#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h9c s LYS 5 N 0.00 2.99 -0.22 0.00 1.02 -1.26 -4.77 119.74 117.50 3h9c s LYS 5 Ca 0.00 1.24 -0.06 0.00 0.02 0.00 0.00 55.97 57.17 3h9c s LYS 5 Cb 0.00 -1.99 -0.03 0.00 -0.52 0.00 0.00 37.83 35.30 3h9c s LYS 5 CO 0.00 -1.08 0.03 0.15 -0.92 0.00 0.00 175.35 173.54 3h9c s LYS 6 N -4.27 3.64 -0.08 1.68 1.02 -1.26 -0.75 119.74 119.72 3h9c s LYS 6 Ca 0.64 -0.50 0.01 0.00 0.02 0.00 0.00 55.97 56.14 3h9c s LYS 6 Cb -0.17 -3.20 0.02 0.00 -0.52 0.00 0.00 37.83 33.95 3h9c s LYS 6 CO 0.42 -0.08 -0.10 0.42 -0.92 0.00 0.00 175.35 175.09 3h9c s ILE 7 N 1.29 1.03 -0.23 2.17 1.01 0.60 -0.52 121.20 126.56 3h9c s ILE 7 Ca 0.04 -0.37 -0.06 0.00 0.00 0.00 0.00 60.65 60.26 3h9c s ILE 7 Cb -0.15 -0.99 -0.02 0.00 0.01 0.00 0.00 42.46 41.31 3h9c s ILE 7 CO 0.02 0.35 0.03 -0.22 0.00 0.00 0.00 174.94 175.12 3h9c s LEU 8 N 1.10 3.31 -0.06 2.97 0.20 0.23 -0.33 118.68 126.10 3h9c s LEU 8 Ca -0.06 -0.23 0.06 0.00 0.69 0.00 0.00 54.13 54.58 3h9c s LEU 8 Cb -0.14 -1.87 -0.01 0.00 -0.43 0.00 0.00 46.19 43.74 3h9c s LEU 8 CO -0.01 -0.01 -0.24 -0.69 -0.29 0.00 0.00 176.35 175.11 3h9c s VAL 9 N 1.43 2.02 0.22 1.68 1.01 0.11 -1.00 120.40 125.88 3h9c s VAL 9 Ca 0.05 -1.04 0.10 0.00 0.00 0.00 0.00 61.98 61.09 3h9c s VAL 9 Cb -0.15 -1.71 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 3h9c s VAL 9 CO 0.02 0.56 -0.18 0.42 0.00 0.00 0.00 175.10 175.92 3h9c s THR 10 N -0.10 2.07 0.26 3.92 -4.23 -0.50 -0.56 115.64 116.50 3h9c s THR 10 Ca -0.05 -2.22 0.09 0.00 -1.18 0.00 0.00 61.69 58.33 3h9c s THR 10 Cb -0.14 -2.11 -0.04 0.00 1.34 0.00 0.00 72.50 71.55 3h9c s THR 10 CO 0.04 -0.44 0.06 0.00 -0.54 0.00 0.00 174.62 173.73 3h9c n ALA 12 N -0.98 1.01 -2.54 0.00 0.00 -1.09 -4.81 120.51 112.09 3h9c n ALA 12 Ca -0.07 0.11 -0.43 0.00 0.00 0.00 0.00 53.44 53.05 3h9c n ALA 12 Cb 0.59 -2.25 -0.02 0.00 0.00 0.00 0.00 19.45 17.76 3h9c n ALA 12 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3h9c s LEU 13 N -2.66 4.06 0.35 0.00 1.43 -1.26 -4.87 118.68 115.73 3h9c s LEU 13 Ca 0.72 1.40 -0.29 0.00 -1.03 0.00 0.00 54.13 54.93 3h9c s LEU 13 Cb -0.44 -3.54 -0.11 0.00 0.03 0.00 0.00 46.19 42.14 3h9c s LEU 13 CO 0.50 -0.80 1.43 -2.84 0.23 0.00 0.00 176.35 174.87 3h9c s PRO 14 N 3.52 4.21 0.27 1.29 0.02 -1.21 -4.35 135.00 138.75 3h9c s PRO 14 Ca 0.49 2.43 -0.30 0.00 0.02 0.00 0.00 61.00 63.65 3h9c s PRO 14 Cb -0.17 -3.02 -0.10 0.00 0.02 0.00 0.00 34.50 31.23 3h9c s PRO 14 CO 0.13 -0.41 1.44 -0.47 -0.33 0.00 0.00 177.00 177.35 3h9c s TYR 15 N -0.98 2.97 -1.53 6.54 5.04 -1.26 -0.73 117.35 127.39 3h9c s TYR 15 Ca 0.52 1.07 0.23 0.00 -2.44 0.00 0.00 57.07 56.45 3h9c s TYR 15 Cb -0.44 -3.83 1.18 0.00 0.35 0.00 0.00 41.96 39.21 3h9c s TYR 15 CO 0.57 -2.65 1.73 0.00 -1.34 0.00 0.00 175.55 173.87 3h9c n ALA 16 N 1.98 2.19 -1.71 3.97 0.00 -0.43 -3.45 120.51 123.06 3h9c n ALA 16 Ca 0.06 -0.11 -0.22 0.00 0.00 0.00 0.00 53.44 53.16 3h9c n ALA 16 Cb 0.40 -1.37 0.08 0.00 0.00 0.00 0.00 19.45 18.56 3h9c n ALA 16 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3h9c n ASN 17 N -1.23 5.05 -3.66 0.00 4.05 -1.26 -4.78 115.26 113.42 3h9c n ASN 17 Ca 0.12 -3.77 -0.15 0.00 0.45 0.00 0.00 54.58 51.23 3h9c n ASN 17 Cb 0.16 -0.58 -0.08 0.00 1.23 0.00 0.00 39.78 40.52 3h9c n ASN 17 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 3h9c s GLY 18 N -2.90 -0.38 0.59 8.20 0.00 -1.22 -5.13 107.32 106.47 3h9c s GLY 18 Ca 0.53 1.09 -0.16 0.00 0.00 0.00 0.00 44.72 46.18 3h9c s GLY 18 CO 0.02 0.84 1.07 -0.56 0.00 0.00 0.00 173.10 174.46 3h9c s SER 19 N -0.64 5.72 0.15 1.64 0.01 -1.26 -4.87 113.70 114.44 3h9c s SER 19 Ca -0.07 1.90 -0.31 0.00 1.31 0.00 0.00 55.95 58.77 3h9c s SER 19 Cb -0.03 -2.54 -0.09 0.00 0.21 0.00 0.00 66.02 63.57 3h9c s SER 19 CO 0.05 -1.21 1.42 -0.63 0.41 0.00 0.00 173.24 173.27 3h9c s ILE 20 N -2.31 3.09 0.36 1.44 -1.09 -1.26 -4.98 121.20 116.45 3h9c s ILE 20 Ca 0.65 0.81 0.01 0.00 -2.23 0.00 0.00 60.65 59.90 3h9c s ILE 20 Cb -0.18 -3.52 -0.00 0.00 -1.58 0.00 0.00 42.46 37.18 3h9c s ILE 20 CO 0.35 0.08 0.04 0.00 -1.23 0.00 0.00 174.94 174.18 3h9c n HIS 21 N 3.58 0.60 0.26 3.97 1.44 -1.26 -0.83 115.22 122.98 3h9c n HIS 21 Ca 0.11 -1.94 0.10 0.00 -2.01 0.00 0.00 57.72 53.98 3h9c n HIS 21 Cb 0.41 -0.16 0.71 0.00 0.12 0.00 0.00 29.99 31.07 3h9c n HIS 21 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 3h9c h LEU 22 N 0.00 0.00 0.04 2.39 3.38 -1.65 -2.00 115.31 117.47 3h9c h LEU 22 Ca -0.29 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.68 3h9c h LEU 22 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3h9c h LEU 22 CO 0.48 0.07 -0.02 1.23 0.09 0.00 0.00 178.44 180.29 3h9c h GLY 23 N 0.30 -0.06 0.37 0.83 0.00 -1.95 -1.88 103.07 100.70 3h9c h GLY 23 Ca -0.00 0.02 0.10 0.00 0.00 0.00 0.00 47.33 47.45 3h9c h GLY 23 CO 0.01 -0.02 0.31 0.45 0.00 0.00 0.00 176.54 177.29 3h9c h HIS 24 N -0.21 0.54 -0.23 5.60 3.86 -1.79 -2.73 115.15 120.19 3h9c h HIS 24 Ca -0.01 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.19 3h9c h HIS 24 Cb 0.19 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 3h9c h HIS 24 CO -0.02 0.16 -0.05 0.52 0.86 0.00 0.00 177.93 179.40 3h9c h MET 25 N 0.51 0.36 -0.37 2.45 2.07 -1.10 -1.58 114.93 117.27 3h9c h MET 25 Ca 0.35 -0.07 0.05 0.00 -2.07 0.00 0.00 59.70 57.96 3h9c h MET 25 Cb 0.43 -0.05 -0.05 0.00 -1.87 0.00 0.00 31.60 30.06 3h9c h MET 25 CO -0.31 0.43 0.10 1.25 1.07 0.00 0.00 176.91 179.44 3h9c h LEU 26 N 0.35 0.06 -0.15 1.22 5.85 -1.02 -0.15 115.31 121.47 3h9c h LEU 26 Ca 0.08 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 3h9c h LEU 26 Cb 0.31 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 3h9c h LEU 26 CO 0.01 0.07 0.02 -0.08 -0.34 0.00 0.00 178.44 178.13 3h9c h GLU 27 N 0.23 0.25 -0.12 1.25 4.81 -1.37 -1.34 114.58 118.27 3h9c h GLU 27 Ca 0.17 -0.07 -0.14 0.00 -0.13 0.00 0.00 59.36 59.20 3h9c h GLU 27 Cb 0.18 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 3h9c h GLU 27 CO -0.21 0.43 -0.53 0.45 -0.73 0.00 0.00 179.01 178.42 3h9c h HIS 28 N 0.02 0.44 -0.30 0.92 3.86 -1.22 -1.86 115.15 117.02 3h9c h HIS 28 Ca 0.04 -0.15 -0.09 0.00 -1.16 0.00 0.00 60.37 59.01 3h9c h HIS 28 Cb 0.31 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 3h9c h HIS 28 CO 0.02 0.81 -0.16 0.82 0.86 0.00 0.00 177.93 180.28 3h9c h ILE 29 N 0.28 1.30 -0.24 2.45 2.04 -1.02 -0.77 117.51 121.55 3h9c h ILE 29 Ca 0.01 -1.27 0.03 0.00 1.00 0.00 0.00 64.86 64.62 3h9c h ILE 29 Cb 1.03 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 38.57 3h9c h ILE 29 CO 0.09 0.41 0.07 -0.61 0.00 0.00 0.00 178.15 178.10 3h9c h GLN 30 N 0.38 0.16 -0.49 2.37 4.15 -1.06 -0.88 115.11 119.74 3h9c h GLN 30 Ca 0.06 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.46 3h9c h GLN 30 Cb 0.69 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.32 3h9c h GLN 30 CO 0.05 0.11 0.24 0.00 -1.93 0.00 0.00 178.83 177.30 3h9c h ALA 31 N 1.16 0.63 -0.87 3.38 0.00 -1.34 -2.77 119.26 119.45 3h9c h ALA 31 Ca 0.11 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3h9c h ALA 31 Cb 0.09 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3h9c h ALA 31 CO -0.12 0.19 0.47 0.22 0.00 0.00 0.00 179.25 180.01 3h9c h ASP 32 N 0.65 1.10 -0.41 0.00 3.58 -0.69 0.26 116.42 120.91 3h9c h ASP 32 Ca 0.17 -0.11 0.01 0.00 0.42 0.00 0.00 57.03 57.53 3h9c h ASP 32 Cb 0.11 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.85 3h9c h ASP 32 CO -0.02 0.89 0.25 0.58 -2.88 0.00 0.00 179.24 178.06 3h9c h VAL 33 N 1.23 1.06 -0.28 2.25 2.07 -1.08 0.59 116.25 122.09 3h9c h VAL 33 Ca 0.31 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.63 3h9c h VAL 33 Cb 0.04 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 3h9c h VAL 33 CO -0.05 0.09 0.11 -0.25 0.02 0.00 0.00 177.57 177.50 3h9c h TRP 34 N 0.51 0.43 -0.33 1.57 7.01 -1.15 -1.67 115.95 122.32 3h9c h TRP 34 Ca 0.16 -0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.14 3h9c h TRP 34 Cb -0.02 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 26.90 3h9c h TRP 34 CO -0.06 0.43 0.19 0.28 -2.79 0.00 0.00 178.44 176.49 3h9c h VAL 35 N 0.30 1.04 -0.86 2.65 2.07 -0.79 -0.56 116.25 120.10 3h9c h VAL 35 Ca 0.09 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 3h9c h VAL 35 Cb 0.18 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 3h9c h VAL 35 CO -0.01 0.07 0.48 0.03 0.02 0.00 0.00 177.57 178.17 3h9c h ARG 36 N 0.39 1.18 -0.34 1.57 3.08 -0.72 -0.47 114.38 119.08 3h9c h ARG 36 Ca 0.13 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 3h9c h ARG 36 Cb -0.01 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.79 3h9c h ARG 36 CO -0.06 0.85 0.15 -0.92 -1.07 0.00 0.00 179.97 178.92 3h9c h TYR 37 N 1.19 0.50 -0.96 3.04 5.03 -0.91 -1.53 116.97 123.33 3h9c h TYR 37 Ca 0.30 -0.03 0.02 0.00 2.58 0.00 0.00 58.73 61.60 3h9c h TYR 37 Cb 0.00 -0.15 -0.05 0.00 1.55 0.00 0.00 36.73 38.08 3h9c h TYR 37 CO 0.01 0.46 0.64 1.96 -1.32 0.00 0.00 178.16 179.90 3h9c h GLN 38 N 0.40 1.24 -0.57 1.82 1.08 -0.59 -1.43 115.11 117.06 3h9c h GLN 38 Ca 0.11 -0.07 -0.07 0.00 -1.45 0.00 0.00 58.65 57.17 3h9c h GLN 38 Cb 0.16 -0.28 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 3h9c h GLN 38 CO -0.01 0.82 0.07 0.00 -0.95 0.00 0.00 178.83 178.76 3h9c h ARG 39 N 1.28 0.93 0.00 1.46 3.08 -0.94 -2.38 114.38 117.82 3h9c h ARG 39 Ca 0.36 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 3h9c h ARG 39 Cb -0.11 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 29.82 3h9c h ARG 39 CO -0.09 0.88 -0.07 0.52 -1.07 0.00 0.00 179.97 180.14 3h9c h MET 40 N 0.88 0.00 -0.24 0.04 2.86 -0.24 -1.72 114.93 116.50 3h9c h MET 40 Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 3h9c h MET 40 Cb 0.42 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 3h9c h MET 40 CO 0.01 0.07 0.00 0.54 1.06 0.00 0.00 176.91 178.60 3h9c n ARG 41 N -4.12 1.86 -0.33 1.72 5.12 -0.82 -4.51 116.66 115.58 3h9c n ARG 41 Ca -0.03 -1.30 0.00 0.00 -1.93 0.00 0.00 57.85 54.59 3h9c n ARG 41 Cb 0.16 -1.39 0.00 0.00 -1.16 0.00 0.00 32.46 30.07 3h9c n ARG 41 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3h9c n GLY 42 N 1.17 0.83 3.86 -0.13 0.00 -0.65 -4.69 105.19 105.59 3h9c n GLY 42 Ca 0.16 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3h9c n GLY 42 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h9c s HIS 43 N -2.00 3.51 -0.46 1.61 3.76 -1.11 -4.03 115.29 116.57 3h9c s HIS 43 Ca 0.00 1.33 -0.28 0.00 -0.15 0.00 0.00 55.06 55.96 3h9c s HIS 43 Cb 0.00 -2.70 0.03 0.00 1.11 0.00 0.00 32.58 31.02 3h9c s HIS 43 CO 0.00 -0.42 1.06 -2.00 -0.85 0.00 0.00 174.74 172.53 3h9c s GLU 44 N -4.38 3.70 -0.07 1.40 2.12 0.07 -4.65 118.70 116.89 3h9c s GLU 44 Ca 0.56 0.48 0.04 0.00 0.36 0.00 0.00 54.97 56.41 3h9c s GLU 44 Cb -0.10 -3.90 -0.02 0.00 0.26 0.00 0.00 34.13 30.38 3h9c s GLU 44 CO 0.38 -1.28 -0.19 0.08 -0.54 0.00 0.00 175.26 173.71 3h9c s VAL 45 N 4.14 2.57 -0.25 3.70 1.01 -1.26 -0.29 120.40 130.02 3h9c s VAL 45 Ca 0.44 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.56 3h9c s VAL 45 Cb -0.09 -1.99 0.06 0.00 0.00 0.00 0.00 36.38 34.36 3h9c s VAL 45 CO 0.28 0.57 -0.07 0.20 0.00 0.00 0.00 175.10 176.08 3h9c s ASN 46 N -0.26 4.12 -0.35 3.32 -0.87 0.55 -4.97 114.94 116.48 3h9c s ASN 46 Ca 0.00 -1.30 -0.12 0.00 -1.57 0.00 0.00 52.86 49.87 