#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h9b s SER 2 N 0.00 6.23 -0.06 -1.34 0.15 -1.26 -4.94 113.70 112.48 1h9b s SER 2 Ca 0.00 2.16 -0.23 0.00 0.70 0.00 0.00 55.95 58.58 1h9b s SER 2 Cb 0.00 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.68 1h9b s SER 2 CO 0.00 -0.87 0.68 -0.70 1.20 0.00 0.00 173.24 173.55 1h9b s GLU 3 N -2.87 4.43 -0.40 5.44 2.12 -1.26 -4.66 118.70 121.50 1h9b s GLU 3 Ca 0.65 0.84 -0.17 0.00 0.36 0.00 0.00 54.97 56.65 1h9b s GLU 3 Cb -0.24 -3.44 0.01 0.00 0.26 0.00 0.00 34.13 30.72 1h9b s GLU 3 CO 0.29 0.10 0.46 0.42 -0.54 0.00 0.00 175.26 175.98 1h9b s ILE 4 N 0.69 5.06 -0.38 -3.70 1.01 -0.21 -5.04 121.20 118.63 1h9b s ILE 4 Ca 0.36 -0.12 -0.18 0.00 0.00 0.00 0.00 60.65 60.71 1h9b s ILE 4 Cb -0.18 -4.00 0.01 0.00 0.01 0.00 0.00 42.46 38.30 1h9b s ILE 4 CO 0.18 -0.34 0.51 -0.54 0.00 0.00 0.00 174.94 174.74 1h9b s LYS 5 N 2.23 3.43 0.03 2.79 1.02 -1.26 -4.71 119.74 123.26 1h9b s LYS 5 Ca 0.14 -0.36 -0.20 0.00 0.02 0.00 0.00 55.97 55.57 1h9b s LYS 5 Cb -0.16 -3.87 0.04 0.00 -0.52 0.00 0.00 37.83 33.32 1h9b s LYS 5 CO 0.14 -0.76 0.46 -0.08 -0.92 0.00 0.00 175.35 174.19 1h9b s THR 6 N 2.39 0.04 -0.20 2.17 -1.32 -1.13 -4.84 115.64 112.76 1h9b s THR 6 Ca 0.17 -0.35 0.01 0.00 -1.21 0.00 0.00 61.69 60.31 1h9b s THR 6 Cb -0.16 -0.93 0.04 0.00 -1.51 0.00 0.00 72.50 69.94 1h9b s THR 6 CO 0.14 -0.20 -0.11 -0.22 -2.21 0.00 0.00 174.62 172.02 1h9b s LEU 7 N -1.88 2.32 -0.18 9.08 0.20 -0.53 -2.15 118.68 125.53 1h9b s LEU 7 Ca -0.06 -0.88 -0.04 0.00 0.69 0.00 0.00 54.13 53.83 1h9b s LEU 7 Cb -0.01 -1.27 -0.02 0.00 -0.43 0.00 0.00 46.19 44.45 1h9b s LEU 7 CO -0.01 -0.13 -0.02 -0.69 -0.29 0.00 0.00 176.35 175.21 1h9b s VAL 8 N 1.37 3.89 -0.22 1.68 1.01 -0.29 -1.30 120.40 126.55 1h9b s VAL 8 Ca -0.01 -0.34 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 1h9b s VAL 8 Cb -0.16 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 1h9b s VAL 8 CO -0.09 0.46 -0.02 -0.89 0.00 0.00 0.00 175.10 174.56 1h9b s THR 9 N 0.76 3.60 -0.46 3.92 2.01 -0.32 -0.16 115.64 124.98 1h9b s THR 9 Ca -0.01 -0.42 -0.13 0.00 0.31 0.00 0.00 61.69 61.44 1h9b s THR 9 Cb -0.14 -2.64 0.08 0.00 0.01 0.00 0.00 72.50 69.81 1h9b s THR 9 CO 0.02 0.42 0.36 -0.36 -0.69 0.00 0.00 174.62 174.36 1h9b s PHE 10 N 1.35 3.28 0.01 4.92 0.08 -0.15 -0.47 117.98 127.00 1h9b s PHE 10 Ca 0.04 -1.19 -0.30 0.00 0.12 0.00 0.00 56.93 55.60 1h9b s PHE 10 Cb -0.14 -3.16 -0.04 0.00 -0.57 0.00 0.00 43.02 39.10 1h9b s PHE 10 CO -0.01 -0.84 1.12 -0.06 -0.10 0.00 0.00 175.22 175.33 1h9b s PHE 11 N 1.56 3.46 0.00 0.36 0.08 0.65 -1.72 117.98 122.37 1h9b s PHE 11 Ca 0.04 1.42 0.00 0.00 0.12 0.00 0.00 56.93 58.51 1h9b s PHE 11 Cb -0.24 -3.31 0.00 0.00 -0.57 0.00 0.00 43.02 38.89 1h9b s PHE 11 CO 0.05 -0.83 0.00 0.41 -0.10 0.00 0.00 175.22 174.75 1h9b n GLY 12 N 3.14 1.10 0.33 4.36 0.00 -0.10 -1.45 105.19 112.57 1h9b n GLY 12 Ca 0.08 -0.46 0.19 0.00 0.00 0.00 0.00 46.02 45.83 1h9b n GLY 12 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1h9b h GLY 13 N 0.00 0.00 -2.17 -0.02 0.00 -0.93 -0.97 103.07 98.99 1h9b h GLY 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1h9b h GLY 13 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 1h9b n THR 14 N -3.45 0.44 -1.09 4.70 -2.24 -1.26 -4.75 114.28 106.64 1h9b n THR 14 Ca -0.02 -0.70 -0.30 0.00 -2.27 0.00 0.00 64.05 60.77 1h9b n THR 14 Cb 0.16 0.96 0.15 0.00 -2.10 0.00 0.00 70.33 69.50 1h9b n THR 14 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1h9b s GLY 15 N -1.53 1.63 0.19 3.38 0.00 -0.37 -4.86 107.32 105.76 1h9b s GLY 15 Ca 0.38 0.05 -0.09 0.00 0.00 0.00 0.00 44.72 45.05 1h9b s GLY 15 CO 0.31 0.53 1.70 -1.80 0.00 0.00 0.00 173.10 173.85 1h9b h ASP 16 N -1.64 1.05 -0.75 1.64 3.58 -1.94 -2.04 116.42 116.32 1h9b h ASP 16 Ca -0.49 -0.24 -0.02 0.00 0.42 0.00 0.00 57.03 56.69 1h9b h ASP 16 Cb 1.28 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 42.02 1h9b h ASP 16 CO 0.52 1.02 0.38 0.25 -2.88 0.00 0.00 179.24 178.53 1h9b h LEU 17 N 1.04 0.97 -0.33 2.28 5.85 -1.93 -0.10 115.31 123.09 1h9b h LEU 17 Ca 0.21 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1h9b h LEU 17 Cb 0.39 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1h9b h LEU 17 CO 0.01 0.82 0.15 0.00 -0.34 0.00 0.00 178.44 179.07 1h9b h ALA 18 N 1.19 0.43 -0.28 1.25 0.00 -1.78 0.99 119.26 121.06 1h9b h ALA 18 Ca 0.26 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1h9b h ALA 18 Cb 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1h9b h ALA 18 CO -0.04 0.01 0.07 0.87 0.00 0.00 0.00 179.25 180.16 1h9b h LYS 19 N 0.40 0.45 0.13 0.00 1.57 -1.08 -1.22 116.57 116.81 1h9b h LYS 19 Ca 0.11 -0.11 -0.21 0.00 -1.87 0.00 0.00 60.65 58.57 1h9b h LYS 19 Cb 0.14 -0.06 0.02 0.00 0.08 0.00 0.00 32.23 32.42 1h9b h LYS 19 CO -0.01 0.53 -0.91 0.00 -0.57 0.00 0.00 179.45 178.49 1h9b h ARG 20 N 0.29 0.39 0.00 3.15 3.08 -0.96 -3.42 114.38 116.91 1h9b h ARG 20 Ca 0.09 -0.59 -0.07 0.00 0.07 0.00 0.00 59.98 59.48 1h9b h ARG 20 Cb 0.28 0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1h9b h ARG 20 CO 0.00 1.26 -1.25 1.63 -1.07 0.00 0.00 179.97 180.54 1h9b n LYS 21 N -4.05 0.10 0.49 0.04 5.02 0.28 -4.65 118.16 115.39 1h9b n LYS 21 Ca -0.14 0.03 -0.20 0.00 -2.02 0.00 0.00 58.31 55.99 1h9b n LYS 21 Cb 0.85 -0.93 -0.09 0.00 -0.02 0.00 0.00 35.03 34.84 1h9b n LYS 21 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1h9b h LEU 22 N -0.06 -1.05 -0.41 -0.35 3.38 -1.28 -2.36 115.31 113.18 1h9b h LEU 22 Ca -0.10 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1h9b h LEU 22 Cb 1.13 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 42.13 1h9b h LEU 22 CO -0.04 -0.73 0.26 1.88 0.09 0.00 0.00 178.44 179.90 1h9b h TYR 23 N -1.29 0.54 -0.46 1.13 0.05 -1.50 -1.35 116.97 114.09 1h9b h TYR 23 Ca -0.13 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.65 1h9b h TYR 23 Cb 0.95 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 38.49 1h9b h TYR 23 CO -0.00 0.37 0.27 -1.35 -1.05 0.00 0.00 178.16 176.39 1h9b h PRO 24 N 0.55 0.62 -0.34 4.88 0.11 -1.80 -0.15 132.00 135.87 1h9b h PRO 24 Ca 0.15 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.13 1h9b h PRO 24 Cb -0.02 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 30.95 1h9b h PRO 24 CO -0.03 0.44 -0.10 0.77 -0.21 0.00 0.00 178.00 178.88 1h9b h SER 25 N 0.63 0.67 0.33 -2.05 0.02 -0.96 -1.62 113.55 110.56 1h9b h SER 25 Ca 0.16 -0.37 -0.07 0.00 -0.84 0.00 0.00 61.79 60.67 1h9b h SER 25 Cb -0.01 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 1h9b h SER 25 CO -0.03 0.89 -0.34 0.58 -1.14 0.00 0.00 176.83 176.79 1h9b h VAL 26 N 0.44 1.25 -0.36 2.27 2.07 -0.83 -2.75 116.25 118.34 1h9b h VAL 26 Ca 0.08 -1.19 -0.06 0.00 0.82 0.00 0.00 66.70 66.36 1h9b h VAL 26 Cb 0.60 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1h9b h VAL 26 CO 0.04 0.34 0.01 0.15 0.02 0.00 0.00 177.57 178.12 1h9b h PHE 27 N 0.02 0.69 -0.84 1.57 3.57 -0.70 -2.70 116.94 118.55 1h9b h PHE 27 Ca 0.00 -0.12 0.05 0.00 3.53 0.00 0.00 57.97 61.43 1h9b h PHE 27 Cb 0.61 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.12 1h9b h PHE 27 CO 0.00 0.73 0.55 -0.91 -2.23 0.00 0.00 178.31 176.45 1h9b h ASN 28 N 0.45 0.86 -0.44 0.41 2.35 -1.01 0.14 115.58 118.34 1h9b h ASN 28 Ca 0.10 -0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 1h9b h ASN 28 Cb 0.45 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 1h9b h ASN 28 CO 0.02 0.57 0.16 -0.07 -1.65 0.00 0.00 177.43 176.46 1h9b h LEU 29 N 0.99 0.66 -0.17 1.61 3.38 -1.35 0.65 115.31 121.07 1h9b h LEU 29 Ca 0.35 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.13 1h9b h LEU 29 Cb 0.13 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1h9b h LEU 29 CO -0.12 0.63 -0.29 0.22 0.09 0.00 0.00 178.44 178.97 1h9b h TYR 30 N 0.71 0.62 -0.55 1.13 3.20 -0.79 -0.33 116.97 120.97 1h9b h TYR 30 Ca 0.17 -0.22 0.02 0.00 3.14 0.00 0.00 58.73 61.84 1h9b h TYR 30 Cb 0.20 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.32 1h9b h TYR 30 CO 0.01 0.93 0.36 0.87 -1.64 0.00 0.00 178.16 178.69 1h9b h LYS 31 N 0.14 0.65 -0.00 1.82 1.57 -0.12 0.30 116.57 120.92 1h9b h LYS 31 Ca 0.01 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1h9b h LYS 31 Cb 0.88 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1h9b h LYS 31 CO 0.07 0.43 -0.02 1.63 -0.57 0.00 0.00 179.45 180.99 1h9b n LYS 32 N -4.46 0.90 -0.84 3.15 5.02 0.16 -4.92 118.16 117.17 1h9b n LYS 32 Ca 0.06 -0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 1h9b n LYS 32 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 1h9b n LYS 32 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h9b n GLY 33 N 1.12 0.67 0.22 0.72 0.00 0.09 -4.92 105.19 103.09 1h9b n GLY 33 Ca 0.20 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 1h9b n GLY 33 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1h9b h TYR 34 N 0.00 0.96 -3.71 1.61 0.05 -1.26 -3.41 116.97 111.22 1h9b h TYR 34 Ca 0.00 -0.40 -0.67 0.00 0.05 0.00 0.00 58.73 57.72 1h9b h TYR 34 Cb 0.00 -0.16 -0.21 0.00 1.01 0.00 0.00 36.73 37.37 1h9b h TYR 34 CO 0.00 1.21 -0.54 -0.51 -1.05 0.00 0.00 178.16 177.27 1h9b s LEU 35 N -8.40 4.09 0.00 3.88 1.43 -1.15 -1.05 118.68 117.49 1h9b s LEU 35 Ca -0.09 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 1h9b s LEU 35 Cb 0.09 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.27 1h9b s LEU 35 CO 0.89 -0.16 0.00 0.00 0.23 0.00 0.00 176.35 177.31 1h9b n GLN 36 N 5.01 0.00 -0.05 1.70 6.02 -1.26 -4.51 117.38 124.29 1h9b n GLN 36 Ca -0.14 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.74 1h9b n GLN 36 Cb 0.50 -0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.72 1h9b n GLN 36 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1h9b n LYS 37 N -1.18 0.22 -2.18 -1.09 5.02 -1.26 -4.86 118.16 112.83 1h9b n LYS 37 Ca 0.00 0.10 -0.42 0.00 -2.02 0.00 0.00 58.31 55.96 1h9b n LYS 37 Cb 0.00 -0.88 0.00 0.00 -0.02 0.00 0.00 35.03 34.13 1h9b n LYS 37 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1h9b n HIS 38 N -3.52 3.28 -3.62 2.13 8.25 -1.26 -4.87 115.22 115.62 1h9b n HIS 38 Ca -0.20 -2.88 -0.16 0.00 -0.26 0.00 0.00 57.72 54.22 1h9b n HIS 38 Cb 0.61 -2.18 -0.07 0.00 1.12 0.00 0.00 29.99 29.47 1h9b n HIS 38 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 1h9b s PHE 39 N 1.47 -0.46 -0.07 4.41 -0.71 -1.26 -2.84 117.98 118.51 1h9b s PHE 39 Ca 0.43 0.75 -0.13 0.00 -1.04 0.00 0.00 56.93 56.94 1h9b s PHE 39 Cb 0.10 0.28 0.03 0.00 -1.21 0.00 0.00 43.02 42.22 1h9b s PHE 39 CO -0.02 -0.53 0.32 0.00 -1.34 0.00 0.00 175.22 173.65 1h9b s ALA 40 N -1.31 -0.80 -0.21 1.99 0.00 -0.92 -4.92 121.76 115.59 1h9b s ALA 40 Ca -0.12 0.66 0.01 0.00 0.00 0.00 0.00 51.96 52.51 1h9b s ALA 40 Cb -0.02 -0.27 0.03 0.00 0.00 0.00 0.00 23.12 22.86 1h9b s ALA 40 CO 0.07 -0.20 -0.15 0.42 0.00 0.00 0.00 175.76 175.90 1h9b s ILE 41 N -0.50 2.27 -0.30 0.00 -1.09 -0.74 -1.13 121.20 119.70 1h9b s ILE 41 Ca -0.06 -1.11 -0.08 0.00 -2.23 0.00 0.00 60.65 57.16 1h9b s ILE 41 Cb -0.04 -2.09 -0.00 0.00 -1.58 0.00 0.00 42.46 38.75 1h9b s ILE 41 CO 0.02 0.34 0.12 -0.69 -1.23 0.00 0.00 174.94 173.50 1h9b s VAL 42 N 1.26 4.35 0.12 2.92 1.01 0.77 -1.74 120.40 129.08 1h9b s VAL 42 Ca 0.01 -0.51 -0.10 0.00 0.00 0.00 0.00 61.98 61.38 1h9b s VAL 42 Cb -0.15 -3.22 -0.06 0.00 0.00 0.00 0.00 36.38 32.94 1h9b s VAL 42 CO -0.09 0.08 0.44 -0.83 0.00 0.00 0.00 175.10 174.70 1h9b s GLY 43 N 1.57 2.34 -0.09 4.51 0.00 0.42 -0.97 107.32 115.10 1h9b s GLY 43 Ca 0.04 -0.34 -0.09 0.00 0.00 0.00 0.00 44.72 44.32 1h9b s GLY 43 CO 0.05 -0.14 0.26 -1.08 0.00 0.00 0.00 173.10 172.19 1h9b s THR 44 N -1.49 0.01 0.26 0.90 -1.32 -0.70 -2.19 115.64 111.11 1h9b s THR 44 Ca 0.36 -0.08 -0.19 0.00 -1.21 0.00 0.00 61.69 60.58 1h9b s THR 44 Cb -0.14 -0.39 0.07 0.00 -1.51 0.00 0.00 72.50 70.53 1h9b s THR 44 CO 0.19 -0.04 0.93 0.00 -2.21 0.00 0.00 174.62 173.49 1h9b n ALA 45 N 2.71 -2.32 0.04 11.08 0.00 -1.25 -0.92 120.51 129.86 1h9b n ALA 45 Ca -0.14 -1.10 -0.20 0.00 0.00 0.00 0.00 53.44 52.00 1h9b n ALA 45 Cb 0.58 0.72 -0.12 0.00 0.00 0.00 0.00 19.45 20.63 1h9b n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h9b h ARG 46 N 0.00 0.47 -6.15 0.00 3.08 -1.92 0.50 114.38 110.36 1h9b h ARG 46 Ca -0.29 -0.59 -0.74 0.00 0.07 0.00 0.00 59.98 58.43 1h9b h ARG 46 Cb 1.20 0.19 0.04 0.00 0.08 0.00 0.00 29.97 31.47 1h9b h ARG 46 CO 0.38 1.23 0.51 0.94 -1.07 0.00 0.00 179.97 181.96 1h9b n GLN 47 N -4.06 0.77 -2.44 0.04 7.27 -1.26 -4.41 117.38 113.30 1h9b n GLN 47 Ca -0.12 0.28 -0.42 0.00 0.07 0.00 0.00 57.00 56.81 1h9b n GLN 47 Cb 0.80 -1.89 -0.02 0.00 2.41 0.00 0.00 30.24 31.54 1h9b n GLN 47 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1h9b s ALA 48 N 1.46 2.90 0.08 1.69 0.00 -1.26 -4.58 121.76 122.05 1h9b s ALA 48 Ca 0.92 -0.62 0.03 0.00 0.00 0.00 0.00 51.96 52.30 1h9b s ALA 48 Cb -1.12 -4.05 -0.03 0.00 0.00 0.00 0.00 23.12 17.92 1h9b s ALA 48 CO 0.58 -2.75 -0.10 -0.51 0.00 0.00 0.00 175.76 172.98 1h9b s LEU 49 N 5.63 2.34 0.50 0.00 1.43 -1.26 -5.10 118.68 122.22 1h9b s LEU 49 Ca 0.51 -0.71 0.08 0.00 -1.03 0.00 0.00 54.13 52.98 1h9b s LEU 49 Cb -0.10 -0.28 0.03 0.00 0.03 0.00 0.00 46.19 45.87 1h9b s LEU 49 CO 0.27 -0.22 0.52 0.54 0.23 0.00 0.00 176.35 177.68 1h9b s ASN 50 N -2.09 4.99 0.22 2.29 2.20 -1.26 -4.61 114.94 116.68 1h9b s ASN 50 Ca -0.00 -0.90 -0.08 0.00 -0.94 0.00 0.00 52.86 50.94 1h9b s ASN 50 Cb -0.06 -0.03 0.33 0.00 -2.00 0.00 0.00 41.25 39.49 1h9b s ASN 50 CO 0.00 -0.99 1.74 0.44 -2.94 0.00 0.00 177.10 175.35 1h9b h ASP 51 N 0.67 0.24 -0.74 3.54 3.32 -1.96 -1.41 116.42 120.07 1h9b h ASP 51 Ca -0.37 0.09 -0.05 0.00 0.02 0.00 0.00 57.03 56.72 1h9b h ASP 51 Cb 1.29 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.87 1h9b h ASP 51 CO 0.52 0.13 0.25 0.44 -1.72 0.00 0.00 179.24 178.86 1h9b h ASP 52 N 0.42 1.06 -0.43 6.45 3.32 -1.96 0.14 116.42 125.43 1h9b h ASP 52 Ca 0.34 -0.20 -0.13 0.00 0.02 0.00 0.00 57.03 57.06 1h9b h ASP 52 Cb 0.44 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1h9b h ASP 52 CO -0.34 0.98 -0.24 -0.33 -1.72 0.00 0.00 179.24 177.59 1h9b h GLU 53 N 1.09 0.95 -0.43 3.56 5.08 -1.86 -1.77 114.58 121.20 1h9b h GLU 53 Ca 0.24 -0.42 -0.13 0.00 -1.00 0.00 0.00 59.36 58.05 1h9b h GLU 53 Cb 0.28 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1h9b h GLU 53 CO -0.01 1.08 -0.25 0.35 -1.00 0.00 0.00 179.01 179.18 1h9b h PHE 54 N 0.81 1.07 -0.82 4.33 3.57 -1.07 -1.92 116.94 122.91 1h9b h PHE 54 Ca 0.10 -0.28 0.04 0.00 3.53 0.00 0.00 57.97 61.36 1h9b h PHE 54 Cb 0.81 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 39.26 1h9b h PHE 54 CO 0.05 1.08 0.54 0.87 -2.23 0.00 0.00 178.31 178.62 1h9b h LYS 55 N 0.75 0.96 -0.26 1.11 1.57 -0.81 -0.71 116.57 119.19 1h9b h LYS 55 Ca 0.09 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.69 1h9b h LYS 55 Cb 0.83 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1h9b h LYS 55 CO 0.07 0.64 -0.33 0.37 -0.57 0.00 0.00 179.45 179.63 1h9b h GLN 56 N 0.99 0.56 -0.30 3.15 5.75 -0.98 0.89 115.11 125.18 1h9b h GLN 56 Ca 0.33 -0.25 -0.01 0.00 -0.15 0.00 0.00 58.65 58.56 1h9b h GLN 56 Cb 0.06 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 1h9b h GLN 56 CO -0.10 0.82 0.14 1.25 -2.65 0.00 0.00 178.83 178.29 1h9b h LEU 57 N 0.48 0.40 -0.55 -2.39 6.46 -0.40 -0.60 115.31 118.72 1h9b h LEU 57 Ca 0.05 -0.14 -0.06 0.00 -0.12 0.00 0.00 57.88 57.61 1h9b h LEU 57 Cb 0.81 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.61 1h9b h LEU 57 CO 0.07 0.43 0.09 0.58 -0.62 0.00 0.00 178.44 178.99 1h9b h VAL 58 N 0.35 1.25 -0.33 1.05 2.07 -0.95 -1.78 116.25 117.91 1h9b h VAL 58 Ca 0.10 -0.96 0.06 0.00 0.82 0.00 0.00 66.70 66.73 1h9b h VAL 58 Cb 0.14 0.82 -0.06 0.00 -1.52 0.00 0.00 31.29 30.67 1h9b h VAL 58 CO -0.01 0.35 -0.02 -0.09 0.02 0.00 0.00 177.57 177.82 1h9b h ARG 59 N 0.79 0.07 0.00 1.57 2.43 -0.47 0.05 114.38 118.82 1h9b h ARG 59 Ca 0.17 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.29 1h9b h ARG 59 Cb 0.41 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1h9b h ARG 59 CO 0.01 0.05 -0.22 -0.44 -1.51 0.00 0.00 179.97 177.86 1h9b h ASP 60 N 0.07 0.00 -0.03 -3.80 3.32 -0.92 -2.19 116.42 112.87 1h9b h ASP 60 Ca 0.16 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.97 1h9b h ASP 60 Cb 0.23 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.79 1h9b h ASP 60 CO -0.29 0.22 -0.91 -1.28 -1.72 0.00 0.00 179.24 175.27 1h9b h SER 61 N 0.00 0.89 -0.01 6.45 0.87 -0.16 -3.29 113.55 118.30 1h9b h SER 61 Ca -0.00 -0.65 0.00 0.00 -1.23 0.00 0.00 61.79 59.91 1h9b h SER 61 Cb 0.46 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 1h9b h SER 61 CO 0.03 1.45 -0.02 2.30 -0.53 0.00 0.00 176.83 180.06 1h9b n ILE 62 N -3.88 0.00 -0.23 2.23 -5.35 -0.23 -4.51 119.36 107.39 1h9b n ILE 62 Ca -0.09 -0.34 -0.02 0.00 -0.27 0.00 0.00 62.75 62.03 1h9b n ILE 62 Cb 0.81 0.88 0.04 0.00 -1.74 0.00 0.00 39.64 39.64 1h9b n ILE 62 