#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h9b s LYS 5 N 0.00 3.14 -0.21 0.00 1.02 -1.26 -4.80 119.74 117.63 3h9b s LYS 5 Ca 0.00 0.98 -0.03 0.00 0.02 0.00 0.00 55.97 56.94 3h9b s LYS 5 Cb 0.00 -2.02 -0.00 0.00 -0.52 0.00 0.00 37.83 35.29 3h9b s LYS 5 CO 0.00 -0.94 -0.08 0.15 -0.92 0.00 0.00 175.35 173.56 3h9b s LYS 6 N -4.82 3.29 -0.07 1.68 1.02 -1.26 -0.69 119.74 118.89 3h9b s LYS 6 Ca 0.59 -0.67 0.02 0.00 0.02 0.00 0.00 55.97 55.92 3h9b s LYS 6 Cb -0.14 -2.89 0.02 0.00 -0.52 0.00 0.00 37.83 34.30 3h9b s LYS 6 CO 0.50 -0.18 -0.10 0.42 -0.92 0.00 0.00 175.35 175.07 3h9b s ILE 7 N 1.38 1.01 -0.23 2.17 1.01 0.63 -0.48 121.20 126.69 3h9b s ILE 7 Ca 0.05 -0.38 -0.03 0.00 0.00 0.00 0.00 60.65 60.28 3h9b s ILE 7 Cb -0.14 -0.95 0.00 0.00 0.01 0.00 0.00 42.46 41.38 3h9b s ILE 7 CO -0.05 0.33 -0.05 -0.22 0.00 0.00 0.00 174.94 174.95 3h9b s LEU 8 N 0.86 2.96 -0.05 2.97 0.20 0.22 -0.32 118.68 125.52 3h9b s LEU 8 Ca -0.11 -0.53 0.06 0.00 0.69 0.00 0.00 54.13 54.24 3h9b s LEU 8 Cb -0.15 -1.71 -0.02 0.00 -0.43 0.00 0.00 46.19 43.88 3h9b s LEU 8 CO 0.01 -0.05 -0.22 -0.69 -0.29 0.00 0.00 176.35 175.11 3h9b s VAL 9 N 1.44 2.39 0.23 1.68 1.01 0.35 -0.95 120.40 126.55 3h9b s VAL 9 Ca 0.04 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.10 3h9b s VAL 9 Cb -0.15 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 3h9b s VAL 9 CO -0.04 0.58 -0.02 0.42 0.00 0.00 0.00 175.10 176.04 3h9b s THR 10 N -0.43 1.11 0.20 3.92 -4.23 -0.45 -0.03 115.64 115.73 3h9b s THR 10 Ca 0.05 -2.05 0.08 0.00 -1.18 0.00 0.00 61.69 58.59 3h9b s THR 10 Cb -0.12 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.37 3h9b s THR 10 CO 0.01 -0.36 -0.16 0.00 -0.54 0.00 0.00 174.62 173.57 3h9b s ALA 12 N -2.70 3.58 0.01 0.00 0.00 -1.16 -4.78 121.76 116.70 3h9b s ALA 12 Ca 0.22 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 53.05 3h9b s ALA 12 Cb -0.02 -3.52 -0.06 0.00 0.00 0.00 0.00 23.12 19.51 3h9b s ALA 12 CO 0.08 -0.62 1.50 -1.54 0.00 0.00 0.00 175.76 175.19 3h9b s SER 13 N 0.57 6.76 0.42 0.00 1.04 -1.26 -4.94 113.70 116.30 3h9b s SER 13 Ca 0.60 2.23 -0.24 0.00 0.48 0.00 0.00 55.95 59.03 3h9b s SER 13 Cb -0.38 -2.56 -0.08 0.00 0.10 0.00 0.00 66.02 63.10 3h9b s SER 13 CO 0.37 -0.80 1.11 -2.84 0.98 0.00 0.00 173.24 172.07 3h9b s PRO 14 N 2.67 3.98 0.37 4.02 0.02 -1.25 -4.40 135.00 140.41 3h9b s PRO 14 Ca 0.68 1.66 -0.27 0.00 0.02 0.00 0.00 61.00 63.09 3h9b s PRO 14 Cb -0.34 -2.50 -0.09 0.00 0.02 0.00 0.00 34.50 31.59 3h9b s PRO 14 CO 0.28 -0.34 1.23 0.71 -0.33 0.00 0.00 177.00 178.55 3h9b s TYR 15 N -1.58 3.07 -1.05 6.54 4.12 -1.26 -0.77 117.35 126.41 3h9b s TYR 15 Ca 0.60 1.50 0.18 0.00 0.02 0.00 0.00 57.07 59.37 3h9b s TYR 15 Cb -0.26 -3.52 0.78 0.00 -1.52 0.00 0.00 41.96 37.44 3h9b s TYR 15 CO 0.32 -1.54 1.56 0.00 0.02 0.00 0.00 175.55 175.91 3h9b n ALA 16 N 0.43 1.83 -0.60 3.71 0.00 -0.47 -3.38 120.51 122.03 3h9b n ALA 16 Ca 0.02 -0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.47 3h9b n ALA 16 Cb 0.44 -1.29 0.35 0.00 0.00 0.00 0.00 19.45 18.96 3h9b n ALA 16 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3h9b n ASN 17 N -1.47 4.95 -3.73 0.00 6.94 -1.26 -4.76 115.26 115.92 3h9b n ASN 17 Ca 0.05 -2.67 -0.13 0.00 -0.02 0.00 0.00 54.58 51.81 3h9b n ASN 17 Cb 0.20 -0.62 -0.08 0.00 -2.36 0.00 0.00 39.78 36.92 3h9b n ASN 17 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 3h9b s GLY 18 N -0.76 -0.18 0.56 4.83 0.00 -1.22 -5.11 107.32 105.44 3h9b s GLY 18 Ca 0.49 0.24 -0.13 0.00 0.00 0.00 0.00 44.72 45.32 3h9b s GLY 18 CO 0.18 0.02 0.99 -0.56 0.00 0.00 0.00 173.10 173.73 3h9b s SER 19 N -1.74 6.40 0.15 1.64 0.01 -1.26 -4.85 113.70 114.05 3h9b s SER 19 Ca -0.09 1.45 -0.30 0.00 1.31 0.00 0.00 55.95 58.32 3h9b s SER 19 Cb -0.02 -2.47 -0.07 0.00 0.21 0.00 0.00 66.02 63.66 3h9b s SER 19 CO 0.00 -0.73 1.23 -0.63 0.41 0.00 0.00 173.24 173.53 3h9b s ILE 20 N -2.91 3.62 0.48 1.44 -1.09 -1.26 -4.98 121.20 116.49 3h9b s ILE 20 Ca 0.56 1.28 0.02 0.00 -2.23 0.00 0.00 60.65 60.28 3h9b s ILE 20 Cb -0.11 -3.82 -0.01 0.00 -1.58 0.00 0.00 42.46 36.95 3h9b s ILE 20 CO 0.44 0.16 0.07 0.00 -1.23 0.00 0.00 174.94 174.38 3h9b n HIS 21 N 3.06 0.72 0.04 3.97 1.44 -1.26 -0.94 115.22 122.25 3h9b n HIS 21 Ca 0.07 -2.65 0.20 0.00 -2.01 0.00 0.00 57.72 53.33 3h9b n HIS 21 Cb 0.45 -0.19 0.71 0.00 0.12 0.00 0.00 29.99 31.08 3h9b n HIS 21 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 3h9b h LEU 22 N 0.00 0.00 -0.08 2.39 3.38 -1.58 -1.74 115.31 117.68 3h9b h LEU 22 Ca -0.39 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 3h9b h LEU 22 Cb 1.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.04 3h9b h LEU 22 CO 0.63 0.00 0.01 1.23 0.09 0.00 0.00 178.44 180.40 3h9b h GLY 23 N 0.00 0.15 0.91 0.83 0.00 -1.92 -2.14 103.07 100.90 3h9b h GLY 23 Ca 0.22 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 47.47 3h9b h GLY 23 CO -0.00 0.09 0.36 0.45 0.00 0.00 0.00 176.54 177.44 3h9b h HIS 24 N -0.10 0.68 -0.42 5.60 3.86 -1.74 -2.74 115.15 120.29 3h9b h HIS 24 Ca 0.03 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.29 3h9b h HIS 24 Cb 0.28 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.51 3h9b h HIS 24 CO 0.02 0.40 0.28 0.52 0.86 0.00 0.00 177.93 180.01 3h9b h MET 25 N 0.73 0.43 -0.34 2.45 2.07 -1.20 -1.87 114.93 117.19 3h9b h MET 25 Ca 0.23 -0.03 0.01 0.00 -2.07 0.00 0.00 59.70 57.84 3h9b h MET 25 Cb -0.01 -0.10 -0.02 0.00 -1.87 0.00 0.00 31.60 29.60 3h9b h MET 25 CO -0.08 0.28 0.20 1.25 1.07 0.00 0.00 176.91 179.63 3h9b h LEU 26 N 0.44 0.33 -0.10 1.22 5.85 -1.07 0.40 115.31 122.39 3h9b h LEU 26 Ca 0.17 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 3h9b h LEU 26 Cb 0.15 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 3h9b h LEU 26 CO -0.04 0.24 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.21 3h9b h GLU 27 N 0.42 0.18 -0.18 1.25 4.81 -1.43 -1.05 114.58 118.57 3h9b h GLU 27 Ca 0.13 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.21 3h9b h GLU 27 Cb -0.01 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 3h9b h GLU 27 CO -0.06 0.45 -0.30 0.45 -0.73 0.00 0.00 179.01 178.83 3h9b h HIS 28 N -0.11 0.40 -0.16 0.92 3.86 -1.28 -1.62 115.15 117.17 3h9b h HIS 28 Ca 0.03 -0.09 -0.15 0.00 -1.16 0.00 0.00 60.37 59.00 3h9b h HIS 28 Cb 0.37 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.75 3h9b h HIS 28 CO 0.04 0.62 -0.48 0.82 0.86 0.00 0.00 177.93 179.79 3h9b h ILE 29 N 0.31 1.34 -0.37 2.45 2.04 -0.90 -0.97 117.51 121.41 3h9b h ILE 29 Ca 0.04 -1.74 0.03 0.00 1.00 0.00 0.00 64.86 64.19 3h9b h ILE 29 Cb 0.68 2.00 -0.03 0.00 -0.74 0.00 0.00 36.82 38.74 3h9b h ILE 29 CO 0.05 0.54 0.18 -0.61 0.00 0.00 0.00 178.15 178.31 3h9b h GLN 30 N 0.26 0.36 -0.59 2.37 4.15 -0.99 -0.97 115.11 119.70 3h9b h GLN 30 Ca -0.02 -0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.33 3h9b h GLN 30 Cb 1.10 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.69 3h9b h GLN 30 CO 0.10 0.24 0.16 0.00 -1.93 0.00 0.00 178.83 177.40 3h9b h ALA 31 N 1.20 0.78 -0.80 3.38 0.00 -1.29 -2.75 119.26 119.77 3h9b h ALA 31 Ca 0.16 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 3h9b h ALA 31 Cb 0.08 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 3h9b h ALA 31 CO -0.12 0.46 0.32 0.22 0.00 0.00 0.00 179.25 180.13 3h9b h ASP 32 N 0.85 1.11 -0.44 0.00 3.58 -0.69 0.77 116.42 121.59 3h9b h ASP 32 Ca 0.19 -0.17 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 3h9b h ASP 32 Cb 0.32 -0.29 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 3h9b h ASP 32 CO -0.00 0.98 0.25 0.58 -2.88 0.00 0.00 179.24 178.17 3h9b h VAL 33 N 1.17 1.15 -0.33 2.25 2.07 -1.10 0.10 116.25 121.56 3h9b h VAL 33 Ca 0.27 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 3h9b h VAL 33 Cb 0.22 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 3h9b h VAL 33 CO -0.02 0.16 0.13 -0.25 0.02 0.00 0.00 177.57 177.61 3h9b h TRP 34 N 0.57 0.50 -0.33 1.57 7.01 -1.17 -1.85 115.95 122.25 3h9b h TRP 34 Ca 0.16 -0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.12 3h9b h TRP 34 Cb 0.03 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 26.92 3h9b h TRP 34 CO -0.03 0.47 0.21 0.28 -2.79 0.00 0.00 178.44 176.59 3h9b h VAL 35 N 0.38 1.10 -0.55 2.65 2.07 -0.58 -0.91 116.25 120.41 3h9b h VAL 35 Ca 0.11 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 3h9b h VAL 35 Cb 0.18 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 3h9b h VAL 35 CO -0.01 0.10 0.20 0.03 0.02 0.00 0.00 177.57 177.90 3h9b h ARG 36 N 0.44 0.81 -0.38 1.57 3.08 -0.68 -1.01 114.38 118.22 3h9b h ARG 36 Ca 0.12 -0.13 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 3h9b h ARG 36 Cb -0.03 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 3h9b h ARG 36 CO -0.02 0.69 -0.02 -0.92 -1.07 0.00 0.00 179.97 178.63 3h9b h TYR 37 N 0.80 0.75 -0.94 3.04 5.03 -0.98 -1.37 116.97 123.29 3h9b h TYR 37 Ca 0.19 -0.14 -0.00 0.00 2.58 0.00 0.00 58.73 61.36 3h9b h TYR 37 Cb 0.20 -0.19 -0.05 0.00 1.55 0.00 0.00 36.73 38.24 3h9b h TYR 37 CO 0.01 0.78 0.59 1.96 -1.32 0.00 0.00 178.16 180.18 3h9b h GLN 38 N 0.50 1.27 -0.42 1.82 1.08 -0.70 -1.55 115.11 117.11 3h9b h GLN 38 Ca 0.11 -0.10 -0.08 0.00 -1.45 0.00 0.00 58.65 57.12 3h9b h GLN 38 Cb 0.50 -0.27 -0.02 0.00 -0.05 0.00 0.00 27.48 27.63 3h9b h GLN 38 CO 0.02 0.87 -0.09 0.00 -0.95 0.00 0.00 178.83 178.68 3h9b h ARG 39 N 1.29 0.73 0.00 1.46 3.08 -1.01 -2.28 114.38 117.66 3h9b h ARG 39 Ca 0.34 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 3h9b h ARG 39 Cb -0.09 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 3h9b h ARG 39 CO -0.07 0.80 -0.12 0.52 -1.07 0.00 0.00 179.97 180.03 3h9b h MET 40 N 0.67 0.00 -0.31 0.04 2.86 -0.27 -1.59 114.93 116.32 3h9b h MET 40 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3h9b h MET 40 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 3h9b h MET 40 CO 0.03 0.12 0.00 0.54 1.06 0.00 0.00 176.91 178.66 3h9b n ARG 41 N -3.83 1.78 -0.70 1.72 5.12 -0.84 -4.49 116.66 115.42 3h9b n ARG 41 Ca -0.02 -1.21 0.00 0.00 -1.93 0.00 0.00 57.85 54.69 3h9b n ARG 41 Cb 0.22 -1.29 0.00 0.00 -1.16 0.00 0.00 32.46 30.23 3h9b n ARG 41 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3h9b n GLY 42 N 1.06 0.66 3.88 -0.13 0.00 -0.60 -4.68 105.19 105.38 3h9b n GLY 42 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 3h9b n GLY 42 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h9b s HIS 43 N -2.12 3.59 -0.39 1.61 3.76 -1.13 -3.31 115.29 117.31 3h9b s HIS 43 Ca 0.00 1.16 -0.24 0.00 -0.15 0.00 0.00 55.06 55.83 3h9b s HIS 43 Cb 0.00 -2.60 0.02 0.00 1.11 0.00 0.00 32.58 31.11 3h9b s HIS 43 CO 0.00 -0.53 0.83 -2.00 -0.85 0.00 0.00 174.74 172.20 3h9b s GLU 44 N -4.92 3.69 -0.03 1.40 2.12 0.14 -4.64 118.70 116.46 3h9b s GLU 44 Ca 0.53 0.28 0.07 0.00 0.36 0.00 0.00 54.97 56.21 3h9b s GLU 44 Cb -0.11 -3.84 -0.02 0.00 0.26 0.00 0.00 34.13 30.42 3h9b s GLU 44 CO 0.49 -0.96 -0.25 0.08 -0.54 0.00 0.00 175.26 174.07 3h9b s VAL 45 N 3.30 2.13 -0.26 3.70 1.01 -1.26 -0.26 120.40 128.76 3h9b s VAL 45 Ca 0.33 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 61.24 3h9b s VAL 45 Cb -0.12 -1.75 0.08 0.00 0.00 0.00 0.00 36.38 34.59 3h9b s VAL 45 CO 0.19 0.58 0.01 0.20 0.00 0.00 0.00 175.10 176.09 3h9b s ASN 46 N -0.55 3.91 -0.44 3.32 0.01 0.56 -4.97 114.94 116.77 3h9b s ASN 46 Ca 0.08 -1.39 -0.19 0.00 -0.71 0.00 0.00 52.86 50.65 3h9b s ASN 46 Cb -0.11 -1.09 0.03 0.00 0.41 0.00 0.00 41.25 40.49 3h9b s ASN 46 CO -0.00 -0.31 0.56 0.12 -1.51 0.00 0.00 177.10 175.96 3h9b s PHE 47 N 1.44 3.11 -0.06 2.20 5.36 -1.26 -0.49 117.98 128.28 3h9b s PHE 47 Ca 0.01 -0.22 0.05 0.00 -0.96 0.00 0.00 56.93 55.81 3h9b s PHE 47 Cb -0.18 -3.18 -0.02 0.00 -0.34 0.00 0.00 43.02 39.30 3h9b s PHE 47 CO -0.11 -0.81 -0.21 0.42 -1.46 0.00 0.00 175.22 173.05 3h9b s ILE 48 N 2.53 2.47 0.29 3.12 -1.09 0.95 -0.17 121.20 129.30 3h9b s ILE 48 Ca 0.18 -0.92 -0.04 0.00 -2.23 0.00 0.00 60.65 57.63 3h9b s ILE 48 Cb -0.16 -1.93 0.02 0.00 -1.58 0.00 0.00 42.46 38.81 3h9b s ILE 48 CO 0.16 0.57 0.46 0.00 -1.23 0.00 0.00 174.94 174.90 3h9b s ALA 50 N -2.33 -2.00 -0.08 0.00 0.00 -1.26 -1.54 121.76 114.55 3h9b s ALA 50 Ca 0.20 0.45 -0.12 0.00 0.00 0.00 0.00 51.96 52.49 3h9b s ALA 50 Cb -0.02 0.48 -0.05 0.00 0.00 0.00 0.00 23.12 23.53 3h9b s ALA 50 CO 0.14 -1.05 0.30 0.34 0.00 0.00 0.00 175.76 175.50 3h9b s ASP 51 N -2.97 6.59 -0.63 0.00 2.15 -0.77 -3.76 116.67 117.28 3h9b s ASP 51 Ca 0.13 0.70 -0.22 0.00 0.43 0.00 0.00 52.55 53.59 3h9b s ASP 51 Cb 0.02 -2.18 0.07 0.00 -0.30 0.00 0.00 42.92 40.53 3h9b s ASP 51 CO -0.01 0.28 0.90 -0.62 -0.17 0.00 0.00 175.17 175.54 3h9b s ASP 52 N -0.59 6.19 0.00 -0.34 3.68 0.05 -1.42 116.67 124.24 3h9b s ASP 52 Ca 0.19 -1.01 0.19 0.00 2.13 0.00 0.00 52.55 54.05 3h9b s ASP 52 Cb -0.14 -2.39 0.37 0.00 -1.45 0.00 0.00 42.92 39.30 3h9b s ASP 52 CO 0.08 -1.34 1.30 0.00 0.13 0.00 0.00 175.17 175.35 3h9b n ALA 53 N 7.36 2.38 -2.20 3.66 0.00 -1.26 -1.36 120.51 129.08 3h9b n ALA 53 Ca -0.05 -0.99 -0.20 0.00 0.00 0.00 0.00 53.44 52.21 3h9b n ALA 53 Cb 0.45 -0.72 -0.02 0.00 0.00 0.00 0.00 19.45 19.15 3h9b n ALA 53 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3h9b s HIS 54 N -1.28 2.75 0.00 0.00 3.76 -1.26 -4.93 115.29 114.32 3h9b s HIS 54 Ca 0.33 -0.46 0.00 0.00 -0.15 0.00 0.00 55.06 54.78 3h9b s HIS 54 Cb 0.19 -2.18 0.00 0.00 1.11 0.00 0.00 32.58 31.70 3h9b s HIS 54 CO 0.26 -0.16 0.00 0.41 -0.85 0.00 0.00 174.74 174.41 3h9b n GLY 55 N -1.59 3.28 0.22 -2.22 0.00 -0.51 -4.73 105.19 99.63 3h9b n GLY 55 Ca 0.04 -1.96 -0.07 0.00 0.00 0.00 0.00 46.02 44.02 3h9b n GLY 55 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3h9b h THR 56 N 0.05 1.17 -0.89 2.61 2.02 -1.94 -1.80 112.91 114.12 3h9b h THR 56 Ca 0.00 -0.41 0.06 0.00 0.77 0.00 0.00 66.41 66.84 3h9b h THR 56 Cb 0.00 0.50 -0.06 0.00 -1.74 0.00 0.00 68.15 66.85 3h9b h THR 56 CO 0.00 0.18 0.56 -0.65 0.37 0.00 0.00 175.52 175.97 3h9b h PRO 57 N 0.69 0.98 -0.36 6.66 0.11 -1.99 -0.48 132.00 137.60 3h9b h PRO 57 Ca 0.18 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.14 3h9b h PRO 57 Cb 0.02 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 30.90 3h9b h PRO 57 CO -0.03 0.65 -0.15 0.82 -0.21 0.00 0.00 178.00 179.08 3h9b h ILE 58 N 1.01 1.28 -0.34 4.15 2.04 -1.80 -1.26 117.51 122.60 3h9b h ILE 58 Ca 0.39 -1.26 0.02 0.00 1.00 0.00 0.00 64.86 65.00 3h9b h ILE 58 Cb 0.17 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 3h9b h ILE 58 CO -0.17 0.42 0.19 -0.03 0.00 0.00 0.00 178.15 178.55 3h9b h MET 59 N 0.53 0.38 -0.54 2.37 4.05 -0.76 -1.90 114.93 119.06 3h9b h MET 59 Ca 0.08 -0.02 -0.11 0.00 -0.28 0.00 0.00 59.70 59.37 3h9b h MET 59 Cb 0.69 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.38 3h9b h MET 59 CO 0.05 0.25 -0.08 -0.07 0.23 0.00 0.00 176.91 177.29 3h9b h LEU 60 N 0.39 0.99 -0.62 3.39 3.38 -1.05 -2.47 115.31 119.33 3h9b h LEU 60 Ca 0.14 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 3h9b h LEU 60 Cb 0.02 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 3h9b h LEU 60 CO -0.07 1.09 0.32 0.50 0.09 0.00 0.00 178.44 180.37 3h9b h LYS 61 N 0.90 0.89 -0.67 1.13 3.64 -0.98 -1.36 116.57 120.11 3h9b h LYS 61 Ca 0.15 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 3h9b h LYS 61 Cb 0.63 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.26 3h9b h LYS 61 CO 0.04 0.69 0.30 0.00 -2.27 0.00 0.00 179.45 178.22 3h9b h ALA 62 N 1.14 0.87 -0.76 5.00 0.00 -1.24 -1.15 119.26 123.13 3h9b h ALA 62 Ca 0.22 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3h9b h ALA 62 Cb 0.08 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3h9b h ALA 62 CO -0.03 0.46 0.31 1.96 0.00 0.00 0.00 179.25 181.95 3h9b h GLN 63 N 0.94 1.12 -0.58 0.00 4.20 -1.10 -1.06 115.11 118.62 3h9b h GLN 63 Ca 0.23 -0.19 -0.06 0.00 0.06 0.00 0.00 58.65 58.69 3h9b h GLN 63 Cb 0.16 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 3h9b h GLN 63 CO -0.02 0.90 0.11 1.96 -0.67 0.00 0.00 178.83 181.11 3h9b h GLN 64 N 1.10 0.92 0.00 1.46 4.20 -0.79 -2.05 115.11 119.95 3h9b h GLN 64 Ca 0.25 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.75 3h9b h GLN 64 Cb 0.19 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.85 3h9b h GLN 64 CO -0.02 0.84 0.00 1.28 -0.67 0.00 0.00 178.83 180.26 3h9b n LEU 65 N -4.24 0.04 -0.80 1.46 4.77 -0.48 -4.91 117.00 112.83 3h9b n LEU 65 Ca 0.04 0.50 -0.08 0.00 -0.03 0.00 0.00 56.01 56.44 3h9b n LEU 65 Cb 0.26 -0.49 -0.02 0.00 -2.33 0.00 0.00 43.42 40.83 3h9b n LEU 65 CO 0.41 -0.06 -0.09 0.61 -1.33 0.00 0.00 177.39 176.93 3h9b n GLY 66 N 1.22 0.49 3.35 -0.72 0.00 -0.46 -5.03 105.19 104.04 3h9b n GLY 66 Ca 0.06 -0.60 -0.18 0.00 0.00 0.00 0.00 46.02 45.31 3h9b n GLY 66 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3h9b s ILE 67 N -2.36 1.29 0.57 -0.61 -4.36 -0.87 -5.04 121.20 109.82 3h9b s ILE 67 Ca 0.00 -2.08 -0.18 0.00 -0.26 0.00 0.00 60.65 58.13 3h9b s ILE 67 Cb 0.00 -2.26 -0.04 0.00 1.25 0.00 0.00 42.46 41.40 3h9b s ILE 67 CO 0.00 -0.41 1.10 0.42 0.24 0.00 0.00 174.94 176.28 3h9b s THR 68 N -3.25 3.41 0.39 8.37 -4.23 -1.26 -4.20 115.64 114.88 3h9b s THR 68 Ca 0.26 0.78 0.08 0.00 -1.18 0.00 0.00 61.69 61.63 3h9b s THR 68 Cb 0.04 -3.28 0.20 0.00 1.34 0.00 0.00 72.50 70.80 3h9b s THR 68 CO 0.08 -0.29 1.97 1.55 -0.54 0.00 0.00 174.62 177.39 3h9b h PRO 69 N 0.81 0.40 -0.59 3.99 0.13 -1.92 -1.77 132.00 133.06 3h9b h PRO 69 Ca -0.48 -0.06 0.01 0.00 -0.87 0.00 0.00 66.00 64.59 3h9b h PRO 69 Cb 1.24 -0.07 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 3h9b h PRO 69 CO 0.57 0.39 0.39 0.93 -0.23 0.00 0.00 178.00 180.04 3h9b h GLU 70 N 0.39 0.77 -0.27 0.86 3.07 -1.98 0.00 114.58 117.43 3h9b h GLU 70 Ca 0.09 -0.05 -0.04 0.00 -0.50 0.00 0.00 59.36 58.87 3h9b h GLU 70 Cb 0.19 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 3h9b h GLU 70 CO -0.00 0.51 0.03 0.37 -1.40 0.00 0.00 179.01 178.52 3h9b h GLN 71 N 0.79 0.46 -0.13 2.33 4.15 -1.74 -2.20 115.11 118.77 3h9b h GLN 71 Ca 0.21 -0.13 -0.00 0.00 0.77 0.00 0.00 58.65 59.50 3h9b h GLN 71 Cb -0.09 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 3h9b h GLN 71 CO -0.05 0.59 0.08 1.98 -1.93 0.00 0.00 178.83 179.50 3h9b h MET 72 N 0.26 0.17 0.00 1.69 4.05 -1.03 -1.91 114.93 118.16 3h9b h MET 72 Ca 0.08 -0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.43 3h9b h MET 72 Cb 0.36 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.12 3h9b h MET 72 CO 0.01 0.16 -0.26 -0.84 0.23 0.00 0.00 176.91 176.21 3h9b h ILE 73 N 0.14 0.93 -0.41 1.77 3.07 -1.02 -1.80 117.51 120.19 3h9b h ILE 73 Ca 0.05 -0.96 -0.12 0.00 1.55 0.00 0.00 64.86 65.37 3h9b h ILE 73 Cb 0.03 1.56 -0.01 0.00 -0.27 0.00 0.00 36.82 38.13 3h9b h ILE 73 CO -0.01 0.25 -0.23 1.23 -1.05 0.00 0.00 178.15 178.34 3h9b h GLY 74 N 1.11 0.95 1.00 0.16 0.00 -1.00 -0.25 103.07 105.04 3h9b h GLY 74 Ca -0.00 -0.88 -0.09 0.00 0.00 0.00 0.00 47.33 46.36 3h9b h GLY 74 CO 0.03 0.80 -0.08 0.83 0.00 0.00 0.00 176.54 178.12 3h9b h GLU 75 N 0.69 0.82 0.00 4.80 5.08 -0.92 -2.36 114.58 122.68 3h9b h GLU 75 Ca 0.09 -0.30 -0.12 0.00 -1.00 0.00 0.00 59.36 58.02 3h9b h GLU 75 Cb 0.80 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 3h9b h GLU 75 CO 0.07 0.92 -0.59 1.98 -1.00 0.00 0.00 179.01 180.38 3h9b h MET 76 N 0.65 0.00 -0.47 2.33 4.05 -1.29 -1.83 114.93 118.37 3h9b h MET 76 Ca 0.11 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.52 3h9b h MET 76 Cb 0.60 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.38 3h9b h MET 76 CO 0.04 0.59 0.25 1.03 0.23 0.00 0.00 176.91 179.05 3h9b h SER 77 N 0.00 0.60 -0.66 1.39 0.87 -0.86 0.34 113.55 115.23 3h9b h SER 77 Ca -0.01 -0.10 -0.07 0.00 -1.23 0.00 0.00 61.79 60.38 3h9b h SER 77 Cb 1.07 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.85 3h9b h SER 77 CO 0.08 0.53 0.14 1.56 -0.53 0.00 0.00 176.83 178.61 3h9b h GLN 78 N 0.62 1.06 -0.32 2.24 1.08 -1.20 -1.17 115.11 117.43 3h9b h GLN 78 Ca 0.17 -0.27 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 3h9b h GLN 78 Cb 0.07 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.35 3h9b h GLN 78 CO -0.03 0.96 0.15 1.49 -0.95 0.00 0.00 178.83 180.46 3h9b h GLU 79 N 0.98 0.45 -0.09 1.46 4.81 -0.94 -0.98 114.58 120.28 3h9b h GLU 79 Ca 0.20 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 3h9b h GLU 79 Cb 0.39 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 3h9b h GLU 79 CO 0.01 0.42 0.04 0.45 -0.73 0.00 0.00 179.01 179.19 3h9b h HIS 80 N 0.38 0.06 -0.14 0.92 3.86 -0.73 -1.98 115.15 117.53 3h9b h HIS 80 Ca 0.11 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.28 3h9b h HIS 80 Cb 0.12 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.56 3h9b h HIS 80 CO -0.02 0.04 -0.10 1.96 0.86 0.00 0.00 177.93 180.67 3h9b h GLN 81 N 0.09 0.21 -0.43 2.45 4.20 -1.10 -0.56 115.11 119.97 3h9b h GLN 81 Ca 0.04 -0.04 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 3h9b h GLN 81 Cb 0.02 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 3h9b h GLN 81 CO -0.04 0.32 -0.09 1.15 -0.67 0.00 0.00 178.83 179.50 3h9b h THR 82 N 0.20 1.27 -0.07 -0.54 2.02 -0.81 -0.55 112.91 114.42 3h9b h THR 82 Ca 0.04 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.03 3h9b h THR 82 Cb 0.31 1.