3h9c s ASN 46 Cb -0.13 -1.34 0.00 0.00 -0.02 0.00 0.00 41.25 39.76 3h9c s ASN 46 CO 0.03 -0.22 0.23 0.12 -2.57 0.00 0.00 177.10 174.68 3h9c s PHE 47 N 1.26 3.22 -0.06 2.20 5.36 -1.26 -0.71 117.98 127.99 3h9c s PHE 47 Ca -0.07 -0.50 0.05 0.00 -0.96 0.00 0.00 56.93 55.45 3h9c s PHE 47 Cb -0.19 -2.46 -0.00 0.00 -0.34 0.00 0.00 43.02 40.02 3h9c s PHE 47 CO -0.06 -0.48 -0.20 0.42 -1.46 0.00 0.00 175.22 173.44 3h9c s ILE 48 N 1.66 1.72 0.19 3.12 -1.09 0.28 -0.16 121.20 126.92 3h9c s ILE 48 Ca 0.05 -0.86 -0.03 0.00 -2.23 0.00 0.00 60.65 57.58 3h9c s ILE 48 Cb -0.18 -1.48 0.01 0.00 -1.58 0.00 0.00 42.46 39.23 3h9c s ILE 48 CO 0.09 0.49 0.29 0.00 -1.23 0.00 0.00 174.94 174.57 3h9c s ALA 50 N -2.04 -2.17 0.19 0.00 0.00 -1.26 -1.49 121.76 114.99 3h9c s ALA 50 Ca 0.13 1.56 -0.24 0.00 0.00 0.00 0.00 51.96 53.41 3h9c s ALA 50 Cb -0.01 -0.13 -0.08 0.00 0.00 0.00 0.00 23.12 22.89 3h9c s ALA 50 CO 0.10 -0.67 0.77 -0.51 0.00 0.00 0.00 175.76 175.45 3h9c s ASP 51 N -2.28 7.29 -0.57 0.00 1.11 -0.92 -3.30 116.67 118.00 3h9c s ASP 51 Ca 0.11 1.60 -0.22 0.00 0.18 0.00 0.00 52.55 54.22 3h9c s ASP 51 Cb 0.00 -2.48 0.06 0.00 1.07 0.00 0.00 42.92 41.57 3h9c s ASP 51 CO -0.04 0.14 0.83 -0.62 1.18 0.00 0.00 175.17 176.67 3h9c s ASP 52 N -1.32 6.24 0.00 0.27 3.68 0.09 -1.30 116.67 124.33 3h9c s ASP 52 Ca 0.39 -0.81 0.06 0.00 2.13 0.00 0.00 52.55 54.32 3h9c s ASP 52 Cb -0.21 -2.38 0.08 0.00 -1.45 0.00 0.00 42.92 38.97 3h9c s ASP 52 CO 0.24 -1.18 0.81 0.00 0.13 0.00 0.00 175.17 175.17 3h9c n ALA 53 N 7.05 2.40 -2.24 3.66 0.00 -1.26 -1.32 120.51 128.80 3h9c n ALA 53 Ca -0.03 -0.68 -0.19 0.00 0.00 0.00 0.00 53.44 52.54 3h9c n ALA 53 Cb 0.46 -0.23 -0.01 0.00 0.00 0.00 0.00 19.45 19.67 3h9c n ALA 53 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3h9c s HIS 54 N -0.65 2.87 0.00 0.00 3.76 -1.26 -4.93 115.29 115.08 3h9c s HIS 54 Ca 0.09 -0.37 0.00 0.00 -0.15 0.00 0.00 55.06 54.63 3h9c s HIS 54 Cb 0.06 -2.15 0.00 0.00 1.11 0.00 0.00 32.58 31.60 3h9c s HIS 54 CO 0.08 -0.16 0.00 0.41 -0.85 0.00 0.00 174.74 174.23 3h9c n GLY 55 N -1.65 2.35 0.09 -2.22 0.00 -0.11 -4.72 105.19 98.92 3h9c n GLY 55 Ca 0.03 -2.16 -0.11 0.00 0.00 0.00 0.00 46.02 43.78 3h9c n GLY 55 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3h9c h THR 56 N 0.04 1.15 -0.93 2.61 2.02 -1.94 -1.17 112.91 114.69 3h9c h THR 56 Ca 0.00 -0.44 0.07 0.00 0.77 0.00 0.00 66.41 66.81 3h9c h THR 56 Cb 0.00 1.21 -0.07 0.00 -1.74 0.00 0.00 68.15 67.56 3h9c h THR 56 CO 0.00 0.13 0.59 -0.65 0.37 0.00 0.00 175.52 175.96 3h9c h PRO 57 N 0.05 1.02 -0.40 6.66 0.11 -2.00 -0.52 132.00 136.92 3h9c h PRO 57 Ca 0.04 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.03 3h9c h PRO 57 Cb 0.17 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 3h9c h PRO 57 CO -0.00 0.67 0.03 0.82 -0.21 0.00 0.00 178.00 179.31 3h9c h ILE 58 N 1.05 1.25 -0.58 4.15 2.04 -1.79 -0.62 117.51 123.00 3h9c h ILE 58 Ca 0.41 -0.95 0.05 0.00 1.00 0.00 0.00 64.86 65.37 3h9c h ILE 58 Cb 0.21 1.08 -0.05 0.00 -0.74 0.00 0.00 36.82 37.32 3h9c h ILE 58 CO -0.19 0.32 0.31 -0.03 0.00 0.00 0.00 178.15 178.57 3h9c h MET 59 N 0.53 0.57 -0.19 2.37 4.05 -0.59 -2.13 114.93 119.54 3h9c h MET 59 Ca 0.12 -0.03 -0.18 0.00 -0.28 0.00 0.00 59.70 59.33 3h9c h MET 59 Cb 0.43 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 31.10 3h9c h MET 59 CO 0.01 0.38 -0.60 -0.07 0.23 0.00 0.00 176.91 176.86 3h9c h LEU 60 N 0.59 0.73 -0.38 3.39 3.38 -0.92 -2.39 115.31 119.71 3h9c h LEU 60 Ca 0.26 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3h9c h LEU 60 Cb 0.15 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3h9c h LEU 60 CO -0.17 1.16 0.20 0.50 0.09 0.00 0.00 178.44 180.22 3h9c h LYS 61 N 0.48 0.54 -0.77 1.13 1.63 -0.88 -0.91 116.57 117.80 3h9c h LYS 61 Ca -0.00 -0.07 -0.02 0.00 -0.85 0.00 0.00 60.65 59.70 3h9c h LYS 61 Cb 1.17 -0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 32.66 3h9c h LYS 61 CO 0.12 0.46 0.39 0.00 -3.45 0.00 0.00 179.45 176.97 3h9c h ALA 62 N 1.05 1.24 -0.62 5.00 0.00 -1.33 -1.06 119.26 123.54 3h9c h ALA 62 Ca 0.13 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3h9c h ALA 62 Cb 0.09 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 3h9c h ALA 62 CO -0.02 0.60 0.24 1.96 0.00 0.00 0.00 179.25 182.03 3h9c h GLN 63 N 1.09 0.93 -0.72 0.00 4.20 -1.01 -0.99 115.11 118.61 3h9c h GLN 63 Ca 0.27 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 3h9c h GLN 63 Cb 0.07 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.67 3h9c h GLN 63 CO -0.04 0.79 0.42 1.96 -0.67 0.00 0.00 178.83 181.30 3h9c h GLN 64 N 0.87 0.98 0.00 1.46 4.20 -0.62 -2.28 115.11 119.72 3h9c h GLN 64 Ca 0.21 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3h9c h GLN 64 Cb 0.21 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.79 3h9c h GLN 64 CO -0.02 0.69 0.00 1.28 -0.67 0.00 0.00 178.83 180.12 3h9c n LEU 65 N -4.38 0.44 -1.24 1.46 4.77 -0.45 -4.93 117.00 112.67 3h9c n LEU 65 Ca 0.07 0.55 -0.11 0.00 -0.03 0.00 0.00 56.01 56.49 3h9c n LEU 65 Cb 0.07 -0.42 -0.01 0.00 -2.33 0.00 0.00 43.42 40.74 3h9c n LEU 65 CO 0.37 -0.14 -0.14 0.61 -1.33 0.00 0.00 177.39 176.76 3h9c n GLY 66 N 1.22 -0.06 3.38 -0.72 0.00 -0.43 -5.04 105.19 103.53 3h9c n GLY 66 Ca 0.06 -0.43 -0.19 0.00 0.00 0.00 0.00 46.02 45.46 3h9c n GLY 66 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3h9c s ILE 67 N -2.54 1.23 0.53 -0.61 -4.36 -0.89 -5.05 121.20 109.51 3h9c s ILE 67 Ca 0.00 -2.05 -0.20 0.00 -0.26 0.00 0.00 60.65 58.14 3h9c s ILE 67 Cb 0.00 -2.44 -0.06 0.00 1.25 0.00 0.00 42.46 41.21 3h9c s ILE 67 CO 0.00 -0.27 1.13 0.42 0.24 0.00 0.00 174.94 176.46 3h9c s THR 68 N -3.28 3.18 0.41 8.37 -4.23 -1.26 -4.29 115.64 114.53 3h9c s THR 68 Ca 0.30 0.75 0.07 0.00 -1.18 0.00 0.00 61.69 61.63 3h9c s THR 68 Cb 0.06 -3.31 0.25 0.00 1.34 0.00 0.00 72.50 70.84 3h9c s THR 68 CO 0.11 -0.15 2.04 -0.65 -0.54 0.00 0.00 174.62 175.43 3h9c h PRO 69 N 1.29 0.50 -0.53 3.99 0.11 -1.91 -1.73 132.00 133.72 3h9c h PRO 69 Ca -0.50 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.58 3h9c h PRO 69 Cb 1.26 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 3h9c h PRO 69 CO 0.57 0.36 0.34 0.93 -0.21 0.00 0.00 178.00 179.99 3h9c h GLU 70 N 0.51 0.66 -0.54 1.05 3.07 -1.98 0.37 114.58 117.72 3h9c h GLU 70 Ca 0.13 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 58.91 3h9c h GLU 70 Cb -0.00 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 27.74 3h9c h GLU 70 CO -0.02 0.44 0.17 0.37 -1.40 0.00 0.00 179.01 178.56 3h9c h GLN 71 N 0.68 0.83 -0.09 2.33 4.15 -1.77 -1.77 115.11 119.47 3h9c h GLN 71 Ca 0.20 -0.18 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 3h9c h GLN 71 Cb -0.03 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 27.53 3h9c h GLN 71 CO -0.07 0.76 0.03 1.98 -1.93 0.00 0.00 178.83 179.60 3h9c h MET 72 N 0.74 0.14 0.00 1.69 4.05 -0.87 -1.87 114.93 118.81 3h9c h MET 72 Ca 0.17 -0.03 -0.07 0.00 -0.28 0.00 0.00 59.70 59.49 3h9c h MET 72 Cb 0.27 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.04 3h9c h MET 72 CO -0.01 0.31 -0.34 -0.84 0.23 0.00 0.00 176.91 176.26 3h9c h ILE 73 N -0.05 1.13 -0.52 1.77 3.07 -0.95 -1.97 117.51 119.99 3h9c h ILE 73 Ca 0.03 -1.22 -0.06 0.00 1.55 0.00 0.00 64.86 65.16 3h9c h ILE 73 Cb 0.23 1.68 -0.02 0.00 -0.27 0.00 0.00 36.82 38.44 3h9c h ILE 73 CO -0.00 0.34 0.10 1.23 -1.05 0.00 0.00 178.15 178.76 3h9c h GLY 74 N 1.21 0.93 0.96 0.16 0.00 -1.01 0.19 103.07 105.50 3h9c h GLY 74 Ca -0.00 -0.61 -0.03 0.00 0.00 0.00 0.00 47.33 46.68 3h9c h GLY 74 CO 0.04 0.57 0.16 0.83 0.00 0.00 0.00 176.54 178.14 3h9c h GLU 75 N 0.75 0.71 -0.17 4.80 5.08 -1.01 -2.13 114.58 122.61 3h9c h GLU 75 Ca 0.16 -0.15 -0.13 0.00 -1.00 0.00 0.00 59.36 58.24 3h9c h GLU 75 Cb 0.39 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3h9c h GLU 75 CO 0.01 0.67 -0.46 1.98 -1.00 0.00 0.00 179.01 180.21 3h9c h MET 76 N 0.61 0.42 -0.60 2.33 4.05 -1.24 -1.83 114.93 118.67 3h9c h MET 76 Ca 0.15 -0.23 0.03 0.00 -0.28 0.00 0.00 59.70 59.38 3h9c h MET 76 Cb 0.25 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.02 3h9c h MET 76 CO -0.01 0.80 0.36 1.03 0.23 0.00 0.00 176.91 179.32 3h9c h SER 77 N 0.34 0.57 -0.57 1.39 0.87 -0.79 0.79 113.55 116.15 3h9c h SER 77 Ca 0.02 0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.51 3h9c h SER 77 Cb 0.94 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.77 3h9c h SER 77 CO 0.08 0.40 0.03 1.56 -0.53 0.00 0.00 176.83 178.37 3h9c h GLN 78 N 0.70 0.99 -0.31 2.24 1.08 -1.13 -1.10 115.11 117.58 3h9c h GLN 78 Ca 0.25 -0.30 -0.00 0.00 -1.45 0.00 0.00 58.65 57.14 3h9c h GLN 78 Cb 0.05 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 3h9c h GLN 78 CO -0.12 0.97 0.18 1.49 -0.95 0.00 0.00 178.83 180.40 3h9c h GLU 79 N 0.88 0.43 -0.24 1.46 4.81 -0.87 -0.79 114.58 120.26 3h9c h GLU 79 Ca 0.17 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 3h9c h GLU 79 Cb 0.50 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 3h9c h GLU 79 CO 0.02 0.35 0.14 0.45 -0.73 0.00 0.00 179.01 179.24 3h9c h HIS 80 N 0.39 0.27 -0.21 0.92 3.86 -0.68 -2.04 115.15 117.66 3h9c h HIS 80 Ca 0.11 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.24 3h9c h HIS 80 Cb 0.04 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 3h9c h HIS 80 CO -0.04 0.17 -0.26 1.96 0.86 0.00 0.00 177.93 180.62 3h9c h GLN 81 N 0.30 0.40 -0.47 2.45 4.20 -1.01 -0.71 115.11 120.26 3h9c h GLN 81 Ca 0.09 -0.15 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 3h9c h GLN 81 Cb -0.01 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 3h9c h GLN 81 CO -0.04 0.64 0.26 1.15 -0.67 0.00 0.00 178.83 180.17 3h9c h THR 82 N 0.36 1.17 -0.21 -0.54 2.02 -0.94 -0.50 112.91 114.26 3h9c h THR 82 Ca 0.05 -0.42 -0.02 0.00 0.77 0.00 0.00 66.41 66.79 3h9c h THR 82 Cb 0.66 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 3h9c h THR 82 CO 0.05 0.17 0.04 0.44 0.37 0.00 0.00 175.52 176.59 3h9c h ASP 83 N 0.63 0.32 -0.64 4.18 3.32 -0.86 -1.45 116.42 121.92 3h9c h ASP 83 Ca 0.17 -0.25 -0.04 0.00 0.02 0.00 0.00 57.03 56.93 3h9c h ASP 83 Cb 0.05 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 3h9c h ASP 83 CO -0.03 0.49 0.26 -0.26 -1.72 0.00 0.00 179.24 177.99 3h9c h PHE 84 N 0.14 0.99 -0.36 4.55 0.05 -1.08 -1.66 116.94 119.57 3h9c h PHE 84 Ca 0.06 -0.06 -0.04 0.00 3.82 0.00 0.00 57.97 61.75 3h9c h PHE 84 Cb 0.30 -0.30 -0.02 0.00 2.00 0.00 0.00 35.95 37.94 3h9c h PHE 84 CO 0.02 0.76 0.04 0.00 -0.18 0.00 0.00 178.31 178.95 3h9c h ALA 85 N 1.33 1.41 0.00 2.45 0.00 -0.95 -1.55 119.26 121.95 3h9c h ALA 85 Ca 0.22 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3h9c h ALA 85 Cb 0.19 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3h9c h ALA 85 CO -0.02 0.42 -0.10 0.78 0.00 0.00 0.00 179.25 180.33 3h9c h GLY 86 N 0.80 0.00 -2.54 0.00 0.00 -0.31 -1.54 103.07 99.48 3h9c h GLY 86 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 3h9c h GLY 86 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.23 3h9c n PHE 87 N -3.84 0.77 -3.58 5.60 3.01 -0.64 -4.61 117.46 114.17 3h9c n PHE 87 Ca -0.02 -0.39 -0.23 0.00 1.01 0.00 0.00 57.45 57.82 3h9c n PHE 87 Cb 0.20 -0.00 0.08 0.00 -0.01 0.00 0.00 39.48 39.75 3h9c n PHE 87 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3h9c n ASN 88 N 1.59 -5.16 -4.64 4.37 5.03 -0.58 -4.95 115.26 110.92 3h9c n ASN 88 Ca 0.22 -0.58 -0.43 0.00 0.87 0.00 0.00 54.58 54.67 3h9c n ASN 88 Cb 0.62 -4.98 -0.02 0.00 -1.02 0.00 0.00 39.78 34.37 3h9c n ASN 88 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3h9c s ILE 89 N -3.34 4.55 -0.61 2.41 -1.09 -0.87 -4.94 121.20 117.31 3h9c s ILE 89 Ca 0.44 1.68 -0.04 0.00 -2.23 0.00 0.00 60.65 60.50 3h9c s ILE 89 Cb -0.20 -4.38 0.09 0.00 -1.58 0.00 0.00 42.46 36.40 3h9c s ILE 89 CO 0.74 -0.44 2.66 -1.54 -1.23 0.00 0.00 174.94 175.13 3h9c n SER 90 N 6.76 6.78 -4.73 3.58 3.41 -1.26 -4.73 113.62 123.42 3h9c n SER 90 Ca 0.11 -3.25 -0.41 0.00 -0.26 0.00 0.00 58.87 55.06 3h9c n SER 90 Cb 0.47 -1.24 0.01 0.00 -0.26 0.00 0.00 64.21 63.19 3h9c n SER 90 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3h9c n TYR 91 N 0.89 2.46 0.11 7.33 4.02 -1.26 -4.83 117.16 125.88 3h9c n TYR 91 Ca 0.51 0.48 -0.01 0.00 -0.01 0.00 0.00 57.90 58.87 3h9c n TYR 91 Cb 0.48 -2.43 -0.03 0.00 -0.02 0.00 0.00 39.34 37.34 3h9c n TYR 91 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 3h9c h ASP 92 N 2.38 0.00 -3.91 7.72 3.32 -0.93 -3.46 116.42 121.54 3h9c h ASP 92 Ca -0.49 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.47 3h9c h ASP 92 Cb 1.28 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.60 3h9c h ASP 92 CO 0.61 0.69 -0.10 0.21 -1.72 0.00 0.00 179.24 178.93 3h9c s ASN 93 N -6.54 -0.55 -0.21 6.45 2.47 -1.14 -5.00 114.94 110.42 3h9c s ASN 93 Ca 0.03 1.05 -0.00 0.00 0.42 0.00 0.00 52.86 54.36 3h9c s ASN 93 Cb 0.08 1.07 0.05 0.00 -1.45 0.00 0.00 41.25 41.00 3h9c s ASN 93 CO 0.77 -0.18 -0.04 -0.47 -3.72 0.00 0.00 177.10 173.46 3h9c s TYR 94 N 0.30 2.00 0.00 0.43 5.04 -1.26 -1.79 117.35 122.07 3h9c s TYR 94 Ca -0.00 -1.43 0.00 0.00 -2.44 0.00 0.00 57.07 53.20 3h9c s TYR 94 Cb -0.04 -1.43 0.00 0.00 0.35 0.00 0.00 41.96 40.85 3h9c s TYR 94 CO 0.00 -0.71 0.00 1.58 -1.34 0.00 0.00 175.55 175.09 3h9c n HIS 95 N 4.79 0.00 -3.76 4.97 -0.00 -0.56 -4.89 115.22 115.76 3h9c n HIS 95 Ca -0.12 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 57.93 3h9c n HIS 95 Cb 0.46 0.00 -0.09 0.00 -0.12 0.00 0.00 29.99 30.24 3h9c n HIS 95 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 3h9c s SER 96 N 0.67 -0.19 0.51 0.26 0.15 -1.26 -2.17 113.70 111.66 3h9c s SER 96 Ca 0.00 0.11 0.32 0.00 0.70 0.00 0.00 55.95 57.08 3h9c s SER 96 Cb 0.00 0.33 1.21 0.00 -1.71 0.00 0.00 66.02 65.85 3h9c s SER 96 CO 0.00 -0.42 1.92 0.71 1.20 0.00 0.00 173.24 176.64 3h9c h THR 97 N 3.92 0.00 -2.19 6.45 1.35 -1.55 -3.34 112.91 117.55 3h9c h THR 97 Ca -0.29 -0.55 -0.73 0.00 -0.55 0.00 0.00 66.41 64.29 3h9c h THR 97 Cb 1.18 1.53 -0.17 0.00 -1.73 0.00 0.00 68.15 68.95 3h9c h THR 97 CO 0.39 0.00 1.27 -2.28 -0.25 0.00 0.00 175.52 174.65 3h9c s HIS 98 N -3.58 3.42 0.11 4.73 5.65 -1.26 -4.69 115.29 119.66 3h9c s HIS 98 Ca 0.02 -1.98 -0.16 0.00 0.25 0.00 0.00 55.06 53.19 3h9c s HIS 98 Cb 0.09 -4.32 0.03 0.00 -1.18 0.00 0.00 32.58 27.20 3h9c s HIS 98 CO 0.55 -1.42 0.40 -1.54 -0.65 0.00 0.00 174.74 172.07 3h9c s SER 99 N 3.01 -0.23 0.28 9.88 1.04 -1.26 -5.05 113.70 121.37 3h9c s SER 99 Ca 0.41 -0.28 0.01 0.00 0.48 0.00 0.00 55.95 56.56 3h9c s SER 99 Cb -0.03 0.46 0.41 0.00 0.10 0.00 0.00 66.02 66.97 3h9c s SER 99 CO -0.02 -0.83 1.77 -0.33 0.98 0.00 0.00 173.24 174.82 3h9c h GLU 100 N 2.45 0.65 -0.45 4.02 4.39 -1.93 -1.17 114.58 122.55 3h9c h GLU 100 Ca -0.34 -0.18 -0.01 0.00 0.34 0.00 0.00 59.36 59.17 3h9c h GLU 100 Cb 1.25 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.81 3h9c h GLU 100 CO 0.47 0.72 0.23 0.93 -1.16 0.00 0.00 179.01 180.20 3h9c h GLU 101 N 0.60 0.63 -0.26 2.33 3.07 -1.95 -0.92 114.58 118.09 3h9c h GLU 101 Ca 0.11 -0.08 -0.11 0.00 -0.50 0.00 0.00 59.36 58.78 3h9c h GLU 101 Cb 0.48 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.26 3h9c h GLU 101 CO 0.03 0.52 -0.32 -0.97 -1.40 0.00 0.00 179.01 176.86 3h9c h ASN 102 N 0.58 0.55 -0.16 1.42 -1.24 -1.79 -1.54 115.58 113.41 3h9c h ASN 102 Ca 0.16 -0.22 -0.00 0.00 0.71 0.00 0.00 56.30 56.95 3h9c h ASN 102 Cb 0.08 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 38.97 3h9c h ASN 102 CO -0.02 0.84 0.10 -0.09 -1.29 0.00 0.00 177.43 176.97 3h9c h ARG 103 N 0.46 0.21 -0.41 6.67 2.43 -0.82 0.58 114.38 123.50 3h9c h ARG 103 Ca 0.06 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.10 3h9c h ARG 103 Cb 0.78 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 3h9c h ARG 103 CO 0.06 0.17 -0.20 1.96 -1.51 0.00 0.00 179.97 180.45 3h9c h GLN 104 N 0.19 0.80 -0.20 0.20 4.20 -1.07 -1.22 115.11 118.02 3h9c h GLN 104 Ca 0.06 -0.32 -0.16 0.00 0.06 0.00 0.00 58.65 58.29 3h9c h GLN 104 Cb 0.01 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 3h9c h GLN 104 CO -0.01 0.94 -0.55 -0.07 -0.67 0.00 0.00 178.83 178.47 3h9c h LEU 105 N 0.71 0.65 -0.45 1.46 3.38 -1.16 -0.68 115.31 119.22 3h9c h LEU 105 Ca 0.10 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 3h9c h LEU 105 Cb 0.71 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 3h9c h LEU 105 CO 0.05 1.07 0.17 0.28 0.09 0.00 0.00 178.44 180.10 3h9c h SER 106 N 0.45 0.63 -0.56 -0.43 0.02 -0.70 0.11 113.55 113.06 3h9c h SER 106 Ca 0.01 -0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 60.73 3h9c h SER 106 Cb 1.09 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 3h9c h SER 106 CO 0.10 0.63 0.16 -0.33 -1.14 0.00 0.00 176.83 176.26 3h9c h GLU 107 N 0.58 0.88 -0.08 3.45 5.08 -1.15 -1.27 114.58 122.08 3h9c h GLU 107 Ca 0.15 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3h9c h GLU 107 Cb 0.21 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 3h9c h GLU 107 CO -0.01 0.81 0.04 1.25 -1.00 0.00 0.00 179.01 180.10 3h9c h LEU 108 N 0.79 0.10 -0.37 1.33 5.85 -0.90 -0.98 115.31 121.13 3h9c h LEU 108 Ca 0.18 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 3h9c h LEU 108 Cb 0.31 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 3h9c h LEU 108 CO -0.00 0.18 0.09 0.40 -0.34 0.00 0.00 178.44 178.77 3h9c h ILE 109 N 0.01 1.22 -0.44 4.05 2.04 -0.89 -1.55 117.51 121.96 3h9c h ILE 109 Ca 0.03 -0.76 0.05 0.00 1.00 0.00 0.00 64.86 65.18 3h9c h ILE 109 Cb 0.10 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 3h9c h ILE 109 CO -0.00 0.26 0.17 0.22 0.00 0.00 0.00 178.15 178.79 3h9c h TYR 110 N 0.46 0.29 -0.75 1.37 3.20 -1.20 -0.00 116.97 120.34 3h9c h TYR 110 Ca 0.12 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.05 3h9c h TYR 110 Cb 0.30 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.45 3h9c h TYR 110 CO 0.02 0.11 0.46 0.77 -1.64 0.00 0.00 178.16 177.88 3h9c h SER 111 N 0.34 0.74 -0.33 -2.11 0.02 -0.82 0.03 113.55 111.42 3h9c h SER 111 Ca 0.20 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 61.04 3h9c h SER 111 Cb 0.19 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 3h9c h SER 111 CO -0.20 0.50 -0.26 0.03 -1.14 0.00 0.00 176.83 175.76 3h9c h ARG 112 N 0.88 0.76 -0.64 3.45 3.08 -0.77 -0.86 114.38 120.28 3h9c h ARG 112 Ca 0.32 -0.38 0.02 0.00 0.07 0.00 0.00 59.98 60.01 3h9c h ARG 112 Cb 0.09 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 3h9c h ARG 112 CO -0.14 1.00 0.41 -0.07 -1.07 0.00 0.00 179.97 180.10 3h9c h LEU 113 N 0.54 0.69 -0.21 3.04 3.38 -0.62 -1.32 115.31 120.81 3h9c h LEU 113 Ca 0.06 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3h9c h LEU 113 Cb 0.83 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 3h9c h LEU 113 CO 0.07 0.49 0.00 0.50 0.09 0.00 0.00 178.44 179.59 3h9c h LYS 114 N 0.82 0.37 -0.45 1.13 3.64 -0.83 -0.53 116.57 120.73 3h9c h LYS 114 Ca 0.25 -0.12 0.02 0.00 -1.27 0.00 0.00 60.65 59.53 3h9c h LYS 114 Cb -0.04 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3h9c h LYS 114 CO -0.08 0.56 0.30 1.49 -2.27 0.00 0.00 179.45 179.46 3h9c h GLU 115 N 0.14 0.52 -0.08 1.90 4.22 -1.00 -2.02 114.58 118.26 3h9c h GLU 115 Ca 0.06 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.47 3h9c h GLU 115 Cb 0.39 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3h9c h GLU 115 CO 0.01 0.35 0.00 0.09 -2.18 0.00 0.00 179.01 177.28 3h9c n ASN 116 N -4.47 1.02 0.00 1.04 3.02 -0.51 -4.92 115.26 110.43 3h9c n ASN 116 Ca 0.04 -1.54 0.00 0.00 -0.03 0.00 0.00 54.58 53.05 3h9c n ASN 116 Cb 0.12 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.23 3h9c n ASN 116 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h9c n GLY 117 N 1.03 0.52 1.14 7.41 0.00 -0.76 -4.96 105.19 109.56 3h9c n GLY 117 Ca 0.16 -0.78 0.11 0.00 0.00 0.00 0.00 46.02 45.52 3h9c n GLY 117 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h9c n PHE 118 N -2.80 0.58 -4.28 1.61 0.99 -0.24 -4.86 117.46 108.46 3h9c n PHE 118 Ca 0.00 -0.31 -0.34 0.00 -0.00 0.00 0.00 57.45 56.80 3h9c n PHE 118 Cb 0.00 -0.00 -0.14 0.00 -1.00 0.00 0.00 39.48 38.34 3h9c n PHE 118 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 3h9c s ILE 119 N -1.34 3.30 0.03 4.37 -1.09 -1.25 -0.80 121.20 124.42 3h9c s ILE 119 Ca 0.39 -0.54 0.07 0.00 -2.23 0.00 0.00 60.65 58.33 3h9c s ILE 119 Cb 0.22 -2.45 -0.03 0.00 -1.58 0.00 0.00 42.46 38.62 3h9c s ILE 119 CO 0.30 0.47 -0.17 -0.54 -1.23 0.00 0.00 174.94 173.78 3h9c s LYS 120 N 0.93 2.13 -0.17 2.79 -0.14 0.54 -4.92 119.74 120.91 3h9c s LYS 120 Ca -0.01 -0.95 -0.07 0.00 -1.36 0.00 0.00 55.97 53.58 3h9c s LYS 120 Cb -0.15 -2.23 -0.04 0.00 -1.68 0.00 0.00 37.83 33.74 3h9c s LYS 120 CO 0.00 0.55 0.05 -0.80 -0.76 0.00 0.00 175.35 174.39 3h9c s ASN 121 N -1.42 5.57 -0.08 2.83 0.02 -1.26 0.27 114.94 120.87 3h9c s ASN 121 Ca 0.15 0.09 -0.07 0.00 -1.02 0.00 0.00 52.86 52.01 3h9c s ASN 121 Cb -0.11 -1.92 0.02 0.00 0.02 0.00 0.00 41.25 39.26 3h9c s ASN 121 CO 0.05 0.20 0.20 -0.60 0.02 0.00 0.00 177.10 176.97 3h9c s ARG 122 N 0.21 0.23 -0.06 -0.60 3.52 -0.44 -5.00 118.95 116.82 3h9c s ARG 122 Ca 0.04 0.28 -0.25 0.00 -0.13 0.00 0.00 55.73 55.67 3h9c s ARG 122 Cb -0.12 0.11 -0.03 0.00 -1.56 0.00 0.00 34.95 33.34 3h9c s ARG 122 CO 0.01 -0.03 0.75 0.99 -0.81 0.00 0.00 175.30 176.21 3h9c s THR 123 N 0.13 5.01 0.30 4.11 2.01 -1.26 -0.41 115.64 125.53 3h9c s THR 123 Ca -0.00 1.55 0.09 0.00 0.31 0.00 0.00 61.69 63.64 3h9c s THR 123 Cb -0.02 -4.09 -0.06 0.00 0.01 0.00 0.00 72.50 68.35 3h9c s THR 123 CO 0.00 0.22 -0.11 0.27 -0.69 0.00 0.00 174.62 174.31 3h9c s ILE 124 N 0.91 2.06 -0.09 1.82 -4.36 -0.04 -4.94 121.20 116.56 3h9c s ILE 124 Ca 0.40 -2.23 0.02 0.00 -0.26 0.00 0.00 60.65 58.58 3h9c s ILE 124 Cb -0.18 -2.45 -0.02 0.00 1.25 0.00 0.00 42.46 41.06 3h9c s ILE 124 CO 0.19 -0.32 -0.15 -0.55 0.24 0.00 0.00 174.94 174.35 3h9c s SER 125 N -3.51 3.89 -0.02 4.36 0.15 -1.26 -0.85 113.70 116.46 3h9c s SER 125 Ca 0.30 -0.30 -0.16 0.00 0.70 0.00 0.00 55.95 56.49 3h9c s SER 125 Cb 0.01 -1.22 0.03 0.00 -1.71 0.00 0.00 66.02 63.13 3h9c s SER 125 CO 0.14 0.25 0.33 -1.58 1.20 0.00 0.00 173.24 173.57 3h9c s GLN 126 N -0.14 0.68 0.35 5.44 0.74 -0.66 -4.93 119.66 121.15 3h9c s GLN 126 Ca -0.02 -0.16 -0.29 0.00 0.05 0.00 0.00 55.36 54.95 3h9c s GLN 126 Cb -0.14 0.30 -0.11 0.00 1.10 0.00 0.00 33.01 34.17 3h9c s GLN 126 CO 0.04 -0.19 1.50 -0.51 -0.55 0.00 0.00 175.29 175.58 3h9c s LEU 127 N -1.29 4.33 -0.02 3.68 1.43 -1.26 -1.50 118.68 124.05 3h9c s LEU 127 Ca -0.13 3.00 0.00 0.00 -1.03 0.00 0.00 54.13 55.97 3h9c s LEU 127 Cb -0.05 -3.66 0.02 0.00 0.03 0.00 0.00 46.19 42.53 