.13 1h9a h ARG 326 Ca 0.53 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.61 1h9a h ARG 326 Cb 0.72 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.80 1h9a h ARG 326 CO -0.30 0.00 0.00 0.91 0.10 0.00 0.00 179.97 180.68 1h9a n TRP 327 N -2.90 0.23 -1.66 4.08 5.03 -0.45 -0.03 117.44 121.75 1h9a n TRP 327 Ca 0.01 -0.56 -0.47 0.00 3.03 0.00 0.00 57.50 59.51 1h9a n TRP 327 Cb 0.30 -0.06 -0.04 0.00 -1.03 0.00 0.00 31.31 30.47 1h9a n TRP 327 CO 0.00 0.00 0.00 0.39 -0.03 0.00 0.00 177.69 178.05 1h9a n GLU 328 N -0.18 2.19 -1.00 -0.99 1.02 -0.65 -1.11 120.64 119.93 1h9a n GLU 328 Ca 0.07 0.78 0.00 0.00 -0.02 0.00 0.00 57.16 57.99 1h9a n GLU 328 Cb 0.38 -2.74 0.00 0.00 -0.02 0.00 0.00 31.44 29.07 1h9a n GLU 328 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h9a n GLY 329 N 4.69 0.66 3.35 0.62 0.00 -1.26 -4.86 105.19 108.39 1h9a n GLY 329 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 1h9a n GLY 329 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h9a s VAL 330 N -2.66 4.70 0.36 1.61 1.01 -0.26 -5.01 120.40 120.15 1h9a s VAL 330 Ca 0.00 -1.08 -0.26 0.00 0.00 0.00 0.00 61.98 60.64 1h9a s VAL 330 Cb 0.00 -3.76 -0.09 0.00 0.00 0.00 0.00 36.38 32.53 1h9a s VAL 330 CO 0.00 -0.43 1.03 -2.16 0.00 0.00 0.00 175.10 173.54 1h9a s PRO 331 N 1.55 4.35 -0.34 2.72 0.04 -1.26 -4.66 135.00 137.40 1h9a s PRO 331 Ca 0.03 1.53 -0.02 0.00 0.04 0.00 0.00 61.00 62.58 1h9a s PRO 331 Cb -0.22 -2.73 0.07 0.00 0.04 0.00 0.00 34.50 31.66 1h9a s PRO 331 CO 0.05 0.02 0.07 -0.06 0.04 0.00 0.00 177.00 177.12 1h9a s PHE 332 N -1.55 3.38 -0.04 0.56 0.40 -0.73 -2.19 117.98 117.81 1h9a s PHE 332 Ca 0.53 -2.05 -0.17 0.00 -0.60 0.00 0.00 56.93 54.64 1h9a s PHE 332 Cb -0.23 -2.48 -0.05 0.00 0.51 0.00 0.00 43.02 40.77 1h9a s PHE 332 CO 0.29 -0.85 0.48 0.71 0.70 0.00 0.00 175.22 176.55 1h9a s TYR 333 N 1.22 3.64 0.07 0.36 2.02 0.74 -0.01 117.35 125.38 1h9a s TYR 333 Ca -0.00 1.00 0.05 0.00 -0.37 0.00 0.00 57.07 57.75 1h9a s TYR 333 Cb -0.21 -2.46 -0.03 0.00 -0.40 0.00 0.00 41.96 38.86 1h9a s TYR 333 CO -0.02 0.40 -0.14 0.14 -1.57 0.00 0.00 175.55 174.36 1h9a s VAL 334 N -0.25 1.07 -0.23 0.71 -7.23 -0.42 -0.67 120.40 113.38 1h9a s VAL 334 Ca 0.26 -1.32 -0.25 0.00 -1.81 0.00 0.00 61.98 58.86 1h9a s VAL 334 Cb -0.17 -1.07 0.07 0.00 0.56 0.00 0.00 36.38 35.77 1h9a s VAL 334 CO 0.13 -0.26 0.68 0.00 -0.31 0.00 0.00 175.10 175.34 1h9a s ARG 335 N -1.82 0.83 -0.18 4.82 1.70 -0.49 -1.30 118.95 122.50 1h9a s ARG 335 Ca -0.02 0.86 -0.16 0.00 -0.47 0.00 0.00 55.73 55.94 1h9a s ARG 335 Cb -0.09 0.40 0.05 0.00 -0.57 0.00 0.00 34.95 34.74 1h9a s ARG 335 CO 0.02 -0.12 0.47 0.45 -1.08 0.00 0.00 175.30 175.04 1h9a s SER 336 N 0.16 -0.51 0.02 -2.89 0.15 -0.48 -1.30 113.70 108.86 1h9a s SER 336 Ca -0.01 0.96 -0.29 0.00 0.70 0.00 0.00 55.95 57.31 1h9a s SER 336 Cb -0.04 0.96 0.10 0.00 -1.71 0.00 0.00 66.02 65.32 1h9a s SER 336 CO 0.02 -0.17 1.02 -0.83 1.20 0.00 0.00 173.24 174.48 1h9a s GLY 337 N 0.40 -0.35 0.44 9.45 0.00 -1.18 -1.11 107.32 114.97 1h9a s GLY 337 Ca -0.01 0.75 0.02 0.00 0.00 0.00 0.00 44.72 45.48 1h9a s GLY 337 CO -0.01 0.22 0.65 0.54 0.00 0.00 0.00 173.10 174.50 1h9a s LYS 338 N -2.97 3.00 -1.67 2.90 -0.14 0.36 -2.11 119.74 119.12 1h9a s LYS 338 Ca 0.09 -0.62 -0.16 0.00 -1.36 0.00 0.00 55.97 53.92 1h9a s LYS 338 Cb -0.00 -2.59 0.14 0.00 -1.68 0.00 0.00 37.83 33.69 1h9a s LYS 338 CO -0.04 -0.28 0.76 0.54 -0.76 0.00 0.00 175.35 175.58 1h9a n ARG 339 N -2.04 -3.32 -2.22 1.68 5.12 -0.32 -4.90 116.66 110.66 1h9a n ARG 339 Ca 0.02 0.39 -0.18 0.00 -1.93 0.00 0.00 57.85 56.15 1h9a n ARG 339 Cb 0.58 -5.06 0.09 0.00 -1.16 0.00 0.00 32.46 26.91 1h9a n ARG 339 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1h9a n LEU 340 N -4.41 0.00 0.12 0.55 4.77 -0.01 -0.49 117.00 117.52 1h9a n LEU 340 Ca 0.03 -1.72 0.02 0.00 -0.03 0.00 0.00 56.01 54.31 1h9a n LEU 340 Cb 0.51 -0.48 0.36 0.00 -2.33 0.00 0.00 43.42 41.48 1h9a n LEU 340 CO 0.84 -0.85 0.85 0.00 -1.33 0.00 0.00 177.39 176.90 1h9a h ALA 341 N -0.45 1.44 -2.26 -1.18 0.00 -0.94 -3.37 119.26 112.50 1h9a h ALA 341 Ca -0.25 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.34 1h9a h ALA 341 Cb 0.97 -0.09 -0.19 0.00 0.00 0.00 0.00 17.79 18.49 1h9a h ALA 341 CO 0.28 0.39 0.02 0.00 0.00 0.00 0.00 179.25 179.94 1h9a s ALA 342 N -4.62 -1.38 -0.25 0.00 0.00 -1.26 -4.97 121.76 109.28 1h9a s ALA 342 Ca -0.05 0.86 -0.29 0.00 0.00 0.00 0.00 51.96 52.48 1h9a s ALA 342 Cb 0.15 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.39 1h9a s ALA 342 CO 0.74 -0.37 1.05 0.21 0.00 0.00 0.00 175.76 177.39 1h9a s LYS 343 N -1.50 4.21 -0.28 0.00 2.47 -1.26 -3.61 119.74 119.76 1h9a s LYS 343 Ca -0.11 1.29 -0.23 0.00 -1.56 0.00 0.00 55.97 55.36 1h9a s LYS 343 Cb -0.02 -3.67 0.13 0.00 -1.46 0.00 0.00 37.83 32.81 1h9a s LYS 343 CO 0.06 -0.70 1.02 -1.14 0.16 0.00 0.00 175.35 174.74 1h9a s GLN 344 N 3.32 0.48 -0.24 4.03 0.74 -0.62 -4.45 119.66 122.92 1h9a s GLN 344 Ca 0.44 0.62 0.02 0.00 0.05 0.00 0.00 55.36 56.49 1h9a s GLN 344 Cb -0.14 0.21 0.06 0.00 1.10 0.00 0.00 33.01 34.24 1h9a s GLN 344 CO 0.09 -0.06 -0.09 0.99 -0.55 0.00 0.00 175.29 175.66 1h9a s THR 345 N 0.44 1.87 0.10 -0.34 2.01 -0.85 -0.35 115.64 118.51 1h9a s THR 345 Ca 0.01 -1.40 -0.10 0.00 0.31 0.00 0.00 61.69 60.51 1h9a s THR 345 Cb -0.05 -2.03 0.00 0.00 0.01 0.00 0.00 72.50 70.43 1h9a s THR 345 CO -0.08 -0.03 0.23 0.00 -0.69 0.00 0.00 174.62 174.05 1h9a s ARG 346 N 1.25 0.91 -0.09 4.92 1.70 -0.28 -0.14 118.95 127.21 1h9a s ARG 346 Ca -0.07 -0.95 0.02 0.00 -0.47 0.00 0.00 55.73 54.26 1h9a s ARG 346 Cb -0.19 0.36 0.01 0.00 -0.57 0.00 0.00 34.95 34.56 1h9a s ARG 346 CO -0.06 -0.31 -0.16 0.08 -1.08 0.00 0.00 175.30 173.77 1h9a s VAL 347 N -3.87 1.51 -0.16 4.99 1.01 -0.49 -1.20 120.40 122.19 1h9a s VAL 347 Ca 0.06 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.38 1h9a s VAL 347 Cb 0.04 -1.36 0.02 0.00 0.00 0.00 0.00 36.38 35.08 1h9a s VAL 347 CO -0.10 0.44 -0.20 -1.81 0.00 0.00 0.00 175.10 173.44 1h9a s ASP 348 N 0.75 3.05 -0.33 3.32 1.01 0.13 -0.47 116.67 124.14 1h9a s ASP 348 Ca -0.12 -0.61 -0.06 0.00 0.71 0.00 0.00 52.55 52.47 1h9a s ASP 348 Cb -0.16 -1.43 0.04 0.00 1.01 0.00 0.00 42.92 42.38 1h9a s ASP 348 CO 0.02 0.01 0.09 -0.63 0.21 0.00 0.00 175.17 174.87 1h9a s ILE 349 N 1.18 3.68 -0.24 0.77 1.01 0.43 -0.40 121.20 127.63 1h9a s ILE 349 Ca 0.02 -1.12 -0.20 0.00 0.00 0.00 0.00 60.65 59.34 1h9a s ILE 349 Cb -0.14 -3.07 -0.02 0.00 0.01 0.00 0.00 42.46 39.25 1h9a s ILE 349 CO -0.10 -0.14 0.63 -0.69 0.00 0.00 0.00 174.94 174.64 1h9a s VAL 350 N 1.39 4.99 0.10 2.92 1.01 -0.65 -1.22 120.40 128.93 1h9a s VAL 350 Ca -0.02 1.14 -0.12 0.00 0.00 0.00 0.00 61.98 62.98 1h9a s VAL 350 Cb -0.19 -3.93 -0.06 0.00 0.00 0.00 0.00 36.38 32.19 1h9a s VAL 350 CO 0.02 0.05 0.45 -0.36 0.00 0.00 0.00 175.10 175.26 1h9a s PHE 351 N 2.37 3.60 0.35 5.22 0.08 0.26 0.05 117.98 129.92 1h9a s PHE 351 Ca 0.27 0.90 -0.29 0.00 0.12 0.00 0.00 56.93 57.93 1h9a s PHE 351 Cb -0.16 -2.24 -0.11 0.00 -0.57 0.00 0.00 43.02 39.94 1h9a s PHE 351 CO 0.09 0.50 1.52 0.15 -0.10 0.00 0.00 175.22 177.38 1h9a s LYS 352 N -1.86 4.12 0.58 0.44 1.02 0.35 -3.63 119.74 120.76 1h9a s LYS 352 Ca 0.34 2.57 -0.19 0.00 0.02 0.00 0.00 55.97 58.70 1h9a s LYS 352 Cb -0.15 -2.99 -0.04 0.00 -0.52 0.00 0.00 37.83 34.14 1h9a s LYS 352 CO 0.18 -0.56 1.22 0.00 -0.92 0.00 0.00 175.35 175.27 1h9a s ALA 353 N -0.75 2.61 0.64 5.17 0.00 -1.26 -4.70 121.76 123.46 1h9a s ALA 353 Ca 0.56 1.03 -0.11 0.00 0.00 0.00 0.00 51.96 53.44 1h9a s ALA 353 Cb -0.47 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.17 1h9a s ALA 353 CO 0.58 -1.13 1.04 0.20 0.00 0.00 0.00 175.76 176.45 1h9a s GLY 354 N -1.51 1.69 -0.06 0.00 0.00 -1.26 -4.99 107.32 101.19 1h9a s GLY 354 Ca 0.76 -0.03 0.20 0.00 0.00 0.00 0.00 44.72 45.65 1h9a s GLY 354 CO 0.34 0.26 1.56 -1.30 0.00 0.00 0.00 173.10 173.96 1h9a n THR 355 N -2.79 1.43 -2.40 0.90 -2.24 -1.26 -4.78 114.28 103.13 1h9a n THR 355 Ca 0.06 -1.12 -0.42 0.00 -2.27 0.00 0.00 64.05 60.31 1h9a n THR 355 Cb 0.54 0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 69.04 1h9a n THR 355 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1h9a s PHE 356 N -1.44 3.43 -0.35 4.78 5.36 -1.26 -4.99 117.98 123.51 1h9a s PHE 356 Ca 0.48 1.34 -0.16 0.00 -0.96 0.00 0.00 56.93 57.62 1h9a s PHE 356 Cb 0.28 -3.43 -0.01 0.00 -0.34 0.00 0.00 43.02 39.52 1h9a s PHE 356 CO 0.27 -1.29 0.43 1.21 -1.46 0.00 0.00 175.22 174.39 1h9a s ASN 357 N 0.68 6.24 0.20 6.13 3.04 -1.26 -4.76 114.94 125.20 1h9a s ASN 357 Ca 0.57 -0.17 0.24 0.00 0.04 0.00 0.00 52.86 53.54 1h9a s ASN 357 Cb -0.31 -2.23 0.26 0.00 -1.54 0.00 0.00 41.25 37.43 1h9a s ASN 357 CO 0.32 -0.40 1.30 -0.26 -3.04 0.00 0.00 177.10 175.02 1h9a h PHE 358 N 8.47 0.00 -0.04 0.43 0.04 -1.96 -3.47 116.94 120.41 1h9a h PHE 358 Ca -0.29 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.46 1h9a h PHE 358 Cb 1.13 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.28 1h9a h PHE 358 CO 0.70 0.00 -0.02 0.41 -0.60 0.00 0.00 178.31 178.80 1h9a n GLY 359 N 1.25 0.49 3.93 -1.45 0.00 -1.26 -5.02 105.19 103.12 1h9a n GLY 359 Ca 0.02 -0.41 -0.26 0.00 0.00 0.00 0.00 46.02 45.38 1h9a n GLY 359 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h9a s SER 360 N -2.40 5.27 0.03 1.61 1.04 -1.26 -5.02 113.70 112.97 1h9a s SER 360 Ca 0.00 0.53 -0.22 0.00 0.48 0.00 0.00 55.95 56.75 1h9a s SER 360 Cb 0.00 -1.39 -0.15 0.00 0.10 0.00 0.00 66.02 64.58 1h9a s SER 360 CO 0.00 -1.27 1.37 -0.08 0.98 0.00 0.00 173.24 174.25 1h9a h GLU 361 N -0.30 0.26 -4.66 4.02 4.81 -1.96 -3.40 114.58 113.35 1h9a h GLU 361 Ca -0.45 -0.12 -0.69 0.00 -0.13 0.00 0.00 59.36 57.97 1h9a h GLU 361 Cb 1.28 -0.00 -0.22 0.00 0.63 0.00 0.00 28.75 30.44 1h9a h GLU 361 CO 0.60 0.62 -0.51 -1.14 -0.73 0.00 0.00 179.01 177.85 1h9a s GLN 362 N -4.50 3.15 0.76 1.92 2.00 -1.26 -5.09 119.66 116.64 1h9a s GLN 362 Ca -0.14 -0.86 -0.08 0.00 -2.00 0.00 0.00 55.36 52.27 1h9a s GLN 362 Cb 0.05 -3.74 0.09 0.00 0.80 0.00 0.00 33.01 30.21 1h9a s GLN 362 CO 0.73 -0.56 1.07 -1.21 -0.50 0.00 0.00 175.29 174.82 1h9a s GLU 363 N 1.63 1.87 0.12 1.67 0.41 -1.26 -3.32 118.70 119.82 1h9a s GLU 363 Ca 0.04 -0.36 -0.32 0.00 -0.41 0.00 0.00 54.97 53.92 1h9a s GLU 363 Cb -0.18 -2.12 -0.12 0.00 -1.78 0.00 0.00 34.13 29.93 1h9a s GLU 363 CO 0.08 -1.48 1.78 0.00 -0.49 0.00 0.00 175.26 175.15 1h9a n ALA 364 N -3.08 1.99 -1.99 5.21 0.00 -1.26 -4.90 120.51 116.48 1h9a n ALA 364 Ca 0.10 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1h9a n ALA 364 Cb 0.60 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1h9a n ALA 364 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h9a s GLU 366 N -2.42 4.35 0.39 0.00 2.02 -1.26 -4.43 118.70 117.34 1h9a s GLU 366 Ca 0.00 0.80 -0.22 0.00 0.02 0.00 0.00 54.97 55.58 1h9a s GLU 366 Cb 0.00 -3.34 -0.10 0.00 0.10 0.00 0.00 34.13 30.79 1h9a s GLU 366 CO 0.00 0.37 0.92 0.00 0.02 0.00 0.00 175.26 176.58 1h9a s ALA 367 N -0.24 3.12 -0.05 5.21 0.00 -1.24 -4.88 121.76 123.68 1h9a s ALA 367 