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1h9b h LYS 63 N 3.19 -0.08 -0.08 6.28 3.64 -1.47 -0.85 116.57 127.20 1h9b h LYS 63 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1h9b h LYS 63 Cb 0.69 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1h9b h LYS 63 CO 0.00 -0.05 0.00 -0.25 -2.27 0.00 0.00 179.45 176.88 1h9b n ASP 64 N -5.46 0.08 -0.13 4.20 8.00 -1.26 -2.13 116.55 119.85 1h9b n ASP 64 Ca 0.07 -1.32 0.02 0.00 0.71 0.00 0.00 54.79 54.27 1h9b n ASP 64 Cb 0.37 -0.04 0.03 0.00 -0.02 0.00 0.00 41.12 41.45 1h9b n ASP 64 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1h9b n PHE 65 N -0.42 0.00 -3.66 1.24 3.01 -0.33 -5.05 117.46 112.25 1h9b n PHE 65 Ca 0.00 -0.33 -0.37 0.00 1.01 0.00 0.00 57.45 57.75 1h9b n PHE 65 Cb 0.02 -0.06 -0.11 0.00 -0.01 0.00 0.00 39.48 39.32 1h9b n PHE 65 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 1h9b s THR 66 N -0.84 4.99 -0.24 4.37 2.01 -0.91 -4.93 115.64 120.08 1h9b s THR 66 Ca 0.06 0.06 -0.12 0.00 0.31 0.00 0.00 61.69 62.00 1h9b s THR 66 Cb 0.06 -3.36 -0.10 0.00 0.01 0.00 0.00 72.50 69.11 1h9b s THR 66 CO 0.01 0.29 -0.31 0.47 -0.69 0.00 0.00 174.62 174.39 1h9b n ASP 67 N 4.89 1.69 -4.44 3.53 9.92 -1.26 -4.93 116.55 125.94 1h9b n ASP 67 Ca -0.15 0.29 -0.37 0.00 -0.53 0.00 0.00 54.79 54.04 1h9b n ASP 67 Cb 0.52 -0.71 -0.12 0.00 -0.64 0.00 0.00 41.12 40.17 1h9b n ASP 67 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1h9b s ASP 68 N -7.16 5.19 0.20 -2.24 2.15 -1.26 -5.01 116.67 108.55 1h9b s ASP 68 Ca -0.34 -0.25 -0.09 0.00 0.43 0.00 0.00 52.55 52.31 1h9b s ASP 68 Cb 0.13 -1.93 0.13 0.00 -0.30 0.00 0.00 42.92 40.95 1h9b s ASP 68 CO 0.42 -0.05 1.76 1.56 -0.17 0.00 0.00 175.17 178.68 1h9b h GLN 69 N 8.25 1.11 -0.50 4.34 4.20 -2.00 -2.53 115.11 127.98 1h9b h GLN 69 Ca -0.37 -0.21 -0.02 0.00 0.06 0.00 0.00 58.65 58.10 1h9b h GLN 69 Cb 1.17 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.75 1h9b h GLN 69 CO 0.58 0.92 0.22 0.00 -0.67 0.00 0.00 178.83 179.89 1h9b h ALA 70 N 1.14 1.46 -0.32 3.87 0.00 -1.99 -1.88 119.26 121.53 1h9b h ALA 70 Ca 0.24 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 1h9b h ALA 70 Cb 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1h9b h ALA 70 CO -0.02 0.43 -0.28 0.37 0.00 0.00 0.00 179.25 179.75 1h9b h GLN 71 N 0.70 0.75 -0.38 0.00 4.15 -1.92 -1.40 115.11 117.01 1h9b h GLN 71 Ca 0.17 -0.38 0.01 0.00 0.77 0.00 0.00 58.65 59.22 1h9b h GLN 71 Cb 0.10 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 1h9b h GLN 71 CO -0.02 1.00 0.24 0.00 -1.93 0.00 0.00 178.83 178.12 1h9b h ALA 72 N 0.73 0.48 -0.23 3.38 0.00 -1.07 -2.27 119.26 120.28 1h9b h ALA 72 Ca 0.06 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1h9b h ALA 72 Cb 0.84 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1h9b h ALA 72 CO 0.07 -0.08 -0.35 0.93 0.00 0.00 0.00 179.25 179.81 1h9b h GLU 73 N 0.49 0.50 -0.23 0.00 4.39 -1.31 -1.60 114.58 116.83 1h9b h GLU 73 Ca 0.14 -0.23 -0.05 0.00 0.34 0.00 0.00 59.36 59.56 1h9b h GLU 73 Cb -0.03 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1h9b h GLU 73 CO -0.05 0.79 -0.08 0.00 -1.16 0.00 0.00 179.01 178.51 1h9b h ALA 74 N 1.20 1.45 0.20 3.43 0.00 -1.01 -2.65 119.26 121.88 1h9b h ALA 74 Ca 0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1h9b h ALA 74 Cb 0.82 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1h9b h ALA 74 CO 0.07 0.39 -0.10 0.35 0.00 0.00 0.00 179.25 179.96 1h9b h PHE 75 N 0.34 -0.25 -0.76 0.00 3.57 -1.06 -3.32 116.94 115.46 1h9b h PHE 75 Ca 0.07 -0.01 0.22 0.00 3.53 0.00 0.00 57.97 61.78 1h9b h PHE 75 Cb 0.36 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 1h9b h PHE 75 CO 0.01 0.13 0.55 0.82 -2.23 0.00 0.00 178.31 177.58 1h9b h ILE 76 N -0.92 0.63 0.00 1.41 2.04 -1.24 -0.12 117.51 119.30 1h9b h ILE 76 Ca -0.03 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1h9b h ILE 76 Cb 0.49 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 1h9b h ILE 76 CO 0.05 0.00 0.00 1.21 0.00 0.00 0.00 178.15 179.41 1h9b n GLU 77 N -4.32 0.13 -0.00 2.37 4.07 -1.00 -1.52 120.64 120.37 1h9b n GLU 77 Ca 0.15 0.56 0.14 0.00 -0.06 0.00 0.00 57.16 57.95 1h9b n GLU 77 Cb 0.82 -1.87 0.54 0.00 -0.06 0.00 0.00 31.44 30.87 1h9b n GLU 77 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 1h9b n HIS 78 N -2.15 0.01 -3.82 4.31 8.25 -0.06 -4.91 115.22 116.86 1h9b n HIS 78 Ca -0.00 -0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.10 1h9b n HIS 78 Cb 0.09 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.14 1h9b n HIS 78 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1h9b s PHE 79 N -1.99 3.59 0.06 4.41 0.40 -0.58 -1.79 117.98 122.08 1h9b s PHE 79 Ca 0.38 0.54 -0.04 0.00 -0.60 0.00 0.00 56.93 57.21 1h9b s PHE 79 Cb 0.21 -1.96 -0.02 0.00 0.51 0.00 0.00 43.02 41.76 1h9b s PHE 79 CO 0.33 0.67 0.07 -1.54 0.70 0.00 0.00 175.22 175.45 1h9b s SER 80 N -1.45 0.30 0.05 1.36 1.04 -0.71 -4.89 113.70 109.40 1h9b s SER 80 Ca 0.22 -0.80 0.01 0.00 0.48 0.00 0.00 55.95 55.87 1h9b s SER 80 Cb -0.13 0.25 -0.03 0.00 0.10 0.00 0.00 66.02 66.22 1h9b s SER 80 CO 0.12 -0.63 -0.06 -0.47 0.98 0.00 0.00 173.24 173.18 1h9b s TYR 81 N -3.66 0.59 -0.22 5.02 5.04 -1.26 -0.44 117.35 122.42 1h9b s TYR 81 Ca 0.04 -0.69 -0.06 0.00 -2.44 0.00 0.00 57.07 53.93 1h9b s TYR 81 Cb 0.05 -0.37 0.11 0.00 0.35 0.00 0.00 41.96 42.10 1h9b s TYR 81 CO -0.09 -0.17 0.43 0.50 -1.34 0.00 0.00 175.55 174.87 1h9b s ARG 82 N -2.40 0.35 0.40 4.97 6.06 -0.93 -4.66 118.95 122.74 1h9b s ARG 82 Ca -0.04 0.92 -0.27 0.00 -2.50 0.00 0.00 55.73 53.84 1h9b s ARG 82 Cb -0.04 0.15 -0.10 0.00 0.06 0.00 0.00 34.95 35.02 1h9b s ARG 82 CO -0.03 -0.38 1.41 0.00 -2.50 0.00 0.00 175.30 173.80 1h9b s ALA 83 N 2.62 3.39 -0.28 6.12 0.00 -1.26 -3.85 121.76 128.50 1h9b s ALA 83 Ca 0.03 1.43 -0.17 0.00 0.00 0.00 0.00 51.96 53.26 1h9b s ALA 83 Cb -0.13 -3.56 0.11 0.00 0.00 0.00 0.00 23.12 19.53 1h9b s ALA 83 CO -0.14 -1.01 0.81 -1.58 0.00 0.00 0.00 175.76 173.84 1h9b s HIS 84 N -1.18 -0.85 -0.36 0.00 5.04 0.18 -4.89 115.29 113.23 1h9b s HIS 84 Ca 0.56 1.72 -0.17 0.00 -1.54 0.00 0.00 55.06 55.62 1h9b s HIS 84 Cb -0.43 0.50 -0.00 0.00 0.04 0.00 0.00 32.58 32.69 1h9b s HIS 84 CO 0.57 -0.42 0.46 0.34 -2.34 0.00 0.00 174.74 173.35 1h9b s ASP 85 N 1.44 6.26 0.64 9.88 2.15 -1.26 -3.80 116.67 131.98 1h9b s ASP 85 Ca -0.09 -0.17 0.40 0.00 0.43 0.00 0.00 52.55 53.13 1h9b s ASP 85 Cb -0.04 -2.24 2.22 0.00 -0.30 0.00 0.00 42.92 42.55 1h9b s ASP 85 CO -0.17 -0.46 2.32 -0.37 -0.17 0.00 0.00 175.17 176.33 1h9b h VAL 86 N 5.61 0.15 0.00 1.11 -1.51 -1.99 -2.37 116.25 117.26 1h9b h VAL 86 Ca -0.28 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 1h9b h VAL 86 Cb 1.13 1.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.32 1h9b h VAL 86 CO 0.75 0.00 -0.59 0.35 -1.23 0.00 0.00 177.57 176.86 1h9b n THR 87 N -3.30 0.19 -3.31 7.19 -2.24 -1.26 -4.69 114.28 106.87 1h9b n THR 87 Ca -0.03 -0.16 -0.44 0.00 -2.27 0.00 0.00 64.05 61.15 1h9b n THR 87 Cb 0.09 0.03 -0.07 0.00 -2.10 0.00 0.00 70.33 68.27 1h9b n THR 87 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1h9b s ASP 88 N -3.69 6.17 0.20 3.42 2.15 -0.89 -4.96 116.67 119.06 1h9b s ASP 88 Ca 0.08 -1.17 -0.13 0.00 0.43 0.00 0.00 52.55 51.76 1h9b s ASP 88 Cb 0.15 -2.22 0.22 0.00 -0.30 0.00 0.00 42.92 40.77 1h9b s ASP 88 CO 0.71 -0.73 1.67 0.00 -0.17 0.00 0.00 175.17 176.65 1h9b h ALA 89 N 8.84 0.50 -0.98 3.66 0.00 -1.86 -0.57 119.26 128.84 1h9b h ALA 89 Ca -0.28 0.17 0.17 0.00 0.00 0.00 0.00 54.91 54.97 1h9b h ALA 89 Cb 1.11 0.30 -0.09 0.00 0.00 0.00 0.00 17.79 19.10 1h9b h ALA 89 CO 0.91 -0.40 0.61 0.00 0.00 0.00 0.00 179.25 180.37 1h9b h ALA 90 N 1.49 1.76 0.00 0.00 0.00 -1.95 -1.02 119.26 119.55 1h9b h ALA 90 Ca 0.27 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1h9b h ALA 90 Cb 0.42 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1h9b h ALA 90 CO -0.47 -0.08 -0.03 1.03 0.00 0.00 0.00 179.25 179.70 1h9b h SER 91 N 0.74 0.00 0.52 0.00 0.87 -1.40 -2.33 113.55 111.95 1h9b h SER 91 Ca 0.53 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 61.08 1h9b h SER 91 Cb 0.85 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.81 1h9b h SER 91 CO -0.30 0.03 -0.07 1.88 -0.53 0.00 0.00 176.83 177.83 1h9b h TYR 92 N 0.00 0.00 -0.36 2.24 -1.99 -1.21 -2.41 116.97 113.25 1h9b h TYR 92 Ca -0.00 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.65 1h9b h TYR 92 Cb 0.07 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.78 1h9b h TYR 92 CO 0.00 0.07 -0.11 0.00 -0.00 0.00 0.00 178.16 178.12 1h9b h ALA 93 N 1.93 1.14 -0.48 3.88 0.00 -1.57 0.25 119.26 124.41 1h9b h ALA 93 Ca -0.00 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.49 1h9b h ALA 93 Cb 0.35 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1h9b h ALA 93 CO 0.01 0.54 -0.20 0.28 0.00 0.00 0.00 179.25 179.88 1h9b h VAL 94 N 0.57 1.27 -0.28 0.00 2.07 -1.60 -2.30 116.25 115.97 1h9b h VAL 94 Ca 0.10 -1.36 -0.17 0.00 0.82 0.00 0.00 66.70 66.09 1h9b h VAL 94 Cb 0.53 1.11 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1h9b h VAL 94 CO 0.03 0.47 -0.50 0.25 0.02 0.00 0.00 177.57 177.84 1h9b h LEU 95 N 0.84 0.86 -0.94 2.57 5.85 -1.47 -2.38 115.31 120.64 1h9b h LEU 95 Ca 0.11 -0.44 0.06 0.00 0.84 0.00 0.00 57.88 58.46 1h9b h LEU 95 Cb 0.77 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.49 1h9b h LEU 95 CO 0.06 1.21 0.60 0.50 -0.34 0.00 0.00 178.44 180.47 1h9b h LYS 96 N 0.61 1.06 -0.10 1.25 3.64 -0.80 -0.57 116.57 121.66 1h9b h LYS 96 Ca 0.03 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1h9b h LYS 96 Cb 1.08 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1h9b h LYS 96 CO 0.11 0.70 -0.01 1.49 -2.27 0.00 0.00 179.45 179.47 1h9b h GLU 97 N 1.09 0.18 -0.81 1.90 4.81 -1.25 -1.82 114.58 118.68 1h9b h GLU 97 Ca 0.41 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.62 1h9b h GLU 97 Cb 0.17 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.48 1h9b h GLU 97 CO -0.17 0.45 0.53 0.00 -0.73 0.00 0.00 179.01 179.10 1h9b h ALA 98 N 0.72 1.55 -0.10 2.92 0.00 -0.89 -0.13 119.26 123.33 1h9b h ALA 98 Ca 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1h9b h ALA 98 Cb 0.38 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1h9b h ALA 98 CO 0.01 0.35 0.00 0.82 0.00 0.00 0.00 179.25 180.43 1h9b h ILE 99 N 0.95 1.24 -0.26 0.00 2.04 -0.99 -1.68 117.51 118.81 1h9b h ILE 99 Ca 0.34 -0.76 -0.05 0.00 1.00 0.00 0.00 64.86 65.39 1h9b h ILE 99 Cb 0.12 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1h9b h ILE 99 CO -0.11 0.22 -0.05 -0.33 0.00 0.00 0.00 178.15 177.87 1h9b h GLU 100 N -0.10 0.40 -0.57 2.37 5.08 -0.89 -1.04 114.58 119.83 1h9b h GLU 100 Ca 0.03 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1h9b h GLU 100 Cb 0.33 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1h9b h GLU 100 CO 0.00 0.47 0.07 0.93 -1.00 0.00 0.00 179.01 179.49 1h9b h GLU 101 N 0.38 0.96 -0.11 2.33 5.08 -0.85 -1.92 114.58 120.46 1h9b h GLU 101 Ca 0.08 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1h9b h GLU 101 Cb 0.34 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 1h9b h GLU 101 CO 0.01 0.93 0.02 0.00 -1.00 0.00 0.00 179.01 178.98 1h9b h ALA 102 N 1.00 0.14 -0.37 3.43 0.00 -0.76 -1.09 119.26 121.60 1h9b h ALA 102 Ca 0.17 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1h9b h ALA 102 Cb 0.44 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1h9b h ALA 102 CO 0.01 -0.22 0.25 0.00 0.00 0.00 0.00 179.25 179.29 1h9b h ALA 103 N 0.81 1.89 0.14 0.00 0.00 -1.11 -2.17 119.26 118.82 1h9b h ALA 103 Ca 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1h9b h ALA 103 Cb 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1h9b h ALA 103 CO 0.00 0.06 -0.07 -0.44 0.00 0.00 0.00 179.25 178.80 1h9b h ASP 104 N 0.37 -0.16 -0.84 0.00 5.19 -1.11 0.35 116.42 120.21 1h9b h ASP 104 Ca 0.15 -0.34 0.21 0.00 -0.62 0.00 0.00 57.03 56.44 1h9b h ASP 104 Cb 0.16 0.04 -0.05 0.00 0.18 0.00 0.00 39.33 39.66 1h9b h ASP 104 CO -0.04 0.43 0.58 0.50 -3.12 0.00 0.00 179.24 177.60 1h9b h LYS 105 N -0.94 0.23 -0.18 3.56 3.64 -1.04 -1.37 116.57 120.47 1h9b h LYS 105 Ca -0.02 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1h9b h LYS 105 Cb 0.48 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1h9b h LYS 105 CO 0.03 0.15 0.00 1.19 -2.27 0.00 0.00 179.45 178.55 1h9b n PHE 106 N -4.42 0.23 -3.23 1.91 3.72 -0.83 -5.04 117.46 109.80 1h9b n PHE 106 Ca 0.18 -0.37 -0.15 0.00 -0.05 0.00 0.00 57.45 57.05 1h9b n PHE 106 Cb 0.76 -0.03 0.01 0.00 -0.94 0.00 0.00 39.48 39.28 1h9b n PHE 106 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1h9b n ASP 107 N 0.25 -6.81 -4.04 4.37 2.03 -0.08 -4.43 116.55 107.85 1h9b n ASP 107 Ca 0.07 -0.07 -0.30 0.00 0.52 0.00 0.00 54.79 55.01 1h9b n ASP 107 Cb 0.32 -3.88 -0.17 0.00 -0.72 0.00 0.00 41.12 36.67 1h9b n ASP 107 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1h9b s ILE 108 N -2.56 1.56 -0.78 5.18 1.01 0.10 -4.88 121.20 120.84 1h9b s ILE 108 Ca 0.16 -0.65 -0.17 0.00 0.00 0.00 0.00 60.65 59.98 1h9b s ILE 108 Cb -0.03 -1.45 0.15 0.00 0.01 0.00 0.00 42.46 41.14 1h9b s ILE 108 CO 0.81 0.46 0.86 -1.81 0.00 0.00 0.00 174.94 175.26 1h9b s ASP 109 N 1.24 6.51 1.65 3.58 1.01 -1.26 -4.76 116.67 124.64 1h9b s ASP 109 Ca -0.01 -2.02 0.00 0.00 0.71 0.00 0.00 52.55 51.23 1h9b s ASP 109 Cb -0.14 -2.31 0.00 0.00 1.01 0.00 0.00 42.92 41.49 1h9b s ASP 109 CO -0.06 -0.93 0.00 0.61 0.21 0.00 0.00 175.17 174.99 1h9b n GLY 110 N 4.94 2.81 3.70 0.21 0.00 -1.25 -4.45 105.19 111.15 1h9b n GLY 110 Ca 0.09 -0.23 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1h9b n GLY 110 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h9b n ASN 111 N 6.73 -5.31 -4.76 1.61 4.13 -1.18 -4.43 115.26 112.05 1h9b n ASN 111 Ca 0.00 -1.03 -0.36 0.00 1.68 0.00 0.00 54.58 54.87 1h9b n ASN 111 Cb 0.00 -3.30 -0.08 0.00 -1.54 0.00 0.00 39.78 34.86 1h9b n ASN 111 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1h9b s ARG 112 N -6.03 3.48 -0.09 3.52 0.52 -0.68 -1.45 118.95 118.22 1h9b s ARG 112 Ca 0.48 -0.26 0.04 0.00 -0.52 0.00 0.00 55.73 55.47 1h9b s ARG 112 Cb -0.18 -3.10 -0.00 0.00 0.52 0.00 0.00 34.95 32.20 1h9b s ARG 112 CO 0.87 0.61 -0.23 0.42 0.02 0.00 0.00 175.30 176.99 1h9b s ILE 113 N -0.58 1.96 -0.22 1.52 1.01 -0.42 -1.00 121.20 123.48 1h9b s ILE 113 Ca 0.11 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 59.77 1h9b s ILE 113 Cb -0.12 -1.70 0.01 0.00 0.01 0.00 0.00 42.46 40.67 1h9b s ILE 113 CO 0.02 0.54 -0.10 -0.36 0.00 0.00 0.00 174.94 175.05 1h9b s PHE 114 N 0.28 2.95 -0.28 3.97 0.08 0.26 -1.18 117.98 124.06 1h9b s PHE 114 Ca -0.16 -1.40 -0.10 0.00 0.12 0.00 0.00 56.93 55.39 1h9b s PHE 114 Cb -0.17 -2.03 -0.03 0.00 -0.57 0.00 0.00 43.02 40.21 1h9b s PHE 114 CO 0.08 -0.70 0.16 -0.47 -0.10 0.00 0.00 175.22 174.19 1h9b s TYR 115 N 1.36 3.18 -1.01 0.36 6.14 0.37 -1.15 117.35 126.61 1h9b s TYR 115 Ca 0.03 -0.15 -0.12 0.00 0.64 0.00 0.00 57.07 57.47 1h9b s TYR 115 Cb -0.15 -2.35 0.23 0.00 0.42 0.00 0.00 41.96 40.11 1h9b s TYR 115 CO -0.07 -0.28 1.03 -1.64 0.64 0.00 0.00 175.55 175.24 1h9b s MET 116 N 1.70 3.93 -0.91 4.97 -1.94 -0.81 -0.25 119.30 125.99 1h9b s MET 116 Ca 0.06 -2.77 -0.03 0.00 -1.71 0.00 0.00 55.69 51.25 1h9b s MET 116 Cb -0.16 -4.59 0.25 0.00 2.01 0.00 0.00 34.83 32.34 1h9b s MET 116 CO 0.08 -1.36 2.15 0.45 -0.01 0.00 0.00 175.02 176.34 1h9b n SER 117 N 3.77 7.37 -3.22 3.03 2.88 -0.53 -3.82 113.62 123.10 1h9b n SER 117 Ca 0.22 -3.57 -0.16 0.00 -1.33 0.00 0.00 58.87 54.03 1h9b n SER 117 Cb 0.43 -1.18 -0.03 0.00 -0.75 0.00 0.00 64.21 62.68 1h9b n SER 117 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1h9b n VAL 118 N 0.21 0.00 -2.35 2.46 0.24 -1.26 -4.33 118.33 113.30 1h9b n VAL 118 Ca 0.52 -1.22 -0.41 0.00 -2.04 0.00 0.00 64.34 61.19 1h9b n VAL 118 Cb 0.30 0.29 -0.04 0.00 -1.47 0.00 0.00 33.84 32.92 1h9b n VAL 118 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1h9b s ALA 119 N -2.47 3.44 0.49 2.33 0.00 -1.26 -4.91 121.76 119.38 1h9b s ALA 119 Ca 0.02 1.02 0.32 0.00 0.00 0.00 0.00 51.96 53.31 1h9b s ALA 119 Cb 0.00 -3.39 1.42 0.00 0.00 0.00 0.00 23.12 21.15 1h9b s ALA 119 CO 0.02 -0.33 1.75 -1.35 0.00 0.00 0.00 175.76 175.84 1h9b h PRO 120 N 3.91 0.12 0.00 0.00 0.11 -1.94 -0.37 132.00 133.83 1h9b h PRO 120 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1h9b h PRO 120 Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1h9b h PRO 120 CO 0.68 0.08 0.00 2.89 -0.21 0.00 0.00 178.00 181.44 1h9b n ARG 121 N -4.36 0.15 0.00 1.05 1.85 -1.26 -2.40 116.66 111.68 1h9b n ARG 121 Ca 0.29 0.56 0.10 0.00 -1.00 0.00 0.00 57.85 57.79 1h9b n ARG 121 Cb 1.23 -1.90 -0.02 0.00 -1.05 0.00 0.00 32.46 30.71 1h9b n ARG 121 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1h9b n PHE 122 N -2.20 0.00 -0.03 2.89 3.72 -0.15 -4.65 117.46 117.05 1h9b n PHE 122 Ca -0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.31 1h9b n PHE 122 Cb 0.09 