3h9c s LEU 127 CO 0.04 -0.86 -0.00 -0.47 0.23 0.00 0.00 176.35 175.29 3h9c s TYR 128 N -0.86 0.24 -0.46 0.29 5.04 0.58 -1.04 117.35 121.14 3h9c s TYR 128 Ca 0.55 0.01 -0.21 0.00 -2.44 0.00 0.00 57.07 54.97 3h9c s TYR 128 Cb -0.46 -0.30 0.03 0.00 0.35 0.00 0.00 41.96 41.58 3h9c s TYR 128 CO 0.59 -0.08 0.69 0.34 -1.34 0.00 0.00 175.55 175.75 3h9c s ASP 129 N 0.69 6.32 0.27 4.32 3.68 0.15 -1.23 116.67 130.88 3h9c s ASP 129 Ca -0.07 -0.39 0.26 0.00 2.13 0.00 0.00 52.55 54.48 3h9c s ASP 129 Cb -0.10 -2.34 0.78 0.00 -1.45 0.00 0.00 42.92 39.81 3h9c s ASP 129 CO -0.01 -0.86 1.75 1.55 0.13 0.00 0.00 175.17 177.72 3h9c h PRO 130 N 8.96 0.00 0.00 4.34 0.13 -1.85 0.31 132.00 143.88 3h9c h PRO 130 Ca -0.26 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 3h9c h PRO 130 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 3h9c h PRO 130 CO 0.93 0.00 -0.20 1.49 -0.23 0.00 0.00 178.00 180.00 3h9c h GLU 131 N 0.00 0.00 -0.36 0.86 4.81 -1.92 -3.34 114.58 114.63 3h9c h GLU 131 Ca 0.00 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.14 3h9c h GLU 131 Cb 0.72 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.09 3h9c h GLU 131 CO 0.00 0.50 -0.14 -0.22 -0.73 0.00 0.00 179.01 178.43 3h9c h LYS 132 N -1.00 0.65 -1.73 1.92 1.63 -1.98 -3.48 116.57 112.59 3h9c h LYS 132 Ca -0.04 -0.21 0.00 0.00 -0.85 0.00 0.00 60.65 59.55 3h9c h LYS 132 Cb 0.59 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.17 3h9c h LYS 132 CO -0.02 0.76 0.00 0.41 -3.45 0.00 0.00 179.45 177.15 3h9c n GLY 133 N -0.49 0.50 3.40 5.01 0.00 0.10 -5.09 105.19 108.62 3h9c n GLY 133 Ca 0.01 -0.39 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 3h9c n GLY 133 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3h9c s MET 134 N -3.10 0.87 0.49 1.61 0.23 -0.85 -4.57 119.30 113.99 3h9c s MET 134 Ca 0.00 0.10 -0.22 0.00 -1.03 0.00 0.00 55.69 54.54 3h9c s MET 134 Cb 0.00 0.40 -0.07 0.00 -1.53 0.00 0.00 34.83 33.64 3h9c s MET 134 CO 0.00 -0.25 1.22 -0.06 -2.03 0.00 0.00 175.02 173.90 3h9c s PHE 135 N -1.15 2.70 -0.24 3.16 0.08 -1.26 -0.67 117.98 120.60 3h9c s PHE 135 Ca -0.11 1.49 -0.06 0.00 0.12 0.00 0.00 56.93 58.37 3h9c s PHE 135 Cb -0.02 -3.49 -0.02 0.00 -0.57 0.00 0.00 43.02 38.91 3h9c s PHE 135 CO 0.07 -1.90 0.03 -0.51 -0.10 0.00 0.00 175.22 172.81 3h9c s LEU 136 N -3.21 3.26 0.82 -0.37 1.43 -0.21 -4.85 118.68 115.55 3h9c s LEU 136 Ca 0.66 -0.26 -0.13 0.00 -1.03 0.00 0.00 54.13 53.37 3h9c s LEU 136 Cb -0.32 -1.86 0.08 0.00 0.03 0.00 0.00 46.19 44.12 3h9c s LEU 136 CO 0.38 -0.03 1.08 -2.65 0.23 0.00 0.00 176.35 175.37 3h9c n PRO 137 N 4.86 0.09 -0.25 1.29 -0.02 -1.26 -4.67 135.00 135.03 3h9c n PRO 137 Ca -0.17 0.10 0.05 0.00 -2.02 0.00 0.00 63.50 61.47 3h9c n PRO 137 Cb 0.51 -2.34 0.17 0.00 -0.02 0.00 0.00 33.50 31.83 3h9c n PRO 137 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3h9c h ASP 138 N -1.01 -0.13 0.18 2.55 3.32 -1.98 -0.83 116.42 118.52 3h9c h ASP 138 Ca -0.46 0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.76 3h9c h ASP 138 Cb 1.30 0.25 0.00 0.00 0.22 0.00 0.00 39.33 41.10 3h9c h ASP 138 CO 0.44 -0.10 0.00 -2.11 -1.72 0.00 0.00 179.24 175.75 3h9c n ARG 139 N -5.23 0.64 -0.66 3.56 1.85 -1.26 -1.75 116.66 113.81 3h9c n ARG 139 Ca 0.14 0.02 0.09 0.00 -1.00 0.00 0.00 57.85 57.10 3h9c n ARG 139 Cb 0.47 -1.50 0.37 0.00 -1.05 0.00 0.00 32.46 30.75 3h9c n ARG 139 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3h9c n PHE 140 N -1.11 1.58 -4.83 2.89 3.72 -0.32 -4.62 117.46 114.78 3h9c n PHE 140 Ca 0.17 -0.63 -0.33 0.00 -0.05 0.00 0.00 57.45 56.61 3h9c n PHE 140 Cb 0.13 -0.28 -0.14 0.00 -0.94 0.00 0.00 39.48 38.25 3h9c n PHE 140 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3h9c s VAL 141 N -1.97 3.00 0.19 -4.37 1.01 -0.72 -0.79 120.40 116.76 3h9c s VAL 141 Ca 0.52 -0.70 0.05 0.00 0.00 0.00 0.00 61.98 61.85 3h9c s VAL 141 Cb 0.34 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 3h9c s VAL 141 CO 0.24 0.54 -0.07 -1.59 0.00 0.00 0.00 175.10 174.22 3h9c s LYS 142 N 0.08 1.24 0.00 2.72 -2.85 -0.53 -0.78 119.74 119.61 3h9c s LYS 142 Ca -0.06 -1.58 0.00 0.00 -1.00 0.00 0.00 55.97 53.34 3h9c s LYS 142 Cb -0.15 -0.74 0.00 0.00 -2.06 0.00 0.00 37.83 34.88 3h9c s LYS 142 CO 0.05 0.03 0.00 0.41 0.10 0.00 0.00 175.35 175.94 3h9c n GLY 143 N -0.33 -0.67 3.74 0.59 0.00 0.07 -0.15 105.19 108.43 3h9c n GLY 143 Ca -0.08 -0.88 -0.35 0.00 0.00 0.00 0.00 46.02 44.71 3h9c n GLY 143 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h9c s THR 144 N -3.00 5.39 0.19 2.61 2.01 0.15 -0.42 115.64 122.58 3h9c s THR 144 Ca 0.00 0.28 -0.33 0.00 0.31 0.00 0.00 61.69 61.95 3h9c s THR 144 Cb 0.00 -3.51 -0.13 0.00 0.01 0.00 0.00 72.50 68.87 3h9c s THR 144 CO 0.00 0.44 1.61 0.00 -0.69 0.00 0.00 174.62 175.98 3h9c h PRO 146 N 5.99 0.00 0.00 0.00 0.13 -1.92 -1.06 132.00 135.14 3h9c h PRO 146 Ca -0.44 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3h9c h PRO 146 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 3h9c h PRO 146 CO 0.89 0.14 -0.29 0.87 -0.23 0.00 0.00 178.00 179.38 3h9c h LYS 147 N 0.00 0.00 0.00 0.86 1.79 -1.94 -3.41 116.57 113.87 3h9c h LYS 147 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3h9c h LYS 147 Cb 0.66 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.31 3h9c h LYS 147 CO 0.02 0.02 -1.01 0.00 -1.08 0.00 0.00 179.45 177.40 3h9c n LYS 149 N -1.54 -0.61 -2.13 0.00 4.76 -0.40 -5.00 118.16 113.24 3h9c n LYS 149 Ca 0.04 0.62 -0.42 0.00 -2.87 0.00 0.00 58.31 55.69 3h9c n LYS 149 Cb 0.34 -4.39 -0.03 0.00 -1.84 0.00 0.00 35.03 29.11 3h9c n LYS 149 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 3h9c s SER 150 N -2.67 6.79 0.72 4.39 0.01 -1.26 -4.66 113.70 117.02 3h9c s SER 150 Ca 0.00 2.47 -0.11 0.00 1.31 0.00 0.00 55.95 59.62 3h9c s SER 150 Cb 0.00 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.65 3h9c s SER 150 CO 0.00 -0.62 1.10 -2.16 0.41 0.00 0.00 173.24 171.97 3h9c s PRO 151 N 0.18 2.74 -1.17 12.44 0.04 -1.26 -0.99 135.00 146.99 3h9c s PRO 151 Ca 0.60 0.47 -0.07 0.00 0.04 0.00 0.00 61.00 62.04 3h9c s PRO 151 Cb -0.39 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.16 3h9c s PRO 151 CO 0.37 -1.12 1.02 -0.25 0.04 0.00 0.00 177.00 177.05 3h9c n ASP 152 N -3.07 -5.43 -4.87 6.66 8.00 -0.94 -4.88 116.55 112.02 3h9c n ASP 152 Ca 0.07 -0.48 -0.35 0.00 0.71 0.00 0.00 54.79 54.74 3h9c n ASP 152 Cb 0.57 -4.45 -0.05 0.00 -0.02 0.00 0.00 41.12 37.17 3h9c n ASP 152 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3h9c s GLN 153 N -6.05 3.67 -0.11 -1.24 -1.52 0.45 -4.83 119.66 110.03 3h9c s GLN 153 Ca 0.46 0.07 -0.02 0.00 -1.95 0.00 0.00 55.36 53.92 3h9c s GLN 153 Cb -0.20 -3.09 -0.03 0.00 -0.22 0.00 0.00 33.01 29.47 3h9c s GLN 153 CO 0.63 0.64 -0.03 0.71 -0.25 0.00 0.00 175.29 176.99 3h9c s TYR 154 N -1.27 3.04 0.00 0.91 1.51 -1.26 -0.75 117.35 119.53 3h9c s TYR 154 Ca 0.27 -0.06 0.00 0.00 -1.01 0.00 0.00 57.07 56.27 3h9c s TYR 154 Cb -0.14 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 39.87 3h9c s TYR 154 CO 0.15 0.21 0.00 0.41 -1.11 0.00 0.00 175.55 175.22 3h9c n GLY 155 N 2.76 2.14 1.51 0.71 0.00 0.03 -3.74 105.19 108.60 3h9c n GLY 155 Ca -0.18 -0.51 0.08 0.00 0.00 0.00 0.00 46.02 45.41 3h9c n GLY 155 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3h9c n ASP 156 N 2.81 4.46 -3.59 1.61 5.68 -1.26 -4.37 116.55 121.89 3h9c n ASP 156 Ca 0.00 -2.48 -0.14 0.00 -0.50 0.00 0.00 54.79 51.67 3h9c n ASP 156 Cb 0.00 -0.57 -0.06 0.00 -1.14 0.00 0.00 41.12 39.35 3h9c n ASP 156 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3h9c s ASN 157 N -0.81 -0.42 -0.18 -1.12 2.20 -1.25 -1.34 114.94 112.02 3h9c s ASN 157 Ca 0.46 0.19 -0.07 0.00 -0.94 0.00 0.00 52.86 52.51 3h9c s ASN 157 Cb 0.31 0.47 -0.04 0.00 -2.00 0.00 0.00 41.25 39.99 3h9c s ASN 157 CO 0.20 -0.68 0.05 0.00 -2.94 0.00 0.00 177.10 173.73 3h9c n GLU 159 N 3.68 1.59 -0.07 0.00 1.02 -1.26 -1.52 120.64 124.08 3h9c n GLU 159 Ca -0.17 -0.88 -0.07 0.00 -0.02 0.00 0.00 57.16 56.03 3h9c n GLU 159 Cb 0.52 -1.42 -0.02 0.00 -0.02 0.00 0.00 31.44 30.50 3h9c n GLU 159 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3h9c n VAL 160 N 0.08 1.22 0.70 2.62 0.31 -1.26 -4.75 118.33 117.25 3h9c n VAL 160 Ca 0.17 0.22 0.11 0.00 -0.01 0.00 0.00 64.34 64.83 3h9c n VAL 160 Cb 0.30 -2.20 0.05 0.00 -0.91 0.00 0.00 33.84 31.07 3h9c n VAL 160 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h9c n GLY 162 N 1.41 0.85 3.72 0.00 0.00 -0.58 -5.03 105.19 105.56 3h9c n GLY 162 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 3h9c n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9c s ALA 163 N -3.35 2.21 0.06 4.61 0.00 -1.26 -4.70 121.76 119.35 3h9c s ALA 163 Ca 0.00 1.05 0.08 0.00 0.00 0.00 0.00 51.96 53.09 3h9c s ALA 163 Cb 0.00 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 3h9c s ALA 163 CO 0.00 -1.78 -0.22 0.95 0.00 0.00 0.00 175.76 174.71 3h9c s THR 164 N -1.70 1.80 0.02 0.00 -4.23 -1.26 -1.20 115.64 109.06 3h9c s THR 164 Ca 0.78 -1.34 -0.28 0.00 -1.18 0.00 0.00 61.69 59.67 3h9c s THR 164 Cb -0.33 -1.57 0.10 0.00 1.34 0.00 0.00 72.50 72.03 3h9c s THR 164 CO 0.43 0.17 0.95 -0.72 -0.54 0.00 0.00 174.62 174.91 3h9c s TYR 165 N -0.90 -0.25 0.40 3.99 -0.85 -0.45 -4.99 117.35 114.30 3h9c s TYR 165 Ca 0.08 0.08 -0.26 0.00 -0.52 0.00 0.00 57.07 56.46 3h9c s TYR 165 Cb -0.09 0.56 -0.09 0.00 0.38 0.00 0.00 41.96 42.73 3h9c s TYR 165 CO 0.03 -0.58 1.26 0.45 -1.52 0.00 0.00 175.55 175.18 3h9c s SER 166 N -2.61 6.41 0.50 -0.18 0.15 -1.26 -4.40 113.70 112.31 3h9c s SER 166 Ca 0.08 2.55 0.33 0.00 0.70 0.00 0.00 55.95 59.61 3h9c s SER 166 Cb -0.01 -2.63 1.80 0.00 -1.71 0.00 0.00 66.02 63.47 3h9c s SER 166 CO -0.05 -0.77 2.01 -0.65 1.20 0.00 0.00 173.24 174.98 3h9c h PRO 167 N 2.71 0.00 0.00 5.44 0.11 -1.91 0.76 132.00 139.11 3h9c h PRO 167 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3h9c h PRO 167 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3h9c h PRO 167 CO 0.63 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.67 3h9c n THR 168 N -2.68 1.34 1.01 -1.15 -2.24 -1.26 -1.97 114.28 107.33 3h9c n THR 168 Ca -0.02 0.47 0.11 0.00 -2.27 0.00 0.00 64.05 62.34 3h9c n THR 168 Cb 0.07 -1.40 0.09 0.00 -2.10 0.00 0.00 70.33 66.99 3h9c n THR 168 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3h9c n GLU 169 N -1.82 0.06 -1.77 -0.78 1.02 0.26 -4.94 120.64 112.67 3h9c n GLU 169 Ca 0.01 -0.04 -0.41 0.00 -0.02 0.00 0.00 57.16 56.69 3h9c n GLU 169 Cb 0.08 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.00 3h9c n GLU 169 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3h9c n LEU 170 N -1.44 4.66 -4.76 -4.62 4.77 -0.83 -4.39 117.00 110.39 3h9c n LEU 170 Ca 0.05 1.22 -0.39 0.00 -0.03 0.00 0.00 56.01 56.86 3h9c n LEU 170 Cb 0.34 -1.61 -0.05 0.00 -2.33 0.00 0.00 43.42 39.76 3h9c n LEU 170 CO 0.38 0.11 0.41 -0.63 -1.33 0.00 0.00 177.39 176.33 3h9c s ILE 171 N -1.05 4.70 -1.17 -0.08 1.01 -0.18 -4.22 121.20 120.21 3h9c s ILE 171 Ca 0.54 1.51 -0.22 0.00 0.00 0.00 0.00 60.65 62.48 3h9c s ILE 171 Cb -0.48 -4.06 0.00 0.00 0.01 0.00 0.00 42.46 37.93 3h9c s ILE 171 CO 0.63 0.43 0.75 -0.62 0.00 0.00 0.00 174.94 176.12 3h9c n GLU 172 N 2.45 -1.16 -2.24 2.79 -0.58 -1.26 -0.67 120.64 119.95 3h9c n GLU 172 Ca -0.05 0.38 -0.36 0.00 -0.42 0.00 0.00 57.16 56.71 3h9c n