Ca 0.32 0.39 0.01 0.00 0.00 0.00 0.00 51.96 52.69 1h9a s ALA 367 Cb -0.19 -3.12 0.02 0.00 0.00 0.00 0.00 23.12 19.84 1h9a s ALA 367 CO 0.19 0.16 -0.05 0.08 0.00 0.00 0.00 175.76 176.14 1h9a s VAL 368 N -2.01 0.60 -0.32 0.00 1.01 -0.60 -0.57 120.40 118.51 1h9a s VAL 368 Ca 0.58 -0.16 -0.09 0.00 0.00 0.00 0.00 61.98 62.31 1h9a s VAL 368 Cb -0.12 -0.61 0.00 0.00 0.00 0.00 0.00 36.38 35.66 1h9a s VAL 368 CO 0.16 0.24 0.15 -0.22 0.00 0.00 0.00 175.10 175.42 1h9a s LEU 369 N 0.89 4.15 -0.11 3.92 2.96 -0.36 -0.83 118.68 129.30 1h9a s LEU 369 Ca -0.11 -0.63 -0.00 0.00 -0.22 0.00 0.00 54.13 53.16 1h9a s LEU 369 Cb -0.14 -1.98 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 1h9a s LEU 369 CO 0.00 -0.22 -0.08 -0.44 -1.32 0.00 0.00 176.35 174.29 1h9a s SER 370 N 1.58 4.46 -0.28 3.68 0.01 0.24 -0.43 113.70 122.96 1h9a s SER 370 Ca 0.04 -0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.17 1h9a s SER 370 Cb -0.17 -1.43 0.08 0.00 0.21 0.00 0.00 66.02 64.70 1h9a s SER 370 CO 0.06 0.25 -0.01 -0.63 0.41 0.00 0.00 173.24 173.32 1h9a s ILE 371 N -0.16 1.76 -0.29 1.44 1.01 0.38 -0.99 121.20 124.36 1h9a s ILE 371 Ca 0.01 -1.65 -0.21 0.00 0.00 0.00 0.00 60.65 58.80 1h9a s ILE 371 Cb -0.13 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.21 1h9a s ILE 371 CO 0.03 -0.32 0.68 -0.63 0.00 0.00 0.00 174.94 174.70 1h9a s ILE 372 N 1.23 4.91 -0.16 2.92 1.09 0.01 -1.39 121.20 129.81 1h9a s ILE 372 Ca 0.01 1.07 -0.11 0.00 -1.10 0.00 0.00 60.65 60.52 1h9a s ILE 372 Cb -0.19 -4.02 -0.23 0.00 -1.06 0.00 0.00 42.46 36.96 1h9a s ILE 372 CO -0.09 -0.11 0.24 -0.38 -0.10 0.00 0.00 174.94 174.50 1h9a n ILE 373 N 5.35 1.68 -4.23 2.92 5.41 0.80 -1.72 119.36 129.58 1h9a n ILE 373 Ca 0.01 -0.46 -0.18 0.00 1.00 0.00 0.00 62.75 63.11 1h9a n ILE 373 Cb 0.49 -1.80 -0.12 0.00 -0.71 0.00 0.00 39.64 37.49 1h9a n ILE 373 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1h9a s ASP 374 N -6.98 1.57 0.25 4.38 1.01 -0.99 -4.18 116.67 111.73 1h9a s ASP 374 Ca -0.26 -0.53 0.14 0.00 0.71 0.00 0.00 52.55 52.61 1h9a s ASP 374 Cb 0.07 -0.07 0.02 0.00 1.01 0.00 0.00 42.92 43.96 1h9a s ASP 374 CO 0.69 -0.04 1.38 1.55 0.21 0.00 0.00 175.17 178.96 1h9a h PRO 375 N 4.62 0.00 -5.09 8.23 0.13 -1.88 -2.26 132.00 135.75 1h9a h PRO 375 Ca -0.39 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.23 1h9a h PRO 375 Cb 1.19 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.01 1h9a h PRO 375 CO 0.42 0.53 -0.82 0.21 -0.23 0.00 0.00 178.00 178.11 1h9a s LYS 376 N -2.93 1.45 0.06 0.86 2.20 -1.26 -5.10 119.74 115.01 1h9a s LYS 376 Ca 0.03 -0.50 -0.30 0.00 -0.36 0.00 0.00 55.97 54.84 1h9a s LYS 376 Cb 0.08 -1.30 -0.09 0.00 -1.51 0.00 0.00 37.83 35.01 1h9a s LYS 376 CO 0.76 0.21 1.79 0.20 -0.36 0.00 0.00 175.35 177.95 1h9a s GLY 377 N 0.04 1.46 0.05 5.54 0.00 -1.26 -4.57 107.32 108.59 1h9a s GLY 377 Ca -0.02 1.28 -0.13 0.00 0.00 0.00 0.00 44.72 45.85 1h9a s GLY 377 CO 0.01 3.14 0.29 0.00 0.00 0.00 0.00 173.10 176.54 1h9a s ALA 378 N 3.31 -0.63 -0.04 3.20 0.00 -0.70 -1.33 121.76 125.58 1h9a s ALA 378 Ca 0.80 -0.08 -0.00 0.00 0.00 0.00 0.00 51.96 52.68 1h9a s ALA 378 Cb -0.42 0.35 0.03 0.00 0.00 0.00 0.00 23.12 23.08 1h9a s ALA 378 CO 0.36 -0.43 0.02 0.42 0.00 0.00 0.00 175.76 176.12 1h9a s ILE 379 N -2.72 0.12 0.02 0.00 1.01 -0.39 -0.81 121.20 118.43 1h9a s ILE 379 Ca -0.04 0.18 0.04 0.00 0.00 0.00 0.00 60.65 60.83 1h9a s ILE 379 Cb -0.00 -0.26 -0.02 0.00 0.01 0.00 0.00 42.46 42.19 1h9a s ILE 379 CO -0.04 0.16 -0.14 -1.61 0.00 0.00 0.00 174.94 173.31 1h9a s GLU 380 N 1.40 0.98 -0.24 2.79 2.02 -0.16 -1.03 118.70 124.46 1h9a s GLU 380 Ca -0.05 -0.63 -0.01 0.00 0.02 0.00 0.00 54.97 54.31 1h9a s GLU 380 Cb -0.13 -0.97 0.07 0.00 0.10 0.00 0.00 34.13 33.20 1h9a s GLU 380 CO -0.03 0.25 0.02 -1.17 0.02 0.00 0.00 175.26 174.35 1h9a s LEU 381 N -0.79 2.10 -0.34 1.80 2.96 0.29 -0.60 118.68 124.11 1h9a s LEU 381 Ca 0.03 -1.20 -0.25 0.00 -0.22 0.00 0.00 54.13 52.49 1h9a s LEU 381 Cb -0.07 -0.92 0.01 0.00 0.50 0.00 0.00 46.19 45.71 1h9a s LEU 381 CO 0.00 -0.31 0.86 -0.75 -1.32 0.00 0.00 176.35 174.84 1h9a s LYS 382 N 1.59 3.89 0.33 1.98 2.20 -0.01 -1.11 119.74 128.60 1h9a s LYS 382 Ca 0.00 0.57 0.10 0.00 -0.36 0.00 0.00 55.97 56.28 1h9a s LYS 382 Cb -0.18 -3.77 -0.06 0.00 -1.51 0.00 0.00 37.83 32.31 1h9a s LYS 382 CO -0.11 -0.82 -0.11 -0.51 -0.36 0.00 0.00 175.35 173.44 1h9a s LEU 383 N 3.22 2.68 -0.04 5.43 1.43 -0.04 -1.55 118.68 129.81 1h9a s LEU 383 Ca 0.35 -1.17 -0.18 0.00 -1.03 0.00 0.00 54.13 52.10 1h9a s LEU 383 Cb -0.13 -0.98 -0.05 0.00 0.03 0.00 0.00 46.19 45.06 1h9a s LEU 383 CO 0.16 -0.18 0.51 0.20 0.23 0.00 0.00 176.35 177.27 1h9a s ASN 384 N -3.57 6.83 0.10 2.29 0.01 -1.26 -0.44 114.94 118.90 1h9a s ASN 384 Ca 0.32 0.99 0.02 0.00 -0.71 0.00 0.00 52.86 53.48 1h9a s ASN 384 Cb 0.01 -2.31 -0.01 0.00 0.41 0.00 0.00 41.25 39.36 1h9a s ASN 384 CO 0.16 0.12 0.10 0.00 -1.51 0.00 0.00 177.10 175.96 1h9a n ALA 385 N 2.87 0.18 -2.50 0.60 0.00 0.93 -4.93 120.51 117.67 1h9a n ALA 385 Ca -0.09 -0.59 -0.39 0.00 0.00 0.00 0.00 53.44 52.38 1h9a n ALA 385 Cb 0.51 0.48 -0.06 0.00 0.00 0.00 0.00 19.45 20.39 1h9a n ALA 385 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1h9a s LYS 386 N -2.40 4.25 0.63 0.00 2.20 -1.26 -1.26 119.74 121.90 1h9a s LYS 386 Ca 0.12 0.65 -0.13 0.00 -0.36 0.00 0.00 55.97 56.25 1h9a s LYS 386 Cb 0.00 -3.33 -0.03 0.00 -1.51 0.00 0.00 37.83 32.97 1h9a s LYS 386 CO 0.09 0.41 1.04 -1.54 -0.36 0.00 0.00 175.35 174.99 1h9a s SER 387 N -0.30 5.84 -1.25 1.43 1.04 -0.02 -4.73 113.70 115.72 1h9a s SER 387 Ca 0.29 1.61 -0.12 0.00 0.48 0.00 0.00 55.95 58.21 1h9a s SER 387 Cb -0.18 -2.50 0.16 0.00 0.10 0.00 0.00 66.02 63.61 1h9a s SER 387 CO 0.16 -1.13 1.62 0.52 0.98 0.00 0.00 173.24 175.39 1h9a n VAL 388 N -2.57 4.25 -4.30 5.02 0.31 -1.26 -4.74 118.33 115.04 1h9a n VAL 388 Ca 0.07 -4.55 -0.16 0.00 -0.01 0.00 0.00 64.34 59.70 1h9a n VAL 388 Cb 0.54 -2.43 -0.10 0.00 -0.91 0.00 0.00 33.84 30.94 1h9a n VAL 388 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1h9a s GLU 389 N 1.34 1.30 0.06 5.55 2.02 -1.26 -5.06 118.70 122.65 1h9a s GLU 389 Ca 0.42 -1.67 -0.18 0.00 0.02 0.00 0.00 54.97 53.57 1h9a s GLU 389 Cb 0.02 -0.36 -0.13 0.00 0.10 0.00 0.00 34.13 33.77 1h9a s GLU 389 CO 0.01 -0.19 1.35 -0.44 0.02 0.00 0.00 175.26 176.01 1h9a h ASP 390 N 2.50 0.57 -3.57 -0.19 3.32 -2.03 -3.43 116.42 113.59 1h9a h ASP 390 Ca -0.38 -0.51 -0.52 0.00 0.02 0.00 0.00 57.03 55.65 1h9a h ASP 390 Cb 1.23 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.58 1h9a h ASP 390 CO 0.63 0.97 0.05 0.00 -1.72 0.00 0.00 179.24 179.17 1h9a s ALA 391 N -4.21 3.42 0.16 3.45 0.00 -1.26 -5.01 121.76 118.32 1h9a s ALA 391 Ca -0.13 0.04 -0.31 0.00 0.00 0.00 0.00 51.96 51.56 1h9a s ALA 391 Cb 0.07 -2.72 -0.09 0.00 0.00 0.00 0.00 23.12 20.37 1h9a s ALA 391 CO 0.80 0.36 1.48 0.12 0.00 0.00 0.00 175.76 178.52 1h9a s PHE 392 N -1.69 3.13 0.17 0.00 2.19 -1.26 -4.96 117.98 115.56 1h9a s PHE 392 Ca 0.46 0.82 -0.21 0.00 0.33 0.00 0.00 56.93 58.34 1h9a s PHE 392 Cb -0.14 -3.81 0.05 0.00 -1.31 0.00 0.00 43.02 37.81 1h9a s PHE 392 CO 0.20 -2.89 0.57 1.21 1.83 0.00 0.00 175.22 176.13 1h9a s ASN 393 N 0.97 -0.43 0.27 6.13 2.47 -1.26 -4.62 114.94 118.47 1h9a s ASN 393 Ca 0.66 -0.20 0.07 0.00 0.42 0.00 0.00 52.86 53.80 1h9a s ASN 393 Cb -0.41 0.59 -0.03 0.00 -1.45 0.00 0.00 41.25 39.95 1h9a s ASN 393 CO 0.33 -1.01 0.25 0.42 -3.72 0.00 0.00 177.10 173.37 1h9a s THR 394 N -3.80 4.38 0.20 -5.21 -4.23 -1.21 -0.84 115.64 104.94 1h9a s THR 394 Ca 0.04 -1.33 -0.18 0.00 -1.18 0.00 0.00 61.69 59.04 1h9a s THR 394 Cb -0.01 -3.43 0.03 0.00 1.34 0.00 0.00 72.50 70.43 1h9a s THR 394 CO -0.09 -0.31 0.55 0.00 -0.54 0.00 0.00 174.62 174.23 1h9a s ARG 395 N -3.90 1.43 -0.03 3.99 1.70 -0.39 -4.54 118.95 117.21 1h9a s ARG 395 Ca 0.35 -0.87 -0.00 0.00 -0.47 0.00 0.00 55.73 54.73 1h9a s ARG 395 Cb -0.08 0.53 -0.04 0.00 -0.57 0.00 0.00 34.95 34.80 1h9a s ARG 395 CO 0.26 -0.61 0.04 0.95 -1.08 0.00 0.00 175.30 174.85 1h9a s THR 396 N -3.88 4.47 0.17 4.99 -4.23 -1.26 -0.05 115.64 115.85 1h9a s THR 396 Ca 0.09 -0.40 0.07 0.00 -1.18 0.00 0.00 61.69 60.28 1h9a s THR 396 Cb -0.02 -2.98 -0.04 0.00 1.34 0.00 0.00 72.50 70.80 1h9a s THR 396 CO -0.02 0.44 -0.15 0.27 -0.54 0.00 0.00 174.62 174.62 1h9a s ILE 397 N -1.07 1.62 -0.20 2.99 -4.36 0.41 -4.92 121.20 115.68 1h9a s ILE 397 Ca 0.19 -1.99 -0.02 0.00 -0.26 0.00 0.00 60.65 58.57 1h9a s ILE 397 Cb -0.12 -1.84 0.00 0.00 1.25 0.00 0.00 42.46 41.76 1h9a s ILE 397 CO 0.09 -0.47 -0.11 -1.81 0.24 0.00 0.00 174.94 172.88 1h9a s ASP 398 N -2.89 3.84 -0.20 4.36 1.11 -1.26 -0.86 116.67 120.77 1h9a s ASP 398 Ca 0.17 -0.48 -0.15 0.00 0.18 0.00 0.00 52.55 52.26 1h9a s ASP 398 Cb -0.03 -1.63 -0.04 0.00 1.07 0.00 0.00 42.92 42.29 1h9a s ASP 398 CO 0.05 0.00 0.38 -0.76 1.18 0.00 0.00 175.17 176.02 1h9a s LEU 399 N 1.33 4.16 0.16 1.23 1.43 -0.26 -4.92 118.68 121.80 1h9a s LEU 399 Ca 0.04 0.49 0.06 0.00 -1.03 0.00 0.00 54.13 53.69 1h9a s LEU 399 Cb -0.14 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 1h9a s LEU 399 CO -0.06 -0.06 -0.13 -0.83 0.23 0.00 0.00 176.35 175.50 1h9a s GLY 400 N 1.02 1.20 -0.06 -3.19 0.00 -1.26 -0.55 107.32 104.48 1h9a s GLY 400 Ca 0.18 -1.51 -0.05 0.00 0.00 0.00 0.00 44.72 43.34 1h9a s GLY 400 CO 0.08 -1.60 0.16 0.86 0.00 0.00 0.00 173.10 172.60 1h9a s TRP 401 N -2.91 -0.18 0.08 1.90 -0.00 -0.19 -5.01 118.94 112.62 1h9a s TRP 401 Ca 0.17 0.45 0.06 0.00 -0.00 0.00 0.00 56.10 56.78 1h9a s TRP 401 Cb -0.00 0.04 -0.03 0.00 -0.00 0.00 0.00 33.47 33.48 1h9a s TRP 401 CO 0.03 -0.10 -0.16 0.99 -0.00 0.00 0.00 176.95 177.71 1h9a s THR 402 N 0.28 1.30 0.32 5.86 2.01 -1.26 -1.26 115.64 122.89 1h9a s THR 402 Ca -0.02 -1.35 -0.29 0.00 0.31 0.00 0.00 61.69 60.34 1h9a s THR 402 Cb -0.03 -1.22 -0.10 0.00 0.01 0.00 0.00 72.50 71.16 1h9a s THR 402 CO -0.01 -0.15 1.36 0.68 -0.69 0.00 0.00 174.62 175.81 1h9a s VAL 403 N -1.20 2.59 0.66 3.82 -7.23 -0.44 -5.00 120.40 113.60 1h9a s VAL 403 Ca 0.01 0.57 -0.08 0.00 -1.81 0.00 0.00 61.98 60.67 1h9a s VAL 403 Cb -0.10 -3.36 0.02 0.00 0.56 0.00 0.00 36.38 33.50 1h9a s VAL 403 CO 0.03 0.13 0.99 -0.94 -0.31 0.00 0.00 175.10 175.00 1h9a s SER 404 N -0.27 5.35 0.32 4.85 1.04 -1.26 -4.91 113.70 118.83 1h9a s SER 404 Ca 0.51 0.79 0.02 0.00 0.48 0.00 0.00 55.95 57.75 1h9a s SER 404 Cb -0.41 -1.64 0.55 0.00 0.10 0.00 0.00 66.02 64.62 1h9a s SER 404 CO 0.53 -1.28 1.90 0.44 0.98 0.00 0.00 173.24 175.80 1h9a h ASP 405 N -0.44 0.65 -0.80 7.02 5.19 -1.99 -1.33 116.42 124.72 1h9a h ASP 405 Ca -0.45 -0.09 -0.05 0.00 -0.62 0.00 0.00 57.03 55.82 1h9a h ASP 405 Cb 1.27 -0.17 -0.04 0.00 0.18 0.00 0.00 39.33 40.58 1h9a h ASP 405 CO 0.62 0.61 0.32 -0.33 -3.12 0.00 0.00 179.24 177.34 1h9a h GLU 406 N 0.69 1.19 0.16 3.56 4.39 -1.99 -0.77 114.58 121.82 1h9a h GLU 406 Ca 0.16 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 1h9a h GLU 406 Cb 0.20 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1h9a h GLU 406 CO -0.01 0.96 -0.08 -0.44 -1.16 0.00 0.00 