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.88 3h9b h THR 82 CO 0.02 0.40 0.01 0.44 0.37 0.00 0.00 175.52 176.76 3h9b h ASP 83 N 0.64 0.12 -0.78 4.18 3.32 -0.79 -1.41 116.42 121.69 3h9b h ASP 83 Ca 0.11 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.88 3h9b h ASP 83 Cb 0.62 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.10 3h9b h ASP 83 CO 0.04 0.37 0.49 -0.26 -1.72 0.00 0.00 179.24 178.16 3h9b h PHE 84 N -0.14 1.01 -0.30 4.55 0.05 -1.09 -1.04 116.94 119.98 3h9b h PHE 84 Ca 0.02 0.01 -0.08 0.00 3.82 0.00 0.00 57.97 61.74 3h9b h PHE 84 Cb 0.31 -0.34 -0.02 0.00 2.00 0.00 0.00 35.95 37.90 3h9b h PHE 84 CO 0.02 0.66 -0.14 0.00 -0.18 0.00 0.00 178.31 178.68 3h9b h ALA 85 N 1.47 1.20 0.00 2.45 0.00 -0.98 -1.84 119.26 121.55 3h9b h ALA 85 Ca 0.28 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3h9b h ALA 85 Cb -0.07 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3h9b h ALA 85 CO -0.06 0.51 -0.10 0.78 0.00 0.00 0.00 179.25 180.39 3h9b h GLY 86 N 0.94 0.00 -2.52 0.00 0.00 -0.06 -1.00 103.07 100.44 3h9b h GLY 86 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3h9b h GLY 86 CO 0.03 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.26 3h9b n PHE 87 N -3.60 0.88 -3.68 5.60 3.01 -0.77 -4.61 117.46 114.29 3h9b n PHE 87 Ca -0.02 -0.47 -0.24 0.00 1.01 0.00 0.00 57.45 57.74 3h9b n PHE 87 Cb 0.22 -0.00 0.06 0.00 -0.01 0.00 0.00 39.48 39.74 3h9b n PHE 87 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3h9b n ASN 88 N 1.53 -3.88 -4.59 4.37 5.03 -0.38 -4.93 115.26 112.41 3h9b n ASN 88 Ca 0.23 -0.69 -0.43 0.00 0.87 0.00 0.00 54.58 54.56 3h9b n ASN 88 Cb 0.60 -4.51 -0.03 0.00 -1.02 0.00 0.00 39.78 34.82 3h9b n ASN 88 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3h9b s ILE 89 N -3.40 4.39 -0.35 2.41 -1.09 -0.77 -4.94 121.20 117.45 3h9b s ILE 89 Ca 0.36 1.09 -0.07 0.00 -2.23 0.00 0.00 60.65 59.80 3h9b s ILE 89 Cb -0.17 -4.48 -0.22 0.00 -1.58 0.00 0.00 42.46 36.01 3h9b s ILE 89 CO 0.78 -0.82 3.33 -1.54 -1.23 0.00 0.00 174.94 175.45 3h9b n SER 90 N 7.33 5.74 -4.75 3.58 3.41 -1.26 -4.73 113.62 122.93 3h9b n SER 90 Ca 0.09 -2.45 -0.39 0.00 -0.26 0.00 0.00 58.87 55.86 3h9b n SER 90 Cb 0.48 -1.38 0.03 0.00 -0.26 0.00 0.00 64.21 63.09 3h9b n SER 90 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3h9b n TYR 91 N 2.79 2.47 0.11 7.33 4.02 -1.26 -4.80 117.16 127.81 3h9b n TYR 91 Ca 0.49 0.43 0.09 0.00 -0.01 0.00 0.00 57.90 58.90 3h9b n TYR 91 Cb 0.72 -2.40 0.01 0.00 -0.02 0.00 0.00 39.34 37.64 3h9b n TYR 91 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 3h9b h ASP 92 N 1.75 0.00 -3.27 7.72 3.32 -0.94 -3.47 116.42 121.53 3h9b h ASP 92 Ca -0.51 0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.57 3h9b h ASP 92 Cb 1.29 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.61 3h9b h ASP 92 CO 0.58 0.12 0.22 0.21 -1.72 0.00 0.00 179.24 178.66 3h9b s ASN 93 N -5.57 -0.69 -0.25 6.45 2.47 -1.17 -5.01 114.94 111.16 3h9b s ASN 93 Ca 0.00 1.21 0.00 0.00 0.42 0.00 0.00 52.86 54.50 3h9b s ASN 93 Cb 0.09 1.26 0.07 0.00 -1.45 0.00 0.00 41.25 41.22 3h9b s ASN 93 CO 0.78 -0.20 0.01 -0.47 -3.72 0.00 0.00 177.10 173.49 3h9b s TYR 94 N 0.85 2.12 0.00 0.43 5.04 -1.26 -1.98 117.35 122.55 3h9b s TYR 94 Ca -0.04 -1.70 0.00 0.00 -2.44 0.00 0.00 57.07 52.89 3h9b s TYR 94 Cb -0.05 -1.64 0.00 0.00 0.35 0.00 0.00 41.96 40.63 3h9b s TYR 94 CO -0.09 -0.78 0.00 1.58 -1.34 0.00 0.00 175.55 174.91 3h9b n HIS 95 N 4.74 0.00 -3.89 4.97 -0.00 -0.59 -4.90 115.22 115.55 3h9b n HIS 95 Ca -0.08 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 57.99 3h9b n HIS 95 Cb 0.44 0.00 -0.11 0.00 -0.12 0.00 0.00 29.99 30.20 3h9b n HIS 95 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 3h9b s SER 96 N -0.09 0.04 0.41 0.26 0.15 -1.26 -1.85 113.70 111.36 3h9b s SER 96 Ca 0.00 -0.17 0.28 0.00 0.70 0.00 0.00 55.95 56.77 3h9b s SER 96 Cb 0.00 0.18 1.06 0.00 -1.71 0.00 0.00 66.02 65.55 3h9b s SER 96 CO 0.00 -0.27 1.83 0.71 1.20 0.00 0.00 173.24 176.71 3h9b h THR 97 N 4.55 0.00 -3.11 6.45 1.35 -1.56 -3.31 112.91 117.29 3h9b h THR 97 Ca -0.30 -0.48 -0.77 0.00 -0.55 0.00 0.00 66.41 64.31 3h9b h THR 97 Cb 1.20 1.39 -0.24 0.00 -1.73 0.00 0.00 68.15 68.77 3h9b h THR 97 CO 0.42 0.00 0.71 -2.28 -0.25 0.00 0.00 175.52 174.11 3h9b s HIS 98 N -3.44 3.92 0.13 4.73 5.65 -1.26 -4.69 115.29 120.33 3h9b s HIS 98 Ca 0.04 -2.37 -0.12 0.00 0.25 0.00 0.00 55.06 52.86 3h9b s HIS 98 Cb 0.09 -4.01 0.01 0.00 -1.18 0.00 0.00 32.58 27.49 3h9b s HIS 98 CO 0.52 -1.12 0.31 -1.54 -0.65 0.00 0.00 174.74 172.26 3h9b s SER 99 N 2.01 -0.04 0.30 9.88 1.04 -1.25 -5.04 113.70 120.59 3h9b s SER 99 Ca 0.33 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 56.18 3h9b s SER 99 Cb -0.08 0.43 0.47 0.00 0.10 0.00 0.00 66.02 66.95 3h9b s SER 99 CO -0.06 -0.85 1.76 -0.33 0.98 0.00 0.00 173.24 174.74 3h9b h GLU 100 N 2.52 0.45 -0.48 4.02 4.39 -1.92 -0.92 114.58 122.64 3h9b h GLU 100 Ca -0.33 -0.15 -0.02 0.00 0.34 0.00 0.00 59.36 59.20 3h9b h GLU 100 Cb 1.23 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.82 3h9b h GLU 100 CO 0.49 0.64 0.21 0.93 -1.16 0.00 0.00 179.01 180.12 3h9b h GLU 101 N 0.41 0.70 -0.07 2.33 3.07 -1.95 -1.06 114.58 118.01 3h9b h GLU 101 Ca 0.07 -0.12 -0.15 0.00 -0.50 0.00 0.00 59.36 58.66 3h9b h GLU 101 Cb 0.60 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 3h9b h GLU 101 CO 0.04 0.61 -0.62 -0.97 -1.40 0.00 0.00 179.01 176.67 3h9b h ASN 102 N 0.63 0.30 -0.21 1.42 -1.24 -1.79 -1.60 115.58 113.08 3h9b h ASN 102 Ca 0.16 -0.18 -0.01 0.00 0.71 0.00 0.00 56.30 56.99 3h9b h ASN 102 Cb 0.16 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.11 3h9b h ASN 102 CO -0.02 0.85 0.10 -0.09 -1.29 0.00 0.00 177.43 176.98 3h9b h ARG 103 N 0.19 0.31 -0.45 6.67 2.43 -0.86 0.16 114.38 122.84 3h9b h ARG 103 Ca -0.01 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.04 3h9b h ARG 103 Cb 1.14 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.62 3h9b h ARG 103 CO 0.10 0.35 0.00 1.96 -1.51 0.00 0.00 179.97 180.87 3h9b h GLN 104 N 0.21 0.79 -0.23 0.20 4.20 -1.14 -0.97 115.11 118.16 3h9b h GLN 104 Ca 0.07 -0.25 -0.13 0.00 0.06 0.00 0.00 58.65 58.40 3h9b h GLN 104 Cb 0.14 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 3h9b h GLN 104 CO -0.01 0.85 -0.40 -0.07 -0.67 0.00 0.00 178.83 178.53 3h9b h LEU 105 N 0.63 0.58 -0.35 1.46 3.38 -1.20 0.01 115.31 119.82 3h9b h LEU 105 Ca 0.13 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 3h9b h LEU 105 Cb 0.50 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3h9b h LEU 105 CO 0.02 0.91 -0.04 0.28 0.09 0.00 0.00 178.44 179.70 3h9b h SER 106 N 0.45 0.64 -0.48 -0.43 0.02 -0.55 -0.33 113.55 112.86 3h9b h SER 106 Ca 0.04 -0.34 -0.08 0.00 -0.84 0.00 0.00 61.79 60.57 3h9b h SER 106 Cb 0.90 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 3h9b h SER 106 CO 0.08 0.82 0.01 -0.33 -1.14 0.00 0.00 176.83 176.27 3h9b h GLU 107 N 0.43 0.89 0.06 3.45 5.08 -1.06 -1.34 114.58 122.10 3h9b h GLU 107 Ca 0.09 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3h9b h GLU 107 Cb 0.52 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3h9b h GLU 107 CO 0.03 0.88 -0.03 1.25 -1.00 0.00 0.00 179.01 180.14 3h9b h LEU 108 N 0.83 -0.06 -0.54 1.33 5.85 -0.78 -0.36 115.31 121.58 3h9b h LEU 108 Ca 0.16 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 3h9b h LEU 108 Cb 0.48 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 3h9b h LEU 108 CO 0.02 0.11 0.25 0.40 -0.34 0.00 0.00 178.44 178.89 3h9b h ILE 109 N -0.24 1.20 -0.45 4.05 2.04 -0.98 -1.07 117.51 122.06 3h9b h ILE 109 Ca -0.01 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3h9b h ILE 109 Cb 0.21 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 3h9b h ILE 109 CO 0.01 0.23 0.28 0.22 0.00 0.00 0.00 178.15 178.90 3h9b h TYR 110 N 0.73 0.58 -0.90 1.37 3.20 -1.18 -0.29 116.97 120.47 3h9b h TYR 110 Ca 0.18 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.06 3h9b h TYR 110 Cb 0.13 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.16 3h9b h TYR 110 CO -0.00 0.39 0.57 0.66 -1.64 0.00 0.00 178.16 178.14 3h9b h SER 111 N 0.60 1.07 -0.44 -2.11 4.64 -0.72 0.59 113.55 117.18 3h9b h SER 111 Ca 0.16 -0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 61.30 3h9b h SER 111 Cb -0.03 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.78 3h9b h SER 111 CO -0.03 0.80 -0.23 0.03 -0.87 0.00 0.00 176.83 176.53 3h9b h ARG 112 N 1.24 0.93 -0.74 4.77 3.08 -0.83 -1.05 114.38 121.78 3h9b h ARG 112 Ca 0.33 -0.41 -0.06 0.00 0.07 0.00 0.00 59.98 59.91 3h9b h ARG 112 Cb -0.09 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 3h9b h ARG 112 CO -0.07 1.07 0.24 -0.07 -1.07 0.00 0.00 179.97 180.08 3h9b h LEU 113 N 0.77 1.08 -0.24 3.04 3.38 -0.63 -1.31 115.31 121.40 3h9b h LEU 113 Ca 0.10 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 3h9b h LEU 113 Cb 0.80 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3h9b h LEU 113 CO 0.07 0.99 -0.01 0.50 0.09 0.00 0.00 178.44 180.08 3h9b h LYS 114 N 1.10 0.43 -0.08 1.13 3.64 -0.71 0.15 116.57 122.23 3h9b h LYS 114 Ca 0.24 -0.14 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 3h9b h LYS 114 Cb 0.30 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3h9b h LYS 114 CO -0.01 0.62 -0.16 1.49 -2.27 0.00 0.00 179.45 179.11 3h9b h GLU 115 N 0.19 0.13 -0.06 1.90 4.81 -1.05 -1.92 114.58 118.58 3h9b h GLU 115 Ca 0.07 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3h9b h GLU 115 Cb 0.43 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.79 3h9b h GLU 115 CO 0.01 0.30 0.00 0.09 -0.73 0.00 0.00 179.01 178.69 3h9b n ASN 116 N -4.28 0.65 -0.02 1.04 3.02 -0.51 -4.91 115.26 110.25 3h9b n ASN 116 Ca -0.01 -1.53 -0.00 0.00 -0.03 0.00 0.00 54.58 53.00 3h9b n ASN 116 Cb 0.27 -0.04 -0.00 0.00 -0.61 0.00 0.00 39.78 39.40 3h9b n ASN 116 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h9b n GLY 117 N 0.92 0.39 1.28 7.41 0.00 -0.72 -4.96 105.19 109.52 3h9b n GLY 117 Ca 0.15 -1.06 0.12 0.00 0.00 0.00 0.00 46.02 45.23 3h9b n GLY 117 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h9b n PHE 118 N -3.15 0.81 -4.57 1.61 0.99 0.02 -4.88 117.46 108.28 3h9b n PHE 118 Ca -0.00 -0.40 -0.33 0.00 -0.00 0.00 0.00 57.45 56.71 3h9b n PHE 118 Cb 0.08 0.00 -0.15 0.00 -1.00 0.00 0.00 39.48 38.41 3h9b n PHE 118 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 3h9b s ILE 119 N -1.19 2.55 0.16 4.37 -1.09 -1.25 -0.58 121.20 124.17 3h9b s ILE 119 Ca 0.45 -0.81 0.08 0.00 -2.23 0.00 0.00 60.65 58.15 3h9b s ILE 119 Cb 0.25 -2.07 -0.04 0.00 -1.58 0.00 0.00 42.46 39.02 3h9b s ILE 119 CO 0.33 0.52 -0.08 -0.54 -1.23 0.00 0.00 174.94 173.94 3h9b s LYS 120 N 0.79 2.13 -0.12 2.79 -0.14 0.61 -4.91 119.74 120.89 3h9b s LYS 120 Ca -0.06 -1.19 0.01 0.00 -1.36 0.00 0.00 55.97 53.37 3h9b s LYS 120 Cb -0.15 -2.22 -0.01 0.00 -1.68 0.00 0.00 37.83 33.76 3h9b s LYS 120 CO -0.00 0.45 -0.16 -0.80 -0.76 0.00 0.00 175.35 174.08 3h9b s ASN 121 N -2.71 3.74 -0.16 2.83 0.02 -1.26 0.14 114.94 117.53 3h9b s ASN 121 Ca 0.24 -0.39 -0.20 0.00 -1.02 0.00 0.00 52.86 51.49 3h9b s ASN 121 Cb -0.09 -1.51 0.05 0.00 0.02 0.00 0.00 41.25 39.71 3h9b s ASN 121 CO 0.15 0.17 0.54 -0.60 0.02 0.00 0.00 177.10 177.38 3h9b s ARG 122 N 0.30 0.70 0.03 -0.60 3.52 -0.58 -4.99 118.95 117.32 3h9b s ARG 122 Ca -0.12 0.59 -0.21 0.00 -0.13 0.00 0.00 55.73 55.86 3h9b s ARG 122 Cb -0.16 0.34 -0.06 0.00 -1.56 0.00 0.00 34.95 33.50 3h9b s ARG 122 CO 0.06 -0.12 0.60 0.99 -0.81 0.00 0.00 175.30 176.03 3h9b s THR 123 N -0.08 4.83 0.27 4.11 2.01 -1.26 -0.73 115.64 124.78 3h9b s THR 123 Ca -0.03 1.27 0.05 0.00 0.31 0.00 0.00 61.69 63.30 3h9b s THR 123 Cb -0.03 -3.94 -0.06 0.00 0.01 0.00 0.00 72.50 68.48 3h9b s THR 123 CO 0.02 0.46 -0.03 0.27 -0.69 0.00 0.00 174.62 174.65 3h9b s ILE 124 N -0.47 1.42 -0.11 1.82 -4.36 -0.39 -4.94 121.20 114.17 3h9b s ILE 124 Ca 0.31 -2.09 -0.00 0.00 -0.26 0.00 0.00 60.65 58.61 3h9b s ILE 124 Cb -0.19 -2.43 -0.02 0.00 1.25 0.00 0.00 42.46 41.07 3h9b s ILE 124 CO 0.18 -0.29 -0.11 -0.55 0.24 0.00 0.00 174.94 174.41 3h9b s SER 125 N -3.40 4.24 0.01 4.36 0.15 -1.26 -1.23 113.70 116.57 3h9b s SER 125 Ca 0.29 -0.23 -0.10 0.00 0.70 0.00 0.00 55.95 56.61 3h9b s SER 125 Cb 0.05 -1.46 0.01 0.00 -1.71 0.00 0.00 66.02 62.90 3h9b s SER 125 CO 0.11 0.22 0.21 -1.58 1.20 0.00 0.00 173.24 173.40 3h9b s GLN 126 N 0.03 0.61 0.31 5.44 0.74 -0.65 -4.92 119.66 121.23 3h9b s GLN 126 Ca -0.03 -0.43 -0.29 0.00 0.05 0.00 0.00 55.36 54.65 3h9b s GLN 126 Cb -0.14 0.26 -0.11 0.00 1.10 0.00 0.00 33.01 34.12 3h9b s GLN 126 CO 0.04 -0.17 1.54 -0.51 -0.55 0.00 0.00 175.29 175.64 3h9b s LEU 127 N -1.63 4.34 -0.02 3.68 1.43 -1.26 -1.39 118.68 123.83 3h9b s LEU 127 Ca -0.11 2.95 0.02 0.00 -1.03 0.00 0.00 54.13 55.95 3h9b s LEU 127 Cb -0.05 -3.64 0.01 0.00 0.03 0.00 0.00 46.19 42.54 3h9b s LEU 127 CO 0.00 -0.87 -0.05 -0.47 0.23 0.00 0.00 176.35 175.19 3h9b s TYR 128 N -0.36 0.61 -0.50 0.29 5.04 0.11 -1.41 117.35 121.13 3h9b s TYR 128 Ca 0.59 -0.13 -0.21 0.00 -2.44 0.00 0.00 57.07 54.88 3h9b s TYR 128 Cb -0.47 -0.48 0.04 0.00 0.35 0.00 0.00 41.96 41.41 3h9b s TYR 128 CO 0.52 -0.09 0.71 0.34 -1.34 0.00 0.00 175.55 175.69 3h9b s ASP 129 N 0.35 6.28 0.47 4.32 3.68 0.10 -1.18 116.67 130.69 3h9b s ASP 129 Ca -0.04 -0.62 0.31 0.00 2.13 0.00 0.00 52.55 54.32 3h9b s ASP 129 Cb -0.08 -2.33 1.18 0.00 -1.45 0.00 0.00 42.92 40.23 3h9b s ASP 129 CO -0.00 -0.94 1.89 1.55 0.13 0.00 0.00 175.17 177.80 3h9b h PRO 130 N 9.04 0.00 0.00 4.34 0.13 -1.85 0.20 132.00 143.86 3h9b h PRO 130 Ca -0.27 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.81 3h9b h PRO 130 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3h9b h PRO 130 CO 0.97 0.00 -0.40 0.93 -0.23 0.00 0.00 178.00 179.28 3h9b h GLU 131 N 0.00 0.00 -0.49 0.86 5.08 -1.92 -3.35 114.58 114.77 3h9b h GLU 131 Ca 0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 3h9b h GLU 131 Cb 0.54 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 3h9b h GLU 131 CO 0.00 0.51 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.27 3h9b h LYS 132 N -1.00 0.83 -1.46 2.33 1.63 -1.99 -3.47 116.57 113.44 3h9b h LYS 132 Ca -0.08 -0.24 0.00 0.00 -0.85 0.00 0.00 60.65 59.48 3h9b h LYS 132 Cb 0.69 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.23 3h9b h LYS 132 CO -0.05 0.85 0.00 0.41 -3.45 0.00 0.00 179.45 177.21 3h9b n GLY 133 N -0.55 0.49 3.42 5.01 0.00 0.66 -5.09 105.19 109.14 3h9b n GLY 133 Ca 0.02 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.54 3h9b n GLY 133 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3h9b s MET 134 N -2.52 0.93 0.43 1.61 0.23 -0.85 -4.54 119.30 114.59 3h9b s MET 134 Ca 0.00 0.07 -0.23 0.00 -1.03 0.00 0.00 55.69 54.50 3h9b s MET 134 Cb 0.00 0.43 -0.08 0.00 -1.53 0.00 0.00 34.83 33.65 3h9b s MET 134 CO 0.00 -0.29 1.09 -0.06 -2.03 0.00 0.00 175.02 173.74 3h9b s PHE 135 N -1.33 3.08 -0.22 3.16 0.08 -1.26 -0.72 117.98 120.77 3h9b s PHE 135 Ca -0.11 1.59 -0.05 0.00 0.12 0.00 0.00 56.93 58.48 3h9b s PHE 135 Cb -0.02 -3.22 -0.02 0.00 -0.57 0.00 0.00 43.02 39.19 3h9b s PHE 135 CO 0.07 -1.00 0.01 -0.51 -0.10 0.00 0.00 175.22 173.69 3h9b s LEU 136 N -2.88 3.21 0.81 -0.37 1.43 -0.50 -4.87 118.68 115.51 3h9b s LEU 136 Ca 0.61 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 53.34 3h9b s LEU 136 Cb -0.24 -1.83 0.08 0.00 0.03 0.00 0.00 46.19 44.23 3h9b s LEU 136 CO 0.30 0.01 1.12 -2.84 0.23 0.00 0.00 176.35 175.16 3h9b s PRO 137 N 1.33 1.87 0.25 1.29 0.02 -1.26 -4.68 135.00 133.82 3h9b s PRO 137 Ca 0.04 1.34 -0.04 0.00 0.02 0.00 0.00 61.00 62.36 3h9b s PRO 137 Cb -0.15 -1.84 0.50 0.00 0.02 0.00 0.00 34.50 33.04 3h9b s PRO 137 CO 0.01 -1.96 1.66 -0.44 -0.33 0.00 0.00 177.00 175.93 3h9b h ASP 138 N -1.27 -0.13 0.26 2.53 3.32 -1.98 -0.66 116.42 118.49 3h9b h ASP 138 Ca -0.44 0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.79 3h9b h ASP 138 Cb 1.25 0.27 0.00 0.00 0.22 0.00 0.00 39.33 41.07 3h9b h ASP 138 CO 0.48 -0.12 0.00 -2.11 -1.72 0.00 0.00 179.24 175.77 3h9b n ARG 139 N -5.25 0.19 -0.64 3.56 1.85 -1.26 -2.14 116.66 112.97 3h9b n ARG 139 Ca 0.15 0.16 0.08 0.00 -1.00 0.00 0.00 57.85 57.25 3h9b n ARG 139 Cb 0.51 -1.50 0.34 0.00 -1.05 0.00 0.00 32.46 30.76 3h9b n ARG 139 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3h9b n PHE 140 N -1.29 1.48 -5.15 2.89 3.72 -0.25 -4.60 117.46 114.25 3h9b n PHE 140 Ca 0.06 -0.70 -0.31 0.00 -0.05 0.00 0.00 57.45 56.45 3h9b n PHE 140 Cb 0.11 -0.33 -0.17 0.00 -0.94 0.00 0.00 39.48 38.15 3h9b n PHE 140 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3h9b s VAL 141 N -2.31 1.92 0.14 -4.37 1.01 -0.91 -0.78 120.40 115.10 3h9b s VAL 141 Ca 0.48 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.53 3h9b s VAL 141 Cb 0.35 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 3h9b s VAL 141 CO 0.17 0.53 -0.09 -1.59 0.00 0.00 0.00 175.10 174.13 3h9b s LYS 142 N 0.16 1.01 0.00 2.72 -2.85 -0.42 -1.12 119.74 119.25 3h9b s LYS 142 Ca -0.12 -1.43 0.00 0.00 -1.00 0.00 0.00 55.97 53.42 3h9b s LYS 142 Cb -0.16 -0.50 0.00 0.00 -2.06 0.00 0.00 37.83 35.12 3h9b s LYS 142 CO 0.06 0.04 0.00 0.41 0.10 0.00 0.00 175.35 175.96 3h9b n GLY 143 N -0.16 -0.62 3.75 0.59 0.00 0.08 0.28 105.19 109.11 3h9b n GLY 143 Ca -0.10 -0.72 -0.36 0.00 0.00 0.00 0.00 46.02 44.84 3h9b n GLY 143 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h9b s THR 144 N -3.00 5.33 0.13 2.61 2.01 -0.12 -0.24 115.64 122.37 3h9b s THR 144 Ca 0.00 0.45 -0.33 0.00 0.31 0.00 0.00 61.69 62.12 3h9b s THR 144 Cb 0.00 -3.58 -0.12 0.00 0.01 0.00 0.00 72.50 68.81 3h9b s THR 144 CO 0.00 0.43 1.71 0.00 -0.69 0.00 0.00 174.62 176.07 3h9b h PRO 146 N 7.12 0.00 0.00 0.00 0.13 -1.92 -0.91 132.00 136.42 3h9b h PRO 146 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3h9b h PRO 146 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3h9b h PRO 146 CO 0.93 0.03 -0.29 0.87 -0.23 0.00 0.00 178.00 179.31 3h9b h LYS 147 N 0.00 0.00 -0.00 0.86 1.79 -1.94 -3.41 116.57 113.87 3h9b h LYS 147 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3h9b h LYS 147 Cb 0.