GLU 172 Cb 0.50 -3.83 0.00 0.00 -0.57 0.00 0.00 31.44 27.54 3h9c n GLU 172 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 3h9c s PRO 173 N -6.31 3.45 0.02 3.49 0.04 -1.26 -4.53 135.00 129.90 3h9c s PRO 173 Ca 0.45 1.67 0.03 0.00 0.04 0.00 0.00 61.00 63.19 3h9c s PRO 173 Cb -0.18 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 3h9c s PRO 173 CO 0.89 -0.78 -0.08 0.15 0.04 0.00 0.00 177.00 177.21 3h9c s LYS 174 N -3.11 0.58 0.10 4.56 -0.14 0.78 -4.24 119.74 118.28 3h9c s LYS 174 Ca 0.70 -0.51 -0.31 0.00 -1.36 0.00 0.00 55.97 54.49 3h9c s LYS 174 Cb -0.26 -0.49 -0.07 0.00 -1.68 0.00 0.00 37.83 35.32 3h9c s LYS 174 CO 0.30 0.12 1.35 0.45 -0.76 0.00 0.00 175.35 176.81 3h9c s SER 175 N -0.84 6.87 0.52 2.83 0.15 0.79 -1.45 113.70 122.56 3h9c s SER 175 Ca -0.02 2.27 0.28 0.00 0.70 0.00 0.00 55.95 59.17 3h9c s SER 175 Cb -0.06 -2.58 1.40 0.00 -1.71 0.00 0.00 66.02 63.06 3h9c s SER 175 CO 0.00 -0.62 2.04 0.58 1.20 0.00 0.00 173.24 176.44 3h9c h VAL 176 N 4.31 0.51 0.02 4.45 2.07 -1.31 -0.07 116.25 126.24 3h9c h VAL 176 Ca -0.42 -0.61 -0.10 0.00 0.82 0.00 0.00 66.70 66.40 3h9c h VAL 176 Cb 1.21 1.41 0.01 0.00 -1.52 0.00 0.00 31.29 32.40 3h9c h VAL 176 CO 0.86 0.12 -0.39 0.58 0.02 0.00 0.00 177.57 178.76 3h9c h VAL 177 N 0.00 1.54 0.00 2.57 2.07 -1.91 -3.42 116.25 117.11 3h9c h VAL 177 Ca -0.00 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.40 3h9c h VAL 177 Cb 0.40 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.04 3h9c h VAL 177 CO 0.02 0.59 -0.36 -1.54 0.02 0.00 0.00 177.57 176.29 3h9c n SER 178 N -4.40 1.81 0.00 0.57 3.41 -1.21 -5.01 113.62 108.79 3h9c n SER 178 Ca -0.11 -0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.31 3h9c n SER 178 Cb 0.59 0.75 0.00 0.00 -0.26 0.00 0.00 64.21 65.28 3h9c n SER 178 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h9c n GLY 179 N 1.29 1.73 3.76 5.00 0.00 -0.04 -4.98 105.19 111.95 3h9c n GLY 179 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 3h9c n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9c s ALA 180 N -3.19 2.41 -0.16 4.61 0.00 -1.26 -4.42 121.76 119.74 3h9c s ALA 180 Ca 0.00 0.59 -0.29 0.00 0.00 0.00 0.00 51.96 52.25 3h9c s ALA 180 Cb 0.00 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.77 3h9c s ALA 180 CO 0.00 -1.38 1.24 0.99 0.00 0.00 0.00 175.76 176.61 3h9c s THR 181 N -2.30 4.31 0.57 0.00 2.01 -1.26 -0.15 115.64 118.81 3h9c s THR 181 Ca 0.68 1.59 -0.15 0.00 0.31 0.00 0.00 61.69 64.12 3h9c s THR 181 Cb -0.22 -4.03 -0.05 0.00 0.01 0.00 0.00 72.50 68.21 3h9c s THR 181 CO 0.42 -0.13 1.02 -2.16 -0.69 0.00 0.00 174.62 173.08 3h9c s PRO 182 N 3.34 3.66 0.13 4.92 0.05 -1.26 -4.63 135.00 141.21 3h9c s PRO 182 Ca 0.54 0.98 0.04 0.00 0.05 0.00 0.00 61.00 62.61 3h9c s PRO 182 Cb -0.21 -2.09 -0.04 0.00 0.05 0.00 0.00 34.50 32.20 3h9c s PRO 182 CO 0.15 -0.52 -0.10 0.14 0.05 0.00 0.00 177.00 176.72 3h9c s VAL 183 N -2.72 1.10 0.17 -0.36 -7.23 -0.37 -4.85 120.40 106.14 3h9c s VAL 183 Ca 0.59 -1.94 -0.30 0.00 -1.81 0.00 0.00 61.98 58.52 3h9c s VAL 183 Cb -0.12 -1.72 -0.07 0.00 0.56 0.00 0.00 36.38 35.03 3h9c s VAL 183 CO 0.39 -0.70 1.15 -0.04 -0.31 0.00 0.00 175.10 175.59 3h9c s MET 184 N -3.49 4.53 0.01 4.82 -1.94 -1.26 -0.30 119.30 121.67 3h9c s MET 184 Ca 0.14 1.78 0.00 0.00 -1.71 0.00 0.00 55.69 55.90 3h9c s MET 184 Cb 0.01 -3.27 -0.01 0.00 2.01 0.00 0.00 34.83 33.57 3h9c s MET 184 CO 0.00 -0.03 -0.01 0.50 -0.01 0.00 0.00 175.02 175.47 3h9c s ARG 185 N -0.15 0.09 0.38 2.03 3.52 -0.56 -4.93 118.95 119.33 3h9c s ARG 185 Ca 0.52 -0.18 -0.18 0.00 -0.13 0.00 0.00 55.73 55.76 3h9c s ARG 185 Cb -0.31 0.03 -0.10 0.00 -1.56 0.00 0.00 34.95 33.01 3h9c s ARG 185 CO 0.35 -0.01 0.85 -0.51 -0.81 0.00 0.00 175.30 175.16 3h9c s ASP 186 N -0.42 6.87 -0.17 -2.12 -0.00 -1.26 -1.66 116.67 117.90 3h9c s ASP 186 Ca -0.05 1.50 -0.21 0.00 -0.00 0.00 0.00 52.55 53.79 3h9c s ASP 186 Cb -0.03 -2.46 0.05 0.00 -0.00 0.00 0.00 42.92 40.49 3h9c s ASP 186 CO -0.00 -0.28 0.56 -0.55 -0.00 0.00 0.00 175.17 174.90 3h9c s SER 187 N -2.22 -0.57 -0.07 0.27 0.15 -0.03 -4.98 113.70 106.26 3h9c s SER 187 Ca 0.58 0.99 -0.30 0.00 0.70 0.00 0.00 55.95 57.92 3h9c s SER 187 Cb -0.10 0.99 -0.02 0.00 -1.71 0.00 0.00 66.02 65.19 3h9c s SER 187 CO 0.15 -0.28 1.05 -0.70 1.20 0.00 0.00 173.24 174.66 3h9c s GLU 188 N -0.07 4.43 0.25 5.44 2.12 -1.26 -0.86 118.70 128.75 3h9c s GLU 188 Ca -0.03 1.48 0.11 0.00 0.36 0.00 0.00 54.97 56.89 3h9c s GLU 188 Cb -0.04 -3.52 -0.05 0.00 0.26 0.00 0.00 34.13 30.79 3h9c s GLU 188 CO 0.02 -0.30 -0.15 -1.01 -0.54 0.00 0.00 175.26 173.29 3h9c s HIS 189 N 1.84 2.42 -0.12 5.30 3.76 0.45 -4.97 115.29 123.97 3h9c s HIS 189 Ca 0.51 -0.30 -0.02 0.00 -0.15 0.00 0.00 55.06 55.10 3h9c s HIS 189 Cb -0.21 -1.09 -0.03 0.00 1.11 0.00 0.00 32.58 32.37 3h9c s HIS 189 CO 0.21 0.64 -0.04 -0.06 -0.85 0.00 0.00 174.74 174.65 3h9c s PHE 190 N -2.26 3.03 -0.01 1.40 2.99 -1.26 -1.32 117.98 120.55 3h9c s PHE 190 Ca 0.28 -0.11 0.08 0.00 0.00 0.00 0.00 56.93 57.18 3h9c s PHE 190 Cb -0.06 -1.86 -0.02 0.00 0.00 0.00 0.00 43.02 41.08 3h9c s PHE 190 CO 0.15 0.17 -0.24 -0.06 -0.00 0.00 0.00 175.22 175.24 3h9c s PHE 191 N -0.21 2.17 -0.10 0.36 0.40 0.14 -0.97 117.98 119.78 3h9c s PHE 191 Ca 0.04 -0.41 -0.23 0.00 -0.60 0.00 0.00 56.93 55.73 3h9c s PHE 191 Cb -0.13 -1.39 -0.03 0.00 0.51 0.00 0.00 43.02 41.98 3h9c s PHE 191 CO 0.02 -0.02 0.68 0.12 0.70 0.00 0.00 175.22 176.72 3h9c s PHE 192 N -0.59 3.53 -1.55 0.36 5.36 0.38 -0.34 117.98 125.13 3h9c s PHE 192 Ca 0.09 1.17 -0.11 0.00 -0.96 0.00 0.00 56.93 57.12 3h9c s PHE 192 Cb -0.09 -2.80 -0.03 0.00 -0.34 0.00 0.00 43.02 39.76 3h9c s PHE 192 CO -0.01 0.03 2.63 -3.47 -1.46 0.00 0.00 175.22 172.94 3h9c n ASP 193 N 4.10 6.71 -0.34 6.13 4.64 0.02 -1.84 116.55 135.96 3h9c n ASP 193 Ca -0.01 -2.71 0.13 0.00 -1.38 0.00 0.00 54.79 50.82 3h9c n ASP 193 Cb 0.51 -1.59 0.34 0.00 -1.04 0.00 0.00 41.12 39.33 3h9c n ASP 193 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 3h9c h LEU 194 N 8.18 0.76 -2.32 -2.67 5.85 -1.88 -2.12 115.31 121.12 3h9c h LEU 194 Ca 0.74 0.09 0.04 0.00 0.84 0.00 0.00 57.88 59.58 3h9c h LEU 194 Cb 0.43 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.41 3h9c h LEU 194 CO 1.82 0.29 0.16 -0.65 -0.34 0.00 0.00 178.44 179.71 3h9c h PRO 195 N 0.75 0.00 0.00 5.25 0.11 -1.84 -0.13 132.00 136.14 3h9c h PRO 195 Ca 0.56 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.67 3h9c h PRO 195 Cb 0.89 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 3h9c h PRO 195 CO -0.35 0.00 -0.00 1.03 -0.21 0.00 0.00 178.00 178.47 3h9c h SER 196 N 0.00 0.00 -0.59 -2.05 0.87 -1.79 -2.57 113.55 107.42 3h9c h SER 196 Ca 0.06 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 3h9c h SER 196 Cb 0.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 3h9c h SER 196 CO -0.00 0.00 0.00 0.49 -0.53 0.00 0.00 176.83 176.79 3h9c n PHE 197 N -3.20 0.87 -0.11 2.24 3.01 -0.06 -4.68 117.46 115.53 3h9c n PHE 197 Ca -0.03 -0.52 -0.05 0.00 1.01 0.00 0.00 57.45 57.86 3h9c n PHE 197 Cb 0.07 -0.05 0.02 0.00 -0.01 0.00 0.00 39.48 39.52 3h9c n PHE 197 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3h9c h SER 198 N 3.46 -0.21 -0.53 4.37 4.64 -1.58 -1.21 113.55 122.49 3h9c h SER 198 Ca 0.00 0.10 -0.06 0.00 -0.47 0.00 0.00 61.79 61.35 3h9c h SER 198 Cb 0.97 0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 63.22 3h9c h SER 198 CO 0.03 -0.07 0.09 -0.33 -0.87 0.00 0.00 176.83 175.68 3h9c h GLU 199 N 0.07 0.88 -0.68 4.77 5.08 -1.85 0.27 114.58 123.12 3h9c h GLU 199 Ca 0.19 -0.23 0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3h9c h GLU 199 Cb 0.27 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 3h9c h GLU 199 CO -0.33 0.86 0.44 1.98 -1.00 0.00 0.00 179.01 180.95 3h9c h MET 200 N 0.77 0.86 -0.30 2.33 4.05 -1.84 -1.34 114.93 119.46 3h9c h MET 200 Ca 0.16 -0.05 -0.14 0.00 -0.28 0.00 0.00 59.70 59.39 3h9c h MET 200 Cb 0.40 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 31.00 3h9c h MET 200 CO 0.01 0.57 -0.38 -0.07 0.23 0.00 0.00 176.91 177.26 3h9c h LEU 201 N 0.88 0.73 -0.74 3.39 3.38 -0.84 -1.88 115.31 120.23 3h9c h LEU 201 Ca 0.26 -0.32 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 3h9c h LEU 201 Cb -0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3h9c h LEU 201 CO -0.07 1.03 -0.02 1.56 0.09 0.00 0.00 178.44 181.03 3h9c h GLN 202 N 0.57 0.94 -0.85 1.13 4.20 -0.70 -1.04 115.11 119.36 3h9c h GLN 202 Ca 0.05 -0.29 -0.02 0.00 0.06 0.00 0.00 58.65 58.45 3h9c h GLN 202 Cb 0.91 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.56 3h9c h GLN 202 CO 0.08 0.94 0.44 0.00 -0.67 0.00 0.00 178.83 179.63 3h9c h ALA 203 N 1.11 1.09 -0.64 3.87 0.00 -1.00 -2.13 119.26 121.56 3h9c h ALA 203 Ca 0.15 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3h9c h ALA 203 Cb 0.54 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3h9c h ALA 203 CO 0.03 0.62 0.16 2.35 0.00 0.00 0.00 179.25 182.41 3h9c h TRP 204 N 1.19 1.07 -0.71 0.00 7.01 -0.92 -2.20 115.95 121.39 3h9c h TRP 204 Ca 0.30 -0.13 0.07 0.00 2.11 0.00 0.00 58.89 61.24 3h9c h TRP 204 Cb 0.07 -0.30 -0.06 0.00 -2.10 0.00 0.00 29.16 26.76 3h9c h TRP 204 CO 0.01 0.89 0.40 1.15 -2.79 0.00 0.00 178.44 178.10 3h9c h THR 205 N 0.94 0.95 -0.02 2.65 2.02 -0.88 -2.25 112.91 116.33 3h9c h THR 205 Ca 0.20 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 67.13 3h9c h THR 205 Cb 0.35 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 3h9c h THR 205 CO 0.00 0.13 0.00 -2.11 0.37 0.00 0.00 175.52 173.91 3h9c n ARG 206 N -4.77 1.44 0.29 6.66 1.85 -0.83 -4.05 116.66 117.25 3h9c n ARG 206 Ca 0.10 -0.65 0.18 0.00 -1.00 0.00 0.00 57.85 56.49 3h9c n ARG 206 Cb 0.20 -1.47 0.79 0.00 -1.05 0.00 0.00 32.46 30.92 3h9c n ARG 206 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3h9c h SER 207 N 1.54 0.00 0.00 2.89 4.64 -0.77 -3.46 113.55 118.39 3h9c h SER 207 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h9c h SER 207 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3h9c h SER 207 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3h9c n GLY 208 N -0.17 0.82 0.19 -0.77 0.00 -1.26 -4.95 105.19 99.06 3h9c n GLY 208 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 3h9c n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9c h ALA 209 N 0.00 0.29 -2.35 4.61 0.00 -1.88 -3.46 119.26 116.47 3h9c h ALA 209 Ca 0.00 -0.48 -0.50 0.00 0.00 0.00 0.00 54.91 53.92 3h9c h ALA 209 Cb 0.00 -0.04 0.08 0.00 0.00 0.00 0.00 17.79 17.83 3h9c h ALA 209 CO 0.00 0.44 0.37 -0.51 0.00 0.00 0.00 179.25 179.55 3h9c s LEU 210 N -8.69 3.34 0.34 0.00 1.43 -1.26 -4.92 118.68 108.91 3h9c s LEU 210 Ca -0.12 1.75 -0.28 0.00 -1.03 0.00 0.00 54.13 54.45 3h9c s LEU 210 Cb 0.07 -4.52 -0.12 0.00 0.03 0.00 0.00 46.19 41.65 3h9c s LEU 210 CO 0.84 -1.34 1.31 0.00 0.23 0.00 0.00 176.35 177.39 3h9c n GLN 211 N -2.52 2.17 -0.33 1.70 6.02 -1.26 -4.79 117.38 118.37 3h9c n GLN 211 Ca 0.08 0.76 0.06 0.00 -0.01 0.00 0.00 57.00 57.90 3h9c n GLN 211 Cb 0.53 -2.36 0.22 0.00 1.02 0.00 0.00 30.24 29.65 3h9c n GLN 211 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 3h9c h GLU 212 N 2.67 0.83 -0.22 -1.09 4.81 -1.95 -0.05 114.58 119.59 3h9c h GLU 212 Ca -0.46 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.66 3h9c h GLU 212 Cb 1.28 