179.01 178.28 1h9a h ASP 407 N 1.16 -0.19 -0.74 1.42 3.32 -1.71 -2.13 116.42 117.55 1h9a h ASP 407 Ca 0.27 0.01 0.10 0.00 0.02 0.00 0.00 57.03 57.42 1h9a h ASP 407 Cb 0.21 0.05 -0.07 0.00 0.22 0.00 0.00 39.33 39.74 1h9a h ASP 407 CO -0.02 -0.13 0.38 0.11 -1.72 0.00 0.00 179.24 177.85 1h9a h LYS 408 N -0.22 0.61 -0.85 3.56 1.57 -0.96 -1.38 116.57 118.90 1h9a h LYS 408 Ca -0.02 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1h9a h LYS 408 Cb 0.17 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.30 1h9a h LYS 408 CO 0.03 0.40 0.57 -0.22 -0.57 0.00 0.00 179.45 179.66 1h9a h LYS 409 N 0.63 1.12 0.00 3.15 3.64 -0.80 -3.00 116.57 121.30 1h9a h LYS 409 Ca 0.37 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1h9a h LYS 409 Cb 0.40 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1h9a h LYS 409 CO -0.28 0.74 -0.27 0.09 -2.27 0.00 0.00 179.45 177.47 1h9a n ASN 410 N -4.49 0.58 -4.67 4.20 3.02 -0.76 -4.87 115.26 108.25 1h9a n ASN 410 Ca 0.09 0.30 -0.42 0.00 -0.03 0.00 0.00 54.58 54.52 1h9a n ASN 410 Cb 0.02 -0.29 -0.03 0.00 -0.61 0.00 0.00 39.78 38.87 1h9a n ASN 410 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1h9a s THR 411 N -3.09 3.76 0.49 3.41 2.01 -0.59 -5.00 115.64 116.63 1h9a s THR 411 Ca 0.10 1.04 -0.22 0.00 0.31 0.00 0.00 61.69 62.92 1h9a s THR 411 Cb 0.15 -3.67 -0.07 0.00 0.01 0.00 0.00 72.50 68.92 1h9a s THR 411 CO 0.64 -0.05 1.17 -2.84 -0.69 0.00 0.00 174.62 172.85 1h9a s PRO 412 N 3.15 3.58 0.71 4.92 0.02 -1.26 -5.00 135.00 141.12 1h9a s PRO 412 Ca 0.65 1.77 -0.14 0.00 0.02 0.00 0.00 61.00 63.31 1h9a s PRO 412 Cb -0.30 -2.28 0.03 0.00 0.02 0.00 0.00 34.50 31.97 1h9a s PRO 412 CO 0.25 -0.70 1.15 -1.21 -0.33 0.00 0.00 177.00 176.16 1h9a s GLU 413 N -2.88 2.39 0.35 5.54 8.01 -1.26 -4.82 118.70 126.03 1h9a s GLU 413 Ca 0.67 1.52 0.06 0.00 0.01 0.00 0.00 54.97 57.23 1h9a s GLU 413 Cb -0.28 -1.89 0.74 0.00 -4.31 0.00 0.00 34.13 28.38 1h9a s GLU 413 CO 0.34 -1.59 1.92 -1.35 0.01 0.00 0.00 175.26 174.59 1h9a h PRO 414 N -0.31 0.75 -0.27 0.39 0.11 -1.91 -2.24 132.00 128.53 1h9a h PRO 414 Ca -0.47 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.47 1h9a h PRO 414 Cb 1.26 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1h9a h PRO 414 CO 0.51 0.50 -0.36 1.88 -0.21 0.00 0.00 178.00 180.32 1h9a h TYR 415 N 0.78 0.71 -0.08 0.65 0.05 -1.90 -1.48 116.97 115.69 1h9a h TYR 415 Ca 0.37 -0.19 -0.00 0.00 0.05 0.00 0.00 58.73 58.96 1h9a h TYR 415 Cb 0.41 -0.16 -0.00 0.00 1.01 0.00 0.00 36.73 37.99 1h9a h TYR 415 CO -0.00 0.88 0.04 1.49 -1.05 0.00 0.00 178.16 179.52 1h9a h GLU 416 N 0.50 0.10 -0.26 4.88 4.81 -1.74 -1.35 114.58 121.53 1h9a h GLU 416 Ca 0.05 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 1h9a h GLU 416 Cb 0.86 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.18 1h9a h GLU 416 CO 0.07 0.13 0.01 -0.09 -0.73 0.00 0.00 179.01 178.40 1h9a h ARG 417 N 0.05 0.09 -0.53 1.92 9.65 -1.27 0.12 114.38 124.41 1h9a h ARG 417 Ca 0.03 -0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 58.87 1h9a h ARG 417 Cb 0.06 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.59 1h9a h ARG 417 CO -0.00 0.06 0.22 0.52 2.80 0.00 0.00 179.97 183.56 1h9a h MET 418 N 0.09 0.78 -0.44 0.20 2.86 -1.08 0.15 114.93 117.49 1h9a h MET 418 Ca 0.12 -0.14 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 1h9a h MET 418 Cb 0.16 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 1h9a h MET 418 CO -0.20 0.68 0.01 0.82 1.06 0.00 0.00 176.91 179.28 1h9a h ILE 419 N 0.71 1.26 -0.56 -1.22 2.04 -1.04 -1.79 117.51 116.90 1h9a h ILE 419 Ca 0.18 -1.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.01 1h9a h ILE 419 Cb 0.18 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1h9a h ILE 419 CO -0.02 0.35 0.29 -0.74 0.00 0.00 0.00 178.15 178.03 1h9a h HIS 420 N 0.60 0.79 -0.61 1.37 2.76 -0.72 -1.28 115.15 118.06 1h9a h HIS 420 Ca 0.13 -0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.23 1h9a h HIS 420 Cb 0.47 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 29.15 1h9a h HIS 420 CO 0.04 0.60 0.24 -0.44 -1.30 0.00 0.00 177.93 177.06 1h9a h ASP 421 N 0.76 0.82 -0.45 3.26 5.19 -0.57 -1.78 116.42 123.65 1h9a h ASP 421 Ca 0.20 -0.11 -0.11 0.00 -0.62 0.00 0.00 57.03 56.39 1h9a h ASP 421 Cb 0.08 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.37 1h9a h ASP 421 CO -0.03 0.74 -0.12 0.74 -3.12 0.00 0.00 179.24 177.45 1h9a h THR 422 N 0.88 1.26 -0.19 0.35 2.02 -0.80 -0.55 112.91 115.89 1h9a h THR 422 Ca 0.21 -1.24 -0.07 0.00 0.77 0.00 0.00 66.41 66.08 1h9a h THR 422 Cb 0.18 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1h9a h THR 422 CO -0.02 0.43 -0.18 0.24 0.37 0.00 0.00 175.52 176.36 1h9a h MET 423 N 0.82 0.32 0.00 6.66 2.86 -0.80 -2.38 114.93 122.40 1h9a h MET 423 Ca 0.13 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1h9a h MET 423 Cb 0.65 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.27 1h9a h MET 423 CO 0.05 0.50 0.00 -0.91 1.06 0.00 0.00 176.91 177.60 1h9a h ASN 424 N 0.30 0.00 -0.07 1.22 2.35 -0.88 -3.47 115.58 115.02 1h9a h ASN 424 Ca 0.05 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.77 1h9a h ASN 424 Cb 0.50 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1h9a h ASN 424 CO 0.03 0.00 -0.03 0.61 -1.65 0.00 0.00 177.43 176.39 1h9a n GLY 425 N 1.13 0.51 3.56 2.83 0.00 -0.35 -5.00 105.19 107.87 1h9a n GLY 425 Ca 0.05 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.88 1h9a n GLY 425 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1h9a