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.02 3h9b h LYS 147 CO 0.00 0.00 -0.58 0.00 -1.08 0.00 0.00 179.45 177.80 3h9b n LYS 149 N -1.37 -0.64 -2.43 0.00 4.76 -0.35 -5.00 118.16 113.14 3h9b n LYS 149 Ca 0.06 0.81 -0.41 0.00 -2.87 0.00 0.00 58.31 55.90 3h9b n LYS 149 Cb 0.34 -4.70 -0.04 0.00 -1.84 0.00 0.00 35.03 28.79 3h9b n LYS 149 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 3h9b s SER 150 N -2.89 7.16 0.76 4.39 0.01 -1.26 -4.66 113.70 117.21 3h9b s SER 150 Ca 0.00 2.19 -0.11 0.00 1.31 0.00 0.00 55.95 59.34 3h9b s SER 150 Cb 0.00 -2.61 0.06 0.00 0.21 0.00 0.00 66.02 63.68 3h9b s SER 150 CO 0.00 -0.30 1.13 -2.16 0.41 0.00 0.00 173.24 172.32 3h9b s PRO 151 N -0.41 2.28 -1.45 12.44 0.04 -1.26 -0.87 135.00 145.77 3h9b s PRO 151 Ca 0.51 0.17 -0.08 0.00 0.04 0.00 0.00 61.00 61.64 3h9b s PRO 151 Cb -0.31 -2.01 0.05 0.00 0.04 0.00 0.00 34.50 32.27 3h9b s PRO 151 CO 0.37 -1.36 0.84 -3.47 0.04 0.00 0.00 177.00 173.42 3h9b n ASP 152 N -3.16 -3.16 -4.87 6.66 2.03 -1.08 -4.89 116.55 108.07 3h9b n ASP 152 Ca 0.08 -0.81 -0.36 0.00 0.52 0.00 0.00 54.79 54.22 3h9b n ASP 152 Cb 0.60 -3.88 -0.06 0.00 -0.72 0.00 0.00 41.12 37.06 3h9b n ASP 152 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3h9b s GLN 153 N -6.38 3.65 -0.09 -0.67 -1.52 0.67 -4.84 119.66 110.48 3h9b s GLN 153 Ca 0.38 0.06 -0.02 0.00 -1.95 0.00 0.00 55.36 53.83 3h9b s GLN 153 Cb -0.19 -3.12 -0.03 0.00 -0.22 0.00 0.00 33.01 29.44 3h9b s GLN 153 CO 0.83 0.67 -0.01 0.71 -0.25 0.00 0.00 175.29 177.24 3h9b s TYR 154 N -1.21 3.11 0.00 0.91 1.51 -1.26 -0.74 117.35 119.67 3h9b s TYR 154 Ca 0.25 0.12 0.00 0.00 -1.01 0.00 0.00 57.07 56.43 3h9b s TYR 154 Cb -0.14 -1.79 0.00 0.00 -0.11 0.00 0.00 41.96 39.92 3h9b s TYR 154 CO 0.13 0.40 0.00 0.41 -1.11 0.00 0.00 175.55 175.38 3h9b n GLY 155 N 2.29 1.86 1.34 0.71 0.00 -0.27 -3.76 105.19 107.36 3h9b n GLY 155 Ca -0.18 -0.59 0.05 0.00 0.00 0.00 0.00 46.02 45.30 3h9b n GLY 155 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3h9b n ASP 156 N 1.57 3.91 -3.67 1.61 5.68 -1.26 -4.34 116.55 120.05 3h9b n ASP 156 Ca 0.00 -2.50 -0.15 0.00 -0.50 0.00 0.00 54.79 51.64 3h9b n ASP 156 Cb 0.00 -0.57 -0.08 0.00 -1.14 0.00 0.00 41.12 39.34 3h9b n ASP 156 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3h9b s ASN 157 N -0.62 -0.38 -0.21 -1.12 2.20 -1.25 -0.73 114.94 112.83 3h9b s ASN 157 Ca 0.36 0.37 -0.10 0.00 -0.94 0.00 0.00 52.86 52.55 3h9b s ASN 157 Cb 0.26 0.43 -0.05 0.00 -2.00 0.00 0.00 41.25 39.89 3h9b s ASN 157 CO 0.13 -0.50 0.14 0.00 -2.94 0.00 0.00 177.10 173.94 3h9b n GLU 159 N 3.76 1.54 -0.06 0.00 1.02 -1.26 -1.54 120.64 124.10 3h9b n GLU 159 Ca -0.16 -0.82 -0.12 0.00 -0.02 0.00 0.00 57.16 56.04 3h9b n GLU 159 Cb 0.52 -1.30 -0.04 0.00 -0.02 0.00 0.00 31.44 30.60 3h9b n GLU 159 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 3h9b n VAL 160 N 0.09 1.25 0.87 2.62 0.24 -1.26 -4.73 118.33 117.41 3h9b n VAL 160 Ca 0.13 0.03 0.11 0.00 -2.04 0.00 0.00 64.34 62.57 3h9b n VAL 160 Cb 0.24 -1.96 0.06 0.00 -1.47 0.00 0.00 33.84 30.71 3h9b n VAL 160 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h9b n GLY 162 N 1.46 0.87 3.74 0.00 0.00 -0.59 -5.03 105.19 105.65 3h9b n GLY 162 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 3h9b n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9b s ALA 163 N -3.41 2.39 0.03 4.61 0.00 -1.25 -4.68 121.76 119.45 3h9b s ALA 163 Ca 0.00 0.93 0.08 0.00 0.00 0.00 0.00 51.96 52.97 3h9b s ALA 163 Cb 0.00 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 3h9b s ALA 163 CO 0.00 -1.43 -0.23 0.95 0.00 0.00 0.00 175.76 175.05 3h9b s THR 164 N -1.78 1.88 0.08 0.00 -4.23 -1.26 -0.78 115.64 109.55 3h9b s THR 164 Ca 0.76 -1.24 -0.27 0.00 -1.18 0.00 0.00 61.69 59.76 3h9b s THR 164 Cb -0.29 -1.61 0.08 0.00 1.34 0.00 0.00 72.50 72.02 3h9b s THR 164 CO 0.38 0.32 1.03 -0.72 -0.54 0.00 0.00 174.62 175.09 3h9b s TYR 165 N -0.76 -0.14 0.34 3.99 -0.85 0.09 -4.98 117.35 115.04 3h9b s TYR 165 Ca 0.09 -0.08 -0.27 0.00 -0.52 0.00 0.00 57.07 56.29 3h9b s TYR 165 Cb -0.09 0.60 -0.09 0.00 0.38 0.00 0.00 41.96 42.75 3h9b s TYR 165 CO 0.01 -0.64 1.07 0.45 -1.52 0.00 0.00 175.55 174.93 3h9b s SER 166 N -2.85 7.01 0.64 -0.18 0.15 -1.26 -4.24 113.70 112.96 3h9b s SER 166 Ca 0.11 2.16 0.38 0.00 0.70 0.00 0.00 55.95 59.30 3h9b s SER 166 Cb 0.00 -2.61 2.06 0.00 -1.71 0.00 0.00 66.02 63.77 3h9b s SER 166 CO -0.01 -0.32 2.16 -0.65 1.20 0.00 0.00 173.24 175.62 3h9b h PRO 167 N 3.17 0.00 0.00 5.44 0.11 -1.92 0.17 132.00 138.97 3h9b h PRO 167 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3h9b h PRO 167 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3h9b h PRO 167 CO 0.65 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.69 3h9b n THR 168 N -2.94 1.10 1.02 -1.15 -2.24 -1.26 -1.81 114.28 107.00 3h9b n THR 168 Ca -0.03 0.29 0.11 0.00 -2.27 0.00 0.00 64.05 62.16 3h9b n THR 168 Cb 0.17 -1.11 0.14 0.00 -2.10 0.00 0.00 70.33 67.43 3h9b n THR 168 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3h9b n GLU 169 N -1.65 0.14 -1.90 -0.78 1.02 0.59 -4.94 120.64 113.13 3h9b n GLU 169 Ca 0.03 -0.10 -0.41 0.00 -0.02 0.00 0.00 57.16 56.66 3h9b n GLU 169 Cb 0.16 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.07 3h9b n GLU 169 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3h9b s LEU 170 N -2.93 4.35 0.04 -4.62 1.43 -0.75 -4.38 118.68 111.82 3h9b s LEU 170 Ca 0.12 2.92 -0.25 0.00 -1.03 0.00 0.00 54.13 55.89 3h9b s LEU 170 Cb 0.17 -3.66 -0.05 0.00 0.03 0.00 0.00 46.19 42.68 3h9b s LEU 170 CO 0.73 -0.78 0.75 -0.63 0.23 0.00 0.00 176.35 176.65 3h9b s ILE 171 N -0.89 4.75 -1.17 -0.59 1.01 -0.03 -4.09 121.20 120.19 3h9b s ILE 171 Ca 0.54 1.60 -0.20 0.00 0.00 0.00 0.00 60.65 62.59 3h9b s ILE 171 Cb -0.45 -4.10 -0.00 0.00 0.01 0.00 0.00 42.46 37.92 3h9b s ILE 171 CO 0.57 0.36 0.76 -0.62 0.00 0.00 0.00 174.94 176.01 3h9b n GLU 172 N 2.82 -1.37 -1.93 2.79 -0.58 -1.26 -0.94 120.64 120.17 3h9b n GLU 172 Ca -0.03 0.43 -0.38 0.00 -0.42 0.00 0.00 57.16 56.76 3h9b n GLU 172 Cb 0.50 -4.06 0.02 0.00 -0.57 0.00 0.00 31.44 27.33 3h9b n GLU 172 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 3h9b s PRO 173 N -6.12 3.39 0.01 3.49 0.04 -1.26 -4.48 135.00 130.07 3h9b s PRO 173 Ca 0.44 2.11 0.02 0.00 0.04 0.00 0.00 61.00 63.61 3h9b s PRO 173 Cb -0.16 -2.35 -0.01 0.00 0.04 0.00 0.00 34.50 32.02 3h9b s PRO 173 CO 0.87 -0.95 -0.07 0.15 0.04 0.00 0.00 177.00 177.04 3h9b s LYS 174 N -2.78 0.53 0.08 4.56 -0.14 0.14 -4.21 119.74 117.92 3h9b s LYS 174 Ca 0.68 -0.38 -0.31 0.00 -1.36 0.00 0.00 55.97 54.61 3h9b s LYS 174 Cb -0.37 -0.46 -0.06 0.00 -1.68 0.00 0.00 37.83 35.26 3h9b s LYS 174 CO 0.45 0.12 1.20 0.45 -0.76 0.00 0.00 175.35 176.81 3h9b s SER 175 N -0.54 7.08 0.49 2.83 0.15 0.66 -1.30 113.70 123.07 3h9b s SER 175 Ca -0.01 2.06 0.27 0.00 0.70 0.00 0.00 55.95 58.97 3h9b s SER 175 Cb -0.04 -2.58 1.23 0.00 -1.71 0.00 0.00 66.02 62.91 3h9b s SER 175 CO 0.00 -0.46 1.96 0.58 1.20 0.00 0.00 173.24 176.52 3h9b h VAL 176 N 4.38 0.49 0.06 4.45 2.07 -1.30 0.12 116.25 126.51 3h9b h VAL 176 Ca -0.42 -0.79 -0.10 0.00 0.82 0.00 0.00 66.70 66.20 3h9b h VAL 176 Cb 1.21 1.55 0.01 0.00 -1.52 0.00 0.00 31.29 32.54 3h9b h VAL 176 CO 0.80 0.15 -0.43 0.58 0.02 0.00 0.00 177.57 178.70 3h9b h VAL 177 N 0.00 1.60 0.00 2.57 2.07 -1.91 -3.42 116.25 117.16 3h9b h VAL 177 Ca -0.00 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.20 3h9b h VAL 177 Cb 0.54 3.12 0.00 0.00 -1.52 0.00 0.00 31.29 33.42 3h9b h VAL 177 CO 0.02 0.64 -0.75 -1.54 0.02 0.00 0.00 177.57 175.96 3h9b n SER 178 N -4.36 3.73 0.00 0.57 3.41 -1.21 -5.01 113.62 110.75 3h9b n SER 178 Ca -0.12 -0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.38 3h9b n SER 178 Cb 0.64 0.98 0.00 0.00 -0.26 0.00 0.00 64.21 65.57 3h9b n SER 178 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h9b n GLY 179 N 2.10 1.01 3.81 5.00 0.00 0.41 -4.97 105.19 112.55 3h9b n GLY 179 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3h9b n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9b s ALA 180 N -2.80 2.67 -0.27 4.61 0.00 -1.26 -4.40 121.76 120.32 3h9b s ALA 180 Ca 0.00 0.24 -0.29 0.00 0.00 0.00 0.00 51.96 51.91 3h9b s ALA 180 Cb 0.00 -3.21 0.01 0.00 0.00 0.00 0.00 23.12 19.92 3h9b s ALA 180 CO 0.00 -1.08 1.06 0.99 0.00 0.00 0.00 175.76 176.73 3h9b s THR 181 N -2.77 4.60 0.61 0.00 2.01 -1.26 -0.24 115.64 118.58 3h9b s THR 181 Ca 0.61 1.90 -0.13 0.00 0.31 0.00 0.00 61.69 64.37 3h9b s THR 181 Cb -0.15 -4.35 -0.04 0.00 0.01 0.00 0.00 72.50 67.97 3h9b s THR 181 CO 0.47 -0.31 1.03 -2.16 -0.69 0.00 0.00 174.62 172.96 3h9b s PRO 182 N 3.40 3.47 0.10 4.92 0.04 -1.26 -4.63 135.00 141.05 3h9b s PRO 182 Ca 0.45 0.92 0.02 0.00 0.04 0.00 0.00 61.00 62.42 3h9b s PRO 182 Cb -0.14 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 3h9b s PRO 182 CO 0.10 -0.67 -0.06 0.14 0.04 0.00 0.00 177.00 176.55 3h9b s VAL 183 N -2.91 0.70 0.14 -0.36 -7.23 -0.32 -4.86 120.40 105.56 3h9b s VAL 183 Ca 0.58 -1.94 -0.30 0.00 -1.81 0.00 0.00 61.98 58.51 3h9b s VAL 183 Cb -0.12 -1.71 -0.07 0.00 0.56 0.00 0.00 36.38 35.04 3h9b s VAL 183 CO 0.46 -0.85 1.06 -0.04 -0.31 0.00 0.00 175.10 175.43 3h9b s MET 184 N -3.84 4.61 0.00 4.82 -1.94 -1.26 0.07 119.30 121.76 3h9b s MET 184 Ca 0.13 1.63 0.00 0.00 -1.71 0.00 0.00 55.69 55.74 3h9b s MET 184 Cb 0.05 -3.32 -0.01 0.00 2.01 0.00 0.00 34.83 33.56 3h9b s MET 184 CO -0.04 0.07 -0.01 0.50 -0.01 0.00 0.00 175.02 175.53 3h9b s ARG 185 N -0.04 0.08 0.42 2.03 3.52 -0.49 -4.91 118.95 119.56 3h9b s ARG 185 Ca 0.50 -0.15 -0.19 0.00 -0.13 0.00 0.00 55.73 55.75 3h9b s ARG 185 Cb -0.27 0.02 -0.10 0.00 -1.56 0.00 0.00 34.95 33.04 3h9b s ARG 185 CO 0.32 -0.01 0.90 -0.51 -0.81 0.00 0.00 175.30 175.20 3h9b s ASP 186 N -0.36 6.85 -0.25 -2.12 -0.00 -1.26 -1.63 116.67 117.89 3h9b s ASP 186 Ca -0.04 1.57 -0.21 0.00 -0.00 0.00 0.00 52.55 53.88 3h9b s ASP 186 Cb -0.03 -2.49 0.07 0.00 -0.00 0.00 0.00 42.92 40.47 3h9b s ASP 186 CO -0.00 -0.36 0.66 -0.55 -0.00 0.00 0.00 175.17 174.92 3h9b s SER 187 N -2.34 -0.75 0.02 0.27 0.15 -0.36 -4.98 113.70 105.72 3h9b s SER 187 Ca 0.60 1.36 -0.30 0.00 0.70 0.00 0.00 55.95 58.31 3h9b s SER 187 Cb -0.09 1.34 -0.04 0.00 -1.71 0.00 0.00 66.02 65.52 3h9b s SER 187 CO 0.17 -0.23 1.01 -0.70 1.20 0.00 0.00 173.24 174.69 3h9b s GLU 188 N 0.72 4.55 0.16 5.44 2.12 -1.26 -1.26 118.70 129.17 3h9b s GLU 188 Ca -0.03 1.48 0.09 0.00 0.36 0.00 0.00 54.97 56.87 3h9b s GLU 188 Cb -0.05 -3.43 -0.04 0.00 0.26 0.00 0.00 34.13 30.87 3h9b s GLU 188 CO -0.05 -0.05 -0.20 -1.01 -0.54 0.00 0.00 175.26 173.41 3h9b s HIS 189 N 0.91 1.92 -0.13 5.30 3.76 0.09 -4.97 115.29 122.16 3h9b s HIS 189 Ca 0.52 -0.43 -0.06 0.00 -0.15 0.00 0.00 55.06 54.94 3h9b s HIS 189 Cb -0.22 -0.98 -0.04 0.00 1.11 0.00 0.00 32.58 32.45 3h9b s HIS 189 CO 0.28 0.34 0.08 -0.06 -0.85 0.00 0.00 174.74 174.53 3h9b s PHE 190 N -1.77 3.36 0.00 1.40 0.40 -1.26 -1.53 117.98 118.59 3h9b s PHE 190 Ca 0.15 0.29 0.08 0.00 -0.60 0.00 0.00 56.93 56.84 3h9b s PHE 190 Cb -0.07 -1.95 -0.02 0.00 0.51 0.00 0.00 43.02 41.49 3h9b s PHE 190 CO 0.07 0.46 -0.24 -0.06 0.70 0.00 0.00 175.22 176.15 3h9b s PHE 191 N -0.49 2.10 -0.15 0.36 0.40 0.12 -1.11 117.98 119.20 3h9b s PHE 191 Ca 0.11 -0.40 -0.17 0.00 -0.60 0.00 0.00 56.93 55.87 3h9b s PHE 191 Cb -0.12 -1.32 -0.04 0.00 0.51 0.00 0.00 43.02 42.05 3h9b s PHE 191 CO 0.02 0.01 0.44 0.12 0.70 0.00 0.00 175.22 176.50 3h9b s PHE 192 N -0.63 3.45 -1.35 0.36 5.36 0.79 -0.29 117.98 125.69 3h9b s PHE 192 Ca 0.09 0.77 -0.14 0.00 -0.96 0.00 0.00 56.93 56.69 3h9b s PHE 192 Cb -0.09 -2.53 -0.03 0.00 -0.34 0.00 0.00 43.02 40.03 3h9b s PHE 192 CO -0.00 0.10 2.35 -3.47 -1.46 0.00 0.00 175.22 172.74 3h9b n ASP 193 N 3.99 4.90 -0.35 6.13 4.64 0.25 -0.97 116.55 135.14 3h9b n ASP 193 Ca -0.08 -2.71 0.07 0.00 -1.38 0.00 0.00 54.79 50.69 3h9b n ASP 193 Cb 0.51 -1.51 0.24 0.00 -1.04 0.00 0.00 41.12 39.33 3h9b n ASP 193 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 3h9b h LEU 194 N 9.76 0.88 -1.99 -2.67 5.85 -1.88 -2.13 115.31 123.13 3h9b h LEU 194 Ca 0.61 0.05 0.22 0.00 0.84 0.00 0.00 57.88 59.61 3h9b h LEU 194 Cb 0.52 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 3h9b h LEU 194 CO 1.84 0.46 0.56 -0.65 -0.34 0.00 0.00 178.44 180.32 3h9b h PRO 195 N 0.95 0.00 0.00 5.25 0.11 -1.84 0.45 132.00 136.92 3h9b h PRO 195 Ca 0.50 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.60 3h9b h PRO 195 Cb 0.52 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.63 3h9b h PRO 195 CO -0.28 0.00 -0.03 1.03 -0.21 0.00 0.00 178.00 178.52 3h9b h SER 196 N 0.00 0.00 -0.70 -2.05 0.87 -1.79 -2.31 113.55 107.57 3h9b h SER 196 Ca 0.36 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.92 3h9b h SER 196 Cb 1.49 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.45 3h9b h SER 196 CO -0.00 0.03 0.00 0.49 -0.53 0.00 0.00 176.83 176.81 3h9b n PHE 197 N -3.45 0.93 -0.14 2.24 3.01 0.15 -4.66 117.46 115.54 3h9b n PHE 197 Ca -0.02 -0.49 -0.04 0.00 1.01 0.00 0.00 57.45 57.91 3h9b n PHE 197 Cb 0.13 -0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.62 3h9b n PHE 197 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3h9b h SER 198 N 4.20 -0.49 -0.47 4.37 0.87 -1.49 -0.66 113.55 119.89 3h9b h SER 198 Ca 0.00 0.14 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 3h9b h SER 198 Cb 0.98 0.31 -0.02 0.00 -0.44 0.00 0.00 62.40 63.22 3h9b h SER 198 CO 0.00 -0.17 0.25 -0.33 -0.53 0.00 0.00 176.83 176.05 3h9b h GLU 199 N -0.03 0.66 -0.43 2.24 4.39 -1.84 0.54 114.58 120.10 3h9b h GLU 199 Ca 0.22 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 3h9b h GLU 199 Cb 0.36 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 3h9b h GLU 199 CO -0.48 0.52 0.26 1.98 -1.16 0.00 0.00 179.01 180.13 3h9b h MET 200 N 0.62 0.59 -0.44 2.33 4.05 -1.80 -0.70 114.93 119.58 3h9b h MET 200 Ca 0.17 -0.05 -0.10 0.00 -0.28 0.00 0.00 59.70 59.43 3h9b h MET 200 Cb 0.06 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 30.72 3h9b h MET 200 CO -0.03 0.43 -0.13 -0.07 0.23 0.00 0.00 176.91 177.34 3h9b h LEU 201 N 0.58 0.80 -0.85 3.39 3.38 -0.86 -1.75 115.31 120.00 3h9b h LEU 201 Ca 0.16 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 3h9b h LEU 201 Cb -0.01 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3h9b h LEU 201 CO -0.03 0.94 -0.27 1.56 0.09 0.00 0.00 178.44 180.73 3h9b h GLN 202 N 0.72 0.54 -0.63 1.13 4.20 -0.60 -0.95 115.11 119.53 3h9b h GLN 202 Ca 0.12 -0.22 -0.09 0.00 0.06 0.00 0.00 58.65 58.52 3h9b h GLN 202 Cb 0.63 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.36 3h9b h GLN 202 CO 0.04 0.77 0.03 0.00 -0.67 0.00 0.00 178.83 179.00 3h9b h ALA 203 N 1.23 0.87 -0.51 3.87 0.00 -0.78 -2.24 119.26 121.69 3h9b h ALA 203 Ca 0.06 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 3h9b h ALA 203 Cb 0.72 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3h9b h ALA 203 CO 0.06 0.67 0.03 2.35 0.00 0.00 0.00 179.25 182.35 3h9b h TRP 204 N 0.99 0.96 -0.99 0.00 7.01 -0.97 -2.23 115.95 120.73 3h9b h TRP 204 Ca 0.18 -0.16 0.05 0.00 2.11 0.00 0.00 58.89 61.07 3h9b h TRP 204 Cb 0.52 -0.25 -0.06 0.00 -2.10 0.00 0.00 29.16 27.27 3h9b h TRP 204 CO 0.04 0.88 0.65 1.15 -2.79 0.00 0.00 178.44 178.37 3h9b h THR 205 N 0.76 1.14 -0.07 2.65 2.02 -0.92 -2.10 112.91 116.39 3h9b h THR 205 Ca 0.15 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.91 3h9b h THR 205 Cb 0.48 -0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.71 3h9b h THR 205 CO 0.02 0.22 0.00 -2.11 0.37 0.00 0.00 175.52 174.02 3h9b n ARG 206 N -4.46 1.69 0.26 6.66 1.85 -0.87 -4.14 116.66 117.66 3h9b n ARG 206 Ca 0.14 -1.01 0.17 0.00 -1.00 0.00 0.00 57.85 56.15 3h9b n ARG 206 Cb 0.13 -1.45 0.75 0.00 -1.05 0.00 0.00 32.46 30.83 3h9b n ARG 206 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3h9b h SER 207 N 2.32 0.00 0.00 2.89 4.64 -0.75 -3.47 113.55 119.18 3h9b h SER 207 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h9b h SER 207 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3h9b h SER 207 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3h9b n GLY 208 N -0.19 0.77 0.15 -0.77 0.00 -1.26 -4.95 105.19 98.93 3h9b n GLY 208 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 3h9b n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9b h ALA 209 N 0.00 0.11 -2.39 4.61 0.00 -1.88 -3.46 119.26 116.25 3h9b h ALA 209 Ca 0.00 -0.54 -0.51 0.00 0.00 0.00 0.00 54.91 53.86 3h9b h ALA 209 Cb 0.00 0.02 0.10 0.00 0.00 0.00 0.00 17.79 17.90 3h9b h ALA 209 CO 0.00 0.35 0.37 -0.51 0.00 0.00 0.00 179.25 179.45 3h9b s LEU 210 N -8.43 3.34 0.45 0.00 1.43 -1.26 -4.90 118.68 109.30 3h9b s LEU 210 Ca -0.13 1.89 -0.25 0.00 -1.03 0.00 0.00 54.13 54.60 3h9b s LEU 210 Cb 0.04 -4.54 -0.08 0.00 0.03 0.00 0.00 46.19 41.64 3h9b s LEU 210 CO 0.82 -1.55 1.44 -1.10 0.23 0.00 0.00 176.35 176.19 3h9b s GLN 211 N -4.31 3.68 0.24 1.70 -0.21 -1.26 -4.79 119.66 114.72 3h9b s GLN 211 Ca 0.64 2.45 -0.05 0.00 0.02 0.00 0.00 55.36 58.42 3h9b s GLN 211 Cb -0.18 -2.67 0.43 0.00 1.00 0.00 0.00 33.01 31.59 3h9b s GLN 211 CO 0.44 -0.83 1.71 1.49 -2.12 0.00 0.00 175.29 175.98 3h9b h GLU 212 N 2.33 0.35 -0.33 2.91 4.81 -1.94 -0.63 114.58 122.08 3h9b h GLU 212 Ca -0.51 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 58.66 3h9b h GLU 212 Cb 1.27 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 3h9b h GLU 212 CO 0.61 0.23 0.02 1.96 -0.73 0.00 0.00 179.01 181.10 3h9b h GLN 213 N 0.36 0.50 -0.16 1.92 4.20 -1.98 -1.16 115.11 118.80 3h9b h GLN 213 Ca 0.40 -0.10 -0.09 0.00 0.06 0.00 0.00 58.65 58.92 3h9b h GLN 213 Cb 0.62 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.32 3h9b h GLN 213 CO -0.43 0.52 -0.25 0.28 -0.67 0.00 0.00 178.83 178.28 3h9b h VAL 214 N 0.49 1.36 -0.71 -0.54 2.07 -1.53 -2.42 116.25 114.97 3h9b h VAL 214 Ca 0.11 -1.48 0.01 0.00 0.82 0.00 0.00 66.70 66.16 3h9b h VAL 214 Cb 0.29 1.