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 3h9c h GLU 212 CO 0.63 0.55 -0.14 1.96 -0.73 0.00 0.00 179.01 181.29 3h9c h GLN 213 N 0.86 0.35 -0.08 1.92 4.20 -1.98 -1.15 115.11 119.23 3h9c h GLN 213 Ca 0.47 -0.09 -0.05 0.00 0.06 0.00 0.00 58.65 59.04 3h9c h GLN 213 Cb 0.51 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.25 3h9c h GLN 213 CO -0.29 0.49 -0.15 0.28 -0.67 0.00 0.00 178.83 178.50 3h9c h VAL 214 N 0.33 1.40 -0.99 -0.54 2.07 -1.43 -2.54 116.25 114.55 3h9c h VAL 214 Ca 0.06 -1.42 0.06 0.00 0.82 0.00 0.00 66.70 66.23 3h9c h VAL 214 Cb 0.44 2.13 -0.07 0.00 -1.52 0.00 0.00 31.29 32.28 3h9c h VAL 214 CO 0.03 0.40 0.64 0.00 0.02 0.00 0.00 177.57 178.66 3h9c h ALA 215 N 0.51 1.37 -0.58 1.67 0.00 -0.94 -0.62 119.26 120.67 3h9c h ALA 215 Ca 0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3h9c h ALA 215 Cb 0.72 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3h9c h ALA 215 CO 0.03 0.45 0.23 -0.91 0.00 0.00 0.00 179.25 179.05 3h9c h ASN 216 N 1.18 0.80 -0.88 0.00 2.35 -1.19 -1.96 115.58 115.88 3h9c h ASN 216 Ca 0.42 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.99 3h9c h ASN 216 Cb 0.14 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.26 3h9c h ASN 216 CO -0.17 0.75 0.49 0.50 -1.65 0.00 0.00 177.43 177.36 3h9c h LYS 217 N 0.80 1.22 -0.63 0.81 1.63 -0.95 -2.53 116.57 116.92 3h9c h LYS 217 Ca 0.19 -0.14 -0.02 0.00 -0.85 0.00 0.00 60.65 59.83 3h9c h LYS 217 Cb 0.21 -0.24 -0.03 0.00 -0.60 0.00 0.00 32.23 31.56 3h9c h LYS 217 CO -0.02 0.89 0.31 0.52 -3.45 0.00 0.00 179.45 177.70 3h9c h MET 218 N 1.23 0.89 -0.58 1.90 2.86 -0.68 -1.45 114.93 119.10 3h9c h MET 218 Ca 0.31 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.82 3h9c h MET 218 Cb 0.01 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.47 3h9c h MET 218 CO -0.05 0.68 0.29 1.96 1.06 0.00 0.00 176.91 180.85 3h9c h GLN 219 N 0.89 0.81 -0.83 1.72 1.08 -0.93 -0.12 115.11 117.72 3h9c h GLN 219 Ca 0.22 -0.09 -0.02 0.00 -1.45 0.00 0.00 58.65 57.31 3h9c h GLN 219 Cb 0.09 -0.16 -0.04 0.00 -0.05 0.00 0.00 27.48 27.32 3h9c h GLN 219 CO -0.03 0.62 0.44 0.93 -0.95 0.00 0.00 178.83 179.84 3h9c h GLU 220 N 0.81 1.16 -0.45 1.46 5.08 -1.12 -1.13 114.58 120.39 3h9c h GLU 220 Ca 0.20 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.28 3h9c h GLU 220 Cb 0.06 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 3h9c h GLU 220 CO -0.03 0.87 -0.25 -1.49 -1.00 0.00 0.00 179.01 177.11 3h9c h TRP 221 N 1.16 1.13 -0.65 4.33 6.55 -0.77 -1.17 115.95 126.52 3h9c h TRP 221 Ca 0.29 -0.29 -0.05 0.00 0.95 0.00 0.00 58.89 59.79 3h9c h TRP 221 Cb 0.05 -0.26 -0.03 0.00 -0.86 0.00 0.00 29.16 28.07 3h9c h TRP 221 CO 0.01 1.11 0.19 0.74 -1.05 0.00 0.00 178.44 179.44 3h9c h PHE 222 N 0.82 1.04 -0.55 0.49 0.05 -0.92 -1.45 116.94 116.42 3h9c h PHE 222 Ca 0.10 -0.10 -0.03 0.00 3.82 0.00 0.00 57.97 61.76 3h9c h PHE 222 Cb 0.83 -0.30 -0.02 0.00 2.00 0.00 0.00 35.95 38.46 3h9c h PHE 222 CO 0.06 0.84 0.22 1.49 -0.18 0.00 0.00 178.31 180.74 3h9c h GLU 223 N 0.97 0.82 -0.06 1.51 4.57 -0.87 -2.19 114.58 119.34 3h9c h GLU 223 Ca 0.21 -0.15 -0.06 0.00 -1.18 0.00 0.00 59.36 58.18 3h9c h GLU 223 Cb 0.30 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.74 3h9c h GLU 223 CO -0.01 0.71 -0.26 0.77 -1.18 0.00 0.00 179.01 179.05 3h9c h SER 224 N 0.75 0.10 0.00 1.04 0.02 -1.05 -3.49 113.55 110.92 3h9c h SER 224 Ca 0.18 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3h9c h SER 224 Cb 0.19 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.71 3h9c h SER 224 CO -0.02 0.36 0.00 0.61 -1.14 0.00 0.00 176.83 176.64 3h9c n GLY 225 N -0.69 2.00 3.77 -3.77 0.00 -0.56 -5.04 105.19 100.90 3h9c n GLY 225 Ca -0.02 -1.37 -0.38 0.00 0.00 0.00 0.00 46.02 44.25 3h9c n GLY 225 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h9c s LEU 226 N 0.00 4.24 0.29 0.99 1.43 -1.26 -4.92 118.68 119.45 3h9c s LEU 226 Ca 0.00 2.27 0.09 0.00 -1.03 0.00 0.00 54.13 55.46 3h9c s LEU 226 Cb 0.00 -3.99 -0.04 0.00 0.03 0.00 0.00 46.19 42.19 3h9c s LEU 226 CO 0.00 -0.55 0.03 0.00 0.23 0.00 0.00 176.35 176.06 3h9c s GLN 227 N -2.20 2.30 0.52 1.70 -2.07 -1.26 -4.70 119.66 113.94 3h9c s GLN 227 Ca 0.55 -1.47 -0.20 0.00 -1.82 0.00 0.00 55.36 52.42 3h9c s GLN 227 Cb -0.29 -2.15 -0.07 0.00 -1.09 0.00 0.00 33.01 29.41 3h9c s GLN 227 CO 0.37 0.29 1.09 -0.65 -1.32 0.00 0.00 175.29 175.06 3h9c s GLN 228 N -3.72 3.56 -0.09 9.60 -0.21 -1.26 -4.31 119.66 123.23 3h9c s GLN 228 Ca 0.33 1.50 0.04 0.00 0.02 0.00 0.00 55.36 57.26 3h9c s GLN 228 Cb -0.05 -2.05 -0.00 0.00 1.00 0.00 0.00 33.01 31.91 3h9c s GLN 228 CO 0.21 -0.65 -0.24 -1.58 -2.12 0.00 0.00 175.29 170.90 3h9c s TRP 229 N -1.86 2.53 0.09 0.91 0.52 -0.77 -4.93 118.94 115.44 3h9c s TRP 229 Ca 0.70 -1.01 -0.31 0.00 0.02 0.00 0.00 56.10 55.51 3h9c s TRP 229 Cb -0.21 -1.69 -0.09 0.00 -1.15 0.00 0.00 33.47 30.33 3h9c s TRP 229 CO 0.24 -0.40 1.73 0.34 0.02 0.00 0.00 176.95 178.88 3h9c s ASP 230 N 0.29 6.53 -0.06 2.95 -1.08 -1.26 -0.47 116.67 123.56 3h9c s ASP 230 Ca -0.17 2.60 0.09 0.00 -0.52 0.00 0.00 52.55 54.55 3h9c s ASP 230 Cb -0.18 -2.56 0.18 0.00 -1.46 0.00 0.00 42.92 38.90 3h9c s ASP 230 CO 0.08 -0.94 1.12 2.30 0.52 0.00 0.00 175.17 178.25 3h9c n ILE 231 N 4.76 1.40 -4.28 4.11 -6.64 -0.14 -4.89 119.36 113.67 3h9c n ILE 231 Ca 0.17 -1.48 -0.20 0.00 -1.77 0.00 0.00 62.75 59.47 3h9c n ILE 231 Cb 0.40 0.20 -0.11 0.00 -1.44 0.00 0.00 39.64 38.68 3h9c n ILE 231 CO 0.00 0.00 0.00 -0.94 -1.77 0.00 0.00 176.55 173.84 3h9c s SER 232 N -1.68 2.29 0.02 7.28 1.04 -1.24 -0.79 113.70 120.63 3h9c s SER 232 Ca 0.17 -0.84 -0.01 0.00 0.48 0.00 0.00 55.95 55.76 3h9c s SER 232 Cb 0.14 -0.11 -0.02 0.00 0.10 0.00 0.00 66.02 66.13 3h9c s SER 232 CO 0.04 -0.10 -0.01 -0.13 0.98 0.00 0.00 173.24 174.01 3h9c s ARG 233 N -2.74 0.31 0.34 4.02 1.81 0.17 -4.62 118.95 118.25 3h9c s ARG 233 Ca 0.12 -0.56 -0.16 0.00 -1.72 0.00 0.00 55.73 53.41 3h9c s ARG 233 Cb -0.05 0.11 -0.09 0.00 -0.45 0.00 0.00 34.95 34.47 3h9c s ARG 233 CO 0.04 -0.05 0.78 -0.51 -0.68 0.00 0.00 175.30 174.88 3h9c s ASP 234 N -1.38 6.80 0.64 0.23 1.01 -1.26 0.10 116.67 122.80 3h9c s ASP 234 Ca -0.15 1.35 -0.18 0.00 0.71 0.00 0.00 52.55 54.28 3h9c s ASP 234 Cb -0.09 -2.40 -0.02 0.00 1.01 0.00 0.00 42.92 41.42 3h9c s ASP 234 CO -0.01 -0.24 1.29 0.00 0.21 0.00 0.00 175.17 176.42 3h9c n ALA 235 N -0.45 1.16 -1.77 5.23 0.00 -0.13 -4.26 120.51 120.29 3h9c n ALA 235 Ca 0.04 0.01 -0.38 0.00 0.00 0.00 0.00 53.44 53.12 3h9c n ALA 235 Cb 0.53 -2.32 -0.06 0.00 0.00 0.00 0.00 19.45 17.60 3h9c n ALA 235 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3h9c s PRO 236 N -3.29 4.64 0.10 0.00 0.04 -1.26 -4.81 135.00 130.41 3h9c s PRO 236 Ca 0.81 1.40 -0.14 0.00 0.04 0.00 0.00 61.00 63.12 3h9c s PRO 236 Cb -0.39 -2.93 0.02 0.00 0.04 0.00 0.00 34.50 31.25 3h9c s PRO 236 CO 0.41 0.32 0.32 -0.47 0.04 0.00 0.00 177.00 177.63 3h9c s TYR 237 N -1.48 -0.09 -0.38 0.56 5.04 -1.26 -4.99 117.35 114.75 3h9c s TYR 237 Ca 0.48 -0.23 -0.05 0.00 -2.44 0.00 0.00 57.07 54.83 3h9c s TYR 237 Cb -0.21 0.14 0.08 0.00 0.35 0.00 0.00 41.96 42.31 3h9c s TYR 237 CO 0.27 -0.62 0.16 0.12 -1.34 0.00 0.00 175.55 174.14 3h9c s PHE 238 N -3.59 3.39 -2.63 4.97 5.36 -1.26 -5.01 117.98 119.21 3h9c s PHE 238 Ca 0.02 -1.87 0.00 0.00 -0.96 0.00 0.00 56.93 54.12 3h9c s PHE 238 Cb 0.02 -2.75 0.00 0.00 -0.34 0.00 0.00 43.02 39.95 3h9c s PHE 238 CO -0.10 -0.86 0.00 0.41 -1.46 0.00 0.00 175.22 173.21 3h9c n GLY 239 N 4.73 -0.57 3.68 13.12 0.00 -1.26 -0.94 105.19 123.96 3h9c n GLY 239 Ca -0.09 -0.75 -0.36 0.00 0.00 0.00 0.00 46.02 44.83 3h9c n GLY 239 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h9c s PHE 240 N -3.36 3.34 0.42 1.61 2.99 -1.26 -5.00 117.98 116.72 3h9c s PHE 240 Ca 0.00 0.23 -0.24 0.00 0.00 0.00 0.00 56.93 56.92 3h9c s PHE 240 Cb 0.00 -2.19 -0.08 0.00 0.00 0.00 0.00 43.02 40.75 3h9c s PHE 240 CO 0.00 0.16 1.13 -2.00 -0.00 0.00 0.00 175.22 174.51 3h9c s GLU 241 N 0.66 4.00 -0.12 0.44 2.12 -1.26 -0.98 118.70 123.56 3h9c s GLU 241 Ca 0.07 1.71 -0.25 0.00 0.36 0.00 0.00 54.97 56.86 3h9c s GLU 241 Cb -0.12 -2.55 -0.02 0.00 0.26 0.00 0.00 34.13 31.69 3h9c s GLU 241 CO 0.01 -0.33 0.78 0.42 -0.54 0.00 0.00 175.26 175.60 3h9c s ILE 242 N -1.53 4.95 0.39 -3.70 1.01 0.06 -4.80 121.20 117.58 3h9c s ILE 242 Ca 0.59 1.56 -0.27 0.00 0.00 0.00 0.00 60.65 62.54 3h9c s ILE 242 Cb -0.27 -4.10 -0.11 0.00 0.01 0.00 0.00 42.46 37.99 3h9c s ILE 242 CO 0.34 0.12 1.35 -2.65 0.00 0.00 0.00 174.94 174.10 3h9c n PRO 243 N 4.59 2.22 -1.01 2.79 -0.02 -1.26 -1.79 135.00 140.53 3h9c n PRO 243 Ca 0.02 0.78 -0.00 0.00 -2.02 0.00 0.00 63.50 62.28 3h9c n PRO 243 Cb 0.50 -2.47 -0.00 0.00 -0.02 0.00 0.00 33.50 31.51 3h9c n PRO 243 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3h9c n ASN 244 N 0.40 -4.84 -3.38 2.55 3.02 -1.26 -4.92 115.26 106.83 3h9c n ASN 244 Ca 0.04 0.01 -0.26 0.00 -0.03 0.00 0.00 54.58 54.34 3h9c n ASN 244 Cb 0.38 -2.37 -0.09 0.00 -0.61 0.00 0.00 39.78 37.10 3h9c n ASN 244 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h9c n ALA 245 N 1.01 2.91 -1.63 5.41 0.00 -0.74 -5.11 120.51 122.36 3h9c n ALA 245 Ca -0.00 -3.60 -0.47 0.00 0.00 0.00 0.00 53.44 49.37 3h9c n ALA 245 Cb 0.31 -0.83 -0.04 0.00 0.00 0.00 0.00 19.45 18.90 3h9c n ALA 245 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3h9c n PRO 246 N 1.93 1.70 -0.90 0.00 -0.02 -1.26 -1.62 135.00 134.82 3h9c n PRO 246 Ca 0.25 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 3h9c n PRO 246 Cb 0.48 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 3h9c n PRO 246 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h9c n GLY 247 N 2.31 0.87 3.55 -1.23 0.00 -1.26 -5.03 105.19 104.40 3h9c n GLY 247 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 3h9c n GLY 247 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h9c s LYS 248 N -0.10 2.38 0.14 1.61 -0.14 -0.64 -0.95 119.74 122.04 3h9c s LYS 248 Ca 0.00 -0.82 0.06 0.00 -1.36 0.00 0.00 55.97 53.86 3h9c s LYS 248 Cb 0.00 -2.39 -0.04 0.00 -1.68 0.00 0.00 37.83 33.72 3h9c s LYS 248 CO 0.00 0.58 -0.14 0.71 -0.76 0.00 0.00 175.35 175.73 3h9c s TYR 249 N -0.98 1.49 0.05 3.18 2.02 0.11 -0.76 117.35 122.47 3h9c s TYR 249 Ca 0.16 -0.56 -0.31 0.00 -0.37 0.00 0.00 57.07 56.00 3h9c s TYR 249 Cb -0.11 -0.76 -0.06 0.00 -0.40 0.00 0.00 41.96 40.63 3h9c s TYR 249 CO 0.07 0.19 1.38 -0.06 -1.57 0.00 0.00 175.55 175.57 3h9c s PHE 250 N -2.32 3.03 0.66 2.71 0.40 -0.15 -0.65 117.98 121.66 3h9c s PHE 250 Ca 0.12 0.90 -0.15 0.00 -0.60 0.00 0.00 56.93 57.20 3h9c s PHE 250 Cb -0.04 -3.65 0.00 0.00 0.51 0.00 0.00 43.02 39.84 3h9c s PHE 250 CO 0.04 -2.34 1.12 -0.47 0.70 0.00 0.00 175.22 174.27 3h9c s TYR 251 N 1.83 2.55 0.61 0.36 5.04 0.03 -4.62 117.35 123.16 3h9c s TYR 251 Ca 0.64 1.56 0.34 0.00 -2.44 0.00 0.00 57.07 57.16 3h9c s TYR 251 Cb -0.33 -3.21 1.99 0.00 0.35 0.00 0.00 41.96 40.76 3h9c s TYR 251 CO 0.28 -1.79 2.27 -0.39 -1.34 0.00 0.00 175.55 174.59 3h9c h VAL 252 N 0.05 0.36 -0.85 3.14 -1.51 -1.93 -1.62 116.25 113.89 3h9c h VAL 252 Ca -0.47 0.00 0.11 0.00 -1.23 0.00 0.00 66.70 65.11 3h9c h VAL 252 Cb 1.25 0.98 -0.06 0.00 -2.13 0.00 0.00 31.29 31.33 3h9c h VAL 252 CO 0.54 0.00 0.55 -0.50 -1.23 0.00 0.00 177.57 176.93 3h9c h TRP 253 N 0.00 0.84 0.07 5.19 4.06 -1.91 0.98 