s ASP 426 N -2.74 6.45 0.00 1.61 2.15 -0.41 -4.93 116.67 118.80 1h9a s ASP 426 Ca 0.00 0.03 0.23 0.00 0.43 0.00 0.00 52.55 53.24 1h9a s ASP 426 Cb 0.00 -2.39 0.60 0.00 -0.30 0.00 0.00 42.92 40.83 1h9a s ASP 426 CO 0.00 -0.86 1.48 0.61 -0.17 0.00 0.00 175.17 176.23 1h9a n GLY 427 N 4.85 0.84 0.33 2.66 0.00 -1.26 -4.52 105.19 108.09 1h9a n GLY 427 Ca 0.03 -0.57 0.09 0.00 0.00 0.00 0.00 46.02 45.57 1h9a n GLY 427 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1h9a h SER 428 N 3.33 0.35 -0.82 1.61 4.64 -1.92 -1.67 113.55 119.07 1h9a h SER 428 Ca 0.00 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 1h9a h SER 428 Cb 0.73 -0.08 -0.21 0.00 -0.31 0.00 0.00 62.40 62.53 1h9a h SER 428 CO 0.00 0.23 0.44 0.59 -0.87 0.00 0.00 176.83 177.22 1h9a n ASN 429 N -4.47 4.17 -4.01 4.97 3.02 -1.26 -4.90 115.26 112.78 1h9a n ASN 429 Ca 0.06 -3.32 -0.18 0.00 -0.03 0.00 0.00 54.58 51.11 1h9a n ASN 429 Cb 0.25 -0.78 -0.14 0.00 -0.61 0.00 0.00 39.78 38.49 1h9a n ASN 429 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1h9a s PHE 430 N -2.95 0.72 0.13 3.10 0.40 -0.63 -4.64 117.98 114.11 1h9a s PHE 430 Ca 0.52 -0.15 -0.30 0.00 -0.60 0.00 0.00 56.93 56.40 1h9a s PHE 430 Cb 0.43 -0.46 -0.06 0.00 0.51 0.00 0.00 43.02 43.43 1h9a s PHE 430 CO 0.11 -0.01 1.07 0.00 0.70 0.00 0.00 175.22 177.10 1h9a s ALA 431 N -0.25 3.33 0.72 5.36 0.00 -1.26 -5.00 121.76 124.66 1h9a s ALA 431 Ca 0.02 0.74 -0.01 0.00 0.00 0.00 0.00 51.96 52.71 1h9a s ALA 431 Cb -0.03 -3.35 0.14 0.00 0.00 0.00 0.00 23.12 19.87 1h9a s ALA 431 CO -0.00 -0.21 0.93 -0.40 0.00 0.00 0.00 175.76 176.08 1h9a n ASP 432 N 2.87 1.17 0.01 0.00 5.75 -1.26 -4.66 116.55 120.43 1h9a n ASP 432 Ca 0.04 -2.01 -0.10 0.00 -0.01 0.00 0.00 54.79 52.71 1h9a n ASP 432 Cb 0.47 -0.61 -0.05 0.00 -1.03 0.00 0.00 41.12 39.91 1h9a n ASP 432 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 1h9a h TRP 433 N -0.65 -0.08 -0.47 2.11 -0.00 -1.97 -2.33 115.95 112.56 1h9a h TRP 433 Ca -0.31 0.01 0.07 0.00 -0.00 0.00 0.00 58.89 58.67 1h9a h TRP 433 Cb 1.11 0.05 -0.06 0.00 -0.00 0.00 0.00 29.16 30.26 1h9a h TRP 433 CO 0.00 -0.06 0.12 -0.97 -0.00 0.00 0.00 178.44 177.53 1h9a h ASN 434 N -0.03 0.06 -0.73 2.65 -0.73 -1.99 0.95 115.58 115.76 1h9a h ASN 434 Ca 0.05 0.07 -0.06 0.00 1.87 0.00 0.00 56.30 58.23 1h9a h ASN 434 Cb 0.10 0.09 -0.03 0.00 0.27 0.00 0.00 38.32 38.75 1h9a h ASN 434 CO -0.10 0.06 0.22 1.23 -0.37 0.00 0.00 177.43 178.47 1h9a h GLY 435 N 0.26 1.24 1.02 1.57 0.00 -1.92 -2.25 103.07 102.98 1h9a h GLY 435 Ca 0.23 -0.74 -0.14 0.00 0.00 0.00 0.00 47.33 46.68 1h9a h GLY 435 CO -0.28 0.69 -0.38 -2.08 0.00 0.00 0.00 176.54 174.49 1h9a h VAL 436 N 1.10 1.30 -0.67 4.60 2.07 -0.83 -2.08 116.25 121.73 1h9a h VAL 436 Ca 0.24 -1.57 -0.08 0.00 0.82 0.00 0.00 66.70 66.11 1h9a h VAL 436 Cb 0.32 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 1h9a h VAL 436 CO -0.01 0.50 0.12 0.77 0.02 0.00 0.00 177.57 178.98 1h9a h SER 437 N 0.49 1.06 -0.54 0.57 4.64 -0.74 -1.25 113.55 117.78 1h9a h SER 437 Ca 0.03 -0.26 -0.12 0.00 -0.47 0.00 0.00 61.79 60.98 1h9a h SER 437 Cb 0.97 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.76 1h9a h SER 437 CO 0.09 1.04 -0.12 0.40 -0.87 0.00 0.00 176.83 177.38 1h9a h ILE 438 N 1.03 1.27 -0.86 0.95 2.04 -1.44 -0.10 117.51 120.40 1h9a h ILE 438 Ca 0.21 -1.28 0.03 0.00 1.00 0.00 0.00 64.86 64.82 1h9a h ILE 438 Cb 0.43 0.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.43 1h9a h ILE 438 CO 0.01 0.45 0.56 0.00 0.00 0.00 0.00 178.15 179.17 1h9a h ALA 439 N 0.94 1.13 -0.33 1.87 0.00 -1.05 -0.33 119.26 121.49 1h9a h ALA 439 Ca 0.14 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1h9a h ALA 439 Cb 0.69 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1h9a h ALA 439 CO 0.05 0.42 -0.09 -1.49 0.00 0.00 0.00 179.25 178.14 1h9a h TRP 440 N 1.10 0.73 -0.49 0.00 -0.00 -0.83 -1.68 115.95 114.77 1h9a h TRP 440 Ca 0.34 -0.16 0.02 0.00 -0.00 0.00 0.00 58.89 59.09 1h9a h TRP 440 Cb -0.02 -0.18 -0.03 0.00 -0.00 0.00 0.00 29.16 28.94 1h9a h TRP 440 CO -0.02 0.82 0.30 0.87 -0.00 0.00 0.00 178.44 180.41 1h9a h LYS 441 N 0.43 0.59 0.08 0.49 1.57 -0.50 0.20 116.57 119.43 1h9a h LYS 441 Ca 0.08 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1h9a h LYS 441 Cb 0.59 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 1h9a h LYS 441 CO 0.03 0.39 -0.06 0.35 -0.57 0.00 0.00 179.45 179.60 1h9a h PHE 442 N 0.61 -0.14 -0.58 -1.35 3.57 -1.00 -2.65 116.94 115.40 1h9a h PHE 442 Ca 0.19 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.60 1h9a h PHE 442 Cb -0.01 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 1h9a h PHE 442 CO -0.06 -0.09 -0.01 0.28 -2.23 0.00 0.00 178.31 176.20 1h9a h VAL 443 N -0.14 1.27 -0.90 1.41 2.07 -1.03 -3.03 116.25 115.89 1h9a h VAL 443 Ca -0.00 -1.14 0.07 0.00 0.82 0.00 0.00 66.70 66.44 1h9a h VAL 443 Cb 0.12 0.86 -0.07 0.00 -1.52 0.00 0.00 31.29 30.68 1h9a h VAL 443 CO 0.00 0.41 0.56 0.44 0.02 0.00 0.00 177.57 179.00 1h9a h ASP 444 N 0.91 0.87 -0.94 0.57 3.32 -0.47 0.11 116.42 120.79 1h9a h ASP 444 Ca 0.16 0.02 0.09 0.00 0.02 0.00 0.00 57.03 57.32 1h9a h ASP 444 Cb 0.56 -0.16 -0.07 0.00 0.22 0.00 0.00 39.33 39.88 1h9a h ASP 444 CO 0.03 0.54 0.61 0.00 -1.72 0.00 0.00 179.24 178.70 1h9a h ALA 445 N 1.43 1.53 0.01 3.45 0.00 -1.35 0.04 119.26 124.37 1h9a h ALA 445 Ca 0.40 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.18 1h9a h ALA 445 Cb 0.22 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1h9a h ALA 445 CO -0.19 0.30 -0.48 