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 3h9b h VAL 214 CO 0.01 0.44 0.47 0.00 0.02 0.00 0.00 177.57 178.51 3h9b h ALA 215 N 0.58 0.90 -0.81 1.67 0.00 -0.92 -0.37 119.26 120.31 3h9b h ALA 215 Ca 0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3h9b h ALA 215 Cb 0.82 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 3h9b h ALA 215 CO 0.06 0.32 0.38 -0.91 0.00 0.00 0.00 179.25 179.10 3h9b h ASN 216 N 0.96 1.06 -0.52 0.00 2.35 -1.21 -1.77 115.58 116.45 3h9b h ASN 216 Ca 0.26 -0.14 -0.05 0.00 -0.55 0.00 0.00 56.30 55.82 3h9b h ASN 216 Cb -0.11 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 37.97 3h9b h ASN 216 CO -0.06 0.90 0.11 0.50 -1.65 0.00 0.00 177.43 177.24 3h9b h LYS 217 N 1.15 0.84 -0.45 0.81 1.63 -0.90 -2.64 116.57 117.01 3h9b h LYS 217 Ca 0.28 -0.21 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 3h9b h LYS 217 Cb 0.13 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.63 3h9b h LYS 217 CO -0.03 0.81 0.25 0.52 -3.45 0.00 0.00 179.45 177.55 3h9b h MET 218 N 0.73 0.60 -0.36 1.90 2.86 -0.67 -0.53 114.93 119.46 3h9b h MET 218 Ca 0.16 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.71 3h9b h MET 218 Cb 0.36 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 3h9b h MET 218 CO 0.00 0.44 0.06 1.96 1.06 0.00 0.00 176.91 180.43 3h9b h GLN 219 N 0.61 0.54 -0.74 1.72 1.08 -0.98 -0.41 115.11 116.94 3h9b h GLN 219 Ca 0.16 -0.09 -0.05 0.00 -1.45 0.00 0.00 58.65 57.22 3h9b h GLN 219 Cb 0.00 -0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.31 3h9b h GLN 219 CO -0.03 0.52 0.28 0.93 -0.95 0.00 0.00 178.83 179.57 3h9b h GLU 220 N 0.52 1.12 -0.30 1.46 5.08 -0.92 -0.75 114.58 120.80 3h9b h GLU 220 Ca 0.12 -0.21 -0.13 0.00 -1.00 0.00 0.00 59.36 58.14 3h9b h GLU 220 Cb 0.24 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3h9b h GLU 220 CO 0.00 0.93 -0.35 -1.49 -1.00 0.00 0.00 179.01 177.10 3h9b h TRP 221 N 1.07 0.77 -0.37 4.33 6.55 -0.84 -1.15 115.95 126.30 3h9b h TRP 221 Ca 0.24 -0.21 -0.13 0.00 0.95 0.00 0.00 58.89 59.75 3h9b h TRP 221 Cb 0.24 -0.17 -0.01 0.00 -0.86 0.00 0.00 29.16 28.36 3h9b h TRP 221 CO 0.02 0.91 -0.27 0.74 -1.05 0.00 0.00 178.44 178.79 3h9b h PHE 222 N 0.55 0.90 -0.52 0.49 0.05 -0.84 -1.37 116.94 116.20 3h9b h PHE 222 Ca 0.06 -0.22 -0.05 0.00 3.82 0.00 0.00 57.97 61.58 3h9b h PHE 222 Cb 0.86 -0.21 -0.02 0.00 2.00 0.00 0.00 35.95 38.58 3h9b h PHE 222 CO 0.04 0.96 0.14 1.49 -0.18 0.00 0.00 178.31 180.76 3h9b h GLU 223 N 0.67 0.83 -0.00 1.51 4.57 -0.90 -2.32 114.58 118.93 3h9b h GLU 223 Ca 0.08 -0.19 -0.07 0.00 -1.18 0.00 0.00 59.36 57.99 3h9b h GLU 223 Cb 0.80 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 3h9b h GLU 223 CO 0.07 0.78 -0.35 0.77 -1.18 0.00 0.00 179.01 179.10 3h9b h SER 224 N 0.72 0.01 0.00 1.04 0.02 -1.07 -3.49 113.55 110.78 3h9b h SER 224 Ca 0.16 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3h9b h SER 224 Cb 0.32 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 3h9b h SER 224 CO 0.00 0.36 0.00 0.61 -1.14 0.00 0.00 176.83 176.66 3h9b n GLY 225 N -0.51 2.13 3.79 -3.77 0.00 -0.53 -5.05 105.19 101.25 3h9b n GLY 225 Ca -0.02 -1.37 -0.36 0.00 0.00 0.00 0.00 46.02 44.27 3h9b n GLY 225 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h9b s LEU 226 N 0.00 4.25 0.28 0.99 1.43 -1.26 -4.91 118.68 119.46 3h9b s LEU 226 Ca 0.00 1.77 0.06 0.00 -1.03 0.00 0.00 54.13 54.94 3h9b s LEU 226 Cb 0.00 -4.11 -0.06 0.00 0.03 0.00 0.00 46.19 42.05 3h9b s LEU 226 CO 0.00 -0.13 -0.06 -1.10 0.23 0.00 0.00 176.35 175.30 3h9b s GLN 227 N -2.31 1.55 0.55 1.70 -1.52 -1.26 -4.71 119.66 113.66 3h9b s GLN 227 Ca 0.52 -1.78 -0.20 0.00 -1.95 0.00 0.00 55.36 51.95 3h9b s GLN 227 Cb -0.16 -1.14 -0.05 0.00 -0.22 0.00 0.00 33.01 31.44 3h9b s GLN 227 CO 0.21 0.03 1.19 -0.65 -0.25 0.00 0.00 175.29 175.83 3h9b s GLN 228 N -3.73 3.21 -0.22 2.91 -0.21 -1.26 -4.37 119.66 115.99 3h9b s GLN 228 Ca 0.30 1.80 -0.05 0.00 0.02 0.00 0.00 55.36 57.42 3h9b s GLN 228 Cb 0.04 -2.05 -0.02 0.00 1.00 0.00 0.00 33.01 31.97 3h9b s GLN 228 CO 0.12 -1.01 0.00 -0.46 -2.12 0.00 0.00 175.29 171.83 3h9b s TRP 229 N -1.60 3.02 -0.46 0.91 -0.00 -0.14 -4.89 118.94 115.78 3h9b s TRP 229 Ca 0.74 -0.58 -0.28 0.00 -0.00 0.00 0.00 56.10 55.98 3h9b s TRP 229 Cb -0.29 -2.12 -0.01 0.00 -0.00 0.00 0.00 33.47 31.05 3h9b s TRP 229 CO 0.33 -0.35 1.67 0.34 -0.00 0.00 0.00 176.95 178.94 3h9b s ASP 230 N 1.26 5.86 -0.07 5.86 -1.08 -1.26 -0.15 116.67 127.09 3h9b s ASP 230 Ca 0.04 0.80 0.14 0.00 -0.52 0.00 0.00 52.55 53.00 3h9b s ASP 230 Cb -0.15 -2.53 0.45 0.00 -1.46 0.00 0.00 42.92 39.23 3h9b s ASP 230 CO 0.01 -1.82 1.37 2.30 0.52 0.00 0.00 175.17 177.55 3h9b n ILE 231 N 7.21 1.54 -4.36 4.11 -5.35 -0.27 -4.92 119.36 117.32 3h9b n ILE 231 Ca 0.19 -1.31 -0.27 0.00 -0.27 0.00 0.00 62.75 61.10 3h9b n ILE 231 Cb 0.49 0.20 -0.12 0.00 -1.74 0.00 0.00 39.64 38.47 3h9b n ILE 231 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3h9b s SER 232 N -1.28 3.07 -0.00 7.28 1.04 -1.23 -0.62 113.70 121.96 3h9b s SER 232 Ca 0.34 -0.77 0.01 0.00 0.48 0.00 0.00 55.95 56.01 3h9b s SER 232 Cb 0.23 -0.20 -0.00 0.00 0.10 0.00 0.00 66.02 66.15 3h9b s SER 232 CO 0.15 0.12 -0.02 -0.13 0.98 0.00 0.00 173.24 174.33 3h9b s ARG 233 N -2.20 0.21 0.50 4.02 1.81 0.37 -4.72 118.95 118.93 3h9b s ARG 233 Ca 0.13 -0.09 -0.18 0.00 -1.72 0.00 0.00 55.73 53.88 3h9b s ARG 233 Cb -0.09 -0.20 -0.08 0.00 -0.45 0.00 0.00 34.95 34.12 3h9b s ARG 233 CO 0.06 0.05 0.98 -0.51 -0.68 0.00 0.00 175.30 175.21 3h9b s ASP 234 N -0.05 6.62 0.62 0.23 1.01 -1.26 -0.33 116.67 123.51 3h9b s ASP 234 Ca 0.01 1.64 -0.17 0.00 0.71 0.00 0.00 52.55 54.74 3h9b s ASP 234 Cb -0.01 -2.52 -0.02 0.00 1.01 0.00 0.00 42.92 41.38 3h9b s ASP 234 CO -0.00 -0.59 1.14 0.00 0.21 0.00 0.00 175.17 175.93 3h9b s ALA 235 N -2.46 2.52 0.28 5.23 0.00 -0.52 -4.24 121.76 122.57 3h9b s ALA 235 Ca 0.61 0.73 -0.29 0.00 0.00 0.00 0.00 51.96 53.00 3h9b s ALA 235 Cb -0.10 -3.36 -0.09 0.00 0.00 0.00 0.00 23.12 19.56 3h9b s ALA 235 CO 0.26 -1.15 1.05 -1.25 0.00 0.00 0.00 175.76 174.67 3h9b s PRO 236 N -3.71 4.64 0.07 0.00 0.04 -1.26 -4.78 135.00 130.00 3h9b s PRO 236 Ca 0.71 1.68 -0.20 0.00 0.04 0.00 0.00 61.00 63.23 3h9b s PRO 236 Cb -0.24 -3.12 0.04 0.00 0.04 0.00 0.00 34.50 31.22 3h9b s PRO 236 CO 0.36 0.25 0.47 -0.47 0.04 0.00 0.00 177.00 177.65 3h9b s TYR 237 N -1.24 -0.34 -0.38 0.56 5.04 -1.26 -4.98 117.35 114.75 3h9b s TYR 237 Ca 0.45 0.25 -0.04 0.00 -2.44 0.00 0.00 57.07 55.29 3h9b s TYR 237 Cb -0.29 0.31 0.09 0.00 0.35 0.00 0.00 41.96 42.41 3h9b s TYR 237 CO 0.37 -0.66 0.17 0.12 -1.34 0.00 0.00 175.55 174.21 3h9b s PHE 238 N -2.90 3.44 -1.07 4.97 5.36 -1.26 -4.99 117.98 121.53 3h9b s PHE 238 Ca -0.03 -2.04 0.00 0.00 -0.96 0.00 0.00 56.93 53.90 3h9b s PHE 238 Cb -0.00 -2.86 0.00 0.00 -0.34 0.00 0.00 43.02 39.81 3h9b s PHE 238 CO -0.05 -0.89 0.00 0.41 -1.46 0.00 0.00 175.22 173.22 3h9b n GLY 239 N 4.69 -0.64 3.68 13.12 0.00 -1.26 -1.42 105.19 123.34 3h9b n GLY 239 Ca -0.07 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 3h9b n GLY 239 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h9b s PHE 240 N -3.48 3.36 0.28 1.61 2.99 -1.26 -4.99 117.98 116.49 3h9b s PHE 240 Ca 0.00 0.40 -0.29 0.00 0.00 0.00 0.00 56.93 57.04 3h9b s PHE 240 Cb 0.00 -2.36 -0.10 0.00 0.00 0.00 0.00 43.02 40.57 3h9b s PHE 240 CO 0.00 0.07 1.12 -2.00 -0.00 0.00 0.00 175.22 174.41 3h9b s GLU 241 N 1.04 4.61 -0.02 0.44 2.12 -1.26 -1.03 118.70 124.60 3h9b s GLU 241 Ca 0.12 1.85 -0.30 0.00 0.36 0.00 0.00 54.97 57.00 3h9b s GLU 241 Cb -0.14 -3.18 -0.03 0.00 0.26 0.00 0.00 34.13 31.04 3h9b s GLU 241 CO 0.05 0.16 1.10 0.42 -0.54 0.00 0.00 175.26 176.45 3h9b s ILE 242 N -1.13 4.49 0.30 -3.70 1.01 0.31 -4.84 121.20 117.64 3h9b s ILE 242 Ca 0.45 1.79 -0.30 0.00 0.00 0.00 0.00 60.65 62.59 3h9b s ILE 242 Cb -0.33 -4.15 -0.12 0.00 0.01 0.00 0.00 42.46 37.87 3h9b s ILE 242 CO 0.42 0.07 1.45 -2.65 0.00 0.00 0.00 174.94 174.23 3h9b n PRO 243 N 4.48 2.35 -1.04 2.79 -0.02 -1.26 -1.84 135.00 140.46 3h9b n PRO 243 Ca 0.09 0.83 -0.01 0.00 -2.02 0.00 0.00 63.50 62.38 3h9b n PRO 243 Cb 0.48 -2.52 -0.01 0.00 -0.02 0.00 0.00 33.50 31.44 3h9b n PRO 243 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3h9b n ASN 244 N 1.56 -4.94 -3.40 2.55 3.02 -1.26 -4.92 115.26 107.87 3h9b n ASN 244 Ca 0.07 0.04 -0.26 0.00 -0.03 0.00 0.00 54.58 54.40 3h9b n ASN 244 Cb 0.35 -2.57 -0.09 0.00 -0.61 0.00 0.00 39.78 36.86 3h9b n ASN 244 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h9b n ALA 245 N 1.03 2.99 -1.60 5.41 0.00 -0.77 -5.11 120.51 122.46 3h9b n ALA 245 Ca -0.01 -3.69 -0.49 0.00 0.00 0.00 0.00 53.44 49.25 3h9b n ALA 245 Cb 0.34 -0.84 -0.04 0.00 0.00 0.00 0.00 19.45 18.91 3h9b n ALA 245 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3h9b n PRO 246 N 1.89 1.31 -0.99 0.00 -0.02 -1.26 -1.49 135.00 134.45 3h9b n PRO 246 Ca 0.25 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 3h9b n PRO 246 Cb 0.47 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 3h9b n PRO 246 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h9b n GLY 247 N 2.15 0.76 3.47 -1.23 0.00 -1.26 -5.02 105.19 104.07 3h9b n GLY 247 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 3h9b n GLY 247 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h9b s LYS 248 N -0.06 2.42 0.16 1.61 -0.14 -0.56 -1.44 119.74 121.73 3h9b s LYS 248 Ca 0.00 -0.75 0.07 0.00 -1.36 0.00 0.00 55.97 53.92 3h9b s LYS 248 Cb 0.00 -2.34 -0.04 0.00 -1.68 0.00 0.00 37.83 33.77 3h9b s LYS 248 CO 0.00 0.61 -0.14 0.71 -0.76 0.00 0.00 175.35 175.76 3h9b s TYR 249 N -0.77 1.55 0.12 3.18 2.02 0.55 -0.53 117.35 123.47 3h9b s TYR 249 Ca 0.12 -0.57 -0.30 0.00 -0.37 0.00 0.00 57.07 55.95 3h9b s TYR 249 Cb -0.11 -0.77 -0.06 0.00 -0.40 0.00 0.00 41.96 40.62 3h9b s TYR 249 CO 0.02 0.23 1.04 -0.06 -1.57 0.00 0.00 175.55 175.21 3h9b s PHE 250 N -2.50 3.67 0.38 2.71 2.99 -0.19 -0.48 117.98 124.56 3h9b s PHE 250 Ca 0.15 1.66 -0.28 0.00 0.00 0.00 0.00 56.93 58.46 3h9b s PHE 250 Cb -0.03 -3.19 -0.11 0.00 0.00 0.00 0.00 43.02 39.70 3h9b s PHE 250 CO 0.04 -0.29 1.46 -0.47 -0.00 0.00 0.00 175.22 175.97 3h9b s TYR 251 N 0.11 2.62 0.31 0.36 5.04 0.21 -4.57 117.35 121.43 3h9b s TYR 251 Ca 0.50 1.20 0.07 0.00 -2.44 0.00 0.00 57.07 56.39 3h9b s TYR 251 Cb -0.26 -3.98 0.82 0.00 0.35 0.00 0.00 41.96 38.89 3h9b s TYR 251 CO 0.32 -2.87 1.70 -0.24 -1.34 0.00 0.00 175.55 173.11 3h9b h VAL 252 N 2.94 0.47 0.00 3.14 3.04 -1.90 -0.02 116.25 123.91 3h9b h VAL 252 Ca -0.51 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.03 3h9b h VAL 252 Cb 1.24 -0.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.51 3h9b h VAL 252 CO 0.64 0.08 0.00 -0.50 -1.01 0.00 0.00 177.57 176.78 3h9b h TRP 253 N 0.44 0.00 -0.04 3.17 4.06 -1.95 0.05 115.95 121.67 3h9b h TRP 253 Ca 0.61 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 61.44 3h9b h TRP 253 Cb 1.19 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.36 3h9b h TRP 253 CO -0.08 0.00 -0.42 1.25 -3.56 0.00 0.00 178.44 175.63 3h9b h LEU 254 N 0.00 0.44 0.00 -4.49 5.85 -1.34 -3.32 115.31 112.44 3h9b h LEU 254 Ca 0.00 -0.70 0.00 0.00 0.84 0.00 0.00 57.88 58.02 3h9b h LEU 254 Cb 0.24 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.14 3h9b h LEU 254 CO 0.00 1.08 -0.25 -2.24 -0.34 0.00 0.00 178.44 176.68 3h9b h ASP 255 N -0.15 0.00 0.32 1.25 -0.00 -1.45 -3.38 116.42 113.01 3h9b h ASP 255 Ca -0.04 -0.02 -0.00 0.00 -0.00 0.00 0.00 57.03 56.97 3h9b h ASP 255 Cb 1.10 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.41 3h9b h ASP 255 CO 0.08 0.01 -0.33 0.00 -0.00 0.00 0.00 179.24 179.01 3h9b h ALA 256 N 2.18 -0.69 0.00 4.15 0.00 -1.10 -0.15 119.26 123.65 3h9b h ALA 256 Ca 0.00 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 3h9b h ALA 256 Cb 0.91 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 3h9b h ALA 256 CO 0.00 -0.93 -0.41 -1.00 0.00 0.00 0.00 179.25 176.91 3h9b h PRO 257 N -0.68 0.00 0.00 0.00 0.13 -1.75 -1.21 132.00 128.49 3h9b h PRO 257 Ca -0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.09 3h9b h PRO 257 Cb 0.62 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.75 3h9b h PRO 257 CO -0.07 0.41 -0.11 0.82 -0.23 0.00 0.00 178.00 178.83 3h9b h ILE 258 N 0.00 0.57 0.00 -3.56 2.04 -1.63 -0.84 117.51 114.09 3h9b h ILE 258 Ca -0.00 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.37 3h9b h ILE 258 Cb 0.78 1.31 -0.00 0.00 -0.74 0.00 0.00 36.82 38.17 3h9b h ILE 258 CO 0.05 0.11 -0.01 1.23 0.00 0.00 0.00 178.15 179.53 3h9b h GLY 259 N 0.77 0.00 1.34 5.37 0.00 0.26 0.55 103.07 111.35 3h9b h GLY 259 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.10 3h9b h GLY 259 CO 0.01 0.00 -0.87 1.41 0.00 0.00 0.00 176.54 177.09 3h9b h LEU 260 N 0.00 0.77 -0.50 3.11 3.38 -1.24 -0.11 115.31 120.72 3h9b h LEU 260 Ca -0.00 -0.56 -0.06 0.00 0.09 0.00 0.00 57.88 57.35 3h9b h LEU 260 Cb 0.06 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3h9b h LEU 260 CO 0.00 1.35 0.06 0.24 0.09 0.00 0.00 178.44 180.18 3h9b h MET 261 N 0.39 0.84 -0.82 1.13 2.86 -1.13 -2.06 114.93 116.15 3h9b h MET 261 Ca -0.07 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.32 3h9b h MET 261 Cb 1.50 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 33.03 3h9b h MET 261 CO 0.17 0.85 0.48 0.78 1.06 0.00 0.00 176.91 180.25 3h9b h GLY 262 N 0.72 1.19 1.22 8.32 0.00 -0.83 -0.10 103.07 113.59 3h9b h GLY 262 Ca 0.15 -0.50 -0.09 0.00 0.00 0.00 0.00 47.33 46.90 3h9b h GLY 262 CO 0.01 0.48 -0.01 0.23 0.00 0.00 0.00 176.54 177.26 3h9b h SER 263 N 1.13 0.91 -0.18 0.19 0.87 -0.71 -0.11 113.55 115.65 3h9b h SER 263 Ca 0.29 -0.24 -0.17 0.00 -1.23 0.00 0.00 61.79 60.44 3h9b h SER 263 Cb -0.03 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 61.68 3h9b h SER 263 CO -0.05 0.97 -0.52 0.15 -0.53 0.00 0.00 176.83 176.85 3h9b h PHE 264 N 0.86 0.95 -0.66 2.24 3.57 -0.75 -1.70 116.94 121.45 3h9b h PHE 264 Ca 0.16 -0.33 -0.03 0.00 3.53 0.00 0.00 57.97 61.30 3h9b h PHE 264 Cb 0.52 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 3h9b h PHE 264 CO 0.03 1.12 0.30 -0.22 -2.23 0.00 0.00 178.31 177.31 3h9b h LYS 265 N 0.59 0.97 -0.82 1.11 3.64 -0.80 -0.75 116.57 120.52 3h9b h LYS 265 Ca 0.02 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 3h9b h LYS 265 Cb 1.10 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.71 3h9b h LYS 265 CO 0.11 0.79 0.53 -0.97 -2.27 0.00 0.00 179.45 177.64 3h9b h ASN 266 N 0.93 0.95 -0.22 4.20 -0.73 -0.85 0.67 115.58 120.53 3h9b h ASN 266 Ca 0.23 -0.04 -0.02 0.00 1.87 0.00 0.00 56.30 58.34 3h9b h ASN 266 Cb 0.16 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.50 3h9b h ASN 266 CO -0.02 0.70 0.07 0.25 -0.37 0.00 0.00 177.43 178.06 3h9b h LEU 267 N 1.11 0.32 -0.43 0.34 5.85 -0.78 -0.75 115.31 120.97 3h9b h LEU 267 Ca 0.30 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.83 3h9b h LEU 267 Cb -0.11 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 3h9b h LEU 267 CO -0.06 0.44 0.27 0.00 -0.34 0.00 0.00 178.44 178.75 3h9b h ASP 269 N 0.55 0.97 -0.09 0.00 3.32 -0.69 0.53 116.42 121.01 3h9b h ASP 269 Ca 0.16 -0.17 -0.06 0.00 0.02 0.00 0.00 57.03 56.98 3h9b h ASP 269 Cb -0.03 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 3h9b h ASP 269 CO -0.05 0.88 -0.12 0.11 -1.72 0.00 0.00 179.24 178.33 3h9b h LYS 270 N 1.01 0.42 0.00 3.56 1.57 -0.88 -2.23 116.57 120.01 3h9b h LYS 270 Ca 0.24 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3h9b h LYS 270 Cb 0.21 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3h9b h LYS 270 CO -0.02 0.55 0.00 0.54 -0.57 0.00 0.00 179.45 179.95 3h9b n ARG 271 N -4.22 0.17 -1.17 3.15 1.74 -0.56 -4.89 116.66 110.88 3h9b n ARG 271 Ca 0.00 0.17 -0.03 0.00 -0.77 0.00 0.00 57.85 57.22 3h9b n ARG 271 Cb 0.31 -1.71 -0.01 0.00 -1.02 0.00 0.00 32.46 30.02 3h9b n ARG 271 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h9b n GLY 272 N 1.22 0.58 3.49 -0.13 0.00 -0.42 -4.99 105.19 104.94 3h9b n GLY 272 Ca 0.06 -0.93 -0.43 0.00 0.00 0.00 0.00 46.02 44.72 3h9b n GLY 272 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h9b s ASP 273 N -2.96 6.30 0.00 1.61 3.68 0.05 -4.92 116.67 120.42 3h9b s ASP 273 Ca 0.00 -0.54 0.21 0.00 2.13 0.00 0.00 52.55 54.35 3h9b s ASP 273 Cb 0.00 -2.35 0.57 0.00 -1.45 0.00 0.00 42.92 39.69 3h9b s ASP 273 CO 0.00 -0.98 1.46 -1.54 0.13 0.00 0.00 175.17 174.24 3h9b n SER 274 N 6.65 2.52 -0.01 -0.34 3.41 -1.26 -4.39 113.62 120.20 3h9b n SER 274 Ca -0.02 -1.86 -0.01 0.00 -0.26 0.00 0.00 58.87 56.72 3h9b n SER 274 Cb 0.47 -0.18 -0.01 0.00 -0.26 0.00 0.00 64.21 64.22 3h9b n SER 274 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3h9b n VAL 275 N 0.88 0.09 0.02 -3.33 0.24 -1.26 -4.81 118.33 110.16 3h9b n VAL 275 Ca 0.17 -0.05 0.02 0.00 -2.04 0.00 0.00 64.34 62.44 3h9b n VAL 275 Cb 0.46 -0.95 0.36 0.00 -1.47 0.00 0.00 33.84 32.24 3h9b n VAL 275 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3h9b h SER 276 N 0.00 0.44 0.11 -1.34 0.02 -1.99 -2.53 113.55 108.26 3h9b h SER 276 Ca -0.03 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3h9b h SER 276 Cb 1.07 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.48 3h9b h SER 276 CO 0.00 0.44 -0.11 0.15 -1.14 0.00 0.00 176.83 176.18 3h9b h PHE 277 N 0.47 -0.28 -0.38 3.45 3.57 -1.87 -1.27 116.94 120.63 3h9b h PHE 277 Ca 0.11 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 3h9b h PHE 277 Cb 0.18 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 3h9b h PHE 277 CO 0.01 -0.17 -0.05 -0.44 -2.23 0.00 0.00 178.31 175.43 3h9b h ASP 278 N -0.24 0.60 -0.04 0.41 3.32 -1.88 -0.67 116.42 117.92 3h9b h ASP 278 Ca 0.00 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 3h9b h ASP 278 Cb 0.23 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 3h9b h ASP 278 CO -0.03 0.70 -0.02 -0.33 -1.72 0.00 0.00 179.24 177.85 3h9b h GLU 279 N 0.59 0.17 0.00 3.56 5.08 -0.99 -0.99 114.58 122.01 3h9b h GLU 279 Ca 0.12 -0.02 -0.26 0.00 -1.00 0.00 0.00 59.36 58.19 3h9b h GLU 279 Cb 0.44 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 3h9b h GLU 279 CO 0.02 0.21 -1.78 0.66 -1.00 0.00 0.00 179.01 177.12 3h9b n TYR 280 N -4.41 0.75 0.35 4.33 4.02 -0.52 -4.29 117.16 117.39 3h9b n TYR 280 Ca -0.01 0.26 0.06 0.00 -0.01 0.00 0.00 57.90 58.20 3h9b n TYR 280 Cb 0.16 -1.09 -0.08 0.00 -0.02 0.00 0.00 39.34 38.31 3h9b n TYR 280 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 3h9b n TRP 281 