115.95 125.17 3h9c h TRP 253 Ca 0.01 0.02 -0.10 0.00 2.06 0.00 0.00 58.89 60.88 3h9c h TRP 253 Cb 0.05 -0.27 0.01 0.00 -1.00 0.00 0.00 29.16 27.95 3h9c h TRP 253 CO 0.00 0.37 -0.48 1.25 -3.56 0.00 0.00 178.44 176.01 3h9c h LEU 254 N 0.76 0.22 0.00 -4.49 6.46 -1.60 -3.40 115.31 113.26 3h9c h LEU 254 Ca 0.40 -0.95 -0.02 0.00 -0.12 0.00 0.00 57.88 57.19 3h9c h LEU 254 Cb 0.52 -0.07 -0.00 0.00 -0.73 0.00 0.00 40.66 40.38 3h9c h LEU 254 CO -0.17 1.22 -0.51 -2.24 -0.62 0.00 0.00 178.44 176.12 3h9c h ASP 255 N -0.70 0.00 0.41 1.25 -0.00 -1.41 -3.34 116.42 112.64 3h9c h ASP 255 Ca -0.09 0.00 -0.02 0.00 -0.00 0.00 0.00 57.03 56.92 3h9c h ASP 255 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.66 3h9c h ASP 255 CO 0.06 0.09 -0.20 0.00 -0.00 0.00 0.00 179.24 179.19 3h9c h ALA 256 N 1.91 -0.56 0.00 4.15 0.00 -1.01 -2.76 119.26 120.99 3h9c h ALA 256 Ca -0.01 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 3h9c h ALA 256 Cb 1.08 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 3h9c h ALA 256 CO 0.01 -0.70 -0.24 -1.00 0.00 0.00 0.00 179.25 177.33 3h9c h PRO 257 N -0.79 0.00 0.00 0.00 0.13 -1.79 -0.49 132.00 129.05 3h9c h PRO 257 Ca -0.06 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.07 3h9c h PRO 257 Cb 0.54 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.67 3h9c h PRO 257 CO 0.09 0.24 -0.02 0.82 -0.23 0.00 0.00 178.00 178.90 3h9c h ILE 258 N 0.00 0.09 -0.16 -3.56 2.04 -1.65 -0.59 117.51 113.69 3h9c h ILE 258 Ca -0.00 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.66 3h9c h ILE 258 Cb 0.66 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 3h9c h ILE 258 CO 0.03 0.02 0.13 1.23 0.00 0.00 0.00 178.15 179.56 3h9c h GLY 259 N 0.79 0.00 0.97 5.37 0.00 -0.78 0.19 103.07 109.61 3h9c h GLY 259 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3h9c h GLY 259 CO 0.00 0.00 0.24 -0.97 0.00 0.00 0.00 176.54 175.81 3h9c h TYR 260 N 0.00 0.63 -0.29 5.60 0.99 -1.23 -0.46 116.97 122.20 3h9c h TYR 260 Ca 0.07 -0.02 -0.09 0.00 2.00 0.00 0.00 58.73 60.69 3h9c h TYR 260 Cb 0.34 -0.20 -0.01 0.00 1.00 0.00 0.00 36.73 37.86 3h9c h TYR 260 CO 0.00 0.49 -0.18 0.52 -0.00 0.00 0.00 178.16 178.99 3h9c h MET 261 N 0.59 0.64 -0.69 4.88 2.86 -1.16 -2.75 114.93 119.30 3h9c h MET 261 Ca 0.16 -0.30 -0.03 0.00 -2.06 0.00 0.00 59.70 57.47 3h9c h MET 261 Cb 0.08 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 3h9c h MET 261 CO -0.02 0.89 0.32 0.78 1.06 0.00 0.00 176.91 179.93 3h9c h GLY 262 N 0.38 1.07 1.17 8.32 0.00 -0.62 0.24 103.07 113.63 3h9c h GLY 262 Ca 0.06 -0.52 -0.10 0.00 0.00 0.00 0.00 47.33 46.77 3h9c h GLY 262 CO 0.05 0.50 -0.05 0.23 0.00 0.00 0.00 176.54 177.27 3h9c h SER 263 N 0.99 0.97 -0.30 0.19 0.87 -1.06 -0.35 113.55 114.86 3h9c h SER 263 Ca 0.24 -0.29 -0.17 0.00 -1.23 0.00 0.00 61.79 60.34 3h9c h SER 263 Cb 0.12 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 61.82 3h9c h SER 263 CO -0.03 1.06 -0.44 0.15 -0.53 0.00 0.00 176.83 177.04 3h9c h PHE 264 N 0.90 1.06 -0.64 2.24 3.57 -1.12 -1.85 116.94 121.10 3h9c h PHE 264 Ca 0.15 -0.34 -0.02 0.00 3.53 0.00 0.00 57.97 61.30 3h9c h PHE 264 Cb 0.59 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 3h9c h PHE 264 CO 0.04 1.15 0.31 -0.22 -2.23 0.00 0.00 178.31 177.36 3h9c h LYS 265 N 0.70 0.91 -0.58 1.11 3.64 -0.75 -0.43 116.57 121.16 3h9c h LYS 265 Ca 0.04 -0.13 0.04 0.00 -1.27 0.00 0.00 60.65 59.34 3h9c h LYS 265 Cb 1.03 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.64 3h9c h LYS 265 CO 0.10 0.72 0.32 -0.97 -2.27 0.00 0.00 179.45 177.36 3h9c h ASN 266 N 0.88 0.49 -0.08 4.20 -0.73 -0.93 0.80 115.58 120.20 3h9c h ASN 266 Ca 0.22 0.02 -0.00 0.00 1.87 0.00 0.00 56.30 58.41 3h9c h ASN 266 Cb 0.11 -0.08 -0.00 0.00 0.27 0.00 0.00 38.32 38.62 3h9c h ASN 266 CO -0.03 0.33 0.05 0.25 -0.37 0.00 0.00 177.43 177.66 3h9c h LEU 267 N 0.62 0.10 -0.62 0.34 5.85 -0.82 -0.22 115.31 120.56 3h9c h LEU 267 Ca 0.25 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.90 3h9c h LEU 267 Cb 0.12 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3h9c h LEU 267 CO -0.15 0.16 0.41 0.00 -0.34 0.00 0.00 178.44 178.51 3h9c h ASP 269 N 0.82 0.86 0.04 0.00 3.32 -0.60 -0.26 116.42 120.60 3h9c h ASP 269 Ca 0.23 -0.21 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 3h9c h ASP 269 Cb -0.07 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 3h9c h ASP 269 CO -0.06 0.84 -0.15 0.11 -1.72 0.00 0.00 179.24 178.26 3h9c h LYS 270 N 0.84 0.24 0.00 3.56 1.57 -0.78 -2.00 116.57 120.00 3h9c h LYS 270 Ca 0.19 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3h9c h LYS 270 Cb 0.28 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.56 3h9c h LYS 270 CO -0.01 0.39 0.00 0.54 -0.57 0.00 0.00 179.45 179.81 3h9c n ARG 271 N -4.26 0.02 -1.85 3.15 1.74 -0.53 -4.91 116.66 110.03 3h9c n ARG 271 Ca -0.01 0.04 -0.11 0.00 -0.77 0.00 0.00 57.85 57.01 3h9c n ARG 271 Cb 0.28 -1.52 -0.02 0.00 -1.02 0.00 0.00 32.46 30.18 3h9c n ARG 271 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h9c n GLY 272 N 1.33 0.45 3.45 -0.13 0.00 -0.66 -4.98 105.19 104.64 3h9c n GLY 272 Ca 0.07 -0.47 -0.44 0.00 0.00 0.00 0.00 46.02 45.18 3h9c n GLY 272 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h9c s ASP 273 N -2.66 6.20 0.00 1.61 3.68 -0.20 -4.93 116.67 120.37 3h9c s ASP 273 Ca 0.00 -0.88 0.24 0.00 2.13 0.00 0.00 52.55 54.04 3h9c s ASP 273 Cb 0.00 -2.25 0.66 0.00 -1.45 0.00 0.00 42.92 39.88 3h9c s ASP 273 CO 0.00 -0.73 1.52 -1.54 0.13 0.00 0.00 175.17 174.55 3h9c n SER 274 N 5.78 2.24 -0.02 -0.34 3.41 -1.26 -4.37 113.62 119.06 3h9c n SER 274 Ca -0.08 -1.76 -0.01 0.00 -0.26 0.00 0.00 58.87 56.76 3h9c n SER 274 Cb 0.46 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 3h9c n SER 274 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3h9c n VAL 275 N 0.72 0.22 0.08 -3.33 0.24 -1.26 -4.79 118.33 110.21 3h9c n VAL 275 Ca 0.17 -0.14 0.00 0.00 -2.04 0.00 0.00 64.34 62.33 3h9c n VAL 275 Cb 0.45 -0.80 0.31 0.00 -1.47 0.00 0.00 33.84 32.33 3h9c n VAL 275 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3h9c h SER 276 N 0.00 0.30 0.13 -1.34 0.02 -1.99 -2.40 113.55 108.28 3h9c h SER 276 Ca -0.09 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.77 3h9c h SER 276 Cb 1.13 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.59 3h9c h SER 276 CO 0.00 0.51 -0.06 0.15 -1.14 0.00 0.00 176.83 176.30 3h9c h PHE 277 N 0.29 -0.17 -0.25 3.45 3.57 -1.87 -1.15 116.94 120.81 3h9c h PHE 277 Ca 0.05 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 3h9c h PHE 277 Cb 0.51 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.29 3h9c h PHE 277 CO 0.01 -0.09 -0.17 -0.44 -2.23 0.00 0.00 178.31 175.39 3h9c h ASP 278 N -0.19 0.43 0.02 0.41 3.32 -1.88 -0.93 116.42 117.60 3h9c h ASP 278 Ca -0.02 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 56.89 3h9c h ASP 278 Cb 0.15 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 3h9c h ASP 278 CO 0.03 0.62 -0.07 -0.33 -1.72 0.00 0.00 179.24 177.77 3h9c h GLU 279 N 0.40 0.13 0.00 3.56 5.08 -0.88 -1.52 114.58 121.34 3h9c h GLU 279 Ca 0.07 -0.02 -0.27 0.00 -1.00 0.00 0.00 59.36 58.15 3h9c h GLU 279 Cb 0.53 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.71 3h9c h GLU 279 CO 0.03 0.21 -1.78 0.66 -1.00 0.00 0.00 179.01 177.13 3h9c n TYR 280 N -4.38 0.76 0.19 4.33 4.02 -0.49 -4.33 117.16 117.26 3h9c n TYR 280 Ca -0.02 0.27 0.04 0.00 -0.01 0.00 0.00 57.90 58.19 3h9c n TYR 280 Cb 0.19 -1.10 -0.06 0.00 -0.02 0.00 0.00 39.34 38.35 3h9c n TYR 280 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 3h9c n TRP 281 N -2.92 0.00 -1.57 -0.72 7.02 -0.40 -4.87 117.44 113.98 3h9c n TRP 281 Ca -0.18 0.00 -0.32 0.00 -1.02 0.00 0.00 57.50 55.98 3h9c n TRP 281 Cb 1.00 -0.11 0.06 0.00 -2.42 0.00 0.00 31.31 29.85 3h9c n TRP 281 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 3h9c s LYS 282 N -2.23 2.66 0.49 -0.99 -0.14 -0.58 -1.34 119.74 117.61 3h9c s LYS 282 Ca -0.00 1.22 0.18 0.00 -1.36 0.00 0.00 55.97 56.00 3h9c s LYS 282 Cb 0.06 -1.94 1.22 0.00 -1.68 0.00 0.00 37.83 35.49 3h9c s LYS 282 CO 0.36 -1.33 2.05 0.87 -0.76 0.00 0.00 175.35 176.54 3h9c h LYS 283 N -0.49 0.14 -0.35 1.68 1.57 -1.86 -1.97 116.57 115.29 3h9c h LYS 283 Ca -0.45 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3h9c h LYS 283 Cb 1.23 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.51 3h9c h LYS 283 CO 0.54 0.09 0.00 -0.40 -0.57 0.00 0.00 179.45 179.11 3h9c n ASP 284 N -4.47 1.38 -4.77 0.86 5.75 -1.26 -4.80 116.55 109.24 3h9c n ASP 284 Ca 0.05 -2.06 -0.41 0.00 -0.01 0.00 0.00 54.79 52.36 3h9c n ASP 284 Cb 0.32 -0.23 -0.01 0.00 -1.03 0.00 0.00 41.12 40.17 3h9c n ASP 284 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3h9c s SER 285 N -0.83 6.36 0.00 -1.12 0.15 -0.74 -4.91 113.70 112.60 3h9c s SER 285 Ca 0.14 3.01 0.23 0.00 0.70 0.00 0.00 55.95 60.03 3h9c s SER 285 Cb 0.08 -2.66 0.32 0.00 -1.71 0.00 0.00 66.02 62.06 3h9c s SER 285 CO 0.08 -0.88 1.32 0.35 1.20 0.00 0.00 173.24 175.32 3h9c n THR 286 N 0.95 0.31 -2.19 6.45 -2.24 -1.26 -4.97 114.28 111.33 3h9c n THR 286 Ca 0.03 -0.66 -0.31 0.00 -2.27 0.00 0.00 64.05 60.84 3h9c n THR 286 Cb 0.39 1.17 -0.01 0.00 -2.10 0.00 0.00 70.33 69.78 3h9c n THR 286 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h9c s ALA 287 N -1.63 3.11 -0.10 6.98 0.00 -1.26 -4.77 121.76 124.09 3h9c s ALA 287 Ca 0.33 0.01 -0.05 0.00 0.00 0.00 0.00 51.96 52.26 3h9c s ALA 287 Cb 0.21 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.24 3h9c s ALA 287 CO 0.30 -0.44 0.08 -1.21 0.00 0.00 0.00 175.76 174.49 3h9c s GLU 288 N -4.59 3.23 -0.14 0.00 2.02 0.32 -5.00 118.70 114.54 3h9c s GLU 288 Ca 0.56 -0.26 0.01 0.00 0.02 0.00 0.00 54.97 55.30 3h9c s GLU 288 Cb -0.10 -3.01 0.02 0.00 0.10 0.00 0.00 34.13 31.14 3h9c s GLU 288 CO 0.42 0.74 -0.15 -1.17 0.02 0.00 0.00 175.26 175.12 3h9c s LEU 289 N -1.00 1.74 -0.04 1.80 2.96 -1.26 -0.61 118.68 122.28 3h9c s LEU 289 Ca 0.15 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.60 3h9c s LEU 289 Cb -0.12 -1.20 -0.00 0.00 0.50 0.00 0.00 46.19 45.37 3h9c s LEU 289 CO 0.04 -0.03 -0.16 -0.31 -1.32 0.00 0.00 176.35 174.56 3h9c s TYR 290 N 1.35 1.60 -0.20 5.38 1.51 -0.17 -0.10 117.35 126.73 3h9c s TYR 290 Ca 0.02 -0.44 -0.02 0.00 -1.01 0.00 0.00 57.07 55.63 3h9c s TYR 290 Cb -0.13 -1.08 -0.00 0.00 -0.11 0.00 0.00 41.96 40.64 3h9c s TYR 290 CO -0.09 -0.14 -0.10 -1.01 -1.11 0.00 0.00 175.55 173.10 3h9c s HIS 291 N 0.00 2.89 -0.14 2.71 3.76 -1.10 -1.40 115.29 122.01 3h9c s HIS 291 Ca -0.02 -1.11 -0.23 0.00 -0.15 0.00 0.00 55.06 53.55 3h9c s HIS 291 Cb -0.11 -2.02 -0.03 0.00 1.11 0.00 0.00 32.58 31.54 3h9c s HIS 291 CO 0.02 -0.58 0.70 -0.06 -0.85 0.00 0.00 174.74 173.96 3h9c s PHE 292 N 1.29 3.47 0.14 1.40 0.40 -0.32 -0.76 117.98 123.60 3h9c s PHE 292 Ca 0.03 1.13 -0.10 0.00 -0.60 0.00 0.00 56.93 57.39 3h9c s PHE 292 Cb -0.14 -2.84 0.00 0.00 0.51 0.00 0.00 43.02 40.55 3h9c s PHE 292 CO -0.05 -0.07 0.29 0.96 0.70 0.00 0.00 175.22 177.05 3h9c s ILE 293 N 1.48 0.09 0.53 0.64 -4.36 -0.53 -2.68 121.20 116.36 3h9c s ILE 293 Ca 0.34 -1.18 0.03 0.00 -0.26 0.00 0.00 60.65 59.58 3h9c s ILE 293 Cb -0.17 -1.60 0.03 0.00 1.25 0.00 0.00 42.46 41.98 3h9c s ILE 293 CO 0.14 -0.39 0.74 -0.83 0.24 0.00 0.00 174.94 174.84 3h9c s GLY 294 N -2.91 1.85 0.35 6.27 