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.61 1h9b n PHE 122 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 1h9b h PHE 123 N 1.77 -0.72 -0.48 1.38 0.04 -1.61 -1.70 116.94 115.61 1h9b h PHE 123 Ca 0.00 0.04 -0.11 0.00 2.80 0.00 0.00 57.97 60.70 1h9b h PHE 123 Cb 0.63 0.35 -0.01 0.00 2.20 0.00 0.00 35.95 39.11 1h9b h PHE 123 CO 0.00 -0.35 -0.13 0.78 -0.60 0.00 0.00 178.31 178.02 1h9b h GLY 124 N -0.30 1.01 0.70 -1.45 0.00 -1.82 -2.93 103.07 98.29 1h9b h GLY 124 Ca 0.12 -0.85 0.02 0.00 0.00 0.00 0.00 47.33 46.63 1h9b h GLY 124 CO -0.37 0.77 -0.13 -0.84 0.00 0.00 0.00 176.54 175.97 1h9b h THR 125 N 0.79 0.69 -0.05 4.70 2.02 -1.76 -1.85 112.91 117.44 1h9b h THR 125 Ca 0.12 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.31 1h9b h THR 125 Cb 0.69 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 1h9b h THR 125 CO 0.05 0.00 -0.04 0.40 0.37 0.00 0.00 175.52 176.30 1h9b h ILE 126 N -0.22 0.88 -0.41 3.11 2.04 -1.34 -1.82 117.51 119.75 1h9b h ILE 126 Ca 0.04 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.95 1h9b h ILE 126 Cb 0.27 0.88 -0.05 0.00 -0.74 0.00 0.00 36.82 37.18 1h9b h ILE 126 CO -0.11 0.00 0.13 0.00 0.00 0.00 0.00 178.15 178.17 1h9b h ALA 127 N 1.00 0.47 -0.59 1.87 0.00 -1.41 0.21 119.26 120.82 1h9b h ALA 127 Ca 0.03 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1h9b h ALA 127 Cb 0.09 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1h9b h ALA 127 CO -0.08 -0.26 0.37 0.87 0.00 0.00 0.00 179.25 180.15 1h9b h LYS 128 N 0.28 0.79 -0.02 0.00 1.57 -1.14 -2.23 116.57 115.82 1h9b h LYS 128 Ca 0.19 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.81 1h9b h LYS 128 Cb 0.19 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1h9b h LYS 128 CO -0.21 0.54 -0.44 1.88 -0.57 0.00 0.00 179.45 180.66 1h9b h TYR 129 N 0.80 0.06 -0.76 -1.35 0.05 -0.74 -2.06 116.97 112.97 1h9b h TYR 129 Ca 0.21 -0.02 0.02 0.00 0.05 0.00 0.00 58.73 59.00 1h9b h TYR 129 Cb -0.06 -0.01 -0.04 0.00 1.01 0.00 0.00 36.73 37.63 1h9b h TYR 129 CO -0.03 0.49 0.50 -0.07 -1.05 0.00 0.00 178.16 178.00 1h9b h LEU 130 N 0.05 0.84 0.00 3.88 3.38 0.03 -0.18 115.31 123.30 1h9b h LEU 130 Ca 0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1h9b h LEU 130 Cb 0.80 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1h9b h LEU 130 CO 0.06 0.60 -0.01 0.50 0.09 0.00 0.00 178.44 179.68 1h9b h LYS 131 N 0.99 0.00 -0.04 1.13 3.64 -1.32 -0.42 116.57 120.54 1h9b h LYS 131 Ca 0.29 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.64 1h9b h LYS 131 Cb -0.05 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.76 1h9b h LYS 131 CO -0.07 0.78 -0.10 0.66 -2.27 0.00 0.00 179.45 178.45 1h9b h SER 132 N -1.00 0.05 -0.26 4.20 4.64 -1.33 -2.50 113.55 117.35 1h9b h SER 132 Ca -0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1h9b h SER 132 Cb 0.78 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1h9b h SER 132 CO -0.00 0.15 0.00 -0.62 -0.87 0.00 0.00 176.83 175.49 1h9b n GLU 133 N -4.40 2.04 -2.68 4.77 -0.58 -0.09 -4.98 120.64 114.73 1h9b n GLU 133 Ca -0.02 -1.57 -0.13 0.00 -0.42 0.00 0.00 57.16 55.02 1h9b n GLU 133 Cb 0.19 -1.43 0.02 0.00 -0.57 0.00 0.00 31.44 29.64 1h9b n GLU 133 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1h9b n GLY 134 N 1.27 -0.01 0.05 0.62 0.00 -0.94 -4.84 105.19 101.34 1h9b n GLY 134 Ca 0.17 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 46.05 1h9b n GLY 134 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h9b n LEU 135 N -2.41 0.65 -4.73 0.99 4.32 -0.17 -4.88 117.00 110.76 1h9b n LEU 135 Ca -0.07 0.22 -0.41 0.00 -0.02 0.00 0.00 56.01 55.73 1h9b n LEU 135 Cb 0.57 -0.21 -0.04 0.00 -1.62 0.00 0.00 43.42 42.12 1h9b n LEU 135 CO 0.27 -0.03 0.80 -0.76 -1.22 0.00 0.00 177.39 176.45 1h9b s LEU 136 N -4.00 4.45 0.31 2.23 1.43 -1.21 -5.00 118.68 116.91 1h9b s LEU 136 Ca 0.08 2.03 -0.29 0.00 -1.03 0.00 0.00 54.13 54.92 1h9b s LEU 136 Cb 0.14 -3.60 -0.10 0.00 0.03 0.00 0.00 46.19 42.66 1h9b s LEU 136 CO 0.70 -0.27 1.39 0.00 0.23 0.00 0.00 176.35 178.40 1h9b s ALA 137 N 0.14 3.56 -1.08 4.21 0.00 -1.26 -4.91 121.76 122.43 1h9b s ALA 137 Ca 0.51 1.35 0.26 0.00 0.00 0.00 0.00 51.96 54.09 1h9b s ALA 137 Cb -0.29 -3.53 0.68 0.00 0.00 0.00 0.00 23.12 19.98 1h9b s ALA 137 CO 0.33 -0.76 1.54 -0.25 0.00 0.00 0.00 175.76 176.61 1h9b n ASP 138 N 1.26 0.44 -4.19 0.00 8.00 -1.26 -4.83 116.55 115.97 1h9b n ASP 138 Ca 0.03 -0.17 -0.23 0.00 0.71 0.00 0.00 54.79 55.13 1h9b n ASP 138 Cb 0.41 0.09 -0.14 0.00 -0.02 0.00 0.00 41.12 41.46 1h9b n ASP 138 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1h9b s THR 139 N -2.95 1.37 0.00 -3.53 -1.32 -1.26 -5.06 115.64 102.89 1h9b s THR 139 Ca 0.13 -1.04 0.00 0.00 -1.21 0.00 0.00 61.69 59.57 1h9b s THR 139 Cb 0.18 -1.20 0.00 0.00 -1.51 0.00 0.00 72.50 69.97 1h9b s THR 139 CO 0.65 0.14 0.00 0.61 -2.21 0.00 0.00 174.62 173.80 1h9b n GLY 140 N 1.98 -0.93 3.97 6.08 0.00 -1.26 -3.30 105.19 111.72 1h9b n GLY 140 Ca -0.17 -1.20 -0.18 0.00 0.00 0.00 0.00 46.02 44.46 1h9b n GLY 140 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1h9b s TYR 141 N 0.00 2.83 -0.10 1.61 -0.85 -1.26 -4.77 117.35 114.82 1h9b s TYR 141 Ca 0.00 -0.39 -0.03 0.00 -0.52 0.00 0.00 57.07 56.12 1h9b s TYR 141 Cb 0.00 -2.25 0.05 0.00 0.38 0.00 0.00 41.96 40.14 1h9b s TYR 141 CO 0.00 -0.26 0.10 -0.80 -1.52 0.00 0.00 175.55 173.07 1h9b s ASN 142 N -4.25 1.47 0.02 -0.18 0.01 -1.26 -1.69 114.94 109.07 1h9b s ASN 142 Ca 0.51 -0.12 0.05 0.00 -0.71 0.00 0.00 52.86 52.60 1h9b s ASN 142 Cb -0.08 -0.07 -0.02 0.00 0.41 0.00 0.00 41.25 41.49 1h9b s ASN 142 CO 0.31 -0.29 -0.16 -0.13 -1.51 0.00 0.00 177.10 175.33 1h9b s ARG 143 N 2.19 1.10 -0.07 -0.60 0.52 -0.17 -4.82 118.95 117.11 1h9b s ARG 143 Ca 0.04 -0.72 0.05 0.00 -0.52 0.00 0.00 55.73 54.58 1h9b s ARG 143 Cb -0.14 -1.11 -0.01 0.00 0.52 0.00 0.00 34.95 34.21 1h9b s ARG 143 CO -0.06 0.29 -0.23 -1.17 0.02 0.00 0.00 175.30 174.15 1h9b s LEU 144 N -0.90 2.17 -0.36 2.53 2.96 -0.42 -0.58 118.68 124.09 1h9b s LEU 144 Ca 0.04 -0.48 -0.04 0.00 -0.22 0.00 0.00 54.13 53.44 1h9b s LEU 144 Cb -0.07 -1.41 0.07 0.00 0.50 0.00 0.00 46.19 45.28 1h9b s LEU 144 CO 0.01 0.24 0.12 -0.04 -1.32 0.00 0.00 176.35 175.36 1h9b s MET 145 N -0.14 2.33 -0.20 1.98 -1.94 -0.30 -0.35 119.30 120.68 1h9b s MET 145 Ca -0.04 -1.47 -0.15 0.00 -1.71 0.00 0.00 55.69 52.32 1h9b s MET 145 Cb -0.14 -3.44 -0.04 0.00 2.01 0.00 0.00 34.83 33.22 1h9b s MET 145 CO 0.04 -0.83 0.38 0.42 -0.01 0.00 0.00 175.02 175.02 1h9b s ILE 146 N 1.26 5.21 0.85 2.53 1.09 -0.66 -1.92 121.20 129.57 1h9b s ILE 146 Ca 0.01 0.67 -0.12 0.00 -1.10 0.00 0.00 60.65 60.11 1h9b s ILE 146 Cb -0.21 -3.71 0.11 0.00 -1.06 0.00 0.00 42.46 37.58 1h9b s ILE 146 CO -0.01 0.26 1.17 -1.61 -0.10 0.00 0.00 174.94 174.64 1h9b s GLU 147 N 1.27 1.60 0.37 2.79 0.41 -1.25 -1.49 118.70 122.40 1h9b s GLU 147 Ca 0.18 0.17 -0.28 0.00 -0.41 0.00 0.00 54.97 54.64 1h9b s GLU 147 Cb -0.15 -1.90 -0.10 0.00 -1.78 0.00 0.00 34.13 30.20 1h9b s GLU 147 CO 0.08 -1.86 1.33 0.21 -0.49 0.00 0.00 175.26 174.53 1h9b s LYS 148 N -5.46 4.17 0.31 1.61 2.20 -1.26 -4.42 119.74 116.90 1h9b s LYS 148 Ca 0.63 2.24 0.07 0.00 -0.36 0.00 0.00 55.97 58.55 1h9b s LYS 148 Cb -0.12 -2.94 -0.03 0.00 -1.51 0.00 0.00 37.83 33.23 1h9b s LYS 148 CO 0.51 -0.35 0.30 -1.25 -0.36 0.00 0.00 175.35 174.20 1h9b s PRO 149 N -2.01 2.86 -1.11 4.03 0.04 -1.26 -4.87 135.00 132.69 1h9b s PRO 149 Ca 0.52 -1.18 -0.08 0.00 0.04 0.00 0.00 61.00 60.31 1h9b s PRO 149 Cb -0.40 -2.57 0.29 0.00 0.04 0.00 0.00 34.50 31.86 1h9b s PRO 149 CO 0.53 0.17 1.24 0.34 0.04 0.00 0.00 177.00 179.31 1h9b n PHE 150 N -1.38 4.38 0.00 0.56 7.35 -1.26 -4.96 117.46 122.16 1h9b n PHE 150 Ca -0.03 -3.51 0.00 0.00 -0.76 0.00 0.00 57.45 53.15 1h9b n PHE 150 Cb 0.59 -1.59 0.00 0.00 0.35 0.00 0.00 39.48 38.83 1h9b n PHE 150 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1h9b n GLY 151 N 2.30 -0.21 0.00 7.13 0.00 -1.26 -4.63 105.19 108.52 1h9b n GLY 151 Ca 0.25 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1h9b n GLY 151 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h9b n THR 152 N -0.21 0.21 -3.73 2.61 -2.24 -1.26 -4.92 114.28 104.74 1h9b n THR 152 Ca 0.00 -0.31 -0.01 0.00 -2.27 0.00 0.00 64.05 61.46 1h9b n THR 152 Cb 0.00 1.18 -0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1h9b n THR 152 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1h9b s SER 153 N -0.21 -0.08 0.16 3.42 1.04 -1.26 -5.01 113.70 111.75 1h9b s SER 153 Ca 0.00 -0.29 -0.13 0.00 0.48 0.00 0.00 55.95 56.00 1h9b s SER 153 Cb 0.00 0.31 0.05 0.00 0.10 0.00 0.00 66.02 66.48 1h9b s SER 153 CO 0.00 -0.58 1.73 0.22 0.98 0.00 0.00 173.24 175.59 1h9b h TYR 154 N 2.00 0.79 0.19 5.02 3.20 -1.94 -1.83 116.97 124.40 1h9b h TYR 154 Ca -0.27 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.55 1h9b h TYR 154 Cb 1.21 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 39.22 1h9b h TYR 154 CO 0.56 0.64 -0.23 -0.44 -1.64 0.00 0.00 178.16 177.04 1h9b h ASP 155 N 0.72 -0.63 -0.58 -2.11 3.32 -1.97 0.26 116.42 115.41 1h9b h ASP 155 Ca 0.18 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 1h9b h ASP 155 Cb 0.17 0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.92 1h9b h ASP 155 CO -0.02 -0.33 0.27 0.71 -1.72 0.00 0.00 179.24 178.15 1h9b h THR 156 N -0.47 1.21 -0.74 0.35 1.35 -1.95 -0.98 112.91 111.68 1h9b h THR 156 Ca 0.01 -0.62 -0.01 0.00 -0.55 0.00 0.00 66.41 65.24 1h9b h THR 156 Cb 0.46 0.54 -0.04 0.00 -1.73 0.00 0.00 68.15 67.38 1h9b h THR 156 CO -0.08 0.25 0.44 0.00 -0.25 0.00 0.00 175.52 175.87 1h9b h ALA 157 N 1.11 0.95 -0.25 6.62 0.00 -1.11 -0.02 119.26 126.56 1h9b h ALA 157 Ca 0.20 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1h9b h ALA 157 Cb 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1h9b h ALA 157 CO -0.02 0.42 -0.09 0.00 0.00 0.00 0.00 179.25 179.56 1h9b h ALA 158 N 1.23 1.39 -0.21 0.00 0.00 -0.07 0.68 119.26 122.28 1h9b h ALA 158 Ca 0.26 -0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 1h9b h ALA 158 Cb -0.02 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.66 1h9b h ALA 158 CO -0.05 0.42 -0.63 1.49 0.00 0.00 0.00 179.25 180.48 1h9b h GLU 159 N 0.37 0.80 -0.09 0.00 4.81 -0.35 -0.81 114.58 119.31 1h9b h GLU 159 Ca 0.08 -0.58 -0.01 0.00 -0.13 0.00 0.00 59.36 58.72 1h9b h GLU 159 Cb 0.39 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 1h9b h GLU 159 CO 0.02 1.20 0.02 1.25 -0.73 0.00 0.00 179.01 180.77 1h9b h LEU 160 N 0.54 0.14 -0.80 1.64 5.85 -0.60 -1.09 115.31 121.00 1h9b h LEU 160 Ca -0.02 -0.22 0.06 0.00 0.84 0.00 0.00 57.88 58.55 1h9b h LEU 160 Cb 1.25 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 42.18 1h9b h LEU 160 CO 0.13 0.32 0.48 -0.61 -0.34 0.00 0.00 178.44 178.42 1h9b h GLN 161 N -0.06 0.84 -0.81 1.25 5.75 -0.86 0.11 115.11 121.33 1h9b h GLN 161 Ca 0.03 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1h9b h GLN 161 Cb 0.24 -0.19 -0.04 0.00 1.07 0.00 0.00 27.48 28.56 1h9b h GLN 161 CO -0.00 0.55 0.52 -0.97 -2.65 0.00 0.00 178.83 176.29 1h9b h ASN 162 N 0.86 0.95 -0.12 -0.69 -0.73 -0.80 -0.24 115.58 114.82 1h9b h ASN 162 Ca 0.35 -0.04 -0.03 0.00 1.87 0.00 0.00 56.30 58.45 1h9b h ASN 162 Cb 0.20 -0.24 -0.00 0.00 0.27 0.00 0.00 38.32 38.55 1h9b h ASN 162 CO -0.18 0.71 -0.04 0.44 -0.37 0.00 0.00 177.43 177.98 1h9b h ASP 163 N 1.11 0.25 -0.96 1.15 3.32 -0.17 -3.19 116.42 117.93 1h9b h ASP 163 Ca 0.30 -0.39 0.08 0.00 0.02 0.00 0.00 57.03 57.03 1h9b h ASP 163 Cb -0.10 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.31 1h9b h ASP 163 CO -0.06 0.58 0.60 -0.07 -1.72 0.00 0.00 179.24 178.58 1h9b h LEU 164 N -0.09 0.94 0.00 1.55 3.38 -0.50 -1.52 115.31 119.06 1h9b h LEU 164 Ca 0.03 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1h9b h LEU 164 Cb 0.48 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1h9b h LEU 164 CO 0.01 0.57 0.00 -0.62 0.09 0.00 0.00 178.44 178.50 1h9b n GLU 165 N -4.57 0.44 -0.02 1.13 1.02 -0.13 -1.49 120.64 117.02 1h9b n GLU 165 Ca 0.15 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 57.12 1h9b n GLU 165 Cb 0.23 -1.39 -0.08 0.00 -0.02 0.00 0.00 31.44 30.18 1h9b n GLU 165 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1h9b h ASN 166 N 0.00 0.88 0.00 1.62 2.35 -1.36 -3.37 115.58 115.71 1h9b h ASN 166 Ca 0.00 -0.64 0.00 0.00 -0.55 0.00 0.00 56.30 55.11 1h9b h ASN 166 Cb 0.00 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.11 1h9b h ASN 166 CO 0.00 1.38 -1.24 0.00 -1.65 0.00 0.00 177.43 175.92 1h9b n ALA 167 N -2.60 2.51 -2.27 -0.83 0.00 -0.94 -5.03 120.51 111.34 1h9b n ALA 167 Ca -0.08 -0.23 -0.15 0.00 0.00 0.00 0.00 53.44 52.98 1h9b n ALA 167 Cb 0.73 -0.32 -0.10 0.00 0.00 0.00 0.00 19.45 19.75 1h9b n ALA 167 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1h9b s PHE 168 N -2.51 1.35 0.20 0.00 0.40 -0.55 -5.00 117.98 111.86 1h9b s PHE 168 Ca -0.02 -0.80 0.00 0.00 -0.60 0.00 0.00 56.93 55.51 1h9b s PHE 168 Cb 0.06 -0.71 -0.04 0.00 0.51 0.00 0.00 43.02 42.84 1h9b s PHE 168 CO 0.39 0.05 0.38 -0.51 0.70 0.00 0.00 175.22 176.22 1h9b s ASP 169 N -3.21 6.37 0.42 1.36 1.11 -1.26 -4.01 116.67 117.45 1h9b s ASP 169 Ca 0.20 0.33 0.14 0.00 0.18 0.00 0.00 52.55 53.40 1h9b s ASP 169 Cb 0.03 -1.98 1.01 0.00 1.07 0.00 0.00 42.92 43.06 1h9b s ASP 169 CO 0.03 -0.04 1.92 -0.78 1.18 0.00 0.00 175.17 177.48 1h9b h ASP 170 N 1.90 0.43 0.27 0.27 3.58 -1.97 0.15 116.42 121.05 1h9b h ASP 170 Ca -0.48 0.02 0.00 0.00 0.42 0.00 0.00 57.03 56.99 1h9b h ASP 170 Cb 1.20 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.18 1h9b h ASP 170 CO 0.67 0.23 0.00 -0.46 -2.88 0.00 0.00 179.24 176.80 1h9b n ASN 171 N -4.49 0.00 -0.29 2.28 0.23 -1.26 -1.56 115.26 110.18 1h9b n ASN 171 Ca 0.14 -0.02 0.09 0.00 -0.53 0.00 0.00 54.58 54.25 1h9b n ASN 171 Cb 0.50 -0.25 -0.03 0.00 -2.08 0.00 0.00 39.78 37.92 1h9b n ASN 171 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1h9b n GLN 172 N -1.25 1.47 -3.30 -3.83 6.02 0.52 -4.92 117.38 112.09 1h9b n GLN 172 Ca 0.08 -0.62 -0.39 0.00 -0.01 0.00 0.00 57.00 56.07 1h9b n GLN 172 Cb 0.12 -1.33 -0.07 0.00 1.02 0.00 0.00 30.24 29.98 1h9b n GLN 172 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1h9b s LEU 173 N -2.36 4.18 -0.46 1.08 1.43 -0.60 -1.31 118.68 120.65 1h9b s LEU 173 Ca 0.12 0.67 0.04 0.00 -1.03 0.00 0.00 54.13 53.93 1h9b s LEU 173 Cb 0.14 -2.66 0.12 0.00 0.03 0.00 0.00 46.19 43.83 1h9b s LEU 173 CO 0.53 -0.11 0.19 -0.36 0.23 0.00 0.00 176.35 176.84 1h9b s PHE 174 N 1.29 3.20 -0.05 0.29 0.40 0.53 -4.98 117.98 118.66 1h9b s PHE 174 Ca 0.23 -3.03 -0.30 0.00 -0.60 0.00 0.00 56.93 53.24 1h9b s PHE 174 Cb -0.15 -2.74 -0.03 0.00 0.51 0.00 0.00 43.02 40.61 1h9b s PHE 174 CO 0.09 -0.81 1.12 1.03 0.70 0.00 0.00 175.22 177.36 1h9b s ARG 175 N 0.15 4.41 -0.20 0.44 0.52 -1.26 -1.65 118.95 121.36 1h9b s ARG 175 Ca 0.15 1.58 -0.24 0.00 -0.52 0.00 0.00 55.73 56.70 1h9b s ARG 175 Cb -0.24 -3.51 -0.02 0.00 0.52 0.00 0.00 34.95 31.71 1h9b s ARG 175 CO -0.03 -0.34 0.77 0.42 0.02 0.00 0.00 175.30 176.14 1h9b s ILE 176 N 1.85 4.91 -0.29 1.52 1.01 -0.55 -4.60 121.20 125.04 1h9b s ILE 176 Ca 0.54 1.48 -0.03 0.00 0.00 0.00 0.00 60.65 62.63 1h9b s ILE 176 Cb -0.23 -4.07 0.11 0.00 0.01 0.00 0.00 42.46 38.27 1h9b s ILE 176 CO 0.23 0.03 0.16 -0.62 0.00 0.00 0.00 174.94 174.74 1h9b s ASP 177 N 1.22 3.18 0.43 3.58 -1.08 -1.26 -4.26 116.67 118.47 1h9b s ASP 177 Ca 0.34 -1.22 0.27 0.00 -0.52 0.00 0.00 52.55 51.42 1h9b s ASP 177 Cb -0.16 -0.19 1.47 0.00 -1.46 0.00 0.00 42.92 42.58 1h9b s ASP 177 CO 0.11 -0.43 1.82 1.12 0.52 0.00 0.00 175.17 178.31 1h9b h HIS 178 N 8.33 0.00 -0.04 -5.34 2.07 -1.96 -1.54 115.15 116.68 1h9b h HIS 178 Ca -0.18 0.00 -0.15 0.00 -2.85 0.00 0.00 60.37 57.19 1h9b h HIS 178 Cb 1.02 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.99 1h9b h HIS 178 CO 0.29 0.00 -0.64 1.88 -3.07 0.00 0.00 177.93 176.39 1h9b h TYR 179 N 0.00 0.22 0.00 6.12 -1.99 -1.96 -2.91 116.97 116.44 1h9b h TYR 179 Ca 0.00 -0.09 -0.01 0.00 2.00 0.00 0.00 58.73 60.63 1h9b h TYR 179 Cb 0.09 -0.04 -0.00 0.00 2.00 0.00 0.00 36.73 38.78 1h9b h TYR 179 CO 0.00 0.76 -0.05 -0.07 -0.00 0.00 0.00 178.16 178.80 1h9b h LEU 180 N 0.12 0.00 -1.26 3.88 3.38 -1.60 -2.91 115.31 116.93 1h9b h LEU 180 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1h9b h LEU 180 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1h9b h LEU 180 CO 0.09 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.29 1h9b n GLY 181 N 0.55 0.57 3.73 0.83 0.00 -1.10 -4.75 105.19 105.02 1h9b n GLY 181 Ca 0.02 -0.39 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 1h9b n GLY 181 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h9b s LYS 182 N -1.59 4.51 0.22 1.61 1.02 -1.10 -4.41 119.74 120.00 1h9b s LYS 182 Ca 0.26 1.10 -0.13 0.00 0.02 0.00 0.00 55.97 57.22 1h9b s LYS 182 Cb 0.13 -3.40 0.27 0.00 -0.52 0.00 0.00 37.83 34.31 1h9b s LYS 182 CO 0.18 0.16 1.61 1.49 -0.92 0.00 0.00 