N -2.91 0.00 -1.67 -0.72 7.02 -0.29 -4.86 117.44 114.01 3h9b n TRP 281 Ca -0.18 0.00 -0.32 0.00 -1.02 0.00 0.00 57.50 55.98 3h9b n TRP 281 Cb 1.00 -0.10 0.05 0.00 -2.42 0.00 0.00 31.31 29.84 3h9b n TRP 281 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 3h9b s LYS 282 N -2.38 2.74 0.47 -0.99 -0.14 -0.39 -1.26 119.74 117.79 3h9b s LYS 282 Ca 0.01 1.31 0.19 0.00 -1.36 0.00 0.00 55.97 56.12 3h9b s LYS 282 Cb 0.08 -1.95 1.18 0.00 -1.68 0.00 0.00 37.83 35.47 3h9b s LYS 282 CO 0.49 -1.29 1.97 0.87 -0.76 0.00 0.00 175.35 176.64 3h9b h LYS 283 N -0.20 0.24 -0.47 1.68 1.57 -1.85 -1.77 116.57 115.77 3h9b h LYS 283 Ca -0.46 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 3h9b h LYS 283 Cb 1.24 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.50 3h9b h LYS 283 CO 0.54 0.16 0.00 -0.40 -0.57 0.00 0.00 179.45 179.18 3h9b n ASP 284 N -4.44 2.03 -4.77 0.86 5.75 -1.26 -4.78 116.55 109.94 3h9b n ASP 284 Ca 0.11 -2.12 -0.41 0.00 -0.01 0.00 0.00 54.79 52.36 3h9b n ASP 284 Cb 0.50 -0.32 -0.00 0.00 -1.03 0.00 0.00 41.12 40.27 3h9b n ASP 284 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 3h9b n SER 285 N 0.35 3.78 -0.85 -1.12 2.88 -0.66 -4.91 113.62 113.09 3h9b n SER 285 Ca 0.11 1.22 0.08 0.00 -1.33 0.00 0.00 58.87 58.95 3h9b n SER 285 Cb 0.38 -1.62 0.17 0.00 -0.75 0.00 0.00 64.21 62.39 3h9b n SER 285 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3h9b n THR 286 N 0.56 0.65 -2.55 2.46 -2.24 -1.26 -4.97 114.28 106.93 3h9b n THR 286 Ca 0.02 -0.82 -0.30 0.00 -2.27 0.00 0.00 64.05 60.68 3h9b n THR 286 Cb 0.39 0.80 -0.02 0.00 -2.10 0.00 0.00 70.33 69.40 3h9b n THR 286 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h9b s ALA 287 N -1.13 3.28 -0.10 6.98 0.00 -1.26 -4.78 121.76 124.74 3h9b s ALA 287 Ca 0.29 -0.21 -0.05 0.00 0.00 0.00 0.00 51.96 51.99 3h9b s ALA 287 Cb 0.16 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 3h9b s ALA 287 CO 0.22 -0.26 0.11 -1.21 0.00 0.00 0.00 175.76 174.62 3h9b s GLU 288 N -4.36 3.32 -0.14 0.00 2.02 0.37 -5.00 118.70 114.90 3h9b s GLU 288 Ca 0.52 -0.22 0.00 0.00 0.02 0.00 0.00 54.97 55.30 3h9b s GLU 288 Cb -0.10 -3.08 0.02 0.00 0.10 0.00 0.00 34.13 31.07 3h9b s GLU 288 CO 0.39 0.75 -0.14 -1.17 0.02 0.00 0.00 175.26 175.12 3h9b s LEU 289 N -1.07 1.64 -0.02 1.80 2.96 -1.26 -0.61 118.68 122.12 3h9b s LEU 289 Ca 0.16 -0.46 0.04 0.00 -0.22 0.00 0.00 54.13 53.65 3h9b s LEU 289 Cb -0.12 -1.13 -0.01 0.00 0.50 0.00 0.00 46.19 45.43 3h9b s LEU 289 CO 0.05 -0.05 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.57 3h9b s TYR 290 N 1.43 1.42 -0.18 5.38 1.51 -0.12 -0.20 117.35 126.58 3h9b s TYR 290 Ca 0.03 -0.32 0.00 0.00 -1.01 0.00 0.00 57.07 55.77 3h9b s TYR 290 Cb -0.13 -0.94 0.01 0.00 -0.11 0.00 0.00 41.96 40.79 3h9b s TYR 290 CO -0.09 -0.08 -0.17 -1.01 -1.11 0.00 0.00 175.55 173.10 3h9b s HIS 291 N -0.16 2.80 -0.23 2.71 3.76 -1.14 -1.34 115.29 121.70 3h9b s HIS 291 Ca 0.02 -1.38 -0.17 0.00 -0.15 0.00 0.00 55.06 53.37 3h9b s HIS 291 Cb -0.08 -1.94 -0.03 0.00 1.11 0.00 0.00 32.58 31.64 3h9b s HIS 291 CO 0.00 -0.68 0.48 -0.06 -0.85 0.00 0.00 174.74 173.63 3h9b s PHE 292 N 1.19 3.33 0.17 1.40 0.40 -0.29 -0.79 117.98 123.37 3h9b s PHE 292 Ca 0.02 0.66 -0.06 0.00 -0.60 0.00 0.00 56.93 56.95 3h9b s PHE 292 Cb -0.14 -2.65 -0.02 0.00 0.51 0.00 0.00 43.02 40.72 3h9b s PHE 292 CO -0.08 -0.15 0.21 0.96 0.70 0.00 0.00 175.22 176.86 3h9b s ILE 293 N 1.82 0.06 0.32 0.64 -4.36 -0.48 -3.01 121.20 116.19 3h9b s ILE 293 Ca 0.21 -1.64 -0.01 0.00 -0.26 0.00 0.00 60.65 58.96 3h9b s ILE 293 Cb -0.15 -2.03 -0.04 0.00 1.25 0.00 0.00 42.46 41.49 3h9b s ILE 293 CO 0.09 -0.28 0.53 -0.83 0.24 0.00 0.00 174.94 174.69 3h9b s GLY 294 N -3.02 1.50 0.60 6.27 0.00 -1.26 -1.60 107.32 109.81 3h9b s GLY 294 Ca 0.23 -0.82 0.35 0.00 0.00 0.00 0.00 44.72 44.47 3h9b s GLY 294 CO 0.03 -0.75 2.24 0.07 0.00 0.00 0.00 173.10 174.69 3h9b h LYS 295 N 1.09 0.00 0.00 2.90 2.10 -1.82 -2.55 116.57 118.29 3h9b h LYS 295 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 3h9b h LYS 295 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 3h9b h LYS 295 CO 0.63 0.03 0.00 -0.44 -2.00 0.00 0.00 179.45 177.67 3h9b h ASP 296 N 0.00 0.00 -0.17 7.07 3.45 -1.94 -3.03 116.42 121.80 3h9b h ASP 296 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3h9b h ASP 296 Cb 0.10 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.87 3h9b h ASP 296 CO 0.00 0.00 0.00 2.30 -1.57 0.00 0.00 179.24 179.97 3h9b n ILE 297 N -2.92 1.38 0.05 0.35 -5.35 -0.96 -4.69 119.36 107.22 3h9b n ILE 297 Ca 0.00 -1.36 0.05 0.00 -0.27 0.00 0.00 62.75 61.17 3h9b n ILE 297 Cb 0.24 0.25 0.47 0.00 -1.74 0.00 0.00 39.64 38.86 3h9b n ILE 297 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 3h9b h VAL 298 N 1.03 1.07 -0.58 7.28 2.07 -1.59 -2.34 116.25 123.21 3h9b h VAL 298 Ca 0.00 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 3h9b h VAL 298 Cb 0.83 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 3h9b h VAL 298 CO 0.04 0.08 0.35 0.22 0.02 0.00 0.00 177.57 178.28 3h9b h TYR 299 N 0.43 0.76 -0.23 1.57 5.03 -1.83 0.91 116.97 123.60 3h9b h TYR 299 Ca 0.12 -0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.39 3h9b h TYR 299 Cb -0.03 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 37.99 3h9b h TYR 299 CO -0.00 0.52 -0.01 0.74 -1.32 0.00 0.00 178.16 178.10 3h9b h PHE 300 N 0.78 0.45 0.00 -3.82 -1.00 -1.79 -2.34 116.94 109.22 3h9b h PHE 300 Ca 0.21 -0.08 0.00 0.00 2.81 0.00 0.00 57.97 60.91 3h9b h PHE 300 Cb -0.01 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 39.43 3h9b h PHE 300 CO -0.02 0.59 -0.19 -0.07 -1.61 0.00 0.00 178.31 177.01 3h9b h LEU 301 N 0.18 0.00 0.00 1.54 -0.00 -1.34 -0.58 115.31 115.11 3h9b h LEU 301 Ca 0.07 -0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.94 3h9b h LEU 301 Cb 0.42 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.08 3h9b h LEU 301 CO 0.01 0.00 -1.99 -1.54 -0.00 0.00 0.00 178.44 174.93 3h9b n SER 302 N -3.01 0.09 0.01 -0.43 3.41 0.30 -4.28 113.62 109.71 3h9b n SER 302 Ca 0.03 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.63 3h9b n SER 302 Cb 0.53 1.97 -0.00 0.00 -0.26 0.00 0.00 64.21 66.45 3h9b n SER 302 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h9b n LEU 303 N -2.25 0.53 0.08 1.04 4.77 -0.89 -4.65 117.00 115.64 3h9b n LEU 303 Ca -0.04 0.07 -0.12 0.00 -0.03 0.00 0.00 56.01 55.89 3h9b n LEU 303 Cb 0.57 -0.24 -0.06 0.00 -2.33 0.00 0.00 43.42 41.36 3h9b n LEU 303 CO 0.45 -0.56 0.78 -0.26 -1.33 0.00 0.00 177.39 176.47 3h9b h PHE 304 N -0.09 -0.35 0.29 -1.77 0.05 -1.52 -2.98 116.94 110.58 3h9b h PHE 304 Ca 0.00 0.01 -0.00 0.00 3.82 0.00 0.00 57.97 61.80 3h9b h PHE 304 Cb 0.09 0.15 -0.02 0.00 2.00 0.00 0.00 35.95 38.17 3h9b h PHE 304 CO -0.04 -0.20 -0.28 2.35 -0.18 0.00 0.00 178.31 179.96 3h9b h TRP 305 N -0.26 -0.74 -0.49 -0.55 -0.00 -1.33 0.58 115.95 113.17 3h9b h TRP 305 Ca 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.91 3h9b h TRP 305 Cb 0.28 0.29 -0.02 0.00 -0.00 0.00 0.00 29.16 29.71 3h9b h TRP 305 CO -0.16 -0.40 0.25 -1.35 -0.00 0.00 0.00 178.44 176.77 3h9b h PRO 306 N -0.60 0.67 -0.41 2.65 0.11 -1.74 -1.41 132.00 131.27 3h9b h PRO 306 Ca -0.01 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 65.97 3h9b h PRO 306 Cb 0.54 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 3h9b h PRO 306 CO -0.05 0.51 0.03 0.00 -0.21 0.00 0.00 178.00 178.28 3h9b h ALA 307 N 1.60 0.55 -0.29 -0.75 0.00 -1.33 -0.54 119.26 118.50 3h9b h ALA 307 Ca 0.17 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3h9b h ALA 307 Cb 0.04 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3h9b h ALA 307 CO -0.03 0.30 0.17 0.52 0.00 0.00 0.00 179.25 180.22 3h9b h MET 308 N 0.54 0.34 -0.23 0.00 2.86 -0.34 -0.34 114.93 117.77 3h9b h MET 308 Ca 0.12 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 3h9b h MET 308 Cb 0.44 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 3h9b h MET 308 CO 0.02 0.23 0.10 -0.07 1.06 0.00 0.00 176.91 178.24 3h9b h LEU 309 N 0.35 0.31 -0.38 1.22 3.38 -1.16 -2.24 115.31 116.79 3h9b h LEU 309 Ca 0.11 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.97 3h9b h LEU 309 Cb -0.00 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 3h9b h LEU 309 CO -0.05 0.37 0.17 -0.08 0.09 0.00 0.00 178.44 178.94 3h9b h GLU 310 N 0.23 0.34 0.00 1.13 4.57 -0.89 -0.79 114.58 119.18 3h9b h GLU 310 Ca 0.08 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 3h9b h GLU 310 Cb 0.15 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 3h9b h GLU 310 CO -0.01 0.23 0.00 0.41 -1.18 0.00 0.00 179.01 178.46 3h9b n GLY 311 N -1.22 -1.13 0.42 1.92 0.00 -0.16 -2.62 105.19 102.41 3h9b n GLY 311 Ca 0.01 0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.17 3h9b n GLY 311 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h9b n SER 312 N -2.04 2.90 -2.95 1.61 3.41 -0.82 -4.16 113.62 111.57 3h9b n SER 312 Ca 0.02 -2.74 -0.19 0.00 -0.26 0.00 0.00 58.87 55.70 3h9b n SER 312 Cb 0.18 -0.37 0.06 0.00 -0.26 0.00 0.00 64.21 63.82 3h9b n SER 312 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3h9b n ASN 313 N -0.70 -5.50 -4.46 4.04 5.15 -0.89 -4.99 115.26 107.91 3h9b n ASN 313 Ca 0.15 -0.43 -0.25 0.00 -0.60 0.00 0.00 54.58 53.45 3h9b n ASN 313 Cb 0.63 -4.11 -0.11 0.00 -0.53 0.00 0.00 39.78 35.67 3h9b n ASN 313 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 3h9b s PHE 314 N -3.25 2.31 0.80 1.20 0.40 -0.36 -4.23 117.98 114.85 3h9b s PHE 314 Ca 0.46 -0.34 -0.11 0.00 -0.60 0.00 0.00 56.93 56.35 3h9b s PHE 314 Cb -0.20 -1.07 0.07 0.00 0.51 0.00 0.00 43.02 42.33 3h9b s PHE 314 CO 0.57 0.62 1.09 -0.98 0.70 0.00 0.00 175.22 177.22 3h9b s ARG 315 N -3.14 2.02 0.39 0.44 1.04 -0.39 -4.09 118.95 115.23 3h9b s ARG 315 Ca 0.26 1.10 0.08 0.00 -1.04 0.00 0.00 55.73 56.13 3h9b s ARG 315 Cb -0.06 -1.87 -0.03 0.00 -2.04 0.00 0.00 34.95 30.94 3h9b s ARG 315 CO 0.13 -1.79 0.32 0.15 -0.04 0.00 0.00 175.30 174.07 3h9b s LYS 316 N -4.91 2.54 0.35 3.89 1.02 -1.26 -4.84 119.74 116.54 3h9b s LYS 316 Ca 0.62 -1.51 -0.28 0.00 0.02 0.00 0.00 55.97 54.82 3h9b s LYS 316 Cb -0.17 -2.35 -0.12 0.00 -0.52 0.00 0.00 37.83 34.67 3h9b s LYS 316 CO 0.56 -0.10 1.39 -2.30 -0.92 0.00 0.00 175.35 173.99 3h9b n PRO 317 N -1.45 2.38 0.02 -1.68 -0.02 -1.26 -4.84 135.00 128.15 3h9b n PRO 317 Ca 0.01 0.84 -0.09 0.00 -2.02 0.00 0.00 63.50 62.24 3h9b n PRO 317 Cb 0.61 -2.49 0.05 0.00 -0.02 0.00 0.00 33.50 31.65 3h9b n PRO 317 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3h9b h SER 318 N 2.87 0.58 -4.89 2.55 0.02 -0.97 -3.47 113.55 110.23 3h9b h SER 318 Ca -0.48 -0.32 0.17 0.00 -0.84 0.00 0.00 61.79 60.31 3h9b h SER 318 Cb 1.26 -0.17 -0.13 0.00 0.14 0.00 0.00 62.40 63.50 3h9b h SER 318 CO 0.64 1.04 0.56 0.21 -1.14 0.00 0.00 176.83 178.14 3h9b s ASN 319 N -6.93 -0.25 -0.08 3.07 3.84 -1.12 -4.96 114.94 108.50 3h9b s ASN 319 Ca -0.07 -0.13 0.05 0.00 0.21 0.00 0.00 52.86 52.92 3h9b s ASN 319 Cb 0.11 0.36 -0.01 0.00 -0.55 0.00 0.00 41.25 41.17 3h9b s ASN 319 CO 0.84 -0.62 -0.23 -0.76 -2.79 0.00 0.00 177.10 173.53 3h9b s LEU 320 N -2.62 2.15 -0.36 3.21 1.43 -1.26 -2.86 118.68 118.36 3h9b s LEU 320 Ca 0.08 -0.50 -0.02 0.00 -1.03 0.00 0.00 54.13 52.66 3h9b s LEU 320 Cb -0.01 -1.41 0.08 0.00 0.03 0.00 0.00 46.19 44.88 3h9b s LEU 320 CO -0.05 0.21 0.11 -0.36 0.23 0.00 0.00 176.35 176.50 3h9b s PHE 321 N 0.02 3.45 -0.14 0.29 2.99 0.03 -4.63 117.98 119.98 3h9b s PHE 321 Ca -0.09 -2.17 -0.09 0.00 0.00 0.00 0.00 56.93 54.59 3h9b s PHE 321 Cb -0.15 -2.71 -0.04 0.00 0.00 0.00 0.00 43.02 40.11 3h9b s PHE 321 CO 0.05 -0.89 0.15 0.08 -0.00 0.00 0.00 175.22 174.62 3h9b s VAL 322 N 1.19 5.45 0.33 -0.44 1.01 -1.26 -1.39 120.40 125.29 3h9b s VAL 322 Ca 0.02 0.24 0.10 0.00 0.00 0.00 0.00 61.98 62.35 3h9b s VAL 322 Cb -0.21 -3.44 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 3h9b s VAL 322 CO -0.03 0.55 -0.12 -1.38 0.00 0.00 0.00 175.10 174.13 3h9b s HIS 323 N -0.53 2.36 0.00 5.22 -3.43 -0.63 -4.28 115.29 114.00 3h9b s HIS 323 Ca 0.13 -0.47 0.00 0.00 -0.80 0.00 0.00 55.06 53.92 3h9b s HIS 323 Cb -0.12 -1.28 0.00 0.00 -1.43 0.00 0.00 32.58 29.75 3h9b s HIS 323 CO 0.02 0.60 0.00 0.41 -2.00 0.00 0.00 174.74 173.78 3h9b n GLY 324 N -0.74 0.49 3.88 -1.38 0.00 -1.07 -2.57 105.19 103.81 3h9b n GLY 324 Ca -0.05 -1.89 -0.30 0.00 0.00 0.00 0.00 46.02 43.78 3h9b n GLY 324 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h9b s TYR 325 N 0.28 3.46 -0.18 1.61 4.12 -1.26 -4.75 117.35 120.62 3h9b s TYR 325 Ca 0.00 1.07 -0.08 0.00 0.02 0.00 0.00 57.07 58.08 3h9b s TYR 325 Cb 0.00 -2.81 -0.04 0.00 -1.52 0.00 0.00 41.96 37.59 3h9b s TYR 325 CO 0.00 -0.84 0.06 0.08 0.02 0.00 0.00 175.55 174.87 3h9b s VAL 326 N -3.17 4.80 0.23 0.71 1.01 -1.26 -0.48 120.40 122.23 3h9b s VAL 326 Ca 0.55 -0.03 0.11 0.00 0.00 0.00 0.00 61.98 62.61 3h9b s VAL 326 Cb -0.11 -3.17 -0.05 0.00 0.00 0.00 0.00 36.38 33.06 3h9b s VAL 326 CO 0.51 0.46 -0.15 0.42 0.00 0.00 0.00 175.10 176.33 3h9b s THR 327 N 0.40 2.79 -0.12 3.92 -4.23 -0.26 -4.46 115.64 113.67 3h9b s THR 327 Ca 0.03 -2.02 0.02 0.00 -1.18 0.00 0.00 61.69 58.54 3h9b s THR 327 Cb -0.12 -2.41 0.01 0.00 1.34 0.00 0.00 72.50 71.32 3h9b s THR 327 CO 0.00 -0.23 -0.17 -0.69 -0.54 0.00 0.00 174.62 172.98 3h9b s VAL 328 N -2.01 1.68 -1.47 2.29 1.01 -0.02 -0.00 120.40 121.88 3h9b s VAL 328 Ca 0.26 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 3h9b s VAL 328 Cb -0.07 -1.52 0.03 0.00 0.00 0.00 0.00 36.38 34.82 3h9b s VAL 328 CO 0.14 0.48 0.71 0.59 0.00 0.00 0.00 175.10 177.02 3h9b n ASN 329 N 4.16 -5.52 0.00 3.32 3.02 -0.45 -2.30 115.26 117.49 3h9b n ASN 329 Ca -0.19 -0.40 0.00 0.00 -0.03 0.00 0.00 54.58 53.96 3h9b n ASN 329 Cb 0.51 -4.45 0.00 0.00 -0.61 0.00 0.00 39.78 35.23 3h9b n ASN 329 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h9b n GLY 330 N -1.54 2.39 3.45 7.41 0.00 -1.26 -5.02 105.19 110.62 3h9b n GLY 330 Ca -0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 3h9b n GLY 330 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9b s ALA 331 N -2.54 2.49 0.50 4.61 0.00 -0.97 -5.00 121.76 120.85 3h9b s ALA 331 Ca 0.00 -1.91 -0.22 0.00 0.00 0.00 0.00 51.96 49.83 3h9b s ALA 331 Cb 0.00 0.05 -0.08 0.00 0.00 0.00 0.00 23.12 23.09 3h9b s ALA 331 CO 0.00 0.02 1.05 1.17 0.00 0.00 0.00 175.76 178.00 3h9b n LYS 332 N -0.61 1.27 -1.66 0.00 4.81 -1.26 -0.84 118.16 119.87 3h9b n LYS 332 Ca -0.06 0.47 -0.45 0.00 -0.87 0.00 0.00 58.31 57.40 3h9b n LYS 332 Cb 0.63 -2.18 -0.03 0.00 0.02 0.00 0.00 35.03 33.47 3h9b n LYS 332 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 3h9b n MET 333 N -0.41 1.97 -4.10 1.64 2.81 -1.26 -4.72 117.12 113.05 3h9b n MET 333 Ca 0.11 0.70 -0.31 0.00 -1.81 0.00 0.00 57.70 56.39 3h9b n MET 333 Cb 0.43 -2.35 -0.16 0.00 -0.71 0.00 0.00 33.22 30.43 3h9b n MET 333 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3h9b s SER 334 N 0.28 2.78 0.13 7.83 0.15 -1.26 -4.76 113.70 118.85 3h9b s SER 334 Ca 0.69 -0.52 -0.17 0.00 0.70 0.00 0.00 55.95 56.65 3h9b s SER 334 Cb -0.66 -1.25 -0.02 0.00 -1.71 0.00 0.00 66.02 62.38 3h9b s SER 334 CO 0.50 -0.03 1.69 0.11 1.20 0.00 0.00 173.24 176.71 3h9b h LYS 335 N 7.96 0.53 -0.54 5.44 1.57 -1.92 0.13 116.57 129.75 3h9b h LYS 335 Ca -0.39 -0.09 0.03 0.00 -1.87 0.00 0.00 60.65 58.33 3h9b h LYS 335 Cb 1.14 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.33 3h9b h LYS 335 CO 0.55 0.50 0.36 0.66 -0.57 0.00 0.00 179.45 180.94 3h9b h SER 336 N 0.45 0.53 0.43 0.86 4.64 -1.93 -0.61 113.55 117.91 3h9b h SER 336 Ca 0.12 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3h9b h SER 336 Cb 0.15 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3h9b h SER 336 CO -0.01 0.36 -0.28 0.54 -0.87 0.00 0.00 176.83 176.57 3h9b n ARG 337 N -4.47 0.44 -1.76 4.77 1.74 -1.05 -4.93 116.66 111.39 3h9b n ARG 337 Ca 0.06 -0.22 -0.05 0.00 -0.77 0.00 0.00 57.85 56.87 3h9b n ARG 337 Cb 0.14 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.08 3h9b n ARG 337 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h9b n GLY 338 N 1.40 0.38 0.74 -0.13 0.00 -0.24 -4.92 105.19 102.41 3h9b n GLY 338 Ca 0.10 -0.73 0.10 0.00 0.00 0.00 0.00 46.02 45.49 3h9b n GLY 338 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h9b n THR 339 N -3.60 0.00 -2.90 2.61 -2.24 0.36 -4.49 114.28 104.02 3h9b n THR 339 Ca -0.06 -0.47 -0.44 0.00 -2.27 0.00 0.00 64.05 60.82 3h9b n THR 339 Cb 0.41 1.38 -0.03 0.00 -2.10 0.00 0.00 70.33 70.00 3h9b n THR 339 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3h9b s PHE 340 N -1.73 2.98 -0.20 4.78 5.36 -1.14 -4.34 117.98 123.68 3h9b s PHE 340 Ca 0.22 -1.14 -0.09 0.00 -0.96 0.00 0.00 56.93 54.96 3h9b s PHE 340 Cb 0.16 -4.29 -0.05 0.00 -0.34 0.00 0.00 43.02 38.51 3h9b s PHE 340 CO 0.28 -1.54 0.11 0.42 -1.46 0.00 0.00 175.22 173.03 3h9b s ILE 341 N 3.12 5.13 0.38 3.12 1.01 -1.26 -4.90 121.20 127.80 3h9b s ILE 341 Ca 0.30 0.09 -0.19 0.00 0.00 0.00 0.00 60.65 60.85 3h9b s ILE 341 Cb -0.08 -3.35 -0.10 0.00 0.01 0.00 0.00 42.46 38.94 3h9b s ILE 341 CO -0.04 0.42 0.86 -0.54 0.00 0.00 0.00 174.94 175.64 3h9b s LYS 342 N 0.55 4.15 0.25 2.79 1.02 -1.26 -1.51 119.74 125.74 3h9b s LYS 342 Ca 0.06 0.94 -0.05 0.00 0.02 0.00 0.00 55.97 56.94 3h9b s LYS 342 Cb -0.12 -2.32 0.29 0.00 -0.52 0.00 0.00 37.83 35.16 3h9b s LYS 342 CO 0.00 0.07 1.89 0.00 -0.92 0.00 0.00 175.35 176.39 3h9b h ALA 343 N 2.13 1.25 -0.65 5.17 0.00 -1.30 -1.37 119.26 124.49 3h9b h ALA 343 Ca -0.48 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.27 3h9b h ALA 343 Cb 1.18 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 3h9b h ALA 343 CO 0.63 0.63 0.20 0.66 0.00 0.00 0.00 179.25 181.38 3h9b h SER 344 N 1.23 0.94 -0.34 0.00 4.64 -1.94 -2.87 113.55 115.20 3h9b h SER 344 Ca 0.32 -0.21 -0.03 0.00 -0.47 0.00 0.00 61.79 61.39 3h9b h SER 344 Cb -0.03 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.80 3h9b h SER 344 CO -0.06 0.90 0.08 0.74 -0.87 0.00 0.00 176.83 177.62 3h9b h THR 345 N 0.94 1.23 -0.59 2.95 2.02 -1.82 -3.09 112.91 114.54 3h9b h THR 345 Ca 0.21 -0.77 0.12 0.00 0.77 0.00 0.00 66.41 66.74 3h9b h THR 345 Cb 0.29 1.07 -0.10 0.00 -1.74 0.00 0.00 68.15 67.67 3h9b h THR 345 CO -0.01 0.26 0.00 -0.25 0.37 0.00 0.00 175.52 175.89 3h9b h TRP 346 N 0.40 -0.04 0.00 3.16 2.91 -1.09 -0.71 115.95 120.59 3h9b h TRP 346 Ca 0.11 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.17 3h9b h TRP 346 Cb 0.31 0.11 0.00 0.00 -0.51 0.00 0.00 29.16 29.07 3h9b h TRP 346 CO 0.02 -0.15 0.00 -0.07 -1.03 0.00 0.00 178.44 177.21 3h9b h LEU 347 N 0.12 0.00 -0.26 0.65 3.38 -1.42 -0.26 115.31 117.51 3h9b h LEU 347 Ca 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 3h9b h LEU 347 Cb 0.49 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 3h9b h LEU 347 CO -0.50 0.00 -0.06 0.78 0.09 0.00 0.00 178.44 178.75 3h9b h ASN 348 N 0.00 0.00 0.00 -0.43 2.35 -1.15 -3.37 115.58 112.98 3h9b h ASN 348 