0.82 0.00 0.00 0.00 179.25 179.69 1h9a h ILE 446 N 1.01 1.49 -0.59 0.00 2.04 -1.18 -3.27 117.51 117.01 1h9a h ILE 446 Ca 0.43 -2.09 0.10 0.00 1.00 0.00 0.00 64.86 64.30 1h9a h ILE 446 Cb 0.31 2.75 -0.08 0.00 -0.74 0.00 0.00 36.82 39.06 1h9a h ILE 446 CO -0.18 0.59 0.17 0.28 0.00 0.00 0.00 178.15 179.01 1h9a h SER 447 N -0.30 0.11 -0.98 1.72 0.02 -0.27 -1.20 113.55 112.65 1h9a h SER 447 Ca -0.06 0.09 0.14 0.00 -0.84 0.00 0.00 61.79 61.12 1h9a h SER 447 Cb 1.23 0.11 -0.09 0.00 0.14 0.00 0.00 62.40 63.78 1h9a h SER 447 CO 0.09 0.07 0.60 0.00 -1.14 0.00 0.00 176.83 176.45 1h9a h ALA 448 N 1.44 1.52 -0.15 3.77 0.00 -1.08 0.40 119.26 125.15 1h9a h ALA 448 Ca 0.31 0.05 -0.17 0.00 0.00 0.00 0.00 54.91 55.09 1h9a h ALA 448 Cb 0.42 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1h9a h ALA 448 CO -0.35 0.11 -0.61 0.28 0.00 0.00 0.00 179.25 178.68 1h9a h VAL 449 N 0.88 1.33 -0.07 0.00 2.07 -1.30 -2.94 116.25 116.22 1h9a h VAL 449 Ca 0.51 -1.90 -0.06 0.00 0.82 0.00 0.00 66.70 66.08 1h9a h VAL 449 Cb 0.62 1.87 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 1h9a h VAL 449 CO -0.31 0.58 -0.18 1.88 0.02 0.00 0.00 177.57 179.56 1h9a h TYR 450 N 0.39 0.32 0.00 1.57 0.05 -0.45 0.99 116.97 119.84 1h9a h TYR 450 Ca -0.01 -0.12 -0.04 0.00 0.05 0.00 0.00 58.73 58.61 1h9a h TYR 450 Cb 1.16 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.84 1h9a h TYR 450 CO 0.05 0.79 -0.20 1.79 -1.05 0.00 0.00 178.16 179.54 1h9a h THR 451 N -0.25 0.62 -0.18 -2.88 1.35 -1.08 -0.89 112.91 109.59 1h9a h THR 451 Ca -0.00 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 64.97 1h9a h THR 451 Cb 0.79 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 1h9a h THR 451 CO 0.04 0.19 0.00 0.00 -0.25 0.00 0.00 175.52 175.50 1h9a n ALA 452 N -2.27 2.51 -4.18 6.62 0.00 -1.11 -4.94 120.51 117.15 1h9a n ALA 452 Ca -0.01 -0.53 -0.36 0.00 0.00 0.00 0.00 53.44 52.54 1h9a n ALA 452 Cb 0.35 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.70 1h9a n ALA 452 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1h9a n ASP 453 N 0.34 -3.61 -1.81 0.00 2.03 -0.34 -4.85 116.55 108.31 1h9a n ASP 453 Ca 0.16 -0.97 -0.07 0.00 0.52 0.00 0.00 54.79 54.43 1h9a n ASP 453 Cb 0.33 -2.94 0.23 0.00 -0.72 0.00 0.00 41.12 38.02 1h9a n ASP 453 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1h9a n LYS 454 N -4.44 3.07 -3.69 -0.67 4.76 0.31 -4.86 118.16 112.64 1h9a n LYS 454 Ca 0.08 -2.47 -0.14 0.00 -2.87 0.00 0.00 58.31 52.90 1h9a n LYS 454 Cb 0.49 -2.03 -0.09 0.00 -1.84 0.00 0.00 35.03 31.57 1h9a n LYS 454 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1h9a s ALA 455 N -2.53 -1.22 0.68 7.82 0.00 -1.26 -4.91 121.76 120.34 1h9a s ALA 455 Ca 0.45 1.19 -0.15 0.00 0.00 0.00 0.00 51.96 53.44 1h9a s ALA 455 Cb 0.36 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.96 1h9a s ALA 455 CO 0.11 -0.26 1.14 -1.25 0.00 0.00 0.00 175.76 175.50 1h9a s PRO 456 N -0.24 2.57 -0.22 0.00 0.04 -1.26 -4.98 135.00 130.92 1h9a s PRO 456 Ca -0.04 1.53 -0.05 0.00 0.04 0.00 0.00 61.00 62.48 1h9a s PRO 456 Cb -0.03 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.58 1h9a s PRO 456 CO 0.03 -1.45 -0.01 -1.17 0.04 0.00 0.00 177.00 174.43 1h9a s LEU 457 N -4.93 3.08 0.58 -3.56 2.96 -1.26 -4.56 118.68 110.98 1h9a s LEU 457 Ca 0.70 -0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 54.29 1h9a s LEU 457 Cb -0.24 -1.79 0.03 0.00 0.50 0.00 0.00 46.19 44.69 1h9a s LEU 457 CO 0.42 -0.00 0.82 -1.61 -1.32 0.00 0.00 176.35 174.66 1h9a s GLU 458 N 1.39 2.54 0.09 1.98 0.41 0.08 -4.96 118.70 120.24 1h9a s GLU 458 Ca 0.05 -0.60 0.06 0.00 -0.41 0.00 0.00 54.97 54.07 1h9a s GLU 458 Cb -0.14 -2.42 -0.03 0.00 -1.78 0.00 0.00 34.13 29.76 1h9a s GLU 458 CO -0.01 -0.78 -0.17 0.99 -0.49 0.00 0.00 175.26 174.81 1h9a s THR 459 N -2.86 1.37 -0.04 3.63 2.01 -1.26 -0.99 115.64 117.51 1h9a s THR 459 Ca 0.57 -1.47 -0.12 0.00 0.31 0.00 0.00 61.69 60.98 1h9a s THR 459 Cb -0.10 -1.33 0.02 0.00 0.01 0.00 0.00 72.50 71.09 1h9a s THR 459 CO 0.40 -0.20 0.27 -0.72 -0.69 0.00 0.00 174.62 173.67 1h9a s TYR 460 N -1.40 -0.17 0.16 4.92 1.13 -1.16 -4.46 117.35 116.37 1h9a s TYR 460 Ca 0.03 0.31 -0.30 0.00 -1.41 0.00 0.00 57.07 55.70 1h9a s TYR 460 Cb -0.09 0.07 -0.08 0.00 -1.10 0.00 0.00 41.96 40.76 1h9a s TYR 460 CO 0.03 -0.30 1.23 0.21 -2.51 0.00 0.00 175.55 174.21 1h9a s LYS 461 N -0.95 4.45 0.27 -3.49 2.20 -1.26 -0.50 119.74 120.46 1h9a s LYS 461 Ca -0.10 1.90 -0.30 0.00 -0.36 0.00 0.00 55.97 57.10 1h9a s LYS 461 Cb -0.05 -3.25 -0.11 0.00 -1.51 0.00 0.00 37.83 32.90 1h9a s LYS 461 CO 0.03 -0.17 1.61 -1.12 -0.36 0.00 0.00 175.35 175.33 1h9a s SER 462 N 0.41 6.39 0.00 1.43 0.01 -1.06 -1.90 113.70 118.98 1h9a s SER 462 Ca 0.55 2.92 0.00 0.00 1.31 0.00 0.00 55.95 60.73 1h9a s SER 462 Cb -0.33 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.27 1h9a s SER 462 CO 0.35 -0.92 0.00 0.61 0.41 0.00 0.00 173.24 173.69 1h9a n GLY 463 N 2.56 0.98 3.69 3.44 0.00 0.35 -4.51 105.19 111.71 1h9a n GLY 463 Ca 0.10 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 1h9a n GLY 463 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h9a n SER 464 N 0.00 1.07 -1.15 1.61 3.41 -0.80 -3.12 113.62 114.65 1h9a n SER 464 Ca 0.00 -1.97 0.10 0.00 -0.26 0.00 0.00 58.87 56.74 1h9a n SER 464 Cb 0.00 -0.68 0.28 0.00 -0.26 0.00 0.00 64.21 63.55 1h9a n SER 464 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1h9a n MET 465 N -2.92 2.44 0.00 4.33 2.81 -1.26 -0.87 117.12 121.65 1h9a n MET 465 Ca 0.16 -2.24 0.00 