175.35 177.87 1h9b h GLU 183 N 6.16 -0.02 0.00 1.68 4.57 -1.90 -1.58 114.58 123.50 1h9b h GLU 183 Ca -0.43 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 57.69 1h9b h GLU 183 Cb 1.21 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.79 1h9b h GLU 183 CO 0.73 -0.01 -0.33 0.52 -1.18 0.00 0.00 179.01 178.74 1h9b h MET 184 N -0.02 0.00 -0.04 1.92 2.86 -1.93 -2.36 114.93 115.35 1h9b h MET 184 Ca 0.33 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.87 1h9b h MET 184 Cb 0.53 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1h9b h MET 184 CO -0.74 0.33 -0.45 0.28 1.06 0.00 0.00 176.91 177.38 1h9b h VAL 185 N 0.00 1.33 0.00 -2.22 2.07 -1.60 -2.37 116.25 113.46 1h9b h VAL 185 Ca -0.00 -1.59 0.00 0.00 0.82 0.00 0.00 66.70 65.92 1h9b h VAL 185 Cb 0.65 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1h9b h VAL 185 CO 0.04 0.46 0.00 0.00 0.02 0.00 0.00 177.57 178.10 1h9b n GLN 186 N -3.99 0.25 0.17 1.57 6.02 -0.91 -3.24 117.38 117.24 1h9b n GLN 186 Ca -0.02 0.01 0.12 0.00 -0.01 0.00 0.00 57.00 57.10 1h9b n GLN 186 Cb 0.49 -1.50 0.10 0.00 1.02 0.00 0.00 30.24 30.35 1h9b n GLN 186 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 1h9b h ASN 187 N 0.00 0.00 -0.13 1.08 2.35 -1.24 -3.37 115.58 114.27 1h9b h ASN 187 Ca 0.00 -0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.78 1h9b h ASN 187 Cb 0.37 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.70 1h9b h ASN 187 CO 0.00 0.00 -0.10 0.40 -1.65 0.00 0.00 177.43 176.08 1h9b h ILE 188 N 0.00 0.71 -0.13 2.81 2.04 -1.62 -0.40 117.51 120.92 1h9b h ILE 188 Ca 0.00 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.79 1h9b h ILE 188 Cb 0.99 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1h9b h ILE 188 CO 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 178.15 177.90 1h9b h ALA 189 N 0.99 1.34 -0.18 1.87 0.00 -1.81 -0.95 119.26 120.52 1h9b h ALA 189 Ca 0.08 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 1h9b h ALA 189 Cb 0.23 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1h9b h ALA 189 CO -0.20 0.45 -0.13 0.00 0.00 0.00 0.00 179.25 179.38 1h9b h ALA 190 N 1.54 0.25 -0.58 0.00 0.00 -1.63 0.43 119.26 119.27 1h9b h ALA 190 Ca 0.03 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1h9b h ALA 190 Cb 0.57 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1h9b h ALA 190 CO 0.04 0.12 0.29 -0.07 0.00 0.00 0.00 179.25 179.63 1h9b h LEU 191 N 0.06 0.75 0.32 0.00 3.38 -0.87 0.30 115.31 119.25 1h9b h LEU 191 Ca 0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1h9b h LEU 191 Cb 0.64 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1h9b h LEU 191 CO 0.03 0.66 -0.15 -0.09 0.09 0.00 0.00 178.44 178.98 1h9b h ARG 192 N 0.79 -0.41 0.00 1.13 2.43 -1.14 -3.28 114.38 113.90 1h9b h ARG 192 Ca 0.20 0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.33 1h9b h ARG 192 Cb 0.10 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1h9b h ARG 192 CO -0.03 -0.27 -0.34 0.74 -1.51 0.00 0.00 179.97 178.56 1h9b h PHE 193 N -0.73 0.00 -0.00 2.20 0.04 -1.00 -3.06 116.94 114.39 1h9b h PHE 193 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 1h9b h PHE 193 Cb 0.33 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.48 1h9b h PHE 193 CO 0.05 0.34 -0.12 0.41 -0.60 0.00 0.00 178.31 178.38 1h9b n GLY 194 N 0.29 -1.27 2.80 -1.45 0.00 0.09 -4.68 105.19 100.98 1h9b n GLY 194 Ca 0.00 -0.20 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 1h9b n GLY 194 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h9b s ASN 195 N -2.79 3.64 0.38 1.61 0.01 -1.22 -5.03 114.94 111.54 1h9b s ASN 195 Ca 0.20 -1.26 0.16 0.00 -0.71 0.00 0.00 52.86 51.25 1h9b s ASN 195 Cb 0.19 -0.90 1.04 0.00 0.41 0.00 0.00 41.25 42.00 1h9b s ASN 195 CO 0.53 -0.33 1.76 -0.65 -1.51 0.00 0.00 177.10 176.91 1h9b h PRO 196 N 8.08 0.44 0.00 -0.60 0.11 -1.83 -0.26 132.00 137.94 1h9b h PRO 196 Ca -0.15 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.90 1h9b h PRO 196 Cb 1.07 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.07 1h9b h PRO 196 CO 0.41 0.29 -0.16 -0.84 -0.21 0.00 0.00 178.00 177.50 1h9b h ILE 197 N 0.45 0.87 0.10 4.15 3.07 -1.96 -1.21 117.51 122.97 1h9b h ILE 197 Ca 0.60 -0.58 -0.37 0.00 1.55 0.00 0.00 64.86 66.06 1h9b h ILE 197 Cb 1.41 1.34 -0.03 0.00 -0.27 0.00 0.00 36.82 39.27 1h9b h ILE 197 CO -0.33 0.15 -2.10 0.49 -1.05 0.00 0.00 178.15 175.31 1h9b n PHE 198 N -4.00 0.99 -0.08 0.16 3.72 -0.25 -3.79 117.46 114.21 1h9b n PHE 198 Ca -0.02 0.21 -0.07 0.00 -0.05 0.00 0.00 57.45 57.52 1h9b n PHE 198 Cb 0.24 -1.13 0.00 0.00 -0.94 0.00 0.00 39.48 37.66 1h9b n PHE 198 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 1h9b h ASP 199 N 0.05 -0.04 0.58 4.37 3.58 -1.02 -0.91 116.42 123.03 1h9b h ASP 199 Ca -0.46 0.06 -0.03 0.00 0.42 0.00 0.00 57.03 57.02 1h9b h ASP 199 Cb 2.00 0.09 -0.00 0.00 1.72 0.00 0.00 39.33 43.14 1h9b h ASP 199 CO 0.05 0.01 -0.12 0.00 -2.88 0.00 0.00 179.24 176.30 1h9b h ALA 200 N 1.25 1.15 -0.01 -0.78 0.00 -1.41 -2.76 119.26 116.68 1h9b h ALA 200 Ca 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1h9b h ALA 200 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1h9b h ALA 200 CO -0.22 0.15 -0.35 0.00 0.00 0.00 0.00 179.25 178.84 1h9b n ALA 201 N -2.22 3.28 -1.45 0.00 0.00 -0.65 -4.68 120.51 114.79 1h9b n ALA 201 Ca -0.01 -0.55 -0.40 0.00 0.00 0.00 0.00 53.44 52.48 1h9b n ALA 201 Cb 0.28 -0.93 -0.02 0.00 0.00 0.00 0.00 19.45 18.78 1h9b n ALA 201 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1h9b n TRP 202 N -0.15 2.81 -3.85 0.00 -0.00 -0.44 -4.08 117.44 111.73 1h9b n TRP 202 Ca 0.11 -2.98 -0.06 0.00 -0.00 0.00 0.00 57.50 54.57 1h9b n TRP 202 Cb 0.43 -2.47 0.02 0.00 -0.00 0.00 0.00 31.31 29.29 1h9b n TRP 202 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1h9b s ASN 203 N 2.69 0.02 0.58 5.87 2.20 -1.26 -5.02 114.94 120.01 1h9b s ASN 203 Ca 0.60 -0.92 0.28 0.00 -0.94 0.00 0.00 52.86 51.87 1h9b s ASN 203 Cb 0.16 0.67 1.66 0.00 -2.00 0.00 0.00 41.25 41.74 1h9b s ASN 203 CO -0.07 -1.34 2.14 0.07 -2.94 0.00 0.00 177.10 174.96 1h9b h LYS 204 N 2.00 0.00 0.00 3.55 2.10 -0.84 -1.59 116.57 121.78 1h9b h LYS 204 Ca -0.30 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.33 1h9b h LYS 204 Cb 1.23 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1h9b h LYS 204 CO 0.39 0.00 -0.10 -0.44 -2.00 0.00 0.00 179.45 177.30 1h9b h ASP 205 N 0.00 0.00 0.00 7.07 3.32 -1.89 -3.36 116.42 121.56 1h9b h ASP 205 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1h9b h ASP 205 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1h9b h ASP 205 CO -0.00 0.10 -0.99 -1.22 -1.72 0.00 0.00 179.24 175.42 1h9b n TYR 206 N -3.23 0.00 -3.12 4.55 4.02 -1.00 -4.92 117.16 113.45 1h9b n TYR 206 Ca 0.01 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.50 1h9b n TYR 206 Cb 0.38 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.65 1h9b n TYR 206 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1h9b s ILE 207 N -1.99 5.03 -0.12 -0.72 1.01 -0.63 0.00 121.20 123.78 1h9b s ILE 207 Ca 0.00 1.33 -0.06 0.00 0.00 0.00 0.00 60.65 61.92 1h9b s ILE 207 Cb 0.00 -3.98 -0.26 0.00 0.01 0.00 0.00 42.46 38.23 1h9b s ILE 207 CO 0.00 0.30 0.35 1.17 0.00 0.00 0.00 174.94 176.76 1h9b n LYS 208 N 3.53 0.75 -3.53 2.79 4.81 0.10 -4.66 118.16 121.95 1h9b n LYS 208 Ca -0.03 0.26 -0.10 0.00 -0.87 0.00 0.00 58.31 57.56 1h9b n LYS 208 Cb 0.51 -1.70 -0.04 0.00 0.02 0.00 0.00 35.03 33.82 1h9b n LYS 208 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1h9b s ASN 209 N -6.98 -0.40 -0.05 3.14 2.20 -1.14 -4.21 114.94 107.50 1h9b s ASN 209 Ca -0.22 0.23 0.04 0.00 -0.94 0.00 0.00 52.86 51.97 1h9b s ASN 209 Cb 0.07 0.37 -0.02 0.00 -2.00 0.00 0.00 41.25 39.67 1h9b s ASN 209 CO 0.76 -0.52 -0.18 -0.69 -2.94 0.00 0.00 177.10 173.54 1h9b s VAL 210 N -2.15 2.76 -0.06 3.54 1.01 -0.92 -1.47 120.40 123.12 1h9b s VAL 210 Ca 0.01 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.20 1h9b s VAL 210 Cb -0.01 -2.06 -0.00 0.00 0.00 0.00 0.00 36.38 34.31 1h9b s VAL 210 CO -0.03 0.58 -0.18 -1.10 0.00 0.00 0.00 175.10 174.37 1h9b s GLN 211 N -0.56 2.03 -0.17 2.72 -0.21 0.12 -0.28 119.66 123.31 1h9b s GLN 211 Ca 0.08 -0.64 -0.00 0.00 0.02 0.00 0.00 55.36 54.82 1h9b s GLN 211 Cb -0.11 -1.70 0.04 0.00 1.00 0.00 0.00 33.01 32.24 1h9b s GLN 211 CO 0.01 0.21 -0.07 0.08 -2.12 0.00 0.00 175.29 173.39 1h9b s VAL 212 N 0.18 1.31 -0.07 1.09 1.01 0.97 -0.47 120.40 124.42 1h9b s VAL 212 Ca -0.08 -0.75 0.05 0.00 0.00 0.00 0.00 61.98 61.20 1h9b s VAL 212 Cb -0.13 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 1h9b s VAL 212 CO 0.04 0.16 -0.21 -0.89 0.00 0.00 0.00 175.10 174.20 1h9b s THR 213 N 1.55 2.42 -0.49 3.92 2.01 -0.42 -1.09 115.64 123.54 1h9b s THR 213 Ca 0.00 -0.93 0.04 0.00 0.31 0.00 0.00 61.69 61.11 1h9b s THR 213 Cb -0.15 -1.92 0.17 0.00 0.01 0.00 0.00 72.50 70.60 1h9b s THR 213 CO -0.08 0.57 0.37 -0.76 -0.69 0.00 0.00 174.62 174.03 1h9b s LEU 214 N -0.18 2.36 0.05 4.42 1.02 -0.23 -0.88 118.68 125.25 1h9b s LEU 214 Ca -0.02 -3.24 -0.07 0.00 0.02 0.00 0.00 54.13 50.82 1h9b s LEU 214 Cb -0.14 -0.78 -0.05 0.00 0.02 0.00 0.00 46.19 45.24 1h9b s LEU 214 CO 0.03 -0.15 0.32 -0.94 0.02 0.00 0.00 176.35 175.63 1h9b s SER 215 N -0.31 6.53 0.05 2.29 1.04 0.51 -3.05 113.70 120.76 1h9b s SER 215 Ca 0.30 0.62 0.06 0.00 0.48 0.00 0.00 55.95 57.40 1h9b s SER 215 Cb -0.00 -2.11 -0.02 0.00 0.10 0.00 0.00 66.02 63.98 1h9b s SER 215 CO -0.18 0.19 -0.16 -1.61 0.98 0.00 0.00 173.24 172.47 1h9b s GLU 216 N -1.97 1.02 0.02 4.02 2.02 -0.94 -1.10 118.70 121.76 1h9b s GLU 216 Ca 0.32 -0.85 0.18 0.00 0.02 0.00 0.00 54.97 54.64 1h9b s GLU 216 Cb -0.13 -1.07 -0.18 0.00 0.10 0.00 0.00 34.13 32.85 1h9b s GLU 216 CO 0.19 0.26 0.66 1.33 0.02 0.00 0.00 175.26 177.72 1h9b n VAL 217 N 1.74 1.00 -1.39 2.63 0.24 -1.26 -0.74 118.33 120.55 1h9b n VAL 217 Ca -0.18 -0.68 -0.30 0.00 -2.04 0.00 0.00 64.34 61.14 1h9b n VAL 217 Cb 0.54 -0.55 0.12 0.00 -1.47 0.00 0.00 33.84 32.48 1h9b n VAL 217 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1h9b s LEU 218 N -5.51 2.38 0.00 1.34 1.43 -1.26 -3.72 118.68 113.34 1h9b s LEU 218 Ca -0.05 1.36 0.00 0.00 -1.03 0.00 0.00 54.13 54.41 1h9b s LEU 218 Cb 0.09 -3.85 0.00 0.00 0.03 0.00 0.00 46.19 42.46 1h9b s LEU 218 CO 0.83 -2.34 0.00 0.61 0.23 0.00 0.00 176.35 175.68 1h9b n GLY 219 N -1.66 2.65 0.23 -3.19 0.00 -1.26 -0.76 105.19 101.21 1h9b n GLY 219 Ca 0.07 -2.01 0.07 0.00 0.00 0.00 0.00 46.02 44.15 1h9b n GLY 219 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1h9b h VAL 220 N 0.00 0.93 0.00 1.61 3.04 -1.98 -3.47 116.25 116.38 1h9b h VAL 220 Ca 0.00 -0.84 0.00 0.00 -1.01 0.00 0.00 66.70 64.85 1h9b h VAL 220 Cb 0.00 1.48 0.00 0.00 -2.01 0.00 0.00 31.29 30.76 1h9b h VAL 220 CO 0.00 0.22 0.00 -0.62 -1.01 0.00 0.00 177.57 176.16 1h9b n GLU 221 N -3.94 0.00 0.05 4.17 -0.58 -1.26 -2.69 120.64 116.39 1h9b n GLU 221 Ca -0.02 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.85 1h9b n GLU 221 Cb 0.31 0.00 0.32 0.00 -0.57 0.00 0.00 31.44 31.50 1h9b n GLU 221 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1h9b n GLU 222 N 13.89 0.18 -0.03 3.49 -0.58 -1.26 -4.12 120.64 132.21 1h9b n GLU 222 Ca 0.00 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 1h9b n GLU 222 Cb 0.00 -1.65 0.02 0.00 -0.57 0.00 0.00 31.44 29.24 1h9b n GLU 222 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1h9b n ARG 223 N -1.93 1.13 -0.34 3.49 5.12 -1.10 -4.50 116.66 118.54 1h9b n ARG 223 Ca 0.05 -0.12 0.15 0.00 -1.93 0.00 0.00 57.85 56.00 1h9b n ARG 223 Cb 0.40 -1.37 0.35 0.00 -1.16 0.00 0.00 32.46 30.69 1h9b n ARG 223 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1h9b h ALA 224 N 2.40 1.68 -0.95 7.54 0.00 -1.72 -2.12 119.26 126.09 1h9b h ALA 224 Ca 0.00 0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1h9b h ALA 224 Cb 0.39 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.14 1h9b h ALA 224 CO 0.01 -0.24 0.62 0.78 0.00 0.00 0.00 179.25 180.42 1h9b h GLY 225 N 0.58 1.43 0.00 0.00 0.00 -1.86 -2.19 103.07 101.03 1h9b h GLY 225 Ca 0.61 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.44 1h9b h GLY 225 CO -0.46 0.28 -0.52 -1.82 0.00 0.00 0.00 176.54 174.02 1h9b h TYR 226 N 1.06 0.00 -0.99 5.60 3.20 -1.78 -3.40 116.97 120.66 1h9b h TYR 226 Ca 0.42 0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.47 1h9b h TYR 226 Cb 0.26 0.00 -0.10 0.00 1.54 0.00 0.00 36.73 38.42 1h9b h TYR 226 CO -0.00 0.63 0.60 -0.92 -1.64 0.00 0.00 178.16 176.82 1h9b h TYR 227 N -1.00 1.05 -0.01 -3.82 3.20 -1.44 -1.74 116.97 113.20 1h9b h TYR 227 Ca -0.10 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1h9b h TYR 227 Cb 0.72 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 1h9b h TYR 227 CO 0.02 0.26 0.16 0.22 -1.64 0.00 0.00 178.16 177.18 1h9b h ASP 228 N 0.78 0.00 0.00 -2.11 3.58 -1.60 0.10 116.42 117.17 1h9b h ASP 228 Ca 0.56 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.01 1h9b h ASP 228 Cb 0.82 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.87 1h9b h ASP 228 CO -0.37 0.00 -1.27 0.41 -2.88 0.00 0.00 179.24 175.13 1h9b n THR 229 N -3.06 0.00 -0.08 2.25 -1.04 -0.67 -4.72 114.28 106.96 1h9b n THR 229 Ca -0.02 -0.24 -0.10 0.00 -2.04 0.00 0.00 64.05 61.65 1h9b n THR 229 Cb 0.22 0.58 -0.03 0.00 -1.82 0.00 0.00 70.33 69.28 1h9b n THR 229 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1h9b n ALA 230 N -1.73 1.18 -0.17 2.41 0.00 -0.12 -5.04 120.51 117.05 1h9b n ALA 230 Ca 0.00 -0.75 0.02 0.00 0.00 0.00 0.00 53.44 52.72 1h9b n ALA 230 Cb 0.36 0.07 -0.01 0.00 0.00 0.00 0.00 19.45 19.87 1h9b n ALA 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h9b n GLY 231 N 1.68 -1.80 0.28 0.00 0.00 0.17 -3.33 105.19 102.20 1h9b n GLY 231 Ca -0.17 -1.47 0.10 0.00 0.00 0.00 0.00 46.02 44.49 1h9b n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h9b h ALA 232 N -0.16 2.06 -0.21 4.61 0.00 -1.52 -0.32 119.26 123.72 1h9b h ALA 232 Ca -0.01 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1h9b h ALA 232 Cb 0.16 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1h9b h ALA 232 CO 0.00 -0.10 0.07 1.25 0.00 0.00 0.00 179.25 180.48 1h9b h LEU 233 N 0.00 0.07 0.03 0.00 5.85 -1.81 -0.05 115.31 119.40 1h9b h LEU 233 Ca 0.04 0.02 -0.32 0.00 0.84 0.00 0.00 57.88 58.46 1h9b h LEU 233 Cb 0.15 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 1h9b h LEU 233 CO -0.00 0.07 -1.87 0.18 -0.34 0.00 0.00 178.44 176.48 1h9b n LEU 234 N -5.05 1.23 0.04 2.25 4.32 -1.05 -1.22 117.00 117.53 1h9b n LEU 234 Ca -0.02 0.31 -0.12 0.00 -0.02 0.00 0.00 56.01 56.15 1h9b n LEU 234 Cb 0.08 -0.11 -0.01 0.00 -1.62 0.00 0.00 43.42 41.75 1h9b n LEU 234 CO 0.30 0.52 0.28 -0.78 -1.22 0.00 0.00 177.39 176.49 1h9b h ASP 235 N 0.02 0.59 0.00 -1.43 3.58 -1.10 -3.40 116.42 114.68 1h9b h ASP 235 Ca -0.35 -0.42 0.00 0.00 0.42 0.00 0.00 57.03 56.68 1h9b h ASP 235 Cb 2.04 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 42.91 1h9b h ASP 235 CO 0.07 1.18 -0.80 0.23 -2.88 0.00 0.00 179.24 177.04 1h9b n MET 236 N -3.83 2.19 -0.02 0.28 2.81 -0.18 -4.77 117.12 113.59 1h9b n MET 236 Ca -0.06 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.77 1h9b n MET 236 Cb 0.75 -0.90 -0.05 0.00 -0.71 0.00 0.00 33.22 32.31 1h9b n MET 236 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1h9b h ILE 237 N 0.00 0.67 -0.50 2.02 1.08 -1.07 -2.20 117.51 117.51 1h9b h ILE 237 Ca 0.00 -1.39 0.09 0.00 -0.39 0.00 0.00 64.86 63.17 1h9b h ILE 237 Cb 0.80 1.24 -0.07 0.00 -3.07 0.00 0.00 36.82 35.72 1h9b h ILE 237 CO 0.00 0.22 0.09 -0.61 -0.69 0.00 0.00 178.15 177.16 1h9b h GLN 238 N -0.99 0.22 0.00 2.37 -0.00 -1.39 -2.23 115.11 113.10 1h9b h GLN 238 Ca -0.01 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.63 1h9b h GLN 238 Cb 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 27.48 27.84 1h9b h GLN 238 CO 0.01 0.14 0.00 0.27 0.00 0.00 0.00 178.83 179.26 1h9b n ASN 239 N -5.13 0.00 0.36 -0.69 0.23 -1.26 -4.29 115.26 104.48 1h9b n ASN 239 Ca 0.06 0.21 -0.17 0.00 -0.53 0.00 0.00 54.58 54.14 1h9b n ASN 239 Cb 0.25 -0.35 -0.09 0.00 -2.08 0.00 0.00 39.78 37.51 1h9b n ASN 239 CO 0.00 0.00 0.00 0.45 -0.93 0.00 0.00 177.26 176.78 1h9b h HIS 240 N 0.00 -0.84 -0.02 -2.53 3.86 -1.73 -2.92 115.15 110.97 1h9b h HIS 240 Ca 0.00 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1h9b h HIS 240 Cb 0.00 0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 1h9b h HIS 240 CO 0.00 -0.50 -0.04 1.15 0.86 0.00 0.00 177.93 179.40 1h9b h THR 241 N -1.00 0.89 -0.89 2.45 2.02 -1.40 -1.90 112.91 113.10 1h9b h THR 241 Ca -0.09 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.15 1h9b h THR 241 Cb 0.72 0.89 -0.06 0.00 -1.74 0.00 0.00 68.15 67.97 1h9b h THR 241 CO 0.15 0.00 0.58 0.24 0.37 0.00 0.00 175.52 176.86 1h9b h MET 242 N -0.06 0.99 -0.03 6.66 2.86 -1.48 -0.11 114.93 123.75 1h9b h MET 242 Ca 0.02 -0.06 -0.16 0.00 -2.06 0.00 0.00 59.70 57.44 1h9b h MET 242 Cb 