Ca 0.00 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.55 3h9b h ASN 348 Cb 0.16 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 3h9b h ASN 348 CO 0.00 0.06 -1.75 1.41 -1.65 0.00 0.00 177.43 175.50 3h9b n HIS 349 N -3.12 0.00 -4.34 1.19 8.25 -0.53 -5.07 115.22 111.60 3h9b n HIS 349 Ca 0.03 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.32 3h9b n HIS 349 Cb 0.51 -0.51 -0.10 0.00 1.12 0.00 0.00 29.99 31.01 3h9b n HIS 349 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3h9b s PHE 350 N -2.26 1.59 0.72 4.41 0.40 -0.22 -5.05 117.98 117.56 3h9b s PHE 350 Ca -0.16 -1.02 -0.06 0.00 -0.60 0.00 0.00 56.93 55.08 3h9b s PHE 350 Cb 0.04 -0.95 0.08 0.00 0.51 0.00 0.00 43.02 42.71 3h9b s PHE 350 CO 0.32 -0.15 1.02 0.16 0.70 0.00 0.00 175.22 177.27 3h9b s ASP 351 N -3.33 4.63 0.13 1.36 -4.77 -1.26 -4.09 116.67 109.35 3h9b s ASP 351 Ca 0.32 0.29 -0.11 0.00 -3.30 0.00 0.00 52.55 49.76 3h9b s ASP 351 Cb 0.07 -0.87 -0.06 0.00 -1.09 0.00 0.00 42.92 40.97 3h9b s ASP 351 CO 0.11 -1.70 1.42 0.00 0.70 0.00 0.00 175.17 175.70 3h9b h ALA 352 N -0.63 0.49 -0.79 2.11 0.00 -1.95 -3.27 119.26 115.23 3h9b h ALA 352 Ca -0.43 -0.51 0.10 0.00 0.00 0.00 0.00 54.91 54.07 3h9b h ALA 352 Cb 1.30 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 3h9b h ALA 352 CO 0.55 0.68 0.52 -0.44 0.00 0.00 0.00 179.25 180.56 3h9b h ASP 353 N 0.66 0.62 -0.41 0.00 3.32 -1.92 -1.48 116.42 117.20 3h9b h ASP 353 Ca 0.02 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 3h9b h ASP 353 Cb 1.14 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 3h9b h ASP 353 CO 0.12 0.36 0.25 0.77 -1.72 0.00 0.00 179.24 179.02 3h9b h SER 354 N 0.68 0.49 -0.25 6.45 4.64 -1.96 0.89 113.55 124.50 3h9b h SER 354 Ca 0.37 -0.06 -0.20 0.00 -0.47 0.00 0.00 61.79 61.44 3h9b h SER 354 Cb 0.51 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3h9b h SER 354 CO -0.14 0.41 -0.61 0.25 -0.87 0.00 0.00 176.83 175.87 3h9b h LEU 355 N 0.54 0.97 -0.53 5.97 5.85 -1.61 -1.96 115.31 124.54 3h9b h LEU 355 Ca 0.15 -0.56 0.03 0.00 0.84 0.00 0.00 57.88 58.34 3h9b h LEU 355 Cb 0.00 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 3h9b h LEU 355 CO -0.03 1.35 0.31 0.03 -0.34 0.00 0.00 178.44 179.76 3h9b h ARG 356 N 0.63 0.59 -0.11 1.25 3.08 -1.06 -1.03 114.38 117.72 3h9b h ARG 356 Ca -0.00 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3h9b h ARG 356 Cb 1.22 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 31.14 3h9b h ARG 356 CO 0.13 0.39 0.04 -0.92 -1.07 0.00 0.00 179.97 178.54 3h9b h TYR 357 N 0.61 0.18 -0.23 3.04 3.20 -0.76 -1.72 116.97 121.28 3h9b h TYR 357 Ca 0.22 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.08 3h9b h TYR 357 Cb 0.05 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 3h9b h TYR 357 CO -0.07 0.30 0.12 -0.92 -1.64 0.00 0.00 178.16 175.95 3h9b h TYR 358 N 0.00 0.22 -0.35 -3.82 5.03 -1.09 -0.04 116.97 116.93 3h9b h TYR 358 Ca 0.04 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.36 3h9b h TYR 358 Cb 0.21 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.40 3h9b h TYR 358 CO -0.01 0.13 0.22 1.88 -1.32 0.00 0.00 178.16 179.07 3h9b h TYR 359 N 0.25 0.44 -0.77 -3.82 0.99 -1.20 -2.61 116.97 110.25 3h9b h TYR 359 Ca 0.09 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.83 3h9b h TYR 359 Cb 0.02 -0.15 -0.04 0.00 1.00 0.00 0.00 36.73 37.56 3h9b h TYR 359 CO -0.09 0.29 0.49 1.15 -0.00 0.00 0.00 178.16 179.99 3h9b h THR 360 N 0.46 1.21 0.00 -2.88 2.02 -0.94 0.52 112.91 113.30 3h9b h THR 360 Ca 0.13 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 3h9b h THR 360 Cb -0.04 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.46 3h9b h THR 360 CO -0.03 0.21 -0.11 0.00 0.37 0.00 0.00 175.52 175.96 3h9b h ALA 361 N 1.49 1.15 0.00 6.16 0.00 -0.65 -3.04 119.26 124.38 3h9b h ALA 361 Ca 0.28 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 3h9b h ALA 361 Cb -0.08 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3h9b h ALA 361 CO -0.06 0.14 -2.01 1.63 0.00 0.00 0.00 179.25 178.95 3h9b n LYS 362 N -3.44 0.66 -2.11 0.00 4.76 -0.60 -4.32 118.16 113.12 3h9b n LYS 362 Ca -0.01 -0.13 -0.35 0.00 -2.87 0.00 0.00 58.31 54.95 3h9b n LYS 362 Cb 0.27 -1.55 0.02 0.00 -1.84 0.00 0.00 35.03 31.93 3h9b n LYS 362 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3h9b s LEU 363 N -4.82 3.66 0.00 -0.35 1.43 0.08 -4.79 118.68 113.88 3h9b s LEU 363 Ca -0.08 2.17 -0.01 0.00 -1.03 0.00 0.00 54.13 55.18 3h9b s LEU 363 Cb 0.12 -4.58 0.00 0.00 0.03 0.00 0.00 46.19 41.76 3h9b s LEU 363 CO 0.88 -1.36 0.18 -1.54 0.23 0.00 0.00 176.35 174.74 3h9b n SER 364 N -1.59 -0.50 -0.18 2.29 3.41 -1.26 -0.02 113.62 115.78 3h9b n SER 364 Ca 0.12 -1.69 0.14 0.00 -0.26 0.00 0.00 58.87 57.17 3h9b n SER 364 Cb 0.51 0.93 0.73 0.00 -0.26 0.00 0.00 64.21 66.12 3h9b n SER 364 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3h9b n SER 365 N -1.94 0.55 -4.94 4.04 3.41 -1.17 -4.76 113.62 108.80 3h9b n SER 365 Ca 0.00 -1.26 -0.20 0.00 -0.26 0.00 0.00 58.87 57.15 3h9b n SER 365 Cb 0.21 -0.01 0.05 0.00 -0.26 0.00 0.00 64.21 64.21 3h9b n SER 365 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3h9b s ARG 366 N -1.98 2.36 -0.06 4.33 0.52 -1.26 -4.95 118.95 117.91 3h9b s ARG 366 Ca 0.41 -1.22 0.17 0.00 -0.52 0.00 0.00 55.73 54.57 3h9b s ARG 366 Cb 0.20 -2.57 0.60 0.00 0.52 0.00 0.00 34.95 33.70 3h9b s ARG 366 CO 0.33 -0.80 1.50 0.44 0.02 0.00 0.00 175.30 176.79 3h9b n ILE 367 N -2.29 1.27 -1.70 1.52 -5.35 -1.26 -4.64 119.36 106.92 3h9b n ILE 367 Ca 0.12 -0.95 -0.36 0.00 -0.27 0.00 0.00 62.75 61.29 3h9b n ILE 367 Cb 0.60 0.22 0.07 0.00 -1.74 0.00 0.00 39.64 38.79 3h9b n ILE 367 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 3h9b s ASP 368 N -0.91 4.60 0.58 7.28 1.01 -1.26 -2.58 116.67 125.39 3h9b s ASP 368 Ca 0.44 2.46 -0.19 0.00 0.71 0.00 0.00 52.55 55.97 3h9b s ASP 368 Cb 0.26 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.54 3h9b s ASP 368 CO 0.25 -1.99 1.19 -1.81 0.21 0.00 0.00 175.17 173.01 3h9b s ASP 369 N -1.69 5.36 -0.22 0.27 1.01 -1.26 -3.48 116.67 116.65 3h9b s ASP 369 Ca 0.78 2.34 -0.06 0.00 0.71 0.00 0.00 52.55 56.32 3h9b s ASP 369 Cb -0.32 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 40.99 3h9b s ASP 369 CO 0.40 -1.47 0.01 -0.63 0.21 0.00 0.00 175.17 173.69 3h9b s ILE 370 N -1.63 3.94 -0.25 0.77 -1.09 0.37 -4.91 121.20 118.39 3h9b s ILE 370 Ca 0.76 -0.31 -0.11 0.00 -2.23 0.00 0.00 60.65 58.76 3h9b s ILE 370 Cb -0.29 -2.81 -0.05 0.00 -1.58 0.00 0.00 42.46 37.74 3h9b s ILE 370 CO 0.31 0.40 0.20 -0.62 -1.23 0.00 0.00 174.94 174.00 3h9b s ASP 371 N 1.33 6.13 -0.82 3.58 3.68 -1.26 -1.11 116.67 128.20 3h9b s ASP 371 Ca 0.04 0.12 -0.16 0.00 2.13 0.00 0.00 52.55 54.69 3h9b s ASP 371 Cb -0.15 -2.13 0.18 0.00 -1.45 0.00 0.00 42.92 39.38 3h9b s ASP 371 CO 0.01 0.00 0.85 -0.22 0.13 0.00 0.00 175.17 175.95 3h9b s LEU 372 N 1.34 6.14 -0.35 -1.34 2.96 1.00 -4.95 118.68 123.48 3h9b s LEU 372 Ca 0.09 -2.36 -0.23 0.00 -0.22 0.00 0.00 54.13 51.41 3h9b s LEU 372 Cb -0.14 -2.27 0.01 0.00 0.50 0.00 0.00 46.19 44.28 3h9b s LEU 372 CO 0.07 -0.77 0.80 0.21 -1.32 0.00 0.00 176.35 175.34 3h9b s ASN 373 N 2.77 6.59 0.31 3.68 3.84 -1.26 -1.34 114.94 129.54 3h9b s ASN 373 Ca 0.21 0.46 -0.01 0.00 0.21 0.00 0.00 52.86 53.73 3h9b s ASN 373 Cb -0.11 -2.41 0.50 0.00 -0.55 0.00 0.00 41.25 38.68 3h9b s ASN 373 CO -0.07 -0.71 1.96 -0.07 -2.79 0.00 0.00 177.10 175.42 3h9b h LEU 374 N 9.70 0.90 -0.44 3.21 3.38 -1.95 0.13 115.31 130.23 3h9b h LEU 374 Ca -0.24 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.65 3h9b h LEU 374 Cb 1.09 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 3h9b h LEU 374 CO 0.91 0.64 0.04 -0.33 0.09 0.00 0.00 178.44 179.78 3h9b h GLU 375 N 1.05 0.75 -0.18 1.13 4.39 -2.01 -2.62 114.58 117.10 3h9b h GLU 375 Ca 0.31 -0.22 -0.09 0.00 0.34 0.00 0.00 59.36 59.70 3h9b h GLU 375 Cb -0.04 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 3h9b h GLU 375 CO -0.08 0.80 -0.28 0.22 -1.16 0.00 0.00 179.01 178.51 3h9b h ASP 376 N 0.61 0.34 -0.10 1.42 1.82 -1.84 -2.54 116.42 116.13 3h9b h ASP 376 Ca 0.13 -0.11 0.02 0.00 -0.39 0.00 0.00 57.03 56.68 3h9b h ASP 376 Cb 0.44 -0.09 -0.02 0.00 0.68 0.00 0.00 39.33 40.33 3h9b h ASP 376 CO 0.02 0.62 -0.03 0.15 -1.61 0.00 0.00 179.24 178.39 3h9b h PHE 377 N 0.30 -0.06 -0.09 0.28 3.57 -0.46 0.27 116.94 120.76 3h9b h PHE 377 Ca 0.04 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.55 3h9b h PHE 377 Cb 0.65 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.43 3h9b h PHE 377 CO 0.02 -0.04 0.05 0.28 -2.23 0.00 0.00 178.31 176.38 3h9b h VAL 378 N -0.00 1.08 -0.53 1.41 2.07 -1.30 -1.53 116.25 117.45 3h9b h VAL 378 Ca 0.05 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 3h9b h VAL 378 Cb 0.08 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3h9b h VAL 378 CO -0.11 0.07 0.25 1.56 0.02 0.00 0.00 177.57 179.36 3h9b h GLN 379 N 0.06 0.76 -0.32 1.57 4.20 -1.21 -2.28 115.11 117.89 3h9b h GLN 379 Ca 0.03 -0.11 -0.13 0.00 0.06 0.00 0.00 58.65 58.50 3h9b h GLN 379 Cb 0.06 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 3h9b h GLN 379 CO -0.01 0.63 -0.30 -0.09 -0.67 0.00 0.00 178.83 178.39 3h9b h ARG 380 N 0.71 0.77 -0.24 1.46 2.43 -0.40 -0.46 114.38 118.64 3h9b h ARG 380 Ca 0.18 -0.40 -0.02 0.00 -0.81 0.00 0.00 59.98 58.93 3h9b h ARG 380 Cb 0.12 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 3h9b h ARG 380 CO -0.02 1.03 0.08 0.28 -1.51 0.00 0.00 179.97 179.82 3h9b h VAL 381 N 0.54 1.19 -0.52 0.20 2.07 -1.27 0.22 116.25 118.68 3h9b h VAL 381 Ca 0.05 -0.61 -0.05 0.00 0.82 0.00 0.00 66.70 66.91 3h9b h VAL 381 Cb 0.88 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 3h9b h VAL 381 CO 0.08 0.20 0.11 0.78 0.02 0.00 0.00 177.57 178.76 3h9b h ASN 382 N 0.22 0.80 -0.18 0.57 2.35 -1.40 -1.25 115.58 116.69 3h9b h ASN 382 Ca 0.08 -0.24 -0.09 0.00 -0.55 0.00 0.00 56.30 55.50 3h9b h ASN 382 Cb 0.23 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.39 3h9b h ASN 382 CO -0.00 0.83 -0.23 0.00 -1.65 0.00 0.00 177.43 176.38 3h9b h ALA 383 N 0.99 0.27 0.02 -0.83 0.00 -0.98 -0.59 119.26 118.13 3h9b h ALA 383 Ca 0.16 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.56 3h9b h ALA 383 Cb 0.35 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3h9b h ALA 383 CO 0.00 0.23 -0.73 -0.44 0.00 0.00 0.00 179.25 178.31 3h9b h ASP 384 N 0.12 0.05 0.02 0.00 3.32 -0.99 -2.56 116.42 116.39 3h9b h ASP 384 Ca 0.02 -0.76 -0.00 0.00 0.02 0.00 0.00 57.03 56.31 3h9b h ASP 384 Cb 0.79 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.32 3h9b h ASP 384 CO 0.05 1.29 -0.01 0.40 -1.72 0.00 0.00 179.24 179.26 3h9b h ILE 385 N -0.91 1.04 0.06 0.35 1.08 -1.38 -1.95 117.51 115.80 3h9b h ILE 385 Ca -0.19 -1.70 -0.00 0.00 -0.39 0.00 0.00 64.86 62.58 3h9b h ILE 385 Cb 1.23 1.94 0.00 0.00 -3.07 0.00 0.00 36.82 36.92 3h9b h ILE 385 CO -0.08 0.34 -0.03 0.58 -0.69 0.00 0.00 178.15 178.27 3h9b h VAL 386 N -0.97 1.26 0.00 1.67 2.07 -1.47 0.06 116.25 118.87 3h9b h VAL 386 Ca -0.00 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.25 3h9b h VAL 386 Cb 0.58 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 3h9b h VAL 386 CO 0.01 0.31 -0.44 0.78 0.02 0.00 0.00 177.57 178.24 3h9b h ASN 387 N -0.67 0.00 0.00 0.57 2.35 -1.13 -2.49 115.58 114.22 3h9b h ASN 387 Ca -0.01 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.63 3h9b h ASN 387 Cb 0.56 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 3h9b h ASN 387 CO 0.01 0.04 -0.76 0.29 -1.65 0.00 0.00 177.43 175.37 3h9b n LYS 388 N -2.47 0.32 -0.01 0.81 5.02 -0.97 -4.60 118.16 116.27 3h9b n LYS 388 Ca 0.03 0.13 -0.01 0.00 -2.02 0.00 0.00 58.31 56.44 3h9b n LYS 388 Cb 0.48 -1.05 -0.01 0.00 -0.02 0.00 0.00 35.03 34.43 3h9b n LYS 388 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3h9b h VAL 389 N -0.59 0.00 0.00 -0.18 2.07 -1.40 -3.33 116.25 112.81 3h9b h VAL 389 Ca -0.05 -0.73 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 3h9b h VAL 389 Cb 0.69 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 3h9b h VAL 389 CO -0.03 0.00 -0.08 0.58 0.02 0.00 0.00 177.57 178.06 3h9b h VAL 390 N -0.81 0.86 -0.92 2.57 2.07 -1.13 -2.25 116.25 116.64 3h9b h VAL 390 Ca -0.01 -0.30 0.10 0.00 0.82 0.00 0.00 66.70 67.31 3h9b h VAL 390 Cb 0.06 1.17 -0.07 0.00 -1.52 0.00 0.00 31.29 30.93 3h9b h VAL 390 CO 0.01 0.08 0.59 -1.13 0.02 0.00 0.00 177.57 177.15 3h9b h ASN 391 N 0.00 0.85 -0.19 0.57 -0.00 -1.59 -0.26 115.58 114.96 3h9b h ASN 391 Ca -0.00 0.03 0.02 0.00 -0.00 0.00 0.00 56.30 56.34 3h9b h ASN 391 Cb 0.16 -0.15 -0.01 0.00 -0.00 0.00 0.00 38.32 38.32 3h9b h ASN 391 CO 0.01 0.50 0.13 -0.07 -0.00 0.00 0.00 177.43 177.99 3h9b h LEU 392 N 0.94 0.16 0.00 0.34 3.38 -1.51 -0.91 115.31 117.71 3h9b h LEU 392 Ca 0.43 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.26 3h9b h LEU 392 Cb 0.40 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3h9b h LEU 392 CO -0.19 0.11 -0.77 0.00 0.09 0.00 0.00 178.44 177.69 3h9b h ALA 393 N 1.89 0.16 0.00 1.53 0.00 -1.28 -3.34 119.26 118.22 3h9b h ALA 393 Ca 0.07 -0.92 -0.02 0.00 0.00 0.00 0.00 54.91 54.05 3h9b h ALA 393 Cb 0.07 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3h9b h ALA 393 CO -0.01 0.43 -0.08 0.66 0.00 0.00 0.00 179.25 180.25 3h9b h SER 394 N -1.00 0.00 0.75 0.00 4.64 -0.97 0.53 113.55 117.51 3h9b h SER 394 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 3h9b h SER 394 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3h9b h SER 394 CO -0.13 0.08 -0.70 -2.11 -0.87 0.00 0.00 176.83 173.11 3h9b n ARG 395 N -3.85 0.27 -0.04 4.77 1.85 -0.36 -4.41 116.66 114.90 3h9b n ARG 395 Ca -0.02 0.06 -0.03 0.00 -1.00 0.00 0.00 57.85 56.86 3h9b n ARG 395 Cb 0.18 -1.65 -0.07 0.00 -1.05 0.00 0.00 32.46 29.87 3h9b n ARG 395 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3h9b n ASN 396 N -2.04 2.95 -0.32 2.89 3.02 -0.94 -4.72 115.26 116.11 3h9b n ASN 396 Ca 0.03 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.55 3h9b n ASN 396 Cb 0.43 0.82 0.12 0.00 -0.61 0.00 0.00 39.78 40.54 3h9b n ASN 396 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h9b h ALA 397 N 0.47 1.24 -0.11 5.41 0.00 -1.12 -3.09 119.26 122.07 3h9b h ALA 397 Ca -0.19 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.65 3h9b h ALA 397 Cb 1.34 -0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 3h9b h ALA 397 CO 0.01 0.64 -0.18 0.78 0.00 0.00 0.00 179.25 180.49 3h9b h GLY 398 N 1.24 -0.15 0.96 0.00 0.00 -1.82 -0.61 103.07 102.69 3h9b h GLY 398 Ca 0.32 0.22 0.02 0.00 0.00 0.00 0.00 47.33 47.89 3h9b h GLY 398 CO -0.06 -0.17 0.59 0.74 0.00 0.00 0.00 176.54 177.64 3h9b h PHE 399 N -0.24 1.11 -0.36 5.60 0.05 -1.85 0.27 116.94 121.52 3h9b h PHE 399 Ca 0.09 0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.89 3h9b h PHE 399 Cb 0.37 -0.37 -0.02 0.00 2.00 0.00 0.00 35.95 37.94 3h9b h PHE 399 CO -0.29 0.68 0.16 0.82 -0.18 0.00 0.00 178.31 179.50 3h9b h ILE 400 N 1.18 1.18 -0.26 -0.55 1.08 -1.36 0.25 117.51 119.03 3h9b h ILE 400 Ca 0.34 -0.53 -0.14 0.00 -0.39 0.00 0.00 64.86 64.14 3h9b h ILE 400 Cb -0.09 0.86 -0.00 0.00 -3.07 0.00 0.00 36.82 34.52 3h9b h ILE 400 CO -0.09 0.19 -0.38 0.78 -0.69 0.00 0.00 178.15 177.97 3h9b h ASN 401 N 0.44 0.79 0.66 1.72 2.35 -0.80 0.58 115.58 121.31 3h9b h ASN 401 Ca 0.12 -0.51 -0.27 0.00 -0.55 0.00 0.00 56.30 55.09 3h9b h ASN 401 Cb 0.16 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.30 3h9b h ASN 401 CO -0.01 1.14 -1.21 0.11 -1.65 0.00 0.00 177.43 175.81 3h9b h LYS 402 N 0.45 0.25 0.00 0.81 1.57 -0.93 -3.30 116.57 115.42 3h9b h LYS 402 Ca 0.03 -0.42 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 3h9b h LYS 402 Cb 0.97 0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.43 3h9b h LYS 402 CO 0.09 1.20 -0.89 0.54 -0.57 0.00 0.00 179.45 179.81 3h9b n ARG 403 N -3.52 2.24 -0.78 3.15 1.74 0.07 -4.68 116.66 114.89 3h9b n ARG 403 Ca -0.08 -0.04 0.05 0.00 -0.77 0.00 0.00 57.85 57.02 3h9b n ARG 403 Cb 1.01 -1.11 0.10 0.00 -1.02 0.00 0.00 32.46 31.44 3h9b n ARG 403 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3h9b n PHE 404 N -1.50 0.00 -2.21 -1.55 3.01 -0.72 -4.99 117.46 109.50 3h9b n PHE 404 Ca 0.01 -0.86 -0.14 0.00 1.01 0.00 0.00 57.45 57.46 3h9b n PHE 404 Cb 0.22 -0.17 -0.02 0.00 -0.01 0.00 0.00 39.48 39.50 3h9b n PHE 404 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 3h9b n ASP 405 N -0.49 -4.26 -0.09 4.37 8.00 -1.14 -1.25 116.55 121.70 3h9b n ASP 405 Ca 0.11 0.19 -0.01 0.00 0.71 0.00 0.00 54.79 55.79 3h9b n ASP 405 Cb 0.83 -3.66 -0.00 0.00 -0.02 0.00 0.00 41.12 38.26 3h9b n ASP 405 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h9b n GLY 406 N -0.73 0.47 3.68 0.44 0.00 0.12 -4.91 105.19 104.25 3h9b n GLY 406 Ca -0.16 -0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 3h9b n GLY 406 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h9b s VAL 407 N -1.85 5.27 0.52 1.61 1.01 -0.38 -0.55 120.40 126.03 3h9b s VAL 407 Ca 0.00 0.14 -0.17 0.00 0.00 0.00 0.00 61.98 61.95 3h9b s VAL 407 Cb 0.00 -3.43 -0.07 0.00 0.00 0.00 0.00 36.38 32.88 3h9b s VAL 407 CO 0.00 0.40 1.01 -0.76 0.00 0.00 0.00 175.10 175.74 3h9b s LEU 408 N 0.71 3.66 0.76 3.92 1.43 0.20 -4.90 118.68 124.46 3h9b s LEU 408 Ca 0.07 1.70 -0.15 0.00 -1.03 0.00 0.00 54.13 54.71 3h9b s LEU 408 Cb -0.12 -4.53 -0.01 0.00 0.03 0.00 0.00 46.19 41.56 3h9b s LEU 408 CO 0.01 -0.73 0.65 0.00 0.23 0.00 0.00 176.35 176.51 3h9b n ALA 409 N -1.50 -1.28 0.46 4.21 0.00 -1.26 -2.34 120.51 118.81 3h9b n ALA 409 Ca 0.08 -0.28 0.13 0.00 0.00 0.00 0.00 53.44 53.36 3h9b n ALA 409 Cb 0.53 -1.93 0.43 0.00 0.00 0.00 0.00 19.45 18.49 3h9b n ALA 409 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3h9b h SER 410 N -0.54 0.00 -5.15 0.00 0.02 -1.94 -1.03 113.55 104.92 3h9b h SER 410 Ca -0.46 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.39 3h9b h SER 410 Cb 1.33 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.72 3h9b h SER 410 CO 0.43 0.00 -0.45 -1.61 -1.14 0.00 0.00 176.83 174.06 3h9b s GLU 411 N -3.25 0.74 0.13 3.45 8.01 -1.26 -4.60 118.70 121.93 3h9b s GLU 411 Ca 0.07 -0.92 -0.30 0.00 0.01 0.00 0.00 54.97 53.83 3h9b s GLU 411 Cb 0.10 0.30 -0.07 0.00 -4.31 0.00 0.00 34.13 30.14 3h9b s GLU 411 CO 0.54 -0.21 1.26 -0.51 0.01 0.00 0.00 175.26 176.34 3h9b s LEU 412 N -2.64 4.40 0.25 1.80 1.43 -1.26 -4.93 118.68 117.74 3h9b s LEU 412 Ca 0.02 2.21 0.04 0.00 -1.03 0.00 0.00 54.13 55.38 3h9b s LEU 412 Cb 0.04 -3.59 0.31 0.00 0.03 0.00 0.00 46.19 42.98 3h9b s LEU 412 CO -0.09 -0.49 1.61 0.00 0.23 0.00 0.00 176.35 177.61 3h9b h ALA 413 N 6.12 0.93 -2.47 4.21 0.00 -1.97 -3.37 119.26 122.71 3h9b h ALA 413 Ca -0.43 -0.49 -0.59 0.00 0.00 0.00 0.00 54.91 53.40 3h9b h ALA 413 Cb 1.21 -0.09 -0.39 0.00 0.00 0.00 0.00 17.79 18.53 3h9b h ALA 413 CO 0.80 0.67 -0.92 0.34 0.00 0.00 0.00 179.25 180.14 3h9b s ASP 414 N -6.89 1.94 0.31 0.00 3.68 -1.26 -4.99 