0.00 -1.81 0.00 0.00 57.70 53.81 1h9a n MET 465 Cb 0.56 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.58 1h9a n MET 465 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1h9a n GLY 466 N 1.49 1.43 3.78 3.03 0.00 -1.26 -4.97 105.19 108.70 1h9a n GLY 466 Ca 0.21 -2.14 -0.31 0.00 0.00 0.00 0.00 46.02 43.78 1h9a n GLY 466 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h9a s PRO 467 N -1.27 2.35 0.53 1.61 0.04 -1.26 -4.84 135.00 132.16 1h9a s PRO 467 Ca 0.00 1.09 0.22 0.00 0.04 0.00 0.00 61.00 62.35 1h9a s PRO 467 Cb 0.00 -1.91 1.45 0.00 0.04 0.00 0.00 34.50 34.08 1h9a s PRO 467 CO 0.00 -1.55 2.15 1.49 0.04 0.00 0.00 177.00 179.13 1h9a h GLU 468 N -1.06 0.00 -0.11 4.56 4.81 -1.99 -1.50 114.58 119.30 1h9a h GLU 468 Ca -0.44 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 58.82 1h9a h GLU 468 Cb 1.23 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.61 1h9a h GLU 468 CO 0.53 0.05 0.12 0.00 -0.73 0.00 0.00 179.01 178.98 1h9a h ALA 469 N 1.95 1.72 -0.47 2.92 0.00 -1.96 -0.10 119.26 123.32 1h9a h ALA 469 Ca -0.00 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1h9a h ALA 469 Cb 0.11 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1h9a h ALA 469 CO 0.01 -0.17 -0.08 1.03 0.00 0.00 0.00 179.25 180.04 1h9a h SER 470 N 0.00 0.87 0.18 0.00 0.87 -1.63 -1.70 113.55 112.14 1h9a h SER 470 Ca 0.05 -0.35 -0.20 0.00 -1.23 0.00 0.00 61.79 60.07 1h9a h SER 470 Cb 0.28 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.00 1h9a h SER 470 CO -0.00 1.01 -0.76 0.44 -0.53 0.00 0.00 176.83 176.99 1h9a h ASP 471 N 0.72 0.59 -0.66 6.23 3.32 -1.21 -3.04 116.42 122.36 1h9a h ASP 471 Ca 0.12 -0.40 0.03 0.00 0.02 0.00 0.00 57.03 56.80 1h9a h ASP 471 Cb 0.61 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.95 1h9a h ASP 471 CO 0.04 1.15 0.44 0.50 -1.72 0.00 0.00 179.24 179.65 1h9a h LYS 472 N 0.33 0.79 -0.24 3.56 3.64 -0.97 -0.64 116.57 123.03 1h9a h LYS 472 Ca -0.04 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1h9a h LYS 472 Cb 1.36 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 1h9a h LYS 472 CO 0.14 0.52 0.12 1.25 -2.27 0.00 0.00 179.45 179.21 1h9a h LEU 473 N 0.81 0.18 -0.11 5.20 5.85 -1.19 -2.67 115.31 123.38 1h9a h LEU 473 Ca 0.26 0.01 -0.24 0.00 0.84 0.00 0.00 57.88 58.75 1h9a h LEU 473 Cb 0.03 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.05 1h9a h LEU 473 CO -0.07 0.14 -1.00 -0.07 -0.34 0.00 0.00 178.44 177.10 1h9a h LEU 474 N 0.25 0.59 -2.10 2.25 4.07 -1.50 -3.23 115.31 115.65 1h9a h LEU 474 Ca 0.10 -0.49 0.07 0.00 0.08 0.00 0.00 57.88 57.64 1h9a h LEU 474 Cb 0.03 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 1h9a h LEU 474 CO -0.07 1.30 0.19 0.00 -1.08 0.00 0.00 178.44 178.78 1h9a h ALA 475 N 0.66 2.07 0.00 1.53 0.00 -0.98 -0.78 119.26 121.75 1h9a h ALA 475 Ca -0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1h9a h ALA 475 Cb 1.64 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.45 1h9a h ALA 475 CO 0.18 -0.31 -0.05 0.00 0.00 0.00 0.00 179.25 179.07 1h9a h ALA 476 N 1.83 1.65 -0.21 0.00 0.00 -1.50 -1.78 119.26 119.27 1h9a h ALA 476 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1h9a h ALA 476 Cb 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1h9a h ALA 476 CO -0.00 0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.40 1h9a n ASN 477 N -4.09 2.60 -0.37 0.00 3.02 -0.43 -4.97 115.26 111.02 1h9a n ASN 477 Ca -0.03 -1.77 -0.02 0.00 -0.03 0.00 0.00 54.58 52.74 1h9a n ASN 477 Cb 0.13 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1h9a n ASN 477 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h9a n GLY 478 N 0.76 0.46 3.63 7.41 0.00 -0.67 -5.06 105.19 111.73 1h9a n GLY 478 Ca 0.11 -0.75 -0.28 0.00 0.00 0.00 0.00 46.02 45.10 1h9a n GLY 478 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h9a s ASP 479 N -2.95 3.94 -0.10 1.61 1.01 -0.44 -4.98 116.67 114.75 1h9a s ASP 479 Ca 0.02 -1.33 -0.18 0.00 0.71 0.00 0.00 52.55 51.76 1h9a s ASP 479 Cb -0.01 -0.41 0.04 0.00 1.01 0.00 0.00 42.92 43.56 1h9a s ASP 479 CO 0.02 -0.46 0.45 0.00 0.21 0.00 0.00 175.17 175.39 1h9a s ALA 480 N -2.70 -1.14 0.18 5.23 0.00 -1.26 -2.96 121.76 119.11 1h9a s ALA 480 Ca 0.36 1.00 -0.32 0.00 0.00 0.00 0.00 51.96 53.00 1h9a s ALA 480 Cb 0.09 -0.36 -0.11 0.00 0.00 0.00 0.00 23.12 22.74 1h9a s ALA 480 CO 0.19 -0.26 1.65 -1.58 0.00 0.00 0.00 175.76 175.75 1h9a s TRP 481 N -0.51 2.93 -0.04 0.00 0.52 -1.26 -4.92 118.94 115.66 1h9a s TRP 481 Ca -0.06 0.46 -0.25 0.00 0.02 0.00 0.00 56.10 56.28 1h9a s TRP 481 Cb -0.03 -4.03 -0.19 0.00 -1.15 0.00 0.00 33.47 28.07 1h9a s TRP 481 CO 0.03 -3.88 1.10 0.28 0.02 0.00 0.00 176.95 174.51 1h9a h VAL 482 N 4.00 1.17 -3.27 4.03 2.07 -2.00 -3.42 116.25 118.83 1h9a h VAL 482 Ca -0.43 -1.16 -0.57 0.00 0.82 0.00 0.00 66.70 65.36 1h9a h VAL 482 Cb 1.20 1.89 -0.06 0.00 -1.52 0.00 0.00 31.29 32.80 1h9a h VAL 482 CO 0.93 0.27 0.96 0.12 0.02 0.00 0.00 177.57 179.87 1h9a s PHE 483 N -3.89 2.75 -1.07 1.57 5.36 -1.26 -4.89 117.98 116.55 1h9a s PHE 483 Ca -0.15 0.88 0.23 0.00 -0.96 0.00 0.00 56.93 56.93 1h9a s PHE 483 Cb 0.01 -3.99 0.11 0.00 -0.34 0.00 0.00 43.02 38.80 1h9a s PHE 483 CO 0.60 -1.52 1.14 1.63 -1.46 0.00 0.00 175.22 175.61 1h9a n LYS 484 N 7.41 0.08 0.00 10.12 4.76 -1.26 -5.12 118.16 134.15 1h9a n LYS 484 Ca 0.14 -0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 1h9a n LYS 484 Cb 0.47 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.16 1h9a n LYS 484 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44