0.09 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 1h9b h MET 242 CO -0.05 0.65 -0.71 1.96 1.06 0.00 0.00 176.91 179.82 1h9b h GLN 243 N 1.02 0.17 -0.35 1.72 1.08 -1.30 -1.47 115.11 115.97 1h9b h GLN 243 Ca 0.38 -0.14 -0.11 0.00 -1.45 0.00 0.00 58.65 57.33 1h9b h GLN 243 Cb 0.17 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 1h9b h GLN 243 CO -0.14 0.81 -0.21 0.82 -0.95 0.00 0.00 178.83 179.16 1h9b h ILE 244 N 0.11 1.29 -0.78 2.54 2.04 -0.62 -2.77 117.51 119.32 1h9b h ILE 244 Ca -0.02 -1.35 0.02 0.00 1.00 0.00 0.00 64.86 64.52 1h9b h ILE 244 Cb 1.26 1.40 -0.04 0.00 -0.74 0.00 0.00 36.82 38.70 1h9b h ILE 244 CO 0.11 0.44 0.52 0.58 0.00 0.00 0.00 178.15 179.80 1h9b h VAL 245 N 0.55 1.15 -0.89 1.67 2.07 -0.91 -2.22 116.25 117.66 1h9b h VAL 245 Ca 0.07 -0.34 0.10 0.00 0.82 0.00 0.00 66.70 67.35 1h9b h VAL 245 Cb 0.77 0.06 -0.08 0.00 -1.52 0.00 0.00 31.29 30.52 1h9b h VAL 245 CO 0.06 0.18 0.53 1.23 0.02 0.00 0.00 177.57 179.59 1h9b h GLY 246 N 1.00 1.41 1.09 2.17 0.00 -0.97 0.32 103.07 108.09 1h9b h GLY 246 Ca 0.30 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 1h9b h GLY 246 CO -0.08 0.15 -0.08 1.49 0.00 0.00 0.00 176.54 178.02 1h9b h TRP 247 N 0.87 1.15 -0.40 5.60 4.06 -1.36 -2.10 115.95 123.78 1h9b h TRP 247 Ca 0.43 -0.23 -0.15 0.00 2.06 0.00 0.00 58.89 61.00 1h9b h TRP 247 Cb 0.40 -0.29 -0.01 0.00 -1.00 0.00 0.00 29.16 28.26 1h9b h TRP 247 CO -0.04 1.05 -0.35 -0.07 -3.56 0.00 0.00 178.44 175.48 1h9b h LEU 248 N 0.92 0.99 0.00 -4.49 3.38 -1.14 -3.33 115.31 111.65 1h9b h LEU 248 Ca 0.15 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1h9b h LEU 248 Cb 0.65 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1h9b h LEU 248 CO 0.04 1.24 -0.79 0.00 0.09 0.00 0.00 178.44 179.02 1h9b n ALA 249 N -2.54 3.08 -1.13 1.53 0.00 0.02 -4.98 120.51 116.49 1h9b n ALA 249 Ca -0.02 -0.30 -0.35 0.00 0.00 0.00 0.00 53.44 52.76 1h9b n ALA 249 Cb 0.53 -1.10 0.08 0.00 0.00 0.00 0.00 19.45 18.96 1h9b n ALA 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h9b n MET 250 N -2.08 0.13 -1.98 0.00 0.00 -0.79 -4.78 117.12 107.63 1h9b n MET 250 Ca 0.03 0.08 -0.28 0.00 0.00 0.00 0.00 57.70 57.53 1h9b n MET 250 Cb 0.44 -1.77 0.08 0.00 0.00 0.00 0.00 33.22 31.97 1h9b n MET 250 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 1h9b s GLU 251 N -2.89 2.18 -0.16 3.17 0.41 -0.84 -4.96 118.70 115.61 1h9b s GLU 251 Ca 0.62 0.09 -0.29 0.00 -0.41 0.00 0.00 54.97 54.97 1h9b s GLU 251 Cb -0.31 -2.02 -0.02 0.00 -1.78 0.00 0.00 34.13 30.01 1h9b s GLU 251 CO 0.62 -1.41 1.29 0.21 -0.49 0.00 0.00 175.26 175.47 1h9b s LYS 252 N -5.46 4.23 0.70 1.61 2.20 -1.26 -4.77 119.74 116.99 1h9b s LYS 252 Ca 0.61 1.70 -0.14 0.00 -0.36 0.00 0.00 55.97 57.77 1h9b s LYS 252 Cb -0.11 -3.77 0.02 0.00 -1.51 0.00 0.00 37.83 32.46 1h9b s LYS 252 CO 0.48 -0.71 1.13 -1.25 -0.36 0.00 0.00 175.35 174.64 1h9b s PRO 253 N 3.50 2.52 0.41 4.03 0.04 -1.26 -4.95 135.00 139.30 1h9b s PRO 253 Ca 0.56 1.45 0.18 0.00 0.04 0.00 0.00 61.00 63.23 1h9b s PRO 253 Cb -0.22 -1.91 0.90 0.00 0.04 0.00 0.00 34.50 33.31 1h9b s PRO 253 CO 0.16 -1.48 1.86 0.93 0.04 0.00 0.00 177.00 178.51 1h9b h GLU 254 N -0.25 0.00 -2.91 4.56 5.08 -1.95 -3.46 114.58 115.65 1h9b h GLU 254 Ca -0.46 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 57.95 1h9b h GLU 254 Cb 1.26 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.47 1h9b h GLU 254 CO 0.52 0.30 0.29 -1.54 -1.00 0.00 0.00 179.01 177.58 1h9b s SER 255 N -6.57 -0.16 -0.46 1.42 1.04 -1.26 -5.05 113.70 102.66 1h9b s SER 255 Ca -0.02 -0.76 -0.00 0.00 0.48 0.00 0.00 55.95 55.65 1h9b s SER 255 Cb 0.13 0.73 0.40 0.00 0.10 0.00 0.00 66.02 67.39 1h9b s SER 255 CO 0.68 -1.40 1.93 0.33 0.98 0.00 0.00 173.24 175.76 1h9b n PHE 256 N -0.49 2.47 -3.40 5.02 7.35 -1.26 -4.32 117.46 122.83 1h9b n PHE 256 Ca -0.06 -2.24 -0.34 0.00 -0.76 0.00 0.00 57.45 54.05 1h9b n PHE 256 Cb 0.59 -1.10 -0.06 0.00 0.35 0.00 0.00 39.48 39.27 1h9b n PHE 256 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1h9b s THR 257 N -3.35 4.90 0.40 -2.13 -4.23 -1.26 -4.92 115.64 105.04 1h9b s THR 257 Ca 0.48 0.69 0.17 0.00 -1.18 0.00 0.00 61.69 61.85 1h9b s THR 257 Cb 0.39 -3.69 0.38 0.00 1.34 0.00 0.00 72.50 70.91 1h9b s THR 257 CO 0.02 0.16 1.81 -2.24 -0.54 0.00 0.00 174.62 173.83 1h9b h ASP 258 N 3.29 0.46 -0.38 3.99 2.03 -1.94 -0.30 116.42 123.58 1h9b h ASP 258 Ca -0.48 0.07 -0.02 0.00 -0.73 0.00 0.00 57.03 55.87 1h9b h ASP 258 Cb 1.19 -0.01 -0.02 0.00 -0.83 0.00 0.00 39.33 39.66 1h9b h ASP 258 CO 0.67 0.14 0.17 0.11 -1.03 0.00 0.00 179.24 179.29 1h9b h LYS 259 N 0.44 0.55 -0.01 4.15 1.57 -1.95 -0.91 116.57 120.40 1h9b h LYS 259 Ca 0.54 -0.09 -0.19 0.00 -1.87 0.00 0.00 60.65 59.05 1h9b h LYS 259 Cb 1.32 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 1h9b h LYS 259 CO -0.25 0.51 -0.82 -0.44 -0.57 0.00 0.00 179.45 177.88 1h9b h ASP 260 N 0.47 0.25 -0.47 0.86 3.32 -1.47 -1.91 116.42 117.48 1h9b h ASP 260 Ca 0.13 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1h9b h ASP 260 Cb 0.15 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1h9b h ASP 260 CO -0.01 0.96 0.17 0.40 -1.72 0.00 0.00 179.24 179.04 1h9b h ILE 261 N 0.12 1.21 -0.59 0.35 2.04 -0.96 -0.67 117.51 119.01 1h9b h ILE 261 Ca -0.03 -0.69 -0.09 0.00 1.00 0.00 0.00 64.86 65.05 1h9b h ILE 261 Cb 1.42 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 1h9b h ILE 261 CO 0.12 0.25 0.01 0.03 0.00 0.00 0.00 178.15 178.57 1h9b h ARG 262 N 0.62 1.02 -0.66 2.37 3.08 -1.10 -0.45 114.38 119.25 1h9b h ARG 262 Ca 0.15 -0.31 -0.05 0.00 0.07 0.00 0.00 59.98 59.84 1h9b h ARG 262 Cb 0.22 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 1h9b h ARG 262 CO -0.01 0.99 0.20 0.00 -1.07 0.00 0.00 179.97 180.08 1h9b h ALA 263 N 1.07 0.87 -0.57 0.04 0.00 -1.11 0.07 119.26 119.62 1h9b h ALA 263 Ca 0.17 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1h9b h ALA 263 Cb 0.53 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1h9b h ALA 263 CO 0.03 0.54 0.05 0.00 0.00 0.00 0.00 179.25 179.87 1h9b h ALA 264 N 1.08 1.01 -0.22 0.00 0.00 -0.76 -2.13 119.26 118.25 1h9b h ALA 264 Ca 0.21 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1h9b h ALA 264 Cb 0.30 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1h9b h ALA 264 CO -0.01 0.62 -0.22 0.87 0.00 0.00 0.00 179.25 180.52 1h9b h LYS 265 N 0.88 0.53 -0.17 0.00 1.57 -0.79 -2.22 116.57 116.37 1h9b h LYS 265 Ca 0.17 -0.28 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1h9b h LYS 265 Cb 0.45 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1h9b h LYS 265 CO 0.02 0.86 -0.02 -0.91 -0.57 0.00 0.00 179.45 178.83 1h9b h ASN 266 N 0.22 0.23 -0.41 0.86 2.35 -0.79 -1.19 115.58 116.86 1h9b h ASN 266 Ca 0.04 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1h9b h ASN 266 Cb 0.77 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 39.06 1h9b h ASN 266 CO 0.05 0.30 0.26 0.00 -1.65 0.00 0.00 177.43 176.39 1h9b h ALA 267 N 1.74 1.66 0.01 -0.83 0.00 -1.42 0.52 119.26 120.94 1h9b h ALA 267 Ca 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1h9b h ALA 267 Cb 0.21 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1h9b h ALA 267 CO 0.01 0.30 -0.00 0.00 0.00 0.00 0.00 179.25 179.55 1h9b h ALA 268 N 1.71 -0.01 -0.94 0.00 0.00 -1.38 -3.19 119.26 115.44 1h9b h ALA 268 Ca 0.15 -0.41 0.14 0.00 0.00 0.00 0.00 54.91 54.79 1h9b h ALA 268 Cb -0.03 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.69 1h9b h ALA 268 CO -0.03 -0.07 0.60 0.74 0.00 0.00 0.00 179.25 180.49 1h9b h PHE 269 N -0.89 0.95 0.00 0.00 0.04 -0.97 0.02 116.94 116.09 1h9b h PHE 269 Ca -0.00 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.80 1h9b h PHE 269 Cb 0.82 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.67 1h9b h PHE 269 CO 0.22 0.36 0.00 -0.91 -0.60 0.00 0.00 178.31 177.37 1h9b h ASN 270 N 0.81 0.00 0.02 2.17 2.35 -0.99 -2.83 115.58 117.10 1h9b h ASN 270 Ca 0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.22 1h9b h ASN 270 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1h9b h ASN 270 CO -0.23 0.00 -0.23 0.00 -1.65 0.00 0.00 177.43 175.31 1h9b n ALA 271 N -1.94 3.01 -1.87 -0.83 0.00 -0.03 -4.96 120.51 113.90 1h9b n ALA 271 Ca 0.02 -0.60 -0.41 0.00 0.00 0.00 0.00 53.44 52.45 1h9b n ALA 271 Cb 0.30 -0.89 -0.03 0.00 0.00 0.00 0.00 19.45 18.84 1h9b n ALA 271 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1h9b s LEU 272 N -2.27 4.42 -0.09 0.00 2.96 -1.06 -0.04 118.68 122.60 1h9b s LEU 272 Ca 0.25 2.56 -0.26 0.00 -0.22 0.00 0.00 54.13 56.46 1h9b s LEU 272 Cb 0.19 -3.63 -0.03 0.00 0.50 0.00 0.00 46.19 43.23 1h9b s LEU 272 CO 0.45 -0.54 0.83 -0.54 -1.32 0.00 0.00 176.35 175.22 1h9b s LYS 273 N -0.94 4.41 -0.13 1.98 1.02 -0.83 -4.93 119.74 120.33 1h9b s LYS 273 Ca 0.53 1.08 -0.20 0.00 0.02 0.00 0.00 55.97 57.40 1h9b s LYS 273 Cb -0.39 -3.50 -0.04 0.00 -0.52 0.00 0.00 37.83 33.39 1h9b s LYS 273 CO 0.45 -0.13 0.57 0.42 -0.92 0.00 0.00 175.35 175.75 1h9b s ILE 274 N 1.41 5.11 0.26 2.17 -1.09 -1.26 -4.83 121.20 122.97 1h9b s ILE 274 Ca 0.42 1.13 -0.15 0.00 -2.23 0.00 0.00 60.65 59.81 1h9b s ILE 274 Cb -0.18 -3.90 -0.08 0.00 -1.58 0.00 0.00 42.46 36.71 1h9b s ILE 274 CO 0.18 0.24 0.68 -0.31 -1.23 0.00 0.00 174.94 174.51 1h9b s TYR 275 N 1.05 3.48 0.61 3.97 2.02 -1.26 -5.10 117.35 122.13 1h9b s TYR 275 Ca 0.29 1.19 0.07 0.00 -0.37 0.00 0.00 57.07 58.25 1h9b s TYR 275 Cb -0.16 -2.49 0.10 0.00 -0.40 0.00 0.00 41.96 39.01 1h9b s TYR 275 CO 0.12 0.22 0.85 0.16 -1.57 0.00 0.00 175.55 175.33 1h9b s ASP 276 N -2.06 4.89 0.22 2.29 1.47 -1.26 -4.79 116.67 117.43 1h9b s ASP 276 Ca 0.48 -0.72 -0.08 0.00 1.18 0.00 0.00 52.55 53.41 1h9b s ASP 276 Cb -0.13 0.22 0.36 0.00 -0.34 0.00 0.00 42.92 43.04 1h9b s ASP 276 CO 0.19 -1.49 1.70 -0.08 0.68 0.00 0.00 175.17 176.17 1h9b h GLU 277 N -0.02 0.27 -0.06 2.11 4.81 -1.99 0.29 114.58 120.00 1h9b h GLU 277 Ca -0.31 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1h9b h GLU 277 Cb 1.28 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 1h9b h GLU 277 CO 0.40 0.18 0.03 0.00 -0.73 0.00 0.00 179.01 178.89 1h9b h ALA 278 N 1.53 0.08 -0.46 2.92 0.00 -1.95 -2.43 119.26 118.94 1h9b h ALA 278 Ca 0.35 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1h9b h ALA 278 Cb 0.55 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1h9b h ALA 278 CO -0.44 -0.37 0.20 0.93 0.00 0.00 0.00 179.25 179.57 1h9b h GLU 279 N -0.01 0.65 -0.59 0.00 5.08 -1.76 -1.47 114.58 116.48 1h9b h GLU 279 Ca 0.02 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 1h9b h GLU 279 Cb 0.10 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1h9b h GLU 279 CO -0.00 0.53 0.06 0.28 -1.00 0.00 0.00 179.01 178.87 1h9b h VAL 280 N 0.65 1.26 -0.06 3.13 2.07 -0.78 0.24 116.25 122.76 1h9b h VAL 280 Ca 0.16 -1.03 -0.11 0.00 0.82 0.00 0.00 66.70 66.54 1h9b h VAL 280 Cb 0.11 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1h9b h VAL 280 CO -0.02 0.38 -0.48 0.78 0.02 0.00 0.00 177.57 178.25 1h9b h ASN 281 N 0.91 0.15 0.44 0.57 2.35 -0.85 -1.92 115.58 117.23 1h9b h ASN 281 Ca 0.18 -0.07 -0.31 0.00 -0.55 0.00 0.00 56.30 55.55 1h9b h ASN 281 Cb 0.46 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1h9b h ASN 281 CO 0.02 0.60 -1.58 0.50 -1.65 0.00 0.00 177.43 175.32 1h9b h LYS 282 N 0.11 0.22 -0.03 0.81 3.64 -0.92 -3.40 116.57 117.01 1h9b h LYS 282 Ca 0.00 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 1h9b h LYS 282 Cb 0.88 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1h9b h LYS 282 CO 0.07 1.06 0.00 0.66 -2.27 0.00 0.00 179.45 178.97 1h9b n TYR 283 N -3.41 0.01 -4.23 1.91 4.01 0.80 -5.00 117.16 111.25 1h9b n TYR 283 Ca -0.17 -0.01 -0.14 0.00 -0.16 0.00 0.00 57.90 57.42 1h9b n TYR 283 Cb 1.04 -0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.97 1h9b n TYR 283 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1h9b s PHE 284 N -1.25 1.20 -0.01 -0.72 0.40 -0.72 -1.13 117.98 115.75 1h9b s PHE 284 Ca 0.18 -0.76 0.00 0.00 -0.60 0.00 0.00 56.93 55.75 1h9b s PHE 284 Cb 0.13 -0.62 0.02 0.00 0.51 0.00 0.00 43.02 43.05 1h9b s PHE 284 CO 0.19 0.05 0.01 0.08 0.70 0.00 0.00 175.22 176.25 1h9b s VAL 285 N -3.22 0.00 -0.01 -0.44 1.01 0.72 -4.75 120.40 113.71 1h9b s VAL 285 Ca 0.14 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.31 1h9b s VAL 285 Cb 0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 36.38 36.30 1h9b s VAL 285 CO -0.00 0.07 -0.22 0.00 0.00 0.00 0.00 175.10 174.94 1h9b s ARG 286 N 0.65 1.77 0.27 2.72 1.70 -1.26 -1.84 118.95 122.96 1h9b s ARG 286 Ca -0.06 -0.80 -0.08 0.00 -0.47 0.00 0.00 55.73 54.32 1h9b s ARG 286 Cb -0.08 -1.72 -0.01 0.00 -0.57 0.00 0.00 34.95 32.57 1h9b s ARG 286 CO -0.02 0.47 0.41 0.00 -1.08 0.00 0.00 175.30 175.09 1h9b s ALA 287 N -0.54 0.30 -0.01 7.88 0.00 -0.90 -0.56 121.76 127.95 1h9b s ALA 287 Ca 0.09 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 50.84 1h9b s ALA 287 Cb -0.09 1.15 0.00 0.00 0.00 0.00 0.00 23.12 24.19 1h9b s ALA 287 CO -0.01 -0.79 -0.01 -1.14 0.00 0.00 0.00 175.76 173.81 1h9b s GLN 288 N -3.76 0.16 0.22 0.00 0.74 -0.77 -0.61 119.66 115.64 1h9b s GLN 288 Ca 0.28 -0.04 -0.30 0.00 0.05 0.00 0.00 55.36 55.35 1h9b s GLN 288 Cb 0.01 -0.19 -0.08 0.00 1.10 0.00 0.00 33.01 33.84 1h9b s GLN 288 CO 0.13 0.01 1.10 1.52 -0.55 0.00 0.00 175.29 177.50 1h9b s TYR 289 N 0.12 3.59 0.00 1.67 -0.85 -1.26 -3.00 117.35 117.62 1h9b s TYR 289 Ca -0.01 1.64 0.00 0.00 -0.52 0.00 0.00 57.07 58.18 1h9b s TYR 289 Cb -0.03 -3.28 0.00 0.00 0.38 0.00 0.00 41.96 39.03 1h9b s TYR 289 CO -0.00 -0.60 0.00 0.41 -1.52 0.00 0.00 175.55 173.84 1h9b n GLY 290 N 1.69 4.12 3.65 5.49 0.00 -0.61 -0.28 105.19 119.25 1h9b n GLY 290 Ca 0.01 -1.90 -0.47 0.00 0.00 0.00 0.00 46.02 43.66 1h9b n GLY 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h9b n ALA 291 N -3.00 0.81 -1.58 4.61 0.00 -1.26 -3.71 120.51 116.38 1h9b n ALA 291 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1h9b n ALA 291 Cb 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.18 1h9b n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h9b n GLY 292 N 2.98 1.34 0.08 0.00 0.00 0.37 -3.13 105.19 106.84 1h9b n GLY 292 Ca 0.16 -1.76 0.04 0.00 0.00 0.00 0.00 46.02 44.47 1h9b n GLY 292 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1h9b n ASP 293 N 0.00 0.56 -4.26 1.61 2.03 -1.26 -4.86 116.55 110.37 1h9b n ASP 293 Ca 0.00 0.24 -0.26 0.00 0.52 0.00 0.00 54.79 55.28 1h9b n ASP 293 Cb 0.00 0.75 -0.08 0.00 -0.72 0.00 0.00 41.12 41.06 1h9b n ASP 293 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1h9b s SER 294 N -5.35 2.97 0.48 1.67 1.04 -1.26 -5.05 113.70 108.20 1h9b s SER 294 Ca -0.04 -1.64 0.19 0.00 0.48 0.00 0.00 55.95 54.94 1h9b s SER 294 Cb 0.10 0.43 1.17 0.00 0.10 0.00 0.00 66.02 67.83 1h9b s SER 294 CO 0.83 -0.88 2.03 0.00 0.98 0.00 0.00 173.24 176.20 1h9b h ALA 295 N 1.75 1.57 0.00 5.32 0.00 -2.04 -2.49 119.26 123.37 1h9b h ALA 295 Ca -0.37 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.29 1h9b h ALA 295 Cb 1.28 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1h9b h ALA 295 CO 0.61 0.19 -0.48 -0.44 0.00 0.00 0.00 179.25 179.13 1h9b h ASP 296 N 0.00 0.00 -1.21 0.00 3.32 -2.00 -3.36 116.42 113.18 1h9b h ASP 296 Ca -0.00 0.00 -0.74 0.00 0.02 0.00 0.00 57.03 56.31 1h9b h ASP 296 Cb 0.31 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.73 1h9b h ASP 296 CO 0.02 0.48 2.13 0.49 -1.72 0.00 0.00 179.24 180.65 1h9b n PHE 297 N -3.58 3.65 -3.09 4.55 3.01 -0.94 -4.99 117.46 116.07 1h9b n PHE 297 Ca -0.00 -2.95 -0.35 0.00 1.01 0.00 0.00 57.45 55.16 1h9b n PHE 297 Cb 0.58 -2.19 -0.06 0.00 -0.01 0.00 0.00 39.48 37.79 1h9b n PHE 297 CO 0.00 0.00 0.00 -1.59 1.01 0.00 0.00 176.76 176.18 1h9b s LYS 298 N 1.58 4.18 0.78 -1.08 -2.85 -1.26 -0.48 119.74 120.61 1h9b s LYS 298 Ca 0.43 0.83 -0.14 0.00 -1.00 0.00 0.00 55.97 56.08 1h9b s LYS 298 Cb 0.07 -2.69 0.04 0.00 -2.06 0.00 0.00 37.83 33.20 1h9b s LYS 298 CO -0.01 0.29 1.00 -0.35 0.10 0.00 0.00 175.35 176.38 1h9b n PRO 299 N 0.28 0.27 -0.34 1.78 -0.04 -1.24 -4.82 135.00 130.88 1h9b n PRO 299 Ca 0.00 0.16 0.12 0.00 -0.04 0.00 0.00 63.50 63.74 1h9b n PRO 299 Cb 0.52 -2.26 0.32 0.00 -0.04 0.00 0.00 33.50 32.03 1h9b n PRO 299 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1h9b h TYR 300 N -0.68 1.03 0.00 0.54 3.20 -0.90 -1.40 116.97 118.75 1h9b h TYR 300 Ca -0.46 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.41 1h9b h TYR 300 Cb 1.31 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 39.26 1h9b h TYR 300 CO 0.42 0.30 -0.12 -0.07 -1.64 0.00 0.00 178.16 177.05 1h9b h LEU 301 N 0.80 0.00 -1.37 2.82 3.38 -1.91 -2.52 115.31 116.51 1h9b h LEU 301 Ca 0.54 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.51 1h9b h LEU 301 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1h9b h LEU 301 CO -0.32 0.12 0.00 -0.62 0.09 0.00 0.00 178.44 177.71 1h9b n GLU 302 N -3.76 1.88 -2.79 1.13 1.02 -0.53 -4.57 120.64 113.03 1h9b n GLU 302 Ca -0.02 -1.34 -0.34 0.00 -0.02 0.00 0.00 57.16 55.44 1h9b n GLU 302 Cb 0.22 -1.38 -0.07 0.00 -0.02 0.00 0.00 31.44 30.20 1h9b n GLU 302 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1h9b s GLU 303 N -1.64 4.23 0.51 3.49 0.41 -0.95 -4.97 118.70 119.77 1h9b s GLU 303 Ca 0.31 1.17 -0.23 0.00 -0.41 0.00 0.00 54.97 55.81 1h9b s GLU 303 Cb 0.17 -2.24 -0.06 0.00 -1.78 0.00 0.00 34.13 30.22 1h9b s GLU 303 CO 0.24 -0.04 1.34 -1.17 -0.49 0.00 0.00 175.26 175.14 1h9b s LEU 304 N -3.08 3.93 0.00 1.80 2.96 -1.26 -2.41 118.68 120.62 1h9b s LEU 304 Ca 0.61 2.72 0.00 0.00 -0.22 0.00 0.00 54.13 57.24 1h9b s LEU 304 Cb -0.11 -4.20 0.00 0.00 0.50 0.00 0.00 46.19 42.39 1h9b s LEU 304 CO 0.15 -1.38 0.00 0.47 -1.32 0.00 0.00 176.35 174.27 1h9b n ASP 305 N -0.76 -2.25 -4.61 3.68 8.00 -1.26 -4.74 116.55 114.61 1h9b n ASP 305 Ca 0.09 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.18 1h9b n ASP 305 Cb 0.45 -2.46 -0.06 0.00 -0.02 0.00 0.00 41.12 39.03 1h9b n ASP 305 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1h9b s VAL 306 N -1.36 4.92 -0.06 2.53 1.01 -1.01 -4.77 120.40 121.66 1h9b s VAL 306 Ca 0.00 1.