116.67 109.47 3h9b s ASP 414 Ca -0.05 -3.17 0.03 0.00 2.13 0.00 0.00 52.55 51.50 3h9b s ASP 414 Cb 0.12 -0.61 0.63 0.00 -1.45 0.00 0.00 42.92 41.61 3h9b s ASP 414 CO 0.79 -0.16 1.87 -0.65 0.13 0.00 0.00 175.17 177.15 3h9b h PRO 415 N 5.63 0.89 -0.28 4.34 0.11 -2.00 -2.17 132.00 138.51 3h9b h PRO 415 Ca 0.25 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.31 3h9b h PRO 415 Cb 0.89 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.78 3h9b h PRO 415 CO 0.42 0.59 0.16 1.96 -0.21 0.00 0.00 178.00 180.92 3h9b h GLN 416 N 0.91 0.32 -0.73 1.05 4.20 -1.97 -0.52 115.11 118.38 3h9b h GLN 416 Ca 0.44 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 59.08 3h9b h GLN 416 Cb 0.46 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 3h9b h GLN 416 CO -0.21 0.21 0.24 1.25 -0.67 0.00 0.00 178.83 179.65 3h9b h LEU 417 N 0.33 1.05 -0.90 1.46 5.85 -1.87 -2.08 115.31 119.15 3h9b h LEU 417 Ca 0.11 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 3h9b h LEU 417 Cb 0.00 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 3h9b h LEU 417 CO -0.05 0.97 0.37 0.22 -0.34 0.00 0.00 178.44 179.61 3h9b h TYR 418 N 1.08 1.17 -0.33 1.25 3.20 -0.95 -2.10 116.97 120.28 3h9b h TYR 418 Ca 0.24 -0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.98 3h9b h TYR 418 Cb 0.29 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 3h9b h TYR 418 CO 0.02 0.85 -0.09 -0.22 -1.64 0.00 0.00 178.16 177.09 3h9b h LYS 419 N 1.15 0.55 -0.76 1.82 3.64 -0.68 -1.18 116.57 121.12 3h9b h LYS 419 Ca 0.28 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 3h9b h LYS 419 Cb 0.13 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.85 3h9b h LYS 419 CO -0.03 0.64 0.43 1.15 -2.27 0.00 0.00 179.45 179.37 3h9b h THR 420 N 0.52 1.22 -0.18 1.00 2.02 -0.72 0.20 112.91 116.96 3h9b h THR 420 Ca 0.10 -0.52 -0.09 0.00 0.77 0.00 0.00 66.41 66.67 3h9b h THR 420 Cb 0.46 0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 3h9b h THR 420 CO 0.02 0.24 -0.23 -0.26 0.37 0.00 0.00 175.52 175.66 3h9b h PHE 421 N 1.05 0.58 0.00 3.16 0.04 -0.93 -3.14 116.94 117.70 3h9b h PHE 421 Ca 0.27 -0.19 -0.10 0.00 2.80 0.00 0.00 57.97 60.75 3h9b h PHE 421 Cb -0.00 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.01 3h9b h PHE 421 CO 0.01 0.87 -0.47 1.79 -0.60 0.00 0.00 178.31 179.90 3h9b h THR 422 N 0.13 1.02 0.00 -1.55 1.35 -0.98 -2.89 112.91 109.98 3h9b h THR 422 Ca 0.02 -1.85 -0.03 0.00 -0.55 0.00 0.00 66.41 64.00 3h9b h THR 422 Cb 0.80 2.10 -0.00 0.00 -1.73 0.00 0.00 68.15 69.31 3h9b h THR 422 CO 0.06 0.46 -0.13 0.44 -0.25 0.00 0.00 175.52 176.10 3h9b h ASP 423 N 0.00 0.00 0.90 5.36 3.45 -0.63 -2.57 116.42 122.94 3h9b h ASP 423 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3h9b h ASP 423 Cb 1.06 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.83 3h9b h ASP 423 CO 0.06 0.13 0.00 0.00 -1.57 0.00 0.00 179.24 177.86 3h9b n ALA 424 N -2.26 2.02 -0.30 3.45 0.00 -1.09 -3.88 120.51 118.45 3h9b n ALA 424 Ca -0.01 -0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.43 3h9b n ALA 424 Cb 0.27 -1.39 0.19 0.00 0.00 0.00 0.00 19.45 18.52 3h9b n ALA 424 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h9b h ALA 425 N 2.65 1.25 0.40 0.00 0.00 -1.59 -1.71 119.26 120.26 3h9b h ALA 425 Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3h9b h ALA 425 Cb 0.45 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3h9b h ALA 425 CO 0.00 0.08 -0.28 1.49 0.00 0.00 0.00 179.25 180.54 3h9b h GLU 426 N 0.79 -0.64 -0.75 0.00 4.81 -1.81 0.16 114.58 117.14 3h9b h GLU 426 Ca 0.43 0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.64 3h9b h GLU 426 Cb 0.44 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.94 3h9b h GLU 426 CO -0.27 -0.43 0.24 -0.24 -0.73 0.00 0.00 179.01 177.58 3h9b h VAL 427 N -0.67 1.26 -0.38 0.32 3.04 -1.77 -1.09 116.25 116.96 3h9b h VAL 427 Ca -0.04 -0.91 -0.08 0.00 -1.01 0.00 0.00 66.70 64.66 3h9b h VAL 427 Cb 0.56 0.43 -0.01 0.00 -2.01 0.00 0.00 31.29 30.26 3h9b h VAL 427 CO 0.02 0.36 -0.08 0.40 -1.01 0.00 0.00 177.57 177.26 3h9b h ILE 428 N 1.12 1.27 -0.77 3.17 2.04 -1.20 -1.72 117.51 121.43 3h9b h ILE 428 Ca 0.24 -1.16 -0.04 0.00 1.00 0.00 0.00 64.86 64.91 3h9b h ILE 428 Cb 0.31 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 3h9b h ILE 428 CO -0.01 0.38 0.33 1.23 0.00 0.00 0.00 178.15 180.09 3h9b h GLY 429 N 0.53 1.21 1.70 5.37 0.00 -0.51 -1.48 103.07 109.90 3h9b h GLY 429 Ca 0.10 -0.63 -0.05 0.00 0.00 0.00 0.00 47.33 46.75 3h9b h GLY 429 CO 0.04 0.59 -0.10 0.83 0.00 0.00 0.00 176.54 177.90 3h9b h GLU 430 N 1.11 0.37 -0.30 4.80 5.08 -1.01 -0.00 114.58 124.63 3h9b h GLU 430 Ca 0.26 -0.09 -0.10 0.00 -1.00 0.00 0.00 59.36 58.44 3h9b h GLU 430 Cb 0.17 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3h9b h GLU 430 CO -0.03 0.47 -0.19 0.00 -1.00 0.00 0.00 179.01 178.27 3h9b h ALA 431 N 1.56 0.43 -0.35 3.43 0.00 -0.45 -0.29 119.26 123.58 3h9b h ALA 431 Ca 0.07 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3h9b h ALA 431 Cb 0.39 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3h9b h ALA 431 CO 0.02 0.36 0.13 -1.49 0.00 0.00 0.00 179.25 178.27 3h9b h TRP 432 N 0.41 0.54 -0.40 0.00 -0.00 -0.92 0.12 115.95 115.70 3h9b h TRP 432 Ca 0.06 -0.04 0.05 0.00 -0.00 0.00 0.00 58.89 58.95 3h9b h TRP 432 Cb 0.73 -0.16 -0.04 0.00 -0.00 0.00 0.00 29.16 29.68 3h9b h TRP 432 CO 0.06 0.51 0.15 1.49 -0.00 0.00 0.00 178.44 180.66 3h9b h GLU 433 N 0.42 0.31 -0.02 0.49 4.57 -0.88 -2.08 114.58 117.39 3h9b h GLU 433 Ca 0.12 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 3h9b h GLU 433 Cb 0.20 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 3h9b h GLU 433 CO -0.01 0.21 0.00 -1.13 -1.18 0.00 0.00 179.01 176.90 3h9b n SER 434 N -4.99 0.31 -0.71 1.04 3.41 -0.13 -4.89 113.62 107.66 3h9b n SER 434 Ca 0.02 -1.35 -0.09 0.00 -0.26 0.00 0.00 58.87 57.19 3h9b n SER 434 Cb 0.14 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.04 3h9b n SER 434 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h9b n ARG 435 N -0.64 -0.79 -2.14 4.33 1.74 -0.78 -4.64 116.66 113.74 3h9b n ARG 435 Ca 0.17 0.79 -0.41 0.00 -0.77 0.00 0.00 57.85 57.63 3h9b n ARG 435 Cb 0.13 -4.72 -0.00 0.00 -1.02 0.00 0.00 32.46 26.85 3h9b n ARG 435 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3h9b n GLU 436 N -2.43 3.96 -0.22 5.56 -0.58 0.36 -3.04 120.64 124.25 3h9b n GLU 436 Ca -0.09 -3.41 -0.04 0.00 -0.42 0.00 0.00 57.16 53.19 3h9b n GLU 436 Cb 0.34 -2.82 0.06 0.00 -0.57 0.00 0.00 31.44 28.45 3h9b n GLU 436 CO 0.00 0.00 0.00 0.74 -0.48 0.00 0.00 177.13 177.39 3h9b h PHE 437 N 5.30 0.74 -0.95 -0.32 0.05 -1.71 -1.99 116.94 118.06 3h9b h PHE 437 Ca 0.53 0.02 0.04 0.00 3.82 0.00 0.00 57.97 62.39 3h9b h PHE 437 Cb 0.49 -0.24 -0.06 0.00 2.00 0.00 0.00 35.95 38.15 3h9b h PHE 437 CO 1.42 0.42 0.62 0.78 -0.18 0.00 0.00 178.31 181.36 3h9b h GLY 438 N 0.77 1.38 0.93 -1.45 0.00 -0.35 -0.66 103.07 103.69 3h9b h GLY 438 Ca 0.26 -0.46 -0.06 0.00 0.00 0.00 0.00 47.33 47.06 3h9b h GLY 438 CO -0.11 0.38 -0.02 1.70 0.00 0.00 0.00 176.54 178.50 3h9b h LYS 439 N 1.16 0.65 -0.23 4.80 1.63 -1.68 -1.34 116.57 121.57 3h9b h LYS 439 Ca 0.38 -0.22 0.02 0.00 -0.85 0.00 0.00 60.65 59.99 3h9b h LYS 439 Cb 0.05 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.61 3h9b h LYS 439 CO -0.13 0.77 0.09 0.00 -3.45 0.00 0.00 179.45 176.73 3h9b h ALA 440 N 0.86 0.26 -0.82 5.00 0.00 -0.74 -0.89 119.26 122.93 3h9b h ALA 440 Ca 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3h9b h ALA 440 Cb 0.49 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 3h9b h ALA 440 CO 0.02 -0.33 0.45 0.28 0.00 0.00 0.00 179.25 179.67 3h9b h VAL 441 N 0.20 1.24 -0.76 0.00 2.07 -1.05 -0.45 116.25 117.49 3h9b h VAL 441 Ca 0.10 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 3h9b h VAL 441 Cb 0.06 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 29.93 3h9b h VAL 441 CO -0.09 0.27 0.41 0.03 0.02 0.00 0.00 177.57 178.21 3h9b h ARG 442 N 1.14 1.07 -0.27 1.57 3.08 -0.77 0.62 114.38 120.81 3h9b h ARG 442 Ca 0.29 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 3h9b h ARG 442 Cb 0.02 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 3h9b h ARG 442 CO -0.05 0.79 0.09 0.93 -1.07 0.00 0.00 179.97 180.66 3h9b h GLU 443 N 1.06 0.41 -0.49 0.04 4.39 -0.71 -1.15 114.58 118.13 3h9b h GLU 443 Ca 0.27 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 3h9b h GLU 443 Cb 0.04 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 3h9b h GLU 443 CO -0.04 0.48 0.29 0.82 -1.16 0.00 0.00 179.01 179.40 3h9b h ILE 444 N 0.27 1.15 0.00 3.13 2.04 -0.75 -1.89 117.51 121.47 3h9b h ILE 444 Ca 0.09 -0.35 -0.09 0.00 1.00 0.00 0.00 64.86 65.51 3h9b h ILE 444 Cb 0.23 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3h9b h ILE 444 CO -0.00 0.16 -0.42 0.24 0.00 0.00 0.00 178.15 178.12 3h9b h MET 445 N 0.66 0.00 -0.46 2.37 2.86 -0.79 -0.26 114.93 119.31 3h9b h MET 445 Ca 0.18 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.71 3h9b h MET 445 Cb -0.00 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 3h9b h MET 445 CO -0.03 0.42 -0.16 0.00 1.06 0.00 0.00 176.91 178.20 3h9b h ALA 446 N 1.58 0.86 -0.45 6.32 0.00 -0.81 -0.48 119.26 126.28 3h9b h ALA 446 Ca -0.00 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 3h9b h ALA 446 Cb 0.81 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3h9b h ALA 446 CO 0.05 0.64 -0.22 -0.07 0.00 0.00 0.00 179.25 179.66 3h9b h LEU 447 N 0.77 0.92 -1.21 0.00 3.38 -0.80 -2.28 115.31 116.09 3h9b h LEU 447 Ca 0.12 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 3h9b h LEU 447 Cb 0.68 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 3h9b h LEU 447 CO 0.05 1.10 0.27 0.00 0.09 0.00 0.00 178.44 179.95 3h9b h ALA 448 N 0.96 1.38 -0.64 1.53 0.00 -0.55 -0.33 119.26 121.62 3h9b h ALA 448 Ca 0.10 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3h9b h ALA 448 Cb 0.77 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3h9b h ALA 448 CO 0.06 0.48 0.20 -0.44 0.00 0.00 0.00 179.25 179.56 3h9b h ASP 449 N 0.82 0.92 -0.45 0.00 3.45 -0.76 -1.50 116.42 118.90 3h9b h ASP 449 Ca 0.20 -0.21 -0.08 0.00 0.43 0.00 0.00 57.03 57.38 3h9b h ASP 449 Cb 0.10 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 38.61 3h9b h ASP 449 CO -0.03 0.88 0.01 -0.07 -1.57 0.00 0.00 179.24 178.47 3h9b h LEU 450 N 0.92 0.82 -0.30 1.55 3.38 -0.77 -0.75 115.31 120.15 3h9b h LEU 450 Ca 0.21 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3h9b h LEU 450 Cb 0.29 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3h9b h LEU 450 CO -0.01 0.88 0.06 0.00 0.09 0.00 0.00 178.44 179.46 3h9b h ALA 451 N 1.22 0.40 0.00 1.53 0.00 -0.72 -0.95 119.26 120.74 3h9b h ALA 451 Ca 0.15 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 3h9b h ALA 451 Cb 0.46 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3h9b h ALA 451 CO 0.02 0.09 -0.40 -0.91 0.00 0.00 0.00 179.25 178.04 3h9b h ASN 452 N 0.33 0.00 -0.45 0.00 2.35 -1.13 -1.83 115.58 114.85 3h9b h ASN 452 Ca 0.09 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.73 3h9b h ASN 452 Cb 0.32 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 3h9b h ASN 452 CO 0.00 0.40 -0.15 -0.09 -1.65 0.00 0.00 177.43 175.94 3h9b h ARG 453 N 0.00 0.91 -0.20 0.81 2.43 -0.85 -1.02 114.38 116.46 3h9b h ARG 453 Ca -0.00 -0.37 0.01 0.00 -0.81 0.00 0.00 59.98 58.80 3h9b h ARG 453 Cb 0.80 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 3h9b h ARG 453 CO 0.05 1.02 0.12 -0.92 -1.51 0.00 0.00 179.97 178.73 3h9b h TYR 454 N 0.74 0.22 -0.76 2.20 3.20 -0.67 0.24 116.97 122.14 3h9b h TYR 454 Ca 0.11 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 3h9b h TYR 454 Cb 0.71 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.88 3h9b h TYR 454 CO 0.05 0.13 0.47 0.28 -1.64 0.00 0.00 178.16 177.45 3h9b h VAL 455 N 0.24 1.21 -0.46 1.81 2.07 -1.16 -1.56 116.25 118.40 3h9b h VAL 455 Ca 0.08 -0.46 -0.06 0.00 0.82 0.00 0.00 66.70 67.08 3h9b h VAL 455 Cb -0.01 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 29.88 3h9b h VAL 455 CO -0.03 0.22 0.06 0.44 0.02 0.00 0.00 177.57 178.27 3h9b h ASP 456 N 1.04 0.68 0.20 0.57 3.32 -0.79 0.57 116.42 122.01 3h9b h ASP 456 Ca 0.27 -0.13 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 3h9b h ASP 456 Cb -0.05 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 3h9b h ASP 456 CO -0.05 0.71 -0.27 -0.33 -1.72 0.00 0.00 179.24 177.58 3h9b h GLU 457 N 0.69 0.12 0.00 3.56 5.08 -0.21 -2.72 114.58 121.10 3h9b h GLU 457 Ca 0.15 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3h9b h GLU 457 Cb 0.34 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3h9b h GLU 457 CO 0.01 0.39 -0.80 1.96 -1.00 0.00 0.00 179.01 179.56 3h9b h GLN 458 N 0.11 0.00 -6.53 2.33 1.08 -0.70 -3.49 115.11 107.91 3h9b h GLN 458 Ca 0.02 0.00 -0.45 0.00 -1.45 0.00 0.00 58.65 56.76 3h9b h GLN 458 Cb 0.54 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.98 3h9b h GLN 458 CO 0.04 0.00 -0.92 0.00 -0.95 0.00 0.00 178.83 177.00 3h9b n ALA 459 N -2.09 -2.67 0.20 3.87 0.00 0.14 -4.69 120.51 115.27 3h9b n ALA 459 Ca 0.01 -0.32 0.14 0.00 0.00 0.00 0.00 53.44 53.27 3h9b n ALA 459 Cb 0.52 -2.11 0.75 0.00 0.00 0.00 0.00 19.45 18.61 3h9b n ALA 459 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3h9b h PRO 460 N -1.22 0.00 0.00 0.00 0.13 -1.90 0.27 132.00 129.28 3h9b h PRO 460 Ca -0.59 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 3h9b h PRO 460 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 3h9b h PRO 460 CO 0.43 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.53 3h9b n TRP 461 N -4.19 0.85 -0.12 1.56 2.14 -1.26 -1.01 117.44 115.42 3h9b n TRP 461 Ca 0.01 0.34 -0.25 0.00 2.07 0.00 0.00 57.50 59.66 3h9b n TRP 461 Cb 0.25 -1.05 -0.11 0.00 -0.81 0.00 0.00 31.31 29.60 3h9b n TRP 461 CO 0.00 0.00 0.00 0.28 2.07 0.00 0.00 177.69 180.04 3h9b n VAL 462 N -2.28 1.55 -0.30 -1.67 0.31 0.00 -4.39 118.33 111.54 3h9b n VAL 462 Ca 0.02 -0.31 0.06 0.00 -0.01 0.00 0.00 64.34 64.10 3h9b n VAL 462 Cb 0.22 -1.87 0.27 0.00 -0.91 0.00 0.00 33.84 31.55 3h9b n VAL 462 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3h9b h VAL 463 N -0.81 1.00 -0.02 2.52 2.07 -1.17 -2.48 116.25 117.36 3h9b h VAL 463 Ca -0.55 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 66.64 3h9b h VAL 463 Cb 1.58 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 3h9b h VAL 463 CO -0.28 0.17 0.02 0.00 0.02 0.00 0.00 177.57 177.50 3h9b h ALA 464 N 1.53 1.73 -0.02 1.67 0.00 -1.28 -2.33 119.26 120.56 3h9b h ALA 464 Ca 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3h9b h ALA 464 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3h9b h ALA 464 CO -0.17 -0.02 -0.13 0.36 0.00 0.00 0.00 179.25 179.28 3h9b n LYS 465 N -4.11 1.82 -3.67 0.00 2.85 -0.93 -4.94 118.16 109.18 3h9b n LYS 465 Ca -0.03 -1.42 -0.36 0.00 -1.05 0.00 0.00 58.31 55.45 3h9b n LYS 465 Cb 0.10 -1.47 -0.07 0.00 -0.65 0.00 0.00 35.03 32.94 3h9b n LYS 465 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 3h9b s GLN 466 N -2.15 4.06 0.14 -1.58 -0.21 -0.88 -5.04 119.66 113.98 3h9b s GLN 466 Ca 0.27 -0.03 -0.34 0.00 0.02 0.00 0.00 55.36 55.28 3h9b s GLN 466 Cb 0.20 -3.37 -0.16 0.00 1.00 0.00 0.00 33.01 30.68 3h9b s GLN 466 CO 0.39 0.39 1.17 -0.85 -2.12 0.00 0.00 175.29 174.28 3h9b n GLU 467 N 3.13 1.01 -1.51 2.91 -0.00 -1.26 -2.67 120.64 122.24 3h9b n GLU 467 Ca -0.15 0.36 -0.18 0.00 -0.00 0.00 0.00 57.16 57.19 3h9b n GLU 467 Cb 0.53 -1.88 -0.08 0.00 -0.00 0.00 0.00 31.44 30.01 3h9b n GLU 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3h9b n GLY 468 N 2.10 1.69 1.86 -1.84 0.00 -1.26 -4.87 105.19 102.87 3h9b n GLY 468 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.07 3h9b n GLY 468 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h9b n ARG 469 N -1.88 2.81 -0.02 1.61 1.74 -1.09 -4.63 116.66 115.19 3h9b n ARG 469 Ca -0.18 -3.07 -0.09 0.00 -0.77 0.00 0.00 57.85 53.74 3h9b n ARG 469 Cb 0.65 -2.11 -0.04 0.00 -1.02 0.00 0.00 32.46 29.95 3h9b n ARG 469 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3h9b h ASP 470 N 1.71 -0.16 -0.58 0.55 3.45 -1.89 -1.43 116.42 118.08 3h9b h ASP 470 Ca 0.38 0.05 0.07 0.00 0.43 0.00 0.00 57.03 57.96 3h9b h ASP 470 Cb 2.35 0.10 -0.06 0.00 -0.56 0.00 0.00 39.33 41.17 3h9b h ASP 470 CO 0.78 -0.06 0.26 0.00 -1.57 0.00 0.00 179.24 178.65 3h9b h ALA 471 N 1.14 0.76 -0.46 3.45 0.00 -2.00 -0.98 119.26 121.16 3h9b h ALA 471 Ca 0.07 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.05 3h9b h ALA 471 Cb 0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3h9b h ALA 471 CO -0.16 -0.12 0.28 -0.44 0.00 0.00 0.00 179.25 178.81 3h9b h ASP 472 N 0.48 0.47 -0.24 0.00 3.45 -1.79 -1.29 116.42 117.50 3h9b h ASP 472 Ca 0.28 -0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.74 3h9b h ASP 472 Cb 0.27 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 38.93 3h9b h ASP 472 CO -0.24 0.34 0.14 0.25 -1.57 0.00 0.00 179.24 178.16 3h9b h LEU 473 N 0.57 0.28 -1.01 1.55 5.85 -0.47 -0.93 115.31 121.16 3h9b h LEU 473 Ca 0.18 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3h9b h LEU 473 Cb -0.01 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 3h9b h LEU 473 CO -0.07 0.25 0.52 -0.61 -0.34 0.00 0.00 178.44 178.19 3h9b h GLN 474 N 0.29 1.20 0.02 1.25 4.15 -1.01 -1.29 115.11 119.73 3h9b h GLN 474 Ca 0.08 -0.12 -0.00 0.00 0.77 0.00 0.00 58.65 59.39 3h9b h GLN 474 Cb 0.02 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 27.46 3h9b h GLN 474 CO -0.02 0.85 -0.01 0.00 -1.93 0.00 0.00 178.83 177.73 3h9b h ALA 475 N 1.35 -0.03 0.28 3.38 0.00 -0.85 -0.59 119.26 122.80 3h9b h ALA 475 Ca 0.31 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3h9b h ALA 475 Cb -0.03 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3h9b h ALA 475 CO -0.06 -0.44 -0.13 0.82 0.00 0.00 0.00 179.25 179.44 3h9b h ILE 476 N -0.19 0.73 -0.52 0.00 2.04 -0.99 -1.52 117.51 117.07 3h9b h ILE 476 Ca -0.00 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 3h9b h ILE 476 Cb 0.18 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 3h9b h ILE 476 CO 0.00 0.01 0.17 0.00 0.00 0.00 0.00 178.15 178.34 3h9b h SER 478 N 0.75 0.83 -0.39 0.00 0.02 -0.99 -2.04 113.55 111.74 3h9b h SER 478 Ca 0.18 -0.31 -0.02 0.00 -0.84 0.00 0.00 61.79 60.80 3h9b h SER 478 Cb 0.21 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 3h9b h SER 478 CO -0.01 1.03 0.16 -0.03 -1.14 0.00 0.00 176.83 176.84 3h9b h MET 479 N 0.71 0.58 -0.97 3.45 -1.53 -0.77 -1.18 114.93 115.22 3h9b h MET 479 Ca 0.09 -0.10 -0.00 0.00 -3.44 0.00 0.00 59.70 56.25 3h9b h MET 479 Cb 0.76 -0.10 -0.05 0.00 -0.55 0.00 0.00 31.60 31.67 3h9b h MET 479 CO 0.06 0.55 0.60 0.78 0.14 0.00 0.00 176.91 179.04 3h9b h GLY 480 N 0.49 1.39 1.49 1.39 0.00 -1.12 -1.43 103.07 105.28 3h9b h GLY 480 Ca 0.13 -0.56 -0.09 0.00 0.00 0.00 0.00 47.33 46.81 3h9b h GLY 480 CO -0.01 0.54 -0.20 -2.22 0.00 