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.73 1h9b s VAL 306 Cb 0.00 -4.01 -0.08 0.00 0.00 0.00 0.00 36.38 32.28 1h9b s VAL 306 CO 0.00 -0.10 2.04 -2.65 0.00 0.00 0.00 175.10 174.39 1h9b n PRO 307 N 5.89 2.50 0.30 2.72 -0.02 -1.26 -4.82 135.00 140.32 1h9b n PRO 307 Ca 0.00 0.87 0.05 0.00 -2.02 0.00 0.00 63.50 62.40 1h9b n PRO 307 Cb 0.49 -3.02 0.27 0.00 -0.02 0.00 0.00 33.50 31.21 1h9b n PRO 307 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1h9b h ALA 308 N 11.70 1.70 -0.76 3.55 0.00 -1.95 0.60 119.26 134.10 1h9b h ALA 308 Ca -0.47 0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.01 1h9b h ALA 308 Cb 1.25 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 18.79 1h9b h ALA 308 CO 0.95 -0.70 0.35 -0.40 0.00 0.00 0.00 179.25 179.44 1h9b n ASP 309 N -2.51 3.93 -4.73 0.00 5.75 -1.26 -5.01 116.55 112.72 1h9b n ASP 309 Ca -0.01 -3.71 -0.40 0.00 -0.01 0.00 0.00 54.79 50.66 1h9b n ASP 309 Cb 0.75 -0.76 -0.04 0.00 -1.03 0.00 0.00 41.12 40.03 1h9b n ASP 309 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1h9b s SER 310 N -1.94 7.24 -0.33 -1.12 0.15 0.21 -4.93 113.70 112.97 1h9b s SER 310 Ca 0.54 1.48 0.07 0.00 0.70 0.00 0.00 55.95 58.74 1h9b s SER 310 Cb 0.46 -2.49 0.50 0.00 -1.71 0.00 0.00 66.02 62.77 1h9b s SER 310 CO 0.05 -0.08 1.48 0.29 1.20 0.00 0.00 173.24 176.18 1h9b n LYS 311 N 3.22 2.20 -2.59 5.44 5.02 -1.26 -5.00 118.16 125.19 1h9b n LYS 311 Ca 0.00 -3.37 -0.38 0.00 -2.02 0.00 0.00 58.31 52.55 1h9b n LYS 311 Cb 0.50 -1.94 -0.05 0.00 -0.02 0.00 0.00 35.03 33.52 1h9b n LYS 311 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1h9b s ASN 312 N -2.64 7.04 -0.26 4.39 3.04 -1.26 -5.01 114.94 120.23 1h9b s ASN 312 Ca 0.48 2.04 -0.21 0.00 0.04 0.00 0.00 52.86 55.22 1h9b s ASN 312 Cb 0.42 -2.59 -0.02 0.00 -1.54 0.00 0.00 41.25 37.52 1h9b s ASN 312 CO 0.00 -0.29 0.64 0.54 -3.04 0.00 0.00 177.10 174.95 1h9b s ASN 313 N -1.40 6.58 0.00 -4.21 2.20 -1.26 -4.61 114.94 112.24 1h9b s ASN 313 Ca 0.52 0.69 0.23 0.00 -0.94 0.00 0.00 52.86 53.36 1h9b s ASN 313 Cb -0.24 -2.34 0.35 0.00 -2.00 0.00 0.00 41.25 37.02 1h9b s ASN 313 CO 0.30 -0.39 1.35 0.35 -2.94 0.00 0.00 177.10 175.77 1h9b n THR 314 N 5.23 0.35 -3.73 0.54 -2.24 0.22 -1.40 114.28 113.26 1h9b n THR 314 Ca -0.00 -0.68 -0.13 0.00 -2.27 0.00 0.00 64.05 60.97 1h9b n THR 314 Cb 0.49 1.14 -0.10 0.00 -2.10 0.00 0.00 70.33 69.77 1h9b n THR 314 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1h9b s PHE 315 N -1.63 -0.42 -0.05 4.78 2.19 -1.08 -0.32 117.98 121.45 1h9b s PHE 315 Ca 0.35 0.99 -0.04 0.00 0.33 0.00 0.00 56.93 58.57 1h9b s PHE 315 Cb 0.22 0.16 0.01 0.00 -1.31 0.00 0.00 43.02 42.10 1h9b s PHE 315 CO 0.31 -0.26 0.12 0.42 1.83 0.00 0.00 175.22 177.64 1h9b s ILE 316 N -0.05 -0.00 -0.04 3.12 -1.09 -0.18 -2.11 121.20 120.85 1h9b s ILE 316 Ca -0.02 0.02 -0.03 0.00 -2.23 0.00 0.00 60.65 58.38 1h9b s ILE 316 Cb -0.03 -0.18 0.01 0.00 -1.58 0.00 0.00 42.46 40.68 1h9b s ILE 316 CO 0.01 0.01 0.10 0.00 -1.23 0.00 0.00 174.94 173.83 1h9b s ALA 317 N 0.17 -0.24 0.13 9.38 0.00 -0.76 -1.17 121.76 129.27 1h9b s ALA 317 Ca -0.01 0.30 -0.25 0.00 0.00 0.00 0.00 51.96 52.00 1h9b s ALA 317 Cb -0.02 -0.18 0.07 0.00 0.00 0.00 0.00 23.12 22.99 1h9b s ALA 317 CO -0.00 -0.05 0.83 0.20 0.00 0.00 0.00 175.76 176.73 1h9b s GLY 318 N 0.13 -0.35 -0.12 0.00 0.00 -0.13 -0.20 107.32 106.64 1h9b s GLY 318 Ca -0.01 0.39 -0.02 0.00 0.00 0.00 0.00 44.72 45.09 1h9b s GLY 318 CO -0.00 0.12 -0.07 1.85 0.00 0.00 0.00 173.10 175.00 1h9b s GLU 319 N -3.43 3.31 0.01 2.90 2.12 -0.28 -1.29 118.70 122.04 1h9b s GLU 319 Ca 0.08 -0.56 0.03 0.00 0.36 0.00 0.00 54.97 54.88 1h9b s GLU 319 Cb -0.02 -2.75 -0.03 0.00 0.26 0.00 0.00 34.13 31.58 1h9b s GLU 319 CO -0.03 0.38 -0.05 -0.51 -0.54 0.00 0.00 175.26 174.50 1h9b s LEU 320 N -0.03 3.25 -0.05 2.70 1.02 0.89 -4.91 118.68 121.55 1h9b s LEU 320 Ca -0.00 -0.12 0.02 0.00 0.02 0.00 0.00 54.13 54.05 1h9b s LEU 320 Cb -0.13 -1.87 0.01 0.00 0.02 0.00 0.00 46.19 44.22 1h9b s LEU 320 CO 0.03 0.28 -0.11 -1.10 0.02 0.00 0.00 176.35 175.47 1h9b s GLN 321 N -1.50 1.38 -0.17 1.70 -0.21 -1.26 -1.80 119.66 117.81 1h9b s GLN 321 Ca 0.18 -0.36 -0.03 0.00 0.02 0.00 0.00 55.36 55.18 1h9b s GLN 321 Cb -0.11 -1.20 -0.02 0.00 1.00 0.00 0.00 33.01 32.68 1h9b s GLN 321 CO 0.09 0.06 -0.07 -0.06 -2.12 0.00 0.00 175.29 173.18 1h9b s PHE 322 N 0.50 2.93 -0.24 0.91 0.08 -1.26 -1.96 117.98 118.95 1h9b s PHE 322 Ca -0.10 -0.60 -0.04 0.00 0.12 0.00 0.00 56.93 56.31 1h9b s PHE 322 Cb -0.13 -1.96 -0.05 0.00 -0.57 0.00 0.00 43.02 40.31 1h9b s PHE 322 CO 0.02 -0.25 2.94 -3.47 -0.10 0.00 0.00 175.22 174.37 1h9b n ASP 323 N 3.90 5.93 -4.49 1.36 2.03 0.94 -4.36 116.55 121.86 1h9b n ASP 323 Ca -0.18 -2.86 -0.29 0.00 0.52 0.00 0.00 54.79 51.98 1h9b n ASP 323 Cb 0.52 -1.27 -0.11 0.00 -0.72 0.00 0.00 41.12 39.54 1h9b n ASP 323 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1h9b s LEU 324 N -1.17 2.71 0.26 -2.67 1.43 -1.26 -4.91 118.68 113.07 1h9b s LEU 324 Ca 0.54 -0.57 -0.02 0.00 -1.03 0.00 0.00 54.13 53.05 1h9b s LEU 324 Cb 0.31 -1.54 0.49 0.00 0.03 0.00 0.00 46.19 45.48 1h9b s LEU 324 CO -0.10 0.17 1.78 -0.65 0.23 0.00 0.00 176.35 177.79 1h9b h PRO 325 N 3.65 0.69 0.00 1.29 0.11 -2.00 -1.45 132.00 134.30 1h9b h PRO 325 Ca -0.50 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 1h9b h PRO 325 Cb 1.17 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1h9b h PRO 325 CO 0.47 0.46 -0.01 -0.09 -0.21 0.00 0.00 178.00 178.62 1h9b h ARG 326 N 0.71 0.00 0.00 1.05 2.43 -1.96 -3.07 114.38 113.54 1h9b h ARG 326 Ca 0.44 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.61 1h9b h ARG 326 Cb 0.54 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1h9b h ARG 326 CO -0.31 0.01 -0.03 0.91 -1.51 0.00 0.00 179.97 179.03 1h9b n TRP 327 N -3.78 0.00 -1.62 2.20 7.02 -0.60 -0.19 117.44 120.48 1h9b n TRP 327 Ca -0.03 -0.72 -0.50 0.00 -1.02 0.00 0.00 57.50 55.23 1h9b n TRP 327 Cb 0.09 -0.10 -0.06 0.00 -2.42 0.00 0.00 31.31 28.82 1h9b n TRP 327 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1h9b n GLU 328 N -0.97 1.71 -0.99 -0.99 1.02 -0.87 -0.80 120.64 118.76 1h9b n GLU 328 Ca 0.09 0.58 0.00 0.00 -0.02 0.00 0.00 57.16 57.81 1h9b n GLU 328 Cb 0.50 -2.57 0.00 0.00 -0.02 0.00 0.00 31.44 29.35 1h9b n GLU 328 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h9b n GLY 329 N 5.08 0.47 3.39 0.62 0.00 -1.26 -4.89 105.19 108.59 1h9b n GLY 329 Ca 0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 1h9b n GLY 329 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h9b s VAL 330 N -2.05 5.03 0.24 1.61 1.01 0.02 -5.01 120.40 121.24 1h9b s VAL 330 Ca 0.00 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 60.70 1h9b s VAL 330 Cb 0.00 -3.94 -0.09 0.00 0.00 0.00 0.00 36.38 32.36 1h9b s VAL 330 CO 0.00 -0.46 1.09 -2.16 0.00 0.00 0.00 175.10 173.57 1h9b s PRO 331 N 1.61 4.64 -0.34 2.72 0.04 -1.26 -4.66 135.00 137.75 1h9b s PRO 331 Ca 0.04 1.75 -0.07 0.00 0.04 0.00 0.00 61.00 62.76 1h9b s PRO 331 Cb -0.22 -3.23 0.04 0.00 0.04 0.00 0.00 34.50 31.13 1h9b s PRO 331 CO 0.07 0.19 0.11 -0.06 0.04 0.00 0.00 177.00 177.35 1h9b s PHE 332 N -0.82 3.25 -0.13 0.56 0.40 -0.74 -2.16 117.98 118.35 1h9b s PHE 332 Ca 0.46 -1.37 -0.13 0.00 -0.60 0.00 0.00 56.93 55.28 1h9b s PHE 332 Cb -0.31 -2.29 -0.05 0.00 0.51 0.00 0.00 43.02 40.89 1h9b s PHE 332 CO 0.38 -0.72 0.30 0.71 0.70 0.00 0.00 175.22 176.59 1h9b s TYR 333 N 1.42 3.52 0.05 0.36 2.02 0.62 -0.08 117.35 125.25 1h9b s TYR 333 Ca -0.01 0.66 0.05 0.00 -0.37 0.00 0.00 57.07 57.40 1h9b s TYR 333 Cb -0.19 -2.29 -0.02 0.00 -0.40 0.00 0.00 41.96 39.05 1h9b s TYR 333 CO 0.03 0.36 -0.14 0.14 -1.57 0.00 0.00 175.55 174.37 1h9b s VAL 334 N 0.04 1.11 -0.17 0.71 -7.23 -0.42 -0.02 120.40 114.44 1h9b s VAL 334 Ca 0.18 -1.08 -0.22 0.00 -1.81 0.00 0.00 61.98 59.05 1h9b s VAL 334 Cb -0.13 -1.03 0.06 0.00 0.56 0.00 0.00 36.38 35.84 1h9b s VAL 334 CO 0.06 -0.05 0.58 0.00 -0.31 0.00 0.00 175.10 175.38 1h9b s ARG 335 N -1.29 0.77 -0.17 4.82 1.70 -0.25 -0.96 118.95 123.57 1h9b s ARG 335 Ca 0.01 0.60 -0.21 0.00 -0.47 0.00 0.00 55.73 55.66 1h9b s ARG 335 Cb -0.08 0.37 0.05 0.00 -0.57 0.00 0.00 34.95 34.72 1h9b s ARG 335 CO 0.01 -0.14 0.56 0.45 -1.08 0.00 0.00 175.30 175.10 1h9b s SER 336 N -0.17 -0.56 -0.08 -2.89 0.15 -0.31 -1.07 113.70 108.77 1h9b s SER 336 Ca -0.04 0.96 -0.32 0.00 0.70 0.00 0.00 55.95 57.25 1h9b s SER 336 Cb -0.03 0.97 0.12 0.00 -1.71 0.00 0.00 66.02 65.37 1h9b s SER 336 CO 0.03 -0.29 1.18 -0.83 1.20 0.00 0.00 173.24 174.54 1h9b s GLY 337 N -0.11 -0.35 0.43 9.45 0.00 -1.17 -1.01 107.32 114.55 1h9b s GLY 337 Ca -0.03 1.09 -0.01 0.00 0.00 0.00 0.00 44.72 45.76 1h9b s GLY 337 CO 0.03 0.32 0.66 0.54 0.00 0.00 0.00 173.10 174.64 1h9b s LYS 338 N -2.57 3.29 -1.45 2.90 -0.14 0.57 -2.21 119.74 120.13 1h9b s LYS 338 Ca 0.11 -0.29 -0.05 0.00 -1.36 0.00 0.00 55.97 54.38 1h9b s LYS 338 Cb 0.01 -2.55 0.04 0.00 -1.68 0.00 0.00 37.83 33.65 1h9b s LYS 338 CO -0.04 -0.13 0.61 0.54 -0.76 0.00 0.00 175.35 175.56 1h9b n ARG 339 N -2.03 -3.90 -3.13 1.68 5.12 0.06 -4.90 116.66 109.56 1h9b n ARG 339 Ca -0.01 0.47 -0.20 0.00 -1.93 0.00 0.00 57.85 56.18 1h9b n ARG 339 Cb 0.57 -4.87 0.05 0.00 -1.16 0.00 0.00 32.46 27.05 1h9b n ARG 339 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1h9b s LEU 340 N -7.00 3.05 0.50 0.55 1.43 0.08 -0.76 118.68 116.53 1h9b s LEU 340 Ca 0.20 -0.90 0.23 0.00 -1.03 0.00 0.00 54.13 52.63 1h9b s LEU 340 Cb -0.11 -1.56 1.32 0.00 0.03 0.00 0.00 46.19 45.88 1h9b s LEU 340 CO 0.87 -1.33 2.06 0.00 0.23 0.00 0.00 176.35 178.18 1h9b h ALA 341 N 0.23 1.45 -1.93 4.21 0.00 -0.74 -3.39 119.26 119.08 1h9b h ALA 341 Ca -0.30 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 1h9b h ALA 341 Cb 1.29 -0.02 -0.20 0.00 0.00 0.00 0.00 17.79 18.86 1h9b h ALA 341 CO 0.42 0.17 0.22 0.00 0.00 0.00 0.00 179.25 180.07 1h9b s ALA 342 N -4.39 -1.80 -0.08 0.00 0.00 -1.26 -4.99 121.76 109.24 1h9b s ALA 342 Ca -0.03 1.57 -0.30 0.00 0.00 0.00 0.00 51.96 53.20 1h9b s ALA 342 Cb 0.14 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 1h9b s ALA 342 CO 0.62 -0.35 1.36 0.21 0.00 0.00 0.00 175.76 177.60 1h9b s LYS 343 N -0.69 4.26 -0.29 0.00 2.47 -1.26 -4.02 119.74 120.21 1h9b s LYS 343 Ca -0.06 1.84 -0.20 0.00 -1.56 0.00 0.00 55.97 55.99 1h9b s LYS 343 Cb -0.02 -3.71 0.16 0.00 -1.46 0.00 0.00 37.83 32.80 1h9b s LYS 343 CO 0.06 -0.65 1.12 -1.14 0.16 0.00 0.00 175.35 174.90 1h9b s GLN 344 N 3.04 0.30 -0.22 4.03 0.74 -0.26 -4.47 119.66 122.82 1h9b s GLN 344 Ca 0.61 0.45 0.02 0.00 0.05 0.00 0.00 55.36 56.48 1h9b s GLN 344 Cb -0.27 0.10 0.04 0.00 1.10 0.00 0.00 33.01 33.98 1h9b s GLN 344 CO 0.22 -0.05 -0.14 0.99 -0.55 0.00 0.00 175.29 175.76 1h9b s THR 345 N 0.79 2.05 0.10 -0.34 2.01 -1.14 -0.36 115.64 118.75 1h9b s THR 345 Ca -0.03 -1.30 -0.10 0.00 0.31 0.00 0.00 61.69 60.56 1h9b s THR 345 Cb -0.04 -2.05 0.01 0.00 0.01 0.00 0.00 72.50 70.43 1h9b s THR 345 CO -0.12 0.19 0.24 0.00 -0.69 0.00 0.00 174.62 174.25 1h9b s ARG 346 N 1.21 0.92 -0.10 4.92 1.70 -0.06 -0.35 118.95 127.20 1h9b s ARG 346 Ca -0.03 -0.92 0.02 0.00 -0.47 0.00 0.00 55.73 54.34 1h9b s ARG 346 Cb -0.17 0.37 0.01 0.00 -0.57 0.00 0.00 34.95 34.59 1h9b s ARG 346 CO -0.08 -0.31 -0.17 0.08 -1.08 0.00 0.00 175.30 173.74 1h9b s VAL 347 N -3.86 1.57 -0.15 4.99 1.01 -0.62 -1.30 120.40 122.05 1h9b s VAL 347 Ca 0.05 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.34 1h9b s VAL 347 Cb 0.04 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 35.03 1h9b s VAL 347 CO -0.10 0.45 -0.20 -1.81 0.00 0.00 0.00 175.10 173.44 1h9b s ASP 348 N 0.73 2.99 -0.31 3.32 1.01 0.38 -0.36 116.67 124.42 1h9b s ASP 348 Ca -0.12 -0.58 -0.04 0.00 0.71 0.00 0.00 52.55 52.52 1h9b s ASP 348 Cb -0.16 -1.39 0.04 0.00 1.01 0.00 0.00 42.92 42.43 1h9b s ASP 348 CO 0.02 0.04 0.04 -0.63 0.21 0.00 0.00 175.17 174.85 1h9b s ILE 349 N 1.02 3.30 -0.24 0.77 1.01 0.82 0.16 121.20 128.04 1h9b s ILE 349 Ca -0.03 -1.27 -0.19 0.00 0.00 0.00 0.00 60.65 59.16 1h9b s ILE 349 Cb -0.15 -2.88 -0.02 0.00 0.01 0.00 0.00 42.46 39.42 1h9b s ILE 349 CO -0.06 -0.12 0.58 -0.69 0.00 0.00 0.00 174.94 174.65 1h9b s VAL 350 N 1.32 5.03 0.16 2.92 1.01 -0.54 -1.28 120.40 129.01 1h9b s VAL 350 Ca -0.04 1.04 -0.12 0.00 0.00 0.00 0.00 61.98 62.87 1h9b s VAL 350 Cb -0.20 -3.89 -0.07 0.00 0.00 0.00 0.00 36.38 32.23 1h9b s VAL 350 CO 0.00 0.08 0.51 -0.36 0.00 0.00 0.00 175.10 175.33 1h9b s PHE 351 N 2.23 3.54 0.32 5.22 0.08 -0.21 0.02 117.98 129.17 1h9b s PHE 351 Ca 0.25 0.92 -0.29 0.00 0.12 0.00 0.00 56.93 57.93 1h9b s PHE 351 Cb -0.16 -2.27 -0.11 0.00 -0.57 0.00 0.00 43.02 39.91 1h9b s PHE 351 CO 0.09 0.40 1.51 0.15 -0.10 0.00 0.00 175.22 177.27 1h9b s LYS 352 N -2.23 4.16 0.66 0.44 1.02 0.10 -3.76 119.74 120.14 1h9b s LYS 352 Ca 0.40 2.50 -0.17 0.00 0.02 0.00 0.00 55.97 58.72 1h9b s LYS 352 Cb -0.14 -3.02 0.00 0.00 -0.52 0.00 0.00 37.83 34.15 1h9b s LYS 352 CO 0.20 -0.52 1.20 0.00 -0.92 0.00 0.00 175.35 175.30 1h9b s ALA 353 N -0.49 2.35 0.60 5.17 0.00 -1.26 -4.73 121.76 123.41 1h9b s ALA 353 Ca 0.58 0.90 -0.10 0.00 0.00 0.00 0.00 51.96 53.34 1h9b s ALA 353 Cb -0.46 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.18 1h9b s ALA 353 CO 0.53 -1.50 0.99 0.20 0.00 0.00 0.00 175.76 175.99 1h9b s GLY 354 N -1.91 1.63 -0.03 0.00 0.00 -1.26 -4.99 107.32 100.76 1h9b s GLY 354 Ca 0.75 -0.18 0.21 0.00 0.00 0.00 0.00 44.72 45.50 1h9b s GLY 354 CO 0.40 0.08 1.56 -1.30 0.00 0.00 0.00 173.10 173.83 1h9b n THR 355 N -2.69 1.24 -2.44 0.90 -2.24 -1.26 -4.80 114.28 103.00 1h9b n THR 355 Ca 0.05 -1.06 -0.42 0.00 -2.27 0.00 0.00 64.05 60.35 1h9b n THR 355 Cb 0.54 0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 69.14 1h9b n THR 355 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1h9b s PHE 356 N -1.25 3.10 -0.41 4.78 5.36 -1.26 -4.99 117.98 123.31 1h9b s PHE 356 Ca 0.49 1.15 -0.20 0.00 -0.96 0.00 0.00 56.93 57.41 1h9b s PHE 356 Cb 0.27 -3.45 0.02 0.00 -0.34 0.00 0.00 43.02 39.52 1h9b s PHE 356 CO 0.30 -1.47 0.61 1.21 -1.46 0.00 0.00 175.22 174.42 1h9b s ASN 357 N 1.60 6.33 0.07 6.13 3.84 -1.26 -4.73 114.94 126.92 1h9b s ASN 357 Ca 0.56 -0.24 0.26 0.00 0.21 0.00 0.00 52.86 53.66 1h9b s ASN 357 Cb -0.25 -2.31 0.71 0.00 -0.55 0.00 0.00 41.25 38.85 1h9b s ASN 357 CO 0.21 -0.69 1.59 0.49 -2.79 0.00 0.00 177.10 175.91 1h9b n PHE 358 N 6.10 0.33 -1.00 0.43 3.72 -1.26 -4.92 117.46 120.86 1h9b n PHE 358 Ca -0.02 0.10 -0.00 0.00 -0.05 0.00 0.00 57.45 57.47 1h9b n PHE 358 Cb 0.48 -0.56 -0.00 0.00 -0.94 0.00 0.00 39.48 38.46 1h9b n PHE 358 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1h9b n GLY 359 N 1.42 0.46 3.91 1.37 0.00 -1.26 -5.02 105.19 106.07 1h9b n GLY 359 Ca 0.05 -0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 1h9b n GLY 359 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h9b s SER 360 N -2.08 5.02 0.21 1.61 1.04 -1.26 -5.00 113.70 113.24 1h9b s SER 360 Ca 0.00 0.70 0.06 0.00 0.48 0.00 0.00 55.95 57.19 1h9b s SER 360 Cb 0.00 -1.42 0.15 0.00 0.10 0.00 0.00 66.02 64.86 1h9b s SER 360 CO 0.00 -1.51 1.49 -0.08 0.98 0.00 0.00 173.24 174.12 1h9b h GLU 361 N -0.62 0.13 -4.78 4.02 4.81 -1.96 -3.40 114.58 112.78 1h9b h GLU 361 Ca -0.45 -0.11 -0.68 0.00 -0.13 0.00 0.00 59.36 57.98 1h9b h GLU 361 Cb 1.30 0.03 -0.33 0.00 0.63 0.00 0.00 28.75 30.37 1h9b h GLU 361 CO 0.62 0.80 -0.71 -1.14 -0.73 0.00 0.00 179.01 177.86 1h9b s GLN 362 N -3.43 2.41 0.79 1.92 2.00 -1.26 -5.11 119.66 116.97 1h9b s GLN 362 Ca -0.02 -1.28 -0.10 0.00 -2.00 0.00 0.00 55.36 51.96 1h9b s GLN 362 Cb 0.11 -3.16 0.10 0.00 0.80 0.00 0.00 33.01 30.87 1h9b s GLN 362 CO 0.80 -0.62 1.13 -1.21 -0.50 0.00 0.00 175.29 174.89 1h9b s GLU 363 N 1.24 1.74 0.14 1.67 0.41 -1.26 -3.38 118.70 119.26 1h9b s GLU 363 Ca -0.05 -0.25 -0.31 0.00 -0.41 0.00 0.00 54.97 53.95 1h9b s GLU 363 Cb -0.20 -2.05 -0.11 0.00 -1.78 0.00 0.00 34.13 30.00 1h9b s GLU 363 CO -0.01 -1.62 1.80 0.00 -0.49 0.00 0.00 175.26 174.93 1h9b s ALA 364 N -3.48 3.81 0.56 5.21 0.00 -1.26 -4.89 121.76 121.71 1h9b s ALA 364 Ca 0.64 1.48 0.00 0.00 0.00 0.00 0.00 51.96 54.09 1h9b s ALA 364 Cb -0.09 -3.74 0.08 0.00 0.00 0.00 0.00 23.12 19.37 1h9b s ALA 364 CO 0.48 -1.14 0.56 0.00 0.00 0.00 0.00 175.76 175.65 1h9b s GLU 366 N -3.89 4.49 0.40 0.00 2.02 -1.26 -4.54 118.70 115.91 1h9b s GLU 366 Ca 0.37 1.21 -0.24 0.00 0.02 0.00 0.00 54.97 56.34 1h9b s GLU 366 Cb -0.02 -3.47 -0.09 0.00 0.10 0.00 0.00 34.13 30.65 1h9b s GLU 366 CO 0.25 -0.05 1.04 0.00 0.02 0.00 0.00 175.26 176.52 1h9b s ALA 367 N 1.09 3.07 -0.04 5.21 0.00 -1.25 -4.86 121.76 124.99 1h9b s ALA 367 Ca 0.46 0.68 0.02 0.00 0.00 0.00 0.00 51.96 53.12 1h9b s ALA 367 Cb -0.19 -3.27 0.01 0.00 0.00 0.00 0.00 23.12 19.67 1h9b s ALA 367 CO 0.23 -0.20 -0.09 0.08 0.00 0.00 0.00 175.76 175.78 1h9b s VAL 368 N -1.70 0.82 -0.28 0.00 1.01 -0.42 -1.05 120.40 118.78 1h9b s VAL 368 Ca 0.58 -0.35 -0.06 0.00 0.00 0.00 0.00 61.98 62.16 1h9b s VAL 368 Cb -0.21 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.43 1h9b s VAL 368 CO 0.26 0.26 0.05 -0.22 0.00 0.00 0.00 175.10 175.46 1h9b s LEU 369 N 0.38 3.66 -0.11 3.92 2.96 -0.40 -0.49 118.68 128.60 1h9b s LEU 369 Ca -0.06 -0.68 0.01 0.00 -0.22 0.00 0.00 54.13 53.17 1h9b s LEU 369 Cb -0.11 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.72 1h9b s LEU 369 CO 0.01 -0.16 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.30 1h9b s SER 370 N 1.48 4.01 -0.31 3.68 0.01 -0.24 -0.13 113.70 122.20 1h9b s SER 370 Ca 0.03 -0.29 0.03 0.00 1.31 0.00 0.00 55.95 57.03 1h9b s SER 370 Cb -0.17 -1.38 0.09 0.00 0.21 0.00 0.00 66.02 64.77 1h9b s SER 370 CO 0.01 0.22 -0.01 -0.63 0.41 0.00 0.00 173.24 173.24 1h9b s ILE 371 N 0.02 2.18 -0.20 1.44 1.01 0.51 -1.39 121.20 124.76 1h9b s ILE 371 Ca -0.04 -2.05 -0.25 0.00 0.00 0.00 0.00 60.65 58.31 1h9b s ILE 371 Cb -0.14 -2.49 -0.01 0.00 0.01 0.00 0.00 42.46 39.83 1h9b s ILE 371 CO 0.04 -0.39 0.85 -0.63 0.00 0.00 0.00 174.94 174.81 1h9b s ILE 372 N 1.00 4.85 -0.21 2.92 1.09 0.04 -1.58 121.20 129.30 1h9b s ILE 372 Ca 0.04 1.64 -0.11 0.00 -1.10 0.00 0.00 60.65 61.11 1h9b s ILE 372 Cb -0.19 -4.14 -0.19 0.00 -1.06 0.00 0.00 42.46 36.87 1h9b s ILE 372 CO -0.07 -0.03 0.03 -0.38 -0.10 0.00 0.00 174.94 174.39 1h9b n ILE 373 N 5.00 1.59 -4.26 2.92 5.41 0.53 -1.92 119.36 128.63 1h9b n ILE 373 Ca 0.06 -0.39 -0.22 0.00 1.00 0.00 0.00 62.75 63.20 1h9b n ILE 373 Cb 0.48 -1.80 -0.12 0.00 -0.71 0.00 0.00 39.64 37.49 1h9b n ILE 373 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1h9b s ASP 374 N -7.00 2.29 0.30 4.38 1.01 -0.99 -4.14 116.67 112.52 1h9b s ASP 374 Ca -0.31 -0.69 0.21 0.00 0.71 0.00 0.00 52.55 52.47 1h9b s ASP 374 Cb 0.09 -0.11 0.14 0.00 1.01 0.00 0.00 42.92 44.04 1h9b s ASP 374 CO 0.62 -0.00 1.30 1.55 0.21 0.00 0.00 175.17 178.85 1h9b h PRO 375 N 4.01 0.00 -4.21 8.23 0.13 -1.89 -3.01 132.00 135.26 1h9b h PRO 375 Ca -0.44 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.24 1h9b h PRO 375 Cb 1.19 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 31.98 1h9b h PRO 375 CO 0.42 0.07 -0.79 0.21 -0.23 0.00 0.00 178.00 177.68 1h9b s LYS 376 N -3.22 1.17 0.29 0.86 2.20 -1.26 -5.12 119.74 114.66 1h9b s LYS 376 Ca 0.03 -0.22 -0.30 0.00 -0.36 0.00 0.00 55.97 55.12 1h9b s LYS 376 Cb 0.07 -1.09 -0.12 0.00 -1.51 0.00 0.00 37.83 35.19 1h9b s LYS 376 CO 0.74 -0.06 1.60 0.41 -0.36 0.00 0.00 175.35 177.68 1h9b n GLY 377 N 4.05 1.35 3.40 5.54 0.00 -1.26 -4.67 105.19 113.60 1h9b n GLY 377 Ca -0.23 0.46 -0.13 0.00 0.00 0.00 0.00 46.02 46.13 1h9b n GLY 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h9b s ALA 378 N 0.01 -1.41 -0.04 4.61 0.00 -0.81 -2.06 121.76 122.07 1h9b s ALA 378 Ca 0.64 0.53 -0.01 0.00 0.00 0.00 0.00 51.96 53.13 1h9b s ALA 378 Cb -0.49 0.57 0.03 0.00 0.00 0.00 0.00 23.12 23.22 1h9b s ALA 378 CO 0.48 -0.60 0.01 0.42 0.00 0.00 0.00 175.76 176.07 1h9b s ILE 379 N -2.98 0.18 -0.01 0.00 1.01 -0.54 -0.78 121.20 118.07 1h9b s ILE 379 Ca -0.02 0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.84 1h9b s ILE 379 Cb -0.00 -0.33 -0.01 0.00 0.01 0.00 0.00 42.46 42.13 1h9b s ILE 379 CO -0.06 0.19 -0.13 -1.61 0.00 0.00 0.00 174.94 173.33 1h9b s GLU 380 N 1.56 1.11 -0.24 2.79 2.02 -0.49 -1.04 118.70 124.41 1h9b s GLU 380 Ca -0.02 -0.47 0.00 0.00 0.02 0.00 0.00 54.97 54.50 1h9b s GLU 380 Cb -0.13 -1.06 0.06 0.00 0.10 0.00 0.00 34.13 33.10 1h9b s GLU 380 CO -0.03 0.28 -0.03 -1.17 0.02 0.00 0.00 175.26 174.32 1h9b s LEU 381 N -0.27 2.47 -0.29 1.80 2.96 0.39 -1.08 118.68 124.67 1h9b s LEU 381 Ca 0.04 -1.19 -0.22 0.00 -0.22 0.00 0.00 54.13 52.54 1h9b s LEU 381 Cb -0.06 -1.11 -0.01 0.00 0.50 0.00 0.00 46.19 45.51 1h9b s LEU 381 CO -0.00 -0.26 0.70 -0.75 -1.32 0.00 0.00 176.35 174.72 1h9b s LYS 382 N 1.44 3.99 0.30 1.98 2.20 0.36 -0.57 119.74 129.44 1h9b s LYS 382 Ca -0.04 0.50 0.06 0.00 -0.36 0.00 0.00 55.97 56.13 1h9b s LYS 382 Cb -0.19 -3.71 -0.06 0.00 -1.51 0.00 0.00 37.83 32.37 1h9b s LYS 382 CO -0.07 -0.58 -0.02 -0.51 -0.36 0.00 0.00 175.35 173.81 1h9b s LEU 383 N 2.73 2.45 0.01 5.43 1.43 -0.12 -1.30 118.68 129.32 1h9b s LEU 383 Ca 0.29 -1.25 -0.17 0.00 -1.03 0.00 0.00 54.13 51.97 1h9b s LEU 383 Cb -0.15 -0.61 -0.06 0.00 0.03 0.00 0.00 46.19 45.41 1h9b s LEU 383 CO 0.11 -0.41 0.48 0.20 0.23 0.00 0.00 176.35 176.96 1h9b s ASN 384 N -3.48 6.90 0.12 2.29 0.01 -1.26 -0.81 114.94 118.71 1h9b s ASN 384 Ca 0.32 1.06 0.01 0.00 -0.71 0.00 0.00 52.86 53.54 1h9b s ASN 384 Cb 0.05 -2.30 -0.00 0.00 0.41 0.00 0.00 41.25 39.41 1h9b s ASN 384 CO 0.13 0.27 0.15 0.00 -1.51 0.00 0.00 177.10 176.14 1h9b n ALA 385 N 2.01 0.03 -2.29 0.60 0.00 0.86 -4.93 120.51 116.78 1h9b n ALA 385 Ca -0.12 -0.64 -0.36 0.00 0.00 0.00 0.00 53.44 52.33 1h9b n ALA 385 Cb 0.52 0.51 -0.06 0.00 0.00 0.00 0.00 19.45 20.42 1h9b n ALA 385 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1h9b s LYS 386 N -2.37 4.06 0.58 0.00 2.20 -1.26 -0.89 119.74 122.06 1h9b s LYS 386 Ca 0.12 0.59 -0.10 0.00 -0.36 0.00 0.00 55.97 56.23 1h9b s LYS 386 Cb 0.00 -2.95 -0.04 0.00 -1.51 0.00 0.00 37.83 33.33 1h9b s LYS 386 CO 0.09 0.47 0.97 -1.54 -0.36 0.00 0.00 175.35 174.98 1h9b s SER 387 N -1.65 6.25 -1.26 1.43 1.04 0.11 -4.69 113.70 114.93 1h9b s SER 387 Ca 0.38 1.30 -0.13 0.00 0.48 0.00 0.00 55.95 57.98 1h9b s SER 387 Cb -0.16 -2.41 0.15 0.00 0.10 0.00 0.00 66.02 63.70 1h9b s SER 387 CO 0.19 -0.79 1.66 0.52 0.98 0.00 0.00 173.24 175.81 1h9b n VAL 388 N -2.59 4.21 -4.25 5.02 0.31 -1.26 -4.78 118.33 114.99 1h9b n VAL 388 Ca 0.05 -4.46 -0.14 0.00 -0.01 0.00 0.00 64.34 59.78 1h9b n VAL 388 Cb 0.54 -2.43 -0.10 0.00 -0.91 0.00 0.00 33.84 30.95 1h9b n VAL 388 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1h9b s GLU 389 N 1.53 1.20 0.05 5.55 2.02 -1.26 -5.06 118.70 122.72 1h9b s GLU 389 Ca 0.43 -1.61 -0.20 0.00 0.02 0.00 0.00 54.97 53.61 1h9b s GLU 389 Cb 0.03 -0.15 -0.14 0.00 0.10 0.00 0.00 34.13 33.98 1h9b s GLU 389 CO 0.01 -0.23 1.36 -0.44 0.02 0.00 0.00 175.26 175.98 1h9b h ASP 390 N 2.60 0.41 -3.40 -0.19 3.32 -2.02 -3.43 116.42 113.71 1h9b h ASP 390 Ca -0.37 -0.47 -0.54 0.00 0.02 0.00 0.00 57.03 55.67 1h9b h ASP 390 Cb 1.22 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 1h9b h ASP 390 CO 0.61 0.80 -0.09 0.00 -1.72 0.00 0.00 179.24 178.83 1h9b s ALA 391 N -4.35 3.56 0.22 3.45 0.00 -1.26 -5.02 121.76 118.36 1h9b s ALA 391 Ca -0.14 -0.18 -0.31 0.00 0.00 0.00 0.00 51.96 51.33 1h9b s ALA 391 Cb 0.06 -2.50 -0.11 0.00 0.00 0.00 0.00 23.12 20.57 1h9b s ALA 391 CO 0.76 0.47 1.58 0.12 0.00 0.00 0.00 175.76 178.69 1h9b s PHE 392 N -1.66 2.95 -0.06 0.00 2.19 -1.26 -4.94 117.98 115.19 1h9b s PHE 392 Ca 0.43 0.68 -0.31 0.00 0.33 0.00 0.00 56.93 58.06 1h9b s PHE 392 Cb -0.13 -3.99 0.08 0.00 -1.31 0.00 0.00 43.02 37.67 1h9b s PHE 392 CO 0.20 -3.52 0.71 1.21 1.83 0.00 0.00 175.22 175.65 1h9b s ASN 393 N 0.84 -0.63 0.43 6.13 2.47 -1.26 -4.61 114.94 118.31 1h9b s ASN 393 Ca 0.67 0.70 0.01 0.00 0.42 0.00 0.00 52.86 54.67 1h9b s ASN 393 Cb -0.46 0.53 -0.00 0.00 -1.45 0.00 0.00 41.25 39.87 1h9b s ASN 393 CO 0.38 -0.58 0.64 0.42 -3.72 0.00 0.00 177.10 174.23 1h9b s THR 394 N -1.16 4.00 0.22 -5.21 -4.23 -1.22 0.05 115.64 108.10 1h9b s THR 394 Ca -0.10 -0.59 -0.22 0.00 -1.18 0.00 0.00 61.69 59.60 1h9b s THR 394 Cb -0.00 -3.46 0.04 0.00 1.34 0.00 0.00 72.50 70.42 1h9b s THR 394 CO 0.09 -0.30 0.72 0.00 -0.54 0.00 0.00 174.62 174.59 1h9b s ARG 395 N -4.49 1.52 -0.04 3.99 1.70 -0.07 -4.50 118.95 117.07 1h9b s ARG 395 Ca 0.48 -0.76 -0.01 0.00 -0.47 0.00 0.00 55.73 54.96 1h9b s ARG 395 Cb -0.10 0.57 -0.04 0.00 -0.57 0.00 0.00 34.95 34.82 1h9b s ARG 395 CO 0.37 -0.69 0.05 0.95 -1.08 0.00 0.00 175.30 174.90 1h9b s THR 396 N -3.76 4.59 0.10 4.99 -4.23 -1.26 -0.10 115.64 115.96 1h9b s THR 396 Ca 0.08 -0.34 0.06 0.00 -1.18 0.00 0.00 61.69 60.31 1h9b s THR 396 Cb -0.04 -3.03 -0.03 0.00 1.34 0.00 0.00 72.50 70.73 1h9b s THR 396 CO -0.00 0.45 -0.15 0.27 -0.54 0.00 0.00 174.62 174.65 1h9b s ILE 397 N -1.07 1.27 -0.26 2.99 -4.36 0.01 -4.93 121.20 114.84 1h9b s ILE 397 Ca 0.19 -1.51 -0.06 0.00 -0.26 0.00 0.00 60.65 59.01 1h9b s ILE 397 Cb -0.12 -1.32 -0.01 0.00 1.25 0.00 0.00 42.46 42.27 1h9b s ILE 397 CO 0.09 -0.29 0.04 -1.81 0.24 0.00 0.00 174.94 173.21 1h9b s ASP 398 N -2.06 4.88 -0.16 4.36 1.11 -1.26 -0.95 116.67 122.59 1h9b s ASP 398 Ca 0.04 -0.47 -0.19 0.00 0.18 0.00 0.00 52.55 52.10 1h9b s ASP 398 Cb -0.08 -1.85 -0.03 0.00 1.07 0.00 0.00 42.92 42.03 1h9b s ASP 398 CO 0.03 -0.09 0.55 -0.76 1.18 0.00 0.00 175.17 176.08 1h9b s LEU 399 N 1.52 4.20 0.13 1.23 1.43 0.27 -4.91 118.68 122.55 1h9b s LEU 399 Ca 0.05 0.81 0.06 0.00 -1.03 0.00 0.00 54.13 54.02 1h9b s LEU 399 Cb -0.16 -2.79 -0.04 0.00 0.03 0.00 0.00 46.19 43.23 1h9b s LEU 399 CO 0.01 -0.14 -0.14 -0.83 0.23 0.00 0.00 176.35 175.48 1h9b s GLY 400 N 0.97 1.10 -0.04 -3.19 0.00 -1.26 -0.46 107.32 104.44 1h9b s GLY 400 Ca 0.27 -1.34 -0.07 0.00 0.00 0.00 0.00 44.72 43.58 1h9b s GLY 400 CO 0.11 -1.41 0.17 0.86 0.00 0.00 0.00 173.10 172.83 1h9b s TRP 401 N -2.33 -0.12 0.03 1.90 -0.00 -0.21 -5.01 118.94 113.21 1h9b s TRP 401 Ca 0.11 0.27 0.01 0.00 -0.00 0.00 0.00 56.10 56.49 1h9b s TRP 401 Cb -0.04 0.03 -0.02 0.00 -0.00 0.00 0.00 33.47 33.44 1h9b s TRP 401 CO 0.03 -0.16 -0.05 0.99 -0.00 0.00 0.00 176.95 177.76 1h9b s THR 402 N -0.42 0.32 0.25 5.86 2.01 -1.26 -1.47 115.64 120.93 1h9b s THR 402 Ca -0.05 -1.07 -0.30 0.00 0.31 0.00 0.00 61.69 60.58 1h9b s THR 402 Cb -0.03 -0.52 -0.10 0.00 0.01 0.00 0.00 72.50 71.85 1h9b s THR 402 CO 0.01 -0.49 1.47 0.68 -0.69 0.00 0.00 174.62 175.60 1h9b s VAL 403 N -1.64 2.55 0.84 3.82 -7.23 -0.87 -5.00 120.40 112.87 1h9b s VAL 403 Ca -0.11 0.46 -0.12 0.00 -1.81 0.00 0.00 61.98 60.40 1h9b s VAL 403 Cb -0.08 -3.29 0.10 0.00 0.56 0.00 0.00 36.38 33.66 1h9b s VAL 403 CO -0.01 0.07 1.15 -0.94 -0.31 0.00 0.00 175.10 175.06 1h9b s SER 404 N 0.41 4.16 0.34 4.85 1.04 -1.26 -4.89 113.70 118.35 1h9b s SER 404 Ca 0.60 0.92 0.07 0.00 0.48 0.00 0.00 55.95 58.03 1h9b s SER 404 Cb -0.43 -1.49 0.61 0.00 0.10 0.00 0.00 66.02 64.81 1h9b s SER 404 CO 0.44 -2.14 1.81 0.44 0.98 0.00 0.00 173.24 174.77 1h9b h ASP 405 N -1.21 0.29 -0.53 7.02 3.32 -2.00 -2.11 116.42 121.20 1h9b h ASP 405 Ca -0.48 -0.08 -0.09 0.00 0.02 0.00 0.00 57.03 56.40 1h9b h ASP 405 Cb 1.32 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 1h9b h ASP 405 CO 0.64 0.53 -0.02 -0.33 -1.72 0.00 0.00 179.24 178.34 1h9b h GLU 406 N 0.27 0.98 0.16 3.56 4.39 -1.99 -2.23 114.58 119.71 1h9b h GLU 406 Ca 0.04 -0.30 -0.01 0.00 0.34 0.00 0.00 59.36 59.43 1h9b h GLU 406 Cb 0.56 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1h9b h GLU 406 CO 0.04 0.97 -0.08 -0.44 -1.16 0.00 0.00 179.01 178.34 1h9b h ASP 407 N 0.89 -0.18 -0.68 1.42 3.32 -1.76 -1.50 116.42 117.93 1h9b h ASP 407 Ca 0.16 0.01 0.10 0.00 0.02 0.00 0.00 57.03 57.32 1h9b h ASP 407 Cb 0.54 0.05 -0.08 0.00 0.22 0.00 0.00 39.33 40.07 1h9b h ASP 407 CO 0.03 -0.13 0.29 0.11 -1.72 0.00 0.00 179.24 177.82 1h9b h LYS 408 N -0.22 0.47 -0.79 3.56 1.57 -1.27 -1.06 116.57 118.83 1h9b h LYS 408 Ca -0.02 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1h9b h LYS 408 Cb 0.17 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.33 1h9b h LYS 408 CO 0.04 0.31 0.50 -0.22 -0.57 0.00 0.00 179.45 179.51 1h9b h LYS 409 N 0.49 1.06 -0.00 3.15 3.64 -1.00 -2.85 116.57 121.05 1h9b h LYS 409 Ca 0.35 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1h9b h LYS 409 Cb 0.43 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1h9b h LYS 409 CO -0.31 0.73 -0.28 0.09 -2.27 0.00 0.00 179.45 177.41 1h9b n ASN 410 N -4.50 0.31 -4.65 4.20 3.02 -0.60 -4.86 115.26 108.19 1h9b n ASN 410 Ca 0.08 0.01 -0.43 0.00 -0.03 0.00 0.00 54.58 54.21 1h9b n ASN 410 Cb 0.04 -0.06 -0.02 0.00 -0.61 0.00 0.00 39.78 39.12 1h9b n ASN 410 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1h9b s THR 411 N -2.96 3.90 0.42 3.41 2.01 -0.46 -4.98 115.64 116.98 1h9b s THR 411 Ca 0.14 1.07 -0.25 0.00 0.31 0.00 0.00 61.69 62.96 1h9b s THR 411 Cb 0.18 -3.75 -0.08 0.00 0.01 0.00 0.00 72.50 68.86 1h9b s THR 411 CO 0.62 -0.16 1.27 -2.84 -0.69 0.00 0.00 174.62 172.81 1h9b s PRO 412 N 3.96 3.90 0.59 4.92 0.02 -1.26 -4.97 135.00 142.16 1h9b s PRO 412 Ca 0.65 2.06 -0.19 0.00 0.02 0.00 0.00 61.00 63.55 1h9b s PRO 412 Cb -0.26 -2.67 -0.04 0.00 0.02 0.00 0.00 34.50 31.55 1h9b s PRO 412 CO 0.23 -0.52 1.19 -1.21 -0.33 0.00 0.00 177.00 176.37 1h9b s GLU 413 N -2.34 3.01 0.45 5.54 8.01 -1.26 -4.79 118.70 127.31 1h9b s GLU 413 Ca 0.59 1.77 0.20 0.00 0.01 0.00 0.00 54.97 57.54 1h9b s GLU 413 Cb -0.36 -1.94 1.17 0.00 -4.31 0.00 0.00 34.13 28.69 1h9b s GLU 413 CO 0.45 -1.16 1.88 -1.00 0.01 0.00 0.00 175.26 175.44 1h9b h PRO 414 N 0.88 0.30 -0.13 0.39 0.13 -1.91 -1.04 132.00 130.62 1h9b h PRO 414 Ca -0.50 -0.02 -0.14 0.00 -0.87 0.00 0.00 66.00 64.47 1h9b h PRO 414 Cb 1.29 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1h9b h PRO 414 CO 0.55 0.20 -0.53 1.88 -0.23 0.00 0.00 178.00 179.87 1h9b h TYR 415 N 0.31 0.47 -0.40 1.56 0.05 -1.90 -0.60 116.97 116.45 1h9b h TYR 415 Ca 0.44 -0.16 -0.05 0.00 0.05 0.00 0.00 58.73 59.01 1h9b h TYR 415 Cb 1.23 -0.09 -0.02 0.00 1.01 0.00 0.00 36.73 38.86 1h9b h TYR 415 CO -0.00 0.83 0.06 1.49 -1.05 0.00 0.00 178.16 179.48 1h9b h GLU 416 N 0.29 0.67 -0.19 4.88 4.81 -1.54 -1.10 114.58 122.40 1h9b h GLU 416 Ca 0.01 -0.18 0.02 0.00 -0.13 0.00 0.00 59.36 59.07 1h9b h GLU 416 Cb 1.03 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.31 1h9b h GLU 416 CO 0.09 0.72 0.06 -0.09 -0.73 0.00 0.00 179.01 179.06 1h9b h ARG 417 N 0.51 0.15 -0.33 1.92 9.65 -1.17 -0.92 114.38 124.20 1h9b h ARG 417 Ca 0.12 -0.01 -0.04 0.00 -1.10 0.00 0.00 59.98 58.95 1h9b h ARG 417 Cb 0.38 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.91 1h9b h ARG 417 CO 0.01 0.10 0.03 0.52 2.80 0.00 0.00 179.97 183.43 1h9b h MET 418 N 0.16 0.55 0.11 0.20 2.86 -0.93 -0.72 114.93 117.16 1h9b h MET 418 Ca 0.08 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1h9b h MET 418 Cb 0.05 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1h9b h MET 418 CO -0.09 0.66 -0.09 0.82 1.06 0.00 0.00 176.91 179.28 1h9b h ILE 419 N 0.37 0.81 -0.68 -1.22 1.08 -1.11 -1.89 117.51 114.86 1h9b h ILE 419 Ca 0.10 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.62 1h9b h ILE 419 Cb 0.39 0.81 -0.05 0.00 -3.07 0.00 0.00 36.82 34.89 1h9b h ILE 419 CO 0.01 0.00 0.40 -0.74 -0.69 0.00 0.00 178.15 177.13 1h9b h HIS 420 N -0.20 0.74 -0.54 1.37 2.76 -1.11 -1.52 115.15 116.64 1h9b h HIS 420 Ca -0.00 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.14 1h9b h HIS 420 Cb 0.19 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 28.89 1h9b h HIS 420 CO -0.10 0.38 0.12 -0.44 -1.30 0.00 0.00 177.93 176.59 1h9b h ASP 421 N 0.75 0.79 -0.36 3.26 5.19 -0.90 -1.74 116.42 123.40 1h9b h ASP 421 Ca 0.30 -0.15 -0.05 0.00 -0.62 0.00 0.00 57.03 56.51 1h9b h ASP 421 Cb 0.13 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.43 1h9b h ASP 421 CO -0.16 0.78 0.02 0.74 -3.12 0.00 0.00 179.24 177.50 1h9b h THR 422 N 0.81 1.25 -0.70 0.35 2.02 -0.69 0.16 112.91 116.11 1h9b h THR 422 Ca 0.18 -0.93 0.02 0.00 0.77 0.00 0.00 66.41 66.44 1h9b h THR 422 Cb 0.31 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 67.84 1h9b h THR 422 CO 0.00 0.31 0.47 0.24 0.37 0.00 0.00 175.52 176.91 1h9b h MET 423 N 0.44 0.88 0.00 6.66 2.86 -1.01 0.01 114.93 124.77 1h9b h MET 423 Ca 0.10 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1h9b h MET 423 Cb 0.42 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.89 1h9b h MET 423 CO 0.01 0.58 0.00 0.09 1.06 0.00 0.00 176.91 178.66 1h9b n ASN 424 N -4.44 0.69 -0.38 1.22 3.02 -0.68 -4.91 115.26 109.77 1h9b n ASN 424 Ca 0.08 0.57 -0.05 0.00 -0.03 0.00 0.00 54.58 55.16 1h9b n ASN 424 Cb 0.07 -0.76 -0.02 0.00 -0.61 0.00 0.00 39.78 38.47 1h9b n ASN 424 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h9b n GLY 425 N 1.21 0.70 3.49 7.41 0.00 0.11 -4.97 105.19 113.14 1h9b n GLY 425 Ca 0.05 -0.84 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 1h9b n GLY 425 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1h9b s ASP 426 N -2.94 6.27 0.00 1.61 2.15 0.34 -4.89 116.67 119.21 1h9b s ASP 426 Ca 0.00 -0.61 0.26 0.00 0.43 0.00 0.00 52.55 52.63 1h9b s ASP 426 Cb 0.00 -2.43 1.34 0.00 -0.30 0.00 0.00 42.92 41.53 1h9b s ASP 426 CO 0.00 -1.31 1.89 0.61 -0.17 0.00 0.00 175.17 176.18 1h9b n GLY 427 N 5.21 -0.57 0.27 2.66 0.00 -1.26 -4.43 105.19 107.07 1h9b n GLY 427 Ca -0.01 -0.27 0.03 0.00 0.00 0.00 0.00 46.02 45.78 1h9b n GLY 427 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1h9b h SER 428 N 0.89 -0.48 -0.90 1.61 0.02 -1.90 -1.75 113.55 111.04 1h9b h SER 428 Ca 0.00 0.20 -0.54 0.00 -0.84 0.00 0.00 61.79 60.61 1h9b h SER 428 Cb 0.19 0.39 -0.27 0.00 0.14 0.00 0.00 62.40 62.85 1h9b h SER 428 CO 0.00 -0.21 0.70 0.59 -1.14 0.00 0.00 176.83 176.77 1h9b n ASN 429 N -5.40 5.67 -3.96 3.07 3.02 -1.26 -4.91 115.26 111.50 1h9b n ASN 429 Ca 0.12 -3.55 -0.18 0.00 -0.03 0.00 0.00 54.58 50.93 1h9b n ASN 429 Cb 0.43 -0.91 -0.15 0.00 -0.61 0.00 0.00 39.78 38.54 1h9b n ASN 429 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1h9b s PHE 430 N -3.22 0.69 0.11 3.10 0.08 -0.66 -4.65 117.98 113.43 1h9b s PHE 430 Ca 0.55 -0.15 -0.31 0.00 0.12 0.00 0.00 56.93 57.14 1h9b s PHE 430 Cb 0.45 -0.51 -0.07 0.00 -0.57 0.00 0.00 43.02 42.32 1h9b s PHE 430 CO 0.04 -0.07 1.27 0.00 -0.10 0.00 0.00 175.22 176.36 1h9b s ALA 431 N 0.21 3.47 0.69 5.36 0.00 -1.26 -5.01 121.76 125.22 1h9b s ALA 431 Ca -0.03 0.97 -0.01 0.00 0.00 0.00 0.00 51.96 52.90 1h9b s ALA 431 Cb -0.07 -3.47 0.11 0.00 0.00 0.00 0.00 23.12 19.69 1h9b s ALA 431 CO -0.00 -0.49 0.96 0.16 0.00 0.00 0.00 175.76 176.39 1h9b s ASP 432 N 0.88 4.50 0.14 0.00 -4.77 -1.26 -4.64 116.67 111.52 1h9b s ASP 432 Ca 0.60 -0.29 -0.18 0.00 -3.30 0.00 0.00 52.55 49.37 1h9b s ASP 432 Cb -0.33 -0.17 0.02 0.00 -1.09 0.00 0.00 42.92 41.35 1h9b s ASP 432 CO 0.31 -1.75 1.71 -0.25 0.70 0.00 0.00 175.17 175.89 1h9b h TRP 433 N -0.44 -0.05 -0.66 2.11 -0.00 -1.96 -1.99 115.95 112.97 1h9b h TRP 433 Ca -0.37 0.02 0.07 0.00 -0.00 0.00 0.00 58.89 58.61 1h9b h TRP 433 Cb 1.27 0.06 -0.06 0.00 -0.00 0.00 0.00 29.16 30.44 1h9b h TRP 433 CO -0.09 -0.07 0.34 -0.97 -0.00 0.00 0.00 178.44 177.65 1h9b h ASN 434 N 0.06 0.46 -0.49 2.65 -0.73 -1.99 0.13 115.58 115.67 1h9b h ASN 434 Ca 0.13 0.05 -0.04 0.00 1.87 0.00 0.00 56.30 58.31 1h9b h ASN 434 Cb 0.18 -0.04 -0.02 0.00 0.27 0.00 0.00 38.32 38.72 1h9b h ASN 434 CO -0.24 0.29 0.14 1.23 -0.37 0.00 0.00 177.43 178.47 1h9b h GLY 435 N 0.60 0.83 1.22 1.57 0.00 -1.87 -1.97 103.07 103.44 1h9b h GLY 435 Ca 0.31 -0.51 -0.18 0.00 0.00 0.00 0.00 47.33 46.96 1h9b h GLY 435 CO -0.22 0.47 -0.53 -2.08 0.00 0.00 0.00 176.54 174.17 1h9b h VAL 436 N 0.66 1.28 -0.47 4.60 2.07 -0.91 -1.97 116.25 121.52 1h9b h VAL 436 Ca 0.16 -1.73 -0.05 0.00 0.82 0.00 0.00 66.70 65.90 1h9b h VAL 436 Cb 0.30 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1h9b h VAL 436 CO -0.00 0.56 0.11 0.77 0.02 0.00 0.00 177.57 179.03 1h9b h SER 437 N 0.64 0.71 -0.45 0.57 4.64 -0.67 -0.99 113.55 118.00 1h9b h SER 437 Ca 0.02 -0.24 -0.10 0.00 -0.47 0.00 0.00 61.79 61.00 1h9b h SER 437 Cb 1.13 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.01 1h9b h SER 437 CO 0.12 0.77 -0.10 0.40 -0.87 0.00 0.00 176.83 177.14 1h9b h ILE 438 N 0.63 1.26 -0.47 0.95 2.04 -1.39 -1.35 117.51 119.17 1h9b h ILE 438 Ca 0.15 -1.22 -0.02 0.00 1.00 0.00 0.00 64.86 64.76 1h9b h ILE 438 Cb 0.33 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1h9b h ILE 438 CO 0.00 0.43 0.19 0.00 0.00 0.00 0.00 178.15 178.77 1h9b h ALA 439 N 1.06 1.45 -0.15 1.87 0.00 -1.02 -2.01 119.26 120.46 1h9b h ALA 439 Ca 0.13 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1h9b h ALA 439 Cb 0.63 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1h9b h ALA 439 CO 0.04 0.42 -0.22 -1.49 0.00 0.00 0.00 179.25 178.01 1h9b h TRP 440 N 0.67 0.50 -0.64 0.00 -0.00 -0.73 -2.76 115.95 112.98 1h9b h TRP 440 Ca 0.16 -0.17 0.06 0.00 -0.00 0.00 0.00 58.89 58.94 1h9b h TRP 440 Cb 0.13 -0.10 -0.05 0.00 -0.00 0.00 0.00 29.16 29.14 1h9b h TRP 440 CO 0.01 0.84 0.35 0.87 -0.00 0.00 0.00 178.44 180.51 1h9b h LYS 441 N 0.02 0.63 -0.10 0.49 1.57 -0.95 0.17 116.57 118.40 1h9b h LYS 441 Ca 0.01 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1h9b h LYS 441 Cb 0.78 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1h9b h LYS 441 CO 0.05 0.42 0.05 0.35 -0.57 0.00 0.00 179.45 179.75 1h9b h PHE 442 N 0.65 0.09 -0.13 -1.35 3.57 -1.39 -2.61 116.94 115.77 1h9b h PHE 442 Ca 0.29 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.65 1h9b h PHE 442 Cb 0.18 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 1h9b h PHE 442 CO -0.08 0.05 -0.54 0.28 -2.23 0.00 0.00 178.31 175.79 1h9b h VAL 443 N 0.11 1.35 -0.72 1.41 2.07 -1.17 -3.13 116.25 116.16 1h9b h VAL 443 Ca 0.04 -1.81 0.01 0.00 0.82 0.00 0.00 66.70 65.76 1h9b h VAL 443 Cb 0.01 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 1h9b h VAL 443 CO -0.03 0.55 0.47 0.44 0.02 0.00 0.00 177.57 179.02 1h9b h ASP 444 N 0.29 0.81 -0.88 0.57 3.32 -0.49 0.39 116.42 120.43 1h9b h ASP 444 Ca 0.01 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.06 1h9b h ASP 444 Cb 1.04 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 40.35 1h9b h ASP 444 CO 0.09 0.58 0.58 0.00 -1.72 0.00 0.00 179.24 178.77 1h9b h ALA 445 N 1.27 1.41 0.03 3.45 0.00 -1.42 0.21 119.26 124.22 1h9b h ALA 445 Ca 0.27 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 1h9b h ALA 445 Cb -0.08 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.39 1h9b h ALA 445 CO -0.07 0.52 -0.54 0.82 0.00 0.00 0.00 179.25 179.98 1h9b h ILE 446 N 1.14 1.49 -0.41 0.00 2.04 -1.32 -3.21 117.51 117.24 1h9b h ILE 446 Ca 0.34 -2.16 0.00 0.00 1.00 0.00 0.00 64.86 64.04 1h9b h ILE 446 Cb -0.05 2.79 -0.02 0.00 -0.74 0.00 0.00 36.82 38.80 1h9b h ILE 446 CO -0.09 0.61 0.26 -1.28 0.00 0.00 0.00 178.15 177.66 1h9b h SER 447 N -0.28 0.47 -0.73 1.72 0.87 0.00 -1.78 113.55 113.82 1h9b h SER 447 Ca -0.08 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.46 1h9b h SER 447 Cb 1.30 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1h9b h SER 447 CO 0.11 0.35 0.42 0.00 -0.53 0.00 0.00 176.83 177.17 1h9b h ALA 448 N 1.74 0.93 -0.20 6.23 0.00 -0.63 -0.05 119.26 127.27 1h9b h ALA 448 Ca 0.15 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 1h9b h ALA 448 Cb -0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1h9b h ALA 448 CO -0.03 0.42 -0.43 0.28 0.00 0.00 0.00 179.25 179.50 1h9b h VAL 449 N 1.00 1.31 -0.11 0.00 2.07 -1.35 -2.46 116.25 116.70 1h9b h VAL 449 Ca 0.26 -1.60 -0.06 0.00 0.82 0.00 0.00 66.70 66.11 1h9b h VAL 449 Cb 0.00 1.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1h9b h VAL 449 CO -0.04 0.50 -0.18 1.88 0.02 0.00 0.00 177.57 179.74 1h9b h TYR 450 N 0.39 0.40 -0.17 1.57 0.05 -0.75 0.82 116.97 119.28 1h9b h TYR 450 Ca 0.03 -0.14 -0.09 0.00 0.05 0.00 0.00 58.73 58.59 1h9b h TYR 450 Cb 0.91 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 38.56 1h9b h TYR 450 CO 0.03 0.78 -0.29 1.79 -1.05 0.00 0.00 178.16 179.43 1h9b h THR 451 N -0.10 1.26 0.00 -2.88 1.35 -1.08 -1.18 112.91 110.28 1h9b h THR 451 Ca 0.01 -1.26 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 1h9b h THR 451 Cb 0.75 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 1h9b h THR 451 CO 0.04 0.39 0.00 0.00 -0.25 0.00 0.00 175.52 175.70 1h9b h ALA 452 N 1.42 1.00 -3.91 6.62 0.00 -1.40 -3.47 119.26 119.52 1h9b h ALA 452 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.67 1h9b h ALA 452 Cb 0.66 0.00 0.07 0.00 0.00 0.00 0.00 17.79 18.52 1h9b h ALA 452 CO 0.05 0.00 -0.45 -3.47 0.00 0.00 0.00 179.25 175.37 1h9b n ASP 453 N -2.59 -4.95 -2.29 0.00 2.03 0.08 -4.93 116.55 103.89 1h9b n ASP 453 Ca 0.04 -0.30 -0.33 0.00 0.52 0.00 0.00 54.79 54.72 1h9b n ASP 453 Cb 0.42 -3.66 0.09 0.00 -0.72 0.00 0.00 41.12 37.25 1h9b n ASP 453 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1h9b n LYS 454 N -3.40 2.65 -3.59 -0.67 5.02 -0.03 -4.87 118.16 113.27 1h9b n LYS 454 Ca -0.03 -3.28 -0.16 0.00 -2.02 0.00 0.00 58.31 52.81 1h9b n LYS 454 Cb 0.56 -2.27 -0.07 0.00 -0.02 0.00 0.00 35.03 33.23 1h9b n LYS 454 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1h9b s ALA 455 N -3.74 -1.60 0.73 7.82 0.00 -1.26 -4.92 121.76 118.79 1h9b s ALA 455 Ca 0.63 1.37 -0.11 0.00 0.00 0.00 0.00 51.96 53.86 1h9b s ALA 455 Cb 0.50 -0.35 0.03 0.00 0.00 0.00 0.00 23.12 23.30 1h9b s ALA 455 CO 0.01 -0.34 1.07 -1.25 0.00 0.00 0.00 175.76 175.26 1h9b s PRO 456 N -0.70 2.64 -0.31 0.00 0.04 -1.26 -5.00 135.00 130.41 1h9b s PRO 456 Ca -0.08 1.02 -0.02 0.00 0.04 0.00 0.00 61.00 61.96 1h9b s PRO 456 Cb -0.02 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.62 1h9b s PRO 456 CO 0.06 -1.33 0.03 -1.17 0.04 0.00 0.00 177.00 174.63 1h9b s LEU 457 N -5.70 4.06 1.06 -3.56 2.96 -1.26 -4.60 118.68 111.64 1h9b s LEU 457 Ca 0.59 -1.34 -0.17 0.00 -0.22 0.00 0.00 54.13 52.99 1h9b s LEU 457 Cb -0.15 -1.73 0.23 0.00 0.50 0.00 0.00 46.19 45.03 1h9b s LEU 457 CO 0.55 -0.29 1.19 -1.61 -1.32 0.00 0.00 176.35 174.87 1h9b s GLU 458 N 1.25 -0.10 0.02 1.98 0.41 0.28 -4.90 118.70 117.63 1h9b s GLU 458 Ca -0.04 -0.10 -0.04 0.00 -0.41 0.00 0.00 54.97 54.38 1h9b s GLU 458 Cb -0.20 -1.73 -0.01 0.00 -1.78 0.00 0.00 34.13 30.41 1h9b s GLU 458 CO -0.01 -2.96 0.07 -0.08 -0.49 0.00 0.00 175.26 171.79 1h9b s THR 459 N -3.35 0.11 -0.02 3.63 -1.32 -1.26 -1.85 115.64 111.57 1h9b s THR 459 Ca 0.70 -0.90 -0.13 0.00 -1.21 0.00 0.00 61.69 60.16 1h9b s THR 459 Cb -0.09 -0.53 0.02 0.00 -1.51 0.00 0.00 72.50 70.39 1h9b s THR 459 CO 0.55 -0.49 0.27 -0.72 -2.21 0.00 0.00 174.62 172.01 1h9b s TYR 460 N -1.80 -0.15 0.05 9.09 1.13 -1.16 -4.52 117.35 119.99 1h9b s TYR 460 Ca -0.12 0.25 -0.31 0.00 -1.41 0.00 0.00 57.07 55.49 1h9b s TYR 460 Cb -0.06 0.07 -0.06 0.00 -1.10 0.00 0.00 41.96 40.81 1h9b s TYR 460 CO -0.01 -0.34 1.31 0.21 -2.51 0.00 0.00 175.55 174.21 1h9b s LYS 461 N -1.14 4.35 0.22 -3.49 2.20 -1.26 -1.58 119.74 119.04 1h9b s LYS 461 Ca -0.12 1.90 -0.32 0.00 -0.36 0.00 0.00 55.97 57.07 1h9b s LYS 461 Cb -0.05 -3.40 -0.12 0.00 -1.51 0.00 0.00 37.83 32.74 1h9b s LYS 461 CO 0.03 -0.41 1.65 0.43 -0.36 0.00 0.00 175.35 176.69 1h9b n SER 462 N 4.45 3.69 0.00 1.43 7.64 -1.18 -1.73 113.62 127.91 1h9b n SER 462 Ca 0.11 1.09 0.00 0.00 1.01 0.00 0.00 58.87 61.08 1h9b n SER 462 Cb 0.44 -1.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.11 1h9b n SER 462 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1h9b n GLY 463 N 3.39 0.42 0.66 0.23 0.00 0.06 -4.30 105.19 105.66 1h9b n GLY 463 Ca 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.13 1h9b n GLY 463 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h9b n SER 464 N 0.00 0.22 -1.26 1.61 3.41 -0.71 -3.29 113.62 113.59 1h9b n SER 464 Ca 0.00 -1.19 0.08 0.00 -0.26 0.00 0.00 58.87 57.50 1h9b n SER 464 Cb 0.00 -0.11 0.30 0.00 -0.26 0.00 0.00 64.21 64.14 1h9b n SER 464 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1h9b n MET 465 N -1.33 3.59 0.00 4.33 2.81 -1.26 -0.44 117.12 124.83 1h9b n MET 465 Ca 0.03 -2.83 0.00 0.00 -1.81 0.00 0.00 57.70 53.09 1h9b n MET 465 Cb 0.10 -1.88 0.00 0.00 -0.71 0.00 0.00 33.22 30.73 1h9b n MET 465 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1h9b n GLY 466 N 0.29 1.79 3.80 3.03 0.00 -1.26 -4.99 105.19 107.84 1h9b n GLY 466 Ca 0.23 -2.19 -0.31 0.00 0.00 0.00 0.00 46.02 43.75 1h9b n GLY 466 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h9b s PRO 467 N -1.52 2.43 0.53 1.61 0.04 -1.26 -4.83 135.00 132.00 1h9b s PRO 467 Ca 0.00 0.90 0.26 0.00 0.04 0.00 0.00 61.00 62.20 1h9b s PRO 467 Cb 0.00 -1.94 1.50 0.00 0.04 0.00 0.00 34.50 34.10 1h9b s PRO 467 CO 0.00 -1.45 2.12 1.49 0.04 0.00 0.00 177.00 179.21 1h9b h GLU 468 N -0.97 0.00 0.00 4.56 4.81 -1.99 -1.33 114.58 119.66 1h9b h GLU 468 Ca -0.45 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1h9b h GLU 468 Cb 1.24 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.62 1h9b h GLU 468 CO 0.56 0.09 -0.01 0.00 -0.73 0.00 0.00 179.01 178.92 1h9b h ALA 469 N 1.91 1.20 -0.24 2.92 0.00 -1.96 -0.17 119.26 122.92 1h9b h ALA 469 Ca -0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1h9b h ALA 469 Cb 0.21 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1h9b h ALA 469 CO 0.01 0.01 -0.20 1.03 0.00 0.00 0.00 179.25 180.10 1h9b h SER 470 N 0.00 0.60 0.29 0.00 0.87 -1.61 -1.89 113.55 111.81 1h9b h SER 470 Ca -0.00 -0.46 -0.17 0.00 -1.23 0.00 0.00 61.79 59.94 1h9b h SER 470 Cb 0.06 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 1h9b h SER 470 CO 0.00 0.93 -0.68 0.44 -0.53 0.00 0.00 176.83 176.99 1h9b h ASP 471 N 0.28 0.41 -0.76 6.23 3.32 -1.33 -2.93 116.42 121.64 1h9b h ASP 471 Ca 0.04 -0.25 0.03 0.00 0.02 0.00 0.00 57.03 56.87 1h9b h ASP 471 Cb 0.74 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 40.13 1h9b h ASP 471 CO 0.05 0.97 0.50 0.50 -1.72 0.00 0.00 179.24 179.54 1h9b h LYS 472 N 0.25 0.91 -0.25 3.56 3.64 -0.99 -1.18 116.57 122.50 1h9b h LYS 472 Ca -0.02 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1h9b h LYS 472 Cb 1.23 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.81 1h9b h LYS 472 CO 0.11 0.60 0.07 1.25 -2.27 0.00 0.00 179.45 179.22 1h9b h LEU 473 N 0.94 0.07 -0.02 5.20 5.85 -1.14 -2.89 115.31 123.31 1h9b h LEU 473 Ca 0.30 0.03 -0.26 0.00 0.84 0.00 0.00 57.88 58.79 1h9b h LEU 473 Cb 0.04 0.03 0.02 0.00 0.37 0.00 0.00 40.66 41.12 1h9b h LEU 473 CO -0.09 0.07 -1.04 -0.07 -0.34 0.00 0.00 178.44 176.97 1h9b h LEU 474 N 0.18 0.85 -2.01 2.25 4.07 -1.51 -3.28 115.31 115.86 1h9b h LEU 474 Ca 0.11 -0.69 0.15 0.00 0.08 0.00 0.00 57.88 57.53 1h9b h LEU 474 Cb 0.09 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.55 1h9b h LEU 474 CO -0.13 1.49 0.40 0.00 -1.08 0.00 0.00 178.44 179.12 1h9b h ALA 475 N 0.45 2.42 0.00 1.53 0.00 -1.09 -1.07 119.26 121.51 1h9b h ALA 475 Ca -0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1h9b h ALA 475 Cb 1.69 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 1h9b h ALA 475 CO 0.20 -0.66 -0.01 0.00 0.00 0.00 0.00 179.25 178.78 1h9b h ALA 476 N 1.69 1.30 -0.19 0.00 0.00 -1.57 -1.93 119.26 118.55 1h9b h ALA 476 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1h9b h ALA 476 Cb 1.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1h9b h ALA 476 CO -0.00 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.35 1h9b n ASN 477 N -3.52 2.57 -0.33 0.00 3.02 -0.48 -4.97 115.26 111.54 1h9b n ASN 477 Ca -0.03 -2.06 -0.03 0.00 -0.03 0.00 0.00 54.58 52.43 1h9b n ASN 477 Cb 0.10 -0.15 -0.00 0.00 -0.61 0.00 0.00 39.78 39.11 1h9b n ASN 477 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h9b n GLY 478 N 0.01 0.28 3.67 7.41 0.00 -0.72 -5.05 105.19 110.79 1h9b n GLY 478 Ca 0.07 -0.78 -0.26 0.00 0.00 0.00 0.00 46.02 45.05 1h9b n GLY 478 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h9b s ASP 479 N -2.87 4.15 -0.05 1.61 1.01 -0.78 -4.98 116.67 114.76 1h9b s ASP 479 Ca 0.00 -1.20 -0.21 0.00 0.71 0.00 0.00 52.55 51.84 1h9b s ASP 479 Cb 0.00 -0.45 0.04 0.00 1.01 0.00 0.00 42.92 43.53 1h9b s ASP 479 CO 0.00 -0.47 0.47 0.00 0.21 0.00 0.00 175.17 175.38 1h9b s ALA 480 N -2.64 -1.22 0.18 5.23 0.00 -1.26 -2.89 121.76 119.17 1h9b s ALA 480 Ca 0.38 0.83 -0.31 0.00 0.00 0.00 0.00 51.96 52.86 1h9b s ALA 480 Cb 0.06 -0.06 -0.10 0.00 0.00 0.00 0.00 23.12 23.03 1h9b s ALA 480 CO 0.20 -0.30 1.52 -1.58 0.00 0.00 0.00 175.76 175.60 1h9b s TRP 481 N -1.10 3.06 -0.00 0.00 0.52 -1.26 -4.93 118.94 115.23 1h9b s TRP 481 Ca -0.11 0.76 -0.22 0.00 0.02 0.00 0.00 56.10 56.54 1h9b s TRP 481 Cb -0.03 -3.88 -0.19 0.00 -1.15 0.00 0.00 33.47 28.21 1h9b s TRP 481 CO 0.06 -3.15 1.19 0.28 0.02 0.00 0.00 176.95 175.34 1h9b h VAL 482 N 3.90 1.44 -3.62 4.03 2.07 -2.00 -3.42 116.25 118.65 1h9b h VAL 482 Ca -0.43 -1.65 -0.58 0.00 0.82 0.00 0.00 66.70 64.85 1h9b h VAL 482 Cb 1.21 2.33 -0.09 0.00 -1.52 0.00 0.00 31.29 33.22 1h9b h VAL 482 CO 0.87 0.47 0.71 0.12 0.02 0.00 0.00 177.57 179.76 1h9b s PHE 483 N -3.70 2.93 -2.00 1.57 5.36 -1.26 -4.91 117.98 115.97 1h9b s PHE 483 Ca -0.15 0.62 0.21 0.00 -0.96 0.00 0.00 56.93 56.65 1h9b s PHE 483 Cb 0.03 -4.04 0.59 0.00 -0.34 0.00 0.00 43.02 39.27 1h9b s PHE 483 CO 0.75 -1.08 1.49 1.63 -1.46 0.00 0.00 175.22 176.56 1h9b n LYS 484 N 7.28 2.55 0.00 10.12 5.02 -1.26 -5.11 118.16 136.76 1h9b n LYS 484 Ca 0.09 -2.41 0.00 0.00 -2.02 0.00 0.00 58.31 53.97 1h9b n LYS 484 Cb 0.48 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 1h9b n LYS 484 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29