0.00 0.00 176.54 174.66 3h9b h ILE 481 N 1.32 1.26 -0.12 2.60 2.04 -1.03 -1.18 117.51 122.40 3h9b h ILE 481 Ca 0.35 -1.22 -0.12 0.00 1.00 0.00 0.00 64.86 64.87 3h9b h ILE 481 Cb -0.09 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 3h9b h ILE 481 CO -0.07 0.40 -0.48 0.78 0.00 0.00 0.00 178.15 178.78 3h9b h ASN 482 N 0.53 0.32 -0.12 1.72 2.35 -0.68 -0.40 115.58 119.30 3h9b h ASN 482 Ca 0.08 -0.15 -0.12 0.00 -0.55 0.00 0.00 56.30 55.57 3h9b h ASN 482 Cb 0.63 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.90 3h9b h ASN 482 CO 0.04 0.75 -0.30 -0.07 -1.65 0.00 0.00 177.43 176.20 3h9b h LEU 483 N 0.24 0.61 -0.61 1.61 3.38 -0.88 -2.47 115.31 117.19 3h9b h LEU 483 Ca 0.01 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 3h9b h LEU 483 Cb 0.93 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 3h9b h LEU 483 CO 0.08 0.88 0.30 0.15 0.09 0.00 0.00 178.44 179.93 3h9b h PHE 484 N 0.51 0.88 -0.52 1.13 3.57 -0.73 -1.69 116.94 120.10 3h9b h PHE 484 Ca 0.06 -0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.59 3h9b h PHE 484 Cb 0.78 -0.27 -0.06 0.00 2.79 0.00 0.00 35.95 39.19 3h9b h PHE 484 CO 0.03 0.67 0.20 -0.09 -2.23 0.00 0.00 178.31 176.89 3h9b h ARG 485 N 0.84 0.38 -0.12 1.11 1.12 -0.70 -0.44 114.38 116.57 3h9b h ARG 485 Ca 0.21 -0.02 -0.01 0.00 -1.11 0.00 0.00 59.98 59.04 3h9b h ARG 485 Cb 0.12 -0.09 -0.00 0.00 -0.01 0.00 0.00 29.97 29.98 3h9b h ARG 485 CO -0.03 0.25 0.03 0.28 -3.11 0.00 0.00 179.97 177.39 3h9b h VAL 486 N 0.40 1.21 -0.79 0.20 2.07 -1.11 -2.49 116.25 115.73 3h9b h VAL 486 Ca 0.25 -0.64 0.01 0.00 0.82 0.00 0.00 66.70 67.13 3h9b h VAL 486 Cb 0.24 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 3h9b h VAL 486 CO -0.23 0.19 0.52 -0.07 0.02 0.00 0.00 177.57 178.00 3h9b h LEU 487 N -0.01 0.89 -1.64 2.57 3.38 -0.98 -1.51 115.31 118.01 3h9b h LEU 487 Ca 0.04 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3h9b h LEU 487 Cb 0.27 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 3h9b h LEU 487 CO 0.00 0.64 -0.16 0.24 0.09 0.00 0.00 178.44 179.26 3h9b h MET 488 N 1.05 0.00 -0.16 1.13 2.86 -1.04 -1.38 114.93 117.40 3h9b h MET 488 Ca 0.29 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.83 3h9b h MET 488 Cb -0.11 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.56 3h9b h MET 488 CO -0.07 0.16 -0.31 1.15 1.06 0.00 0.00 176.91 178.90 3h9b h THR 489 N 0.00 1.36 -0.04 2.22 2.02 -0.82 0.01 112.91 117.65 3h9b h THR 489 Ca -0.00 -1.56 -0.05 0.00 0.77 0.00 0.00 66.41 65.57 3h9b h THR 489 Cb 0.48 1.97 -0.01 0.00 -1.74 0.00 0.00 68.15 68.86 3h9b h THR 489 CO 0.02 0.47 -0.21 1.88 0.37 0.00 0.00 175.52 178.05 3h9b h TYR 490 N 0.11 0.06 -0.02 3.16 0.99 -1.01 -2.55 116.97 117.71 3h9b h TYR 490 Ca 0.01 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3h9b h TYR 490 Cb 0.90 -0.02 0.00 0.00 1.00 0.00 0.00 36.73 38.61 3h9b h TYR 490 CO 0.10 0.27 -0.11 1.28 -0.00 0.00 0.00 178.16 179.70 3h9b n LEU 491 N -4.26 1.86 -0.36 3.88 4.77 -0.56 -4.47 117.00 117.87 3h9b n LEU 491 Ca -0.02 -0.61 0.10 0.00 -0.03 0.00 0.00 56.01 55.44 3h9b n LEU 491 Cb 0.29 -0.02 0.27 0.00 -2.33 0.00 0.00 43.42 41.62 3h9b n LEU 491 CO 0.37 0.32 1.22 0.50 -1.33 0.00 0.00 177.39 178.47 3h9b h LYS 492 N 2.75 0.87 0.00 3.23 3.64 -0.55 0.53 116.57 127.05 3h9b h LYS 492 Ca 0.00 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 3h9b h LYS 492 Cb 0.66 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 3h9b h LYS 492 CO 0.00 0.58 -0.11 -1.35 -2.27 0.00 0.00 179.45 176.30 3h9b h PRO 493 N 0.90 0.00 0.11 1.90 0.11 -1.80 -3.28 132.00 129.94 3h9b h PRO 493 Ca 0.53 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 66.31 3h9b h PRO 493 Cb 0.66 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 3h9b h PRO 493 CO -0.31 0.11 -1.80 0.28 -0.21 0.00 0.00 178.00 176.06 3h9b h VAL 494 N 0.00 0.74 -2.88 3.15 2.07 -1.25 -3.39 116.25 114.68 3h9b h VAL 494 Ca -0.00 -2.33 -0.62 0.00 0.82 0.00 0.00 66.70 64.57 3h9b h VAL 494 Cb 0.46 2.50 -0.42 0.00 -1.52 0.00 0.00 31.29 32.32 3h9b h VAL 494 CO 0.01 0.78 -0.58 0.18 0.02 0.00 0.00 177.57 177.99 3h9b n LEU 495 N -3.70 3.20 -0.18 2.57 4.77 -0.51 -4.54 117.00 118.62 3h9b n LEU 495 Ca -0.31 -5.27 -0.02 0.00 -0.03 0.00 0.00 56.01 50.39 3h9b n LEU 495 Cb 0.98 -0.74 0.08 0.00 -2.33 0.00 0.00 43.42 41.41 3h9b n LEU 495 CO 0.40 1.83 0.99 -0.65 -1.33 0.00 0.00 177.39 178.62 3h9b h PRO 496 N 5.11 0.41 -0.09 3.23 0.11 -1.85 -0.73 132.00 138.20 3h9b h PRO 496 Ca 0.16 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.18 3h9b h PRO 496 Cb 0.73 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.75 3h9b h PRO 496 CO 0.75 0.27 -0.20 0.87 -0.21 0.00 0.00 178.00 179.48 3h9b h LYS 497 N 0.42 0.29 -0.65 1.05 1.79 -1.93 -1.82 116.57 115.72 3h9b h LYS 497 Ca 0.27 -0.19 0.01 0.00 -2.18 0.00 0.00 60.65 58.55 3h9b h LYS 497 Cb 0.28 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.93 3h9b h LYS 497 CO -0.25 0.79 0.43 1.25 -1.08 0.00 0.00 179.45 180.59 3h9b h LEU 498 N -0.17 0.74 -0.65 2.94 5.85 -1.90 -1.43 115.31 120.70 3h9b h LEU 498 Ca 0.00 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 3h9b h LEU 498 Cb 0.79 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 3h9b h LEU 498 CO 0.04 0.53 0.32 0.74 -0.34 0.00 0.00 178.44 179.73 3h9b h THR 499 N 0.87 1.22 -0.72 1.05 2.02 -0.99 0.86 112.91 117.22 3h9b h THR 499 Ca 0.24 -0.60 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 3h9b h THR 499 Cb -0.08 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 66.72 3h9b h THR 499 CO -0.05 0.25 0.39 -0.33 0.37 0.00 0.00 175.52 176.14 3h9b h GLU 500 N 0.89 1.01 -0.45 6.66 5.08 -0.40 0.73 114.58 128.09 3h9b h GLU 500 Ca 0.22 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.38 3h9b h GLU 500 Cb 0.10 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3h9b h GLU 500 CO -0.03 0.76 -0.06 0.00 -1.00 0.00 0.00 179.01 178.68 3h9b h ARG 501 N 0.99 0.77 -0.52 2.33 3.08 -0.84 -1.67 114.38 118.52 3h9b h ARG 501 Ca 0.25 -0.23 -0.11 0.00 0.07 0.00 0.00 59.98 59.96 3h9b h ARG 501 Cb 0.05 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 3h9b h ARG 501 CO -0.04 0.81 -0.11 0.00 -1.07 0.00 0.00 179.97 179.56 3h9b h ALA 502 N 1.23 0.72 -0.26 0.04 0.00 -0.23 -1.98 119.26 118.79 3h9b h ALA 502 Ca 0.13 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3h9b h ALA 502 Cb 0.51 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3h9b h ALA 502 CO 0.03 0.64 -0.19 0.93 0.00 0.00 0.00 179.25 180.66 3h9b h GLU 503 N 0.87 0.46 -0.39 0.00 5.08 -0.63 0.35 114.58 120.31 3h9b h GLU 503 Ca 0.13 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 3h9b h GLU 503 Cb 0.68 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 3h9b h GLU 503 CO 0.05 0.63 -0.08 0.00 -1.00 0.00 0.00 179.01 178.60 3h9b h ALA 504 N 1.39 0.54 -0.20 3.43 0.00 -1.09 0.36 119.26 123.68 3h9b h ALA 504 Ca 0.07 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3h9b h ALA 504 Cb 0.57 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3h9b h ALA 504 CO 0.04 0.40 0.07 0.35 0.00 0.00 0.00 179.25 180.11 3h9b h PHE 505 N 0.56 0.32 0.00 0.00 3.57 -0.96 -2.95 116.94 117.47 3h9b h PHE 505 Ca 0.10 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 3h9b h PHE 505 Cb 0.60 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.25 3h9b h PHE 505 CO 0.05 0.38 0.00 1.28 -2.23 0.00 0.00 178.31 177.79 3h9b n LEU 506 N -4.81 0.00 -3.04 0.59 4.77 0.08 -0.52 117.00 114.06 3h9b n LEU 506 Ca -0.04 0.47 -0.23 0.00 -0.03 0.00 0.00 56.01 56.19 3h9b n LEU 506 Cb 0.14 -0.47 0.03 0.00 -2.33 0.00 0.00 43.42 40.79 3h9b n LEU 506 CO 0.35 -0.04 -0.00 0.59 -1.33 0.00 0.00 177.39 176.96 3h9b n ASN 507 N -1.47 -6.04 -3.59 -1.43 3.02 0.07 -4.78 115.26 101.03 3h9b n ASN 507 Ca 0.07 -0.30 -0.16 0.00 -0.03 0.00 0.00 54.58 54.17 3h9b n ASN 507 Cb 0.30 -4.88 -0.07 0.00 -0.61 0.00 0.00 39.78 34.52 3h9b n ASN 507 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3h9b s THR 508 N -3.17 0.01 0.23 3.41 -1.32 -0.90 -5.05 115.64 108.83 3h9b s THR 508 Ca 0.31 -0.05 -0.30 0.00 -1.21 0.00 0.00 61.69 60.44 3h9b s THR 508 Cb -0.14 -0.92 -0.09 0.00 -1.51 0.00 0.00 72.50 69.84 3h9b s THR 508 CO 0.39 -0.03 1.00 -0.70 -2.21 0.00 0.00 174.62 173.07 3h9b s GLU 509 N -0.64 4.76 -0.30 7.08 2.12 -1.26 -4.48 118.70 125.97 3h9b s GLU 509 Ca -0.07 1.59 -0.19 0.00 0.36 0.00 0.00 54.97 56.66 3h9b s GLU 509 Cb -0.02 -3.27 -0.02 0.00 0.26 0.00 0.00 34.13 31.08 3h9b s GLU 509 CO 0.06 0.36 0.55 -0.51 -0.54 0.00 0.00 175.26 175.18 3h9b s LEU 510 N -1.00 4.15 0.19 2.70 1.43 -1.26 -5.05 118.68 119.83 3h9b s LEU 510 Ca 0.43 0.36 0.10 0.00 -1.03 0.00 0.00 54.13 53.99 3h9b s LEU 510 Cb -0.27 -2.69 -0.04 0.00 0.03 0.00 0.00 46.19 43.22 3h9b s LEU 510 CO 0.34 -0.39 -0.14 0.42 0.23 0.00 0.00 176.35 176.81 3h9b s THR 511 N 2.42 2.89 0.15 5.49 -4.23 -1.26 -5.03 115.64 116.07 3h9b s THR 511 Ca 0.22 -1.82 -0.16 0.00 -1.18 0.00 0.00 61.69 58.74 3h9b s THR 511 Cb -0.15 -2.43 0.01 0.00 1.34 0.00 0.00 72.50 71.27 3h9b s THR 511 CO 0.11 -0.13 1.78 -0.25 -0.54 0.00 0.00 174.62 175.58 3h9b h TRP 512 N 2.95 0.33 0.00 3.99 2.91 -1.93 -2.70 115.95 121.49 3h9b h TRP 512 Ca -0.46 0.01 -0.04 0.00 1.13 0.00 0.00 58.89 59.53 3h9b h TRP 512 Cb 1.21 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 29.76 3h9b h TRP 512 CO 0.67 0.17 -0.19 -0.44 -1.03 0.00 0.00 178.44 177.63 3h9b h ASP 513 N 0.36 0.00 -0.12 2.65 3.45 -1.97 -3.31 116.42 117.49 3h9b h ASP 513 Ca 0.15 0.00 0.03 0.00 0.43 0.00 0.00 57.03 57.64 3h9b h ASP 513 Cb 0.06 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 38.82 3h9b h ASP 513 CO -0.10 0.19 0.13 1.23 -1.57 0.00 0.00 179.24 179.12 3h9b h GLY 514 N 3.24 0.00 2.00 2.75 0.00 -1.87 -2.27 103.07 106.92 3h9b h GLY 514 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h9b h GLY 514 CO 0.02 0.00 0.00 0.16 0.00 0.00 0.00 176.54 176.72 3h9b h ILE 515 N 0.00 0.00 0.00 2.60 3.07 -1.67 -1.03 117.51 120.48 3h9b h ILE 515 Ca 0.06 -0.08 0.00 0.00 1.55 0.00 0.00 64.86 66.39 3h9b h ILE 515 Cb 0.32 0.79 0.00 0.00 -0.27 0.00 0.00 36.82 37.66 3h9b h ILE 515 CO -0.00 0.00 0.00 1.56 -1.05 0.00 0.00 178.15 178.66 3h9b h GLN 516 N 0.00 0.00 -4.33 0.16 1.08 -1.70 -3.36 115.11 106.96 3h9b h GLN 516 Ca 0.00 0.00 -0.67 0.00 -1.45 0.00 0.00 58.65 56.53 3h9b h GLN 516 Cb 0.10 0.00 -0.38 0.00 -0.05 0.00 0.00 27.48 27.15 3h9b h GLN 516 CO 0.00 0.00 -0.61 -0.65 -0.95 0.00 0.00 178.83 176.62 3h9b s GLN 517 N -3.50 1.85 0.93 1.46 1.11 -0.39 -5.11 119.66 116.01 3h9b s GLN 517 Ca 0.02 -2.02 -0.11 0.00 0.01 0.00 0.00 55.36 53.26 3h9b s GLN 517 Cb 0.09 -3.42 0.15 0.00 -1.01 0.00 0.00 33.01 28.82 3h9b s GLN 517 CO 0.46 -1.04 1.10 -1.25 0.01 0.00 0.00 175.29 174.58 3h9b s PRO 518 N 0.74 0.96 -0.39 2.91 0.04 -1.26 -4.94 135.00 133.06 3h9b s PRO 518 Ca 0.11 1.19 -0.26 0.00 0.04 0.00 0.00 61.00 62.08 3h9b s PRO 518 Cb -0.21 -1.75 0.02 0.00 0.04 0.00 0.00 34.50 32.60 3h9b s PRO 518 CO -0.05 -2.55 0.94 -0.51 0.04 0.00 0.00 177.00 174.87 3h9b s LEU 519 N -6.50 3.97 -0.02 -3.56 1.43 -1.26 -5.02 118.68 107.72 3h9b s LEU 519 Ca 0.65 0.51 0.05 0.00 -1.03 0.00 0.00 54.13 54.31 3h9b s LEU 519 Cb -0.21 -3.28 -0.01 0.00 0.03 0.00 0.00 46.19 42.72 3h9b s LEU 519 CO 0.59 -0.92 -0.18 -0.76 0.23 0.00 0.00 176.35 175.31 3h9b s LEU 520 N 3.59 2.02 -1.47 1.79 1.43 -1.26 -4.72 118.68 120.06 3h9b s LEU 520 Ca 0.39 -0.32 -0.04 0.00 -1.03 0.00 0.00 54.13 53.12 3h9b s LEU 520 Cb -0.11 -0.92 0.04 0.00 0.03 0.00 0.00 46.19 45.23 3h9b s LEU 520 CO 0.21 0.21 0.53 0.61 0.23 0.00 0.00 176.35 178.13 3h9b n GLY 521 N 2.71 -0.28 3.26 -3.19 0.00 -0.39 -4.93 105.19 102.38 3h9b n GLY 521 Ca -0.15 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3h9b n GLY 521 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3h9b s HIS 522 N -3.79 2.38 -0.07 1.61 5.04 -1.24 -4.87 115.29 114.34 3h9b s HIS 522 Ca 0.18 -0.69 -0.24 0.00 -1.54 0.00 0.00 55.06 52.77 3h9b s HIS 522 Cb -0.10 -1.56 -0.03 0.00 0.04 0.00 0.00 32.58 30.93 3h9b s HIS 522 CO 0.89 -0.20 0.75 0.21 -2.34 0.00 0.00 174.74 174.05 3h9b s LYS 523 N -0.19 4.43 0.29 2.88 2.47 -1.26 -0.62 119.74 127.74 3h9b s LYS 523 Ca -0.02 0.95 0.10 0.00 -1.56 0.00 0.00 55.97 55.43 3h9b s LYS 523 Cb -0.13 -3.47 -0.05 0.00 -1.46 0.00 0.00 37.83 32.72 3h9b s LYS 523 CO 0.03 -0.01 -0.01 0.14 0.16 0.00 0.00 175.35 175.67 3h9b s VAL 524 N 1.02 3.10 0.16 4.02 -7.23 0.29 -4.62 120.40 117.15 3h9b s VAL 524 Ca 0.39 -1.96 0.05 0.00 -1.81 0.00 0.00 61.98 58.65 3h9b s VAL 524 Cb -0.18 -2.78 -0.04 0.00 0.56 0.00 0.00 36.38 33.94 3h9b s VAL 524 CO 0.18 -0.32 0.11 0.20 -0.31 0.00 0.00 175.10 174.97 3h9b s ASN 525 N -3.68 5.39 0.68 4.85 0.01 0.33 -4.77 114.94 117.75 3h9b s ASN 525 Ca 0.33 -0.17 -0.13 0.00 -0.71 0.00 0.00 52.86 52.18 3h9b s ASN 525 Cb -0.04 -1.37 0.01 0.00 0.41 0.00 0.00 41.25 40.25 3h9b s ASN 525 CO 0.19 0.08 1.07 -2.84 -1.51 0.00 0.00 177.10 174.09 3h9b s PRO 526 N -3.05 2.84 0.00 -0.60 0.02 -1.26 -4.73 135.00 128.22 3h9b s PRO 526 Ca 0.30 1.13 -0.06 0.00 0.02 0.00 0.00 61.00 62.39 3h9b s PRO 526 Cb -0.10 -1.97 -0.00 0.00 0.02 0.00 0.00 34.50 32.45 3h9b s PRO 526 CO 0.23 -1.18 0.12 -0.59 -0.33 0.00 0.00 177.00 175.24 3h9b s PHE 527 N -2.76 0.05 0.00 6.54 -0.71 -1.26 -4.91 117.98 114.93 3h9b s PHE 527 Ca 0.61 -0.15 0.00 0.00 -1.04 0.00 0.00 56.93 56.35 3h9b s PHE 527 Cb -0.16 -0.06 0.00 0.00 -1.21 0.00 0.00 43.02 41.59 3h9b s PHE 527 CO 0.49 -0.27 0.04 1.17 -1.34 0.00 0.00 175.22 175.31 3h9b n LYS 528 N 1.55 0.00 -3.27 1.99 3.00 -1.26 -4.87 118.16 115.30 3h9b n LYS 528 Ca -0.22 0.01 -0.04 0.00 -0.00 0.00 0.00 58.31 58.06 3h9b n LYS 528 Cb 0.56 -0.54 -0.05 0.00 0.00 0.00 0.00 35.03 35.00 3h9b n LYS 528 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3h9b s ALA 529 N -2.28 -1.55 0.37 3.14 0.00 -1.26 -5.06 121.76 115.12 3h9b s ALA 529 Ca 0.00 1.26 0.08 0.00 0.00 0.00 0.00 51.96 53.31 3h9b s ALA 529 Cb 0.00 -1.88 0.81 0.00 0.00 0.00 0.00 23.12 22.05 3h9b s ALA 529 CO 0.00 -1.30 1.92 -0.07 0.00 0.00 0.00 175.76 176.31 3h9b h LEU 530 N 8.11 0.63 -6.89 0.00 3.38 -1.97 -3.42 115.31 115.14 3h9b h LEU 530 Ca -0.21 0.02 0.09 0.00 0.09 0.00 0.00 57.88 57.88 3h9b h LEU 530 Cb 1.16 -0.11 -0.22 0.00 0.09 0.00 0.00 40.66 41.58 3h9b h LEU 530 CO 0.27 0.36 0.01 -0.47 0.09 0.00 0.00 178.44 178.70 3h9b s TYR 531 N -5.64 -1.10 0.37 1.13 5.04 -1.26 -4.92 117.35 110.97 3h9b s TYR 531 Ca -0.10 1.96 -0.00 0.00 -2.44 0.00 0.00 57.07 56.50 3h9b s TYR 531 Cb 0.21 0.66 -0.03 0.00 0.35 0.00 0.00 41.96 43.14 3h9b s TYR 531 CO 0.78 -0.54 0.58 -0.80 -1.34 0.00 0.00 175.55 174.23 3h9b s ASN 532 N 2.47 6.26 0.69 4.32 0.01 -1.26 -4.85 114.94 122.58 3h9b s ASN 532 Ca -0.06 0.49 -0.12 0.00 -0.71 0.00 0.00 52.86 52.46 3h9b s ASN 532 Cb -0.09 -2.03 0.01 0.00 0.41 0.00 0.00 41.25 39.55 3h9b s ASN 532 CO -0.19 -0.35 1.07 -0.13 -1.51 0.00 0.00 177.10 175.99 3h9b s ARG 533 N -4.38 2.89 0.37 -0.60 0.52 -1.26 -4.96 118.95 111.53 3h9b s ARG 533 Ca 0.41 1.06 0.07 0.00 -0.52 0.00 0.00 55.73 56.75 3h9b s ARG 533 Cb -0.10 -1.98 -0.07 0.00 0.52 0.00 0.00 34.95 33.32 3h9b s ARG 533 CO 0.37 -1.14 -0.02 0.96 0.02 0.00 0.00 175.30 175.48 3h9b s ILE 534 N -2.88 1.95 0.20 1.52 -4.36 -1.26 -5.12 121.20 111.26 3h9b s ILE 534 Ca 0.60 -2.08 -0.07 0.00 -0.26 0.00 0.00 60.65 58.84 3h9b s ILE 534 Cb -0.15 -2.82 -0.02 0.00 1.25 0.00 0.00 42.46 40.72 3h9b s ILE 534 CO 0.51 -0.09 0.30 1.51 0.24 0.00 0.00 174.94 177.41 3h9b s ASP 535 N -3.63 0.04 0.58 4.36 3.84 -1.26 -4.95 116.67 115.65 3h9b s ASP 535 Ca 0.34 -1.07 0.35 0.00 -0.00 0.00 0.00 52.55 52.16 3h9b s ASP 535 Cb 0.07 0.47 1.77 0.00 -1.38 0.00 0.00 42.92 43.85 3h9b s ASP 535 CO 0.17 -0.96 2.16 0.24 -0.00 0.00 0.00 175.17 176.77 3h9b h MET 536 N 2.48 0.00 -0.69 2.11 2.86 -1.98 -1.94 114.93 117.77 3h9b h MET 536 Ca -0.31 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.29 3h9b h MET 536 Cb 1.24 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.87 3h9b h MET 536 CO 0.45 0.05 0.26 0.00 1.06 0.00 0.00 176.91 178.73 3h9b h ARG 537 N 0.00 1.02 -0.38 1.72 3.08 -1.99 0.44 114.38 118.27 3h9b h ARG 537 Ca -0.00 -0.18 -0.12 0.00 0.07 0.00 0.00 59.98 59.75 3h9b h ARG 537 Cb 0.26 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3h9b h ARG 537 CO 0.01 0.84 -0.26 1.96 -1.07 0.00 0.00 179.97 181.45 3h9b h GLN 538 N 1.00 0.78 -0.35 0.04 4.20 -1.78 -1.83 115.11 117.18 3h9b h GLN 538 Ca 0.23 -0.34 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 3h9b h GLN 538 Cb 0.21 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 3h9b h GLN 538 CO -0.02 0.96 0.09 0.28 -0.67 0.00 0.00 178.83 179.47 3h9b h VAL 539 N 0.67 1.22 -0.61 -0.54 2.07 -1.26 -1.23 116.25 116.58 3h9b h VAL 539 Ca 0.09 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.85 3h9b h VAL 539 Cb 0.78 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 3h9b h VAL 539 CO 0.06 0.25 0.34 -0.33 0.02 0.00 0.00 177.57 177.91 3h9b h GLU 540 N 0.41 0.84 -0.53 1.57 5.08 -0.79 -1.37 114.58 119.79 3h9b h GLU 540 Ca 0.11 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 58.27 3h9b h GLU 540 Cb 0.29 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3h9b h GLU 540 CO 0.00 0.62 -0.12 0.00 -1.00 0.00 0.00 179.01 178.51 3h9b h ALA 541 N 1.52 0.78 -0.27 3.43 0.00 -1.00 -1.11 119.26 122.62 3h9b h ALA 541 Ca 0.22 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 3h9b h ALA 541 Cb 0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3h9b h ALA 541 CO -0.04 0.67 0.15 1.25 0.00 0.00 0.00 179.25 181.28 3h9b h LEU 542 N 0.89 0.33 -0.40 0.00 5.85 -0.51 -0.70 115.31 120.76 3h9b h LEU 542 Ca 0.14 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 3h9b h LEU 542 Cb 0.68 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 3h9b h LEU 542 CO 0.05 0.30 0.16 0.58 -0.34 0.00 0.00 178.44 179.19 3h9b h VAL 543 N 0.33 1.20 -0.92 1.05 2.07 -1.15 -1.89 116.25 116.92 3h9b h VAL 543 Ca 0.09 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 3h9b h VAL 543 Cb 0.04 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 3h9b h VAL 543 CO -0.02 0.22 0.55 -0.08 0.02 0.00 0.00 177.57 178.26 3h9b h GLU 544 N 0.50 1.26 0.00 1.57 4.57 -1.03 -1.60 114.58 119.84 3h9b h GLU 544 Ca 0.13 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3h9b h GLU 544 Cb 0.20 -0.26 0.00 0.00 -0.16 0.00 0.00 28.75 28.53 3h9b h GLU 544 CO -0.01 0.89 0.00 0.00 -1.18 0.00 0.00 179.01 178.71 3h9b h ALA 545 N 1.30 1.00 0.00 2.92 0.00 -0.86 -2.84 119.26 120.77 3h9b h ALA 545 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3h9b h ALA 545 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3h9b h ALA 545 CO -0.06 0.00 -0.72 0.43 0.00 0.00 0.00 179.25 178.90 3h9b n SER 546 N -2.84 0.62 0.00 0.00 7.64 -0.64 -5.09 113.62 113.31 3h9b n SER 546 Ca 0.01 -0.31 0.11 0.00 1.01 0.00 0.00 58.87 59.69 3h9b n SER 546 Cb 0.30 0.49 0.65 0.00 -1.01 0.00 0.00 64.21 64.64 3h9b n SER 546 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32