0.00 -1.26 -1.64 107.32 109.98 3h9c s GLY 294 Ca 0.11 -1.42 0.06 0.00 0.00 0.00 0.00 44.72 43.47 3h9c s GLY 294 CO -0.05 -1.15 1.93 0.50 0.00 0.00 0.00 173.10 174.33 3h9c h LYS 295 N 0.17 0.75 0.00 2.90 1.57 -1.85 -2.70 116.57 117.42 3h9c h LYS 295 Ca -0.41 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3h9c h LYS 295 Cb 1.29 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.43 3h9c h LYS 295 CO 0.50 0.50 0.00 -0.25 -0.57 0.00 0.00 179.45 179.63 3h9c n ASP 296 N -4.50 0.00 -0.15 0.86 8.00 -1.26 -2.86 116.55 116.64 3h9c n ASP 296 Ca 0.13 0.21 0.09 0.00 0.71 0.00 0.00 54.79 55.92 3h9c n ASP 296 Cb 0.28 -0.38 0.12 0.00 -0.02 0.00 0.00 41.12 41.13 3h9c n ASP 296 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 3h9c n ILE 297 N -1.38 1.66 -0.07 0.53 -5.35 -1.02 -4.77 119.36 108.96 3h9c n ILE 297 Ca 0.08 -2.02 -0.14 0.00 -0.27 0.00 0.00 62.75 60.40 3h9c n ILE 297 Cb 0.20 -0.14 -0.05 0.00 -1.74 0.00 0.00 39.64 37.91 3h9c n ILE 297 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 3h9c h VAL 298 N 0.94 1.31 -0.41 7.28 2.07 -1.60 -2.30 116.25 123.54 3h9c h VAL 298 Ca -0.00 -1.58 0.07 0.00 0.82 0.00 0.00 66.70 66.01 3h9c h VAL 298 Cb 1.05 1.75 -0.06 0.00 -1.52 0.00 0.00 31.29 32.51 3h9c h VAL 298 CO 0.00 0.50 0.05 0.22 0.02 0.00 0.00 177.57 178.35 3h9c h TYR 299 N 0.39 0.06 -0.16 1.57 5.03 -1.86 0.43 116.97 122.44 3h9c h TYR 299 Ca 0.02 0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.37 3h9c h TYR 299 Cb 0.97 0.03 -0.01 0.00 1.55 0.00 0.00 36.73 39.27 3h9c h TYR 299 CO 0.08 -0.03 0.07 0.35 -1.32 0.00 0.00 178.16 177.31 3h9c h PHE 300 N 0.16 0.13 0.00 -3.82 3.57 -1.89 -1.93 116.94 113.16 3h9c h PHE 300 Ca 0.20 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 3h9c h PHE 300 Cb 0.27 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 3h9c h PHE 300 CO -0.23 0.07 -0.37 0.45 -2.23 0.00 0.00 178.31 176.00 3h9c h HIS 301 N 0.16 0.00 0.00 0.41 3.86 -1.03 -1.27 115.15 117.28 3h9c h HIS 301 Ca 0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 3h9c h HIS 301 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 3h9c h HIS 301 CO -0.10 0.37 -1.44 -1.13 0.86 0.00 0.00 177.93 176.49 3h9c n SER 302 N -3.28 0.44 0.02 2.45 3.41 0.11 -4.25 113.62 112.52 3h9c n SER 302 Ca 0.02 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 3h9c n SER 302 Cb 0.62 1.22 0.00 0.00 -0.26 0.00 0.00 64.21 65.78 3h9c n SER 302 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h9c n LEU 303 N -2.29 0.29 -0.01 1.04 4.77 -0.73 -4.72 117.00 115.34 3h9c n LEU 303 Ca -0.01 0.06 -0.10 0.00 -0.03 0.00 0.00 56.01 55.93 3h9c n LEU 303 Cb 0.53 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.50 3h9c n LEU 303 CO 0.43 -0.58 0.90 0.15 -1.33 0.00 0.00 177.39 176.95 3h9c h PHE 304 N 0.00 0.09 0.08 -1.77 3.57 -1.56 -2.84 116.94 114.50 3h9c h PHE 304 Ca 0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 3h9c h PHE 304 Cb 0.00 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.72 3h9c h PHE 304 CO 0.00 0.05 -0.04 2.35 -2.23 0.00 0.00 178.31 178.44 3h9c h TRP 305 N 0.11 -0.10 -0.14 0.41 -0.00 -1.46 -0.96 115.95 113.82 3h9c h TRP 305 Ca 0.06 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 58.92 3h9c h TRP 305 Cb 0.03 0.03 -0.01 0.00 -0.00 0.00 0.00 29.16 29.21 3h9c h TRP 305 CO -0.10 0.23 -0.03 -1.35 -0.00 0.00 0.00 178.44 177.19 3h9c h PRO 306 N -0.43 0.20 -0.43 2.65 0.11 -1.74 -1.50 132.00 130.86 3h9c h PRO 306 Ca -0.01 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 3h9c h PRO 306 Cb 0.37 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.43 3h9c h PRO 306 CO 0.02 0.24 0.02 0.00 -0.21 0.00 0.00 178.00 178.07 3h9c h ALA 307 N 1.79 0.57 -0.61 -0.75 0.00 -1.30 -0.41 119.26 118.55 3h9c h ALA 307 Ca 0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 3h9c h ALA 307 Cb 0.18 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3h9c h ALA 307 CO 0.01 0.34 0.22 1.98 0.00 0.00 0.00 179.25 181.79 3h9c h MET 308 N 0.58 0.93 -0.19 0.00 -1.53 -0.63 -0.17 114.93 113.93 3h9c h MET 308 Ca 0.12 -0.18 -0.01 0.00 -3.44 0.00 0.00 59.70 56.19 3h9c h MET 308 Cb 0.46 -0.14 -0.01 0.00 -0.55 0.00 0.00 31.60 31.36 3h9c h MET 308 CO 0.02 0.81 0.06 -0.07 0.14 0.00 0.00 176.91 177.87 3h9c h LEU 309 N 0.86 0.27 -0.49 3.39 3.38 -1.15 -2.22 115.31 119.34 3h9c h LEU 309 Ca 0.20 -0.19 0.04 0.00 0.09 0.00 0.00 57.88 58.03 3h9c h LEU 309 Cb 0.25 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 3h9c h LEU 309 CO -0.01 0.38 0.24 -0.08 0.09 0.00 0.00 178.44 179.07 3h9c h GLU 310 N 0.14 0.46 0.00 1.13 4.57 -0.88 -0.75 114.58 119.25 3h9c h GLU 310 Ca 0.06 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 3h9c h GLU 310 Cb 0.21 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 3h9c h GLU 310 CO -0.00 0.31 0.00 0.41 -1.18 0.00 0.00 179.01 178.54 3h9c n GLY 311 N -1.25 -1.20 0.39 1.92 0.00 -0.09 -2.03 105.19 102.93 3h9c n GLY 311 Ca 0.04 0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.24 3h9c n GLY 311 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h9c n SER 312 N -2.21 2.89 -2.15 1.61 3.41 -0.85 -4.20 113.62 112.11 3h9c n SER 312 Ca 0.02 -2.83 -0.15 0.00 -0.26 0.00 0.00 58.87 55.64 3h9c n SER 312 Cb 0.20 -0.40 0.03 0.00 -0.26 0.00 0.00 64.21 63.78 3h9c n SER 312 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3h9c n ASN 313 N -0.83 -4.63 -4.56 4.04 5.15 -0.85 -5.00 115.26 108.58 3h9c n ASN 313 Ca 0.15 -0.22 -0.25 0.00 -0.60 0.00 0.00 54.58 53.67 3h9c n ASN 313 Cb 0.66 -3.45 -0.09 0.00 -0.53 0.00 0.00 39.78 36.37 3h9c n ASN 313 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 3h9c s PHE 314 N -3.00 2.56 0.84 1.20 0.40 -0.35 -4.31 117.98 115.32 3h9c s PHE 314 Ca 0.23 -0.26 -0.10 0.00 -0.60 0.00 0.00 56.93 56.20 3h9c s PHE 314 Cb -0.10 -1.18 0.10 0.00 0.51 0.00 0.00 43.02 42.34 3h9c s PHE 314 CO 0.29 0.59 1.11 -0.98 0.70 0.00 0.00 175.22 176.93 3h9c s ARG 315 N -3.24 1.69 0.33 0.44 1.04 -0.45 -4.02 118.95 114.74 3h9c s ARG 315 Ca 0.28 1.30 0.08 0.00 -1.04 0.00 0.00 55.73 56.35 3h9c s ARG 315 Cb -0.07 -1.82 -0.03 0.00 -2.04 0.00 0.00 34.95 30.99 3h9c s ARG 315 CO 0.16 -2.08 0.26 0.15 -0.04 0.00 0.00 175.30 173.75 3h9c s LYS 316 N -4.80 2.67 0.41 3.89 1.02 -1.26 -4.83 119.74 116.84 3h9c s LYS 316 Ca 0.64 -1.33 -0.26 0.00 0.02 0.00 0.00 55.97 55.03 3h9c s LYS 316 Cb -0.19 -2.42 -0.10 0.00 -0.52 0.00 0.00 37.83 34.59 3h9c s LYS 316 CO 0.57 0.11 1.36 -2.30 -0.92 0.00 0.00 175.35 174.17 3h9c n PRO 317 N -1.32 2.18 -0.13 -1.68 -0.02 -1.26 -4.84 135.00 127.93 3h9c n PRO 317 Ca -0.02 0.77 -0.13 0.00 -2.02 0.00 0.00 63.50 62.10 3h9c n PRO 317 Cb 0.60 -2.50 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 3h9c n PRO 317 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3h9c h SER 318 N 2.35 0.98 -4.97 2.55 0.02 -0.89 -3.48 113.55 110.12 3h9c h SER 318 Ca -0.49 -0.45 0.01 0.00 -0.84 0.00 0.00 61.79 60.03 3h9c h SER 318 Cb 1.28 -0.28 -0.11 0.00 0.14 0.00 0.00 62.40 63.43 3h9c h SER 318 CO 0.61 1.22 0.25 0.21 -1.14 0.00 0.00 176.83 177.98 3h9c s ASN 319 N -6.77 -0.49 -0.10 3.07 3.84 -1.10 -4.96 114.94 108.43 3h9c s ASN 319 Ca -0.11 -0.11 0.02 0.00 0.21 0.00 0.00 52.86 52.87 3h9c s ASN 319 Cb 0.11 0.59 -0.02 0.00 -0.55 0.00 0.00 41.25 41.39 3h9c s ASN 319 CO 0.87 -0.99 -0.15 -0.76 -2.79 0.00 0.00 177.10 173.28 3h9c s LEU 320 N -2.75 2.61 -0.31 3.21 1.43 -1.26 -2.71 118.68 118.89 3h9c s LEU 320 Ca 0.03 -0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 52.78 3h9c s LEU 320 Cb -0.02 -1.56 0.05 0.00 0.03 0.00 0.00 46.19 44.69 3h9c s LEU 320 CO -0.09 0.23 0.04 -0.36 0.23 0.00 0.00 176.35 176.39 3h9c s PHE 321 N -0.02 3.26 -0.14 0.29 2.99 0.06 -4.62 117.98 119.80 3h9c s PHE 321 Ca -0.04 -1.73 -0.04 0.00 0.00 0.00 0.00 56.93 55.12 3h9c s PHE 321 Cb -0.14 -2.18 -0.03 0.00 0.00 0.00 0.00 43.02 40.67 3h9c s PHE 321 CO 0.04 -0.78 0.01 0.08 -0.00 0.00 0.00 175.22 174.57 3h9c s VAL 322 N 1.30 4.37 0.33 -0.44 1.01 -1.26 -1.45 120.40 124.26 3h9c s VAL 322 Ca -0.04 -0.20 0.09 0.00 0.00 0.00 0.00 61.98 61.84 3h9c s VAL 322 Cb -0.20 -2.91 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 3h9c s VAL 322 CO 0.00 0.53 -0.02 -1.38 0.00 0.00 0.00 175.10 174.22 3h9c s HIS 323 N -0.12 2.52 0.17 5.22 -3.43 -0.65 -4.30 115.29 114.70 3h9c s HIS 323 Ca 0.05 -0.41 -0.01 0.00 -0.80 0.00 0.00 55.06 53.89 3h9c s HIS 323 Cb -0.13 -1.39 0.04 0.00 -1.43 0.00 0.00 32.58 29.67 3h9c s HIS 323 CO 0.02 0.53 0.23 0.41 -2.00 0.00 0.00 174.74 173.93 3h9c n GLY 324 N -0.89 -0.12 3.84 -1.38 0.00 -1.23 -2.89 105.19 102.52 3h9c n GLY 324 Ca -0.05 -1.84 -0.32 0.00 0.00 0.00 0.00 46.02 43.81 3h9c n GLY 324 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h9c s TYR 325 N -0.94 3.36 0.09 1.61 4.12 -1.26 -4.74 117.35 119.60 3h9c s TYR 325 Ca 0.14 1.43 -0.21 0.00 0.02 0.00 0.00 57.07 58.45 3h9c s TYR 325 Cb -0.01 -2.83 -0.07 0.00 -1.52 0.00 0.00 41.96 37.54 3h9c s TYR 325 CO 0.10 -0.67 0.63 0.08 0.02 0.00 0.00 175.55 175.70 3h9c s VAL 326 N -2.75 4.65 0.26 0.71 1.01 -1.26 -0.35 120.40 122.67 3h9c s VAL 326 Ca 0.59 1.36 0.11 0.00 0.00 0.00 0.00 61.98 64.04 3h9c s VAL 326 Cb -0.12 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 3h9c s VAL 326 CO 0.40 0.53 -0.19 0.42 0.00 0.00 0.00 175.10 176.26 3h9c s THR 327 N -1.03 2.32 -0.10 3.92 -4.23 -0.35 -4.56 115.64 111.61 3h9c s THR 327 Ca 0.31 -2.35 0.02 0.00 -1.18 0.00 0.00 61.69 58.48 3h9c s THR 327 Cb -0.20 -2.24 0.01 0.00 1.34 0.00 0.00 72.50 71.41 3h9c s THR 327 CO 0.21 -0.43 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.02 3h9c s VAL 328 N -2.58 1.43 -1.36 2.29 1.01 -0.15 -0.61 120.40 120.44 3h9c s VAL 328 Ca 0.28 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 3h9c s VAL 328 Cb -0.04 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 35.04 3h9c s VAL 328 CO 0.13 0.43 0.21 0.59 0.00 0.00 0.00 175.10 176.45 3h9c n ASN 329 N 4.13 -4.75 0.00 3.32 3.02 -0.16 -2.22 115.26 118.60 3h9c n ASN 329 Ca -0.19 -0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.31 3h9c n ASN 329 Cb 0.51 -3.95 0.00 0.00 -0.61 0.00 0.00 39.78 35.73 3h9c n ASN 329 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h9c n GLY 330 N -1.06 0.98 3.38 7.41 0.00 -1.26 -5.03 105.19 109.61 3h9c n GLY 330 Ca -0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 3h9c n GLY 330 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9c s ALA 331 N -2.29 2.17 0.48 4.61 0.00 -0.94 -5.00 121.76 120.78 3h9c s ALA 331 Ca 0.00 -1.75 -0.22 0.00 0.00 0.00 0.00 51.96 49.99 3h9c s ALA 331 Cb 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 23.12 23.01 3h9c s ALA 331 CO 0.00 0.04 0.92 1.17 0.00 0.00 0.00 175.76 177.89 3h9c n LYS 332 N -0.46 1.11 -1.66 0.00 4.81 -1.26 -0.98 118.16 119.72 3h9c n LYS 332 Ca -0.07 0.41 -0.44 0.00 -0.87 0.00 0.00 58.31 57.34 3h9c n LYS 332 Cb 0.61 -2.00 -0.01 0.00 0.02 0.00 0.00 35.03 33.65 3h9c n LYS 332 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 3h9c n MET 333 N -0.12 1.83 -3.86 1.64 2.81 -1.26 -4.72 117.12 113.44 3h9c n MET 333 Ca 0.11 0.64 -0.27 0.00 -1.81 0.00 0.00 57.70 56.37 3h9c n MET 333 Cb 0.42 -2.16 -0.17 0.00 -0.71 0.00 0.00 33.22 30.60 3h9c n MET 333 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3h9c s SER 334 N -0.29 2.45 0.19 7.83 0.15 -1.26 -4.76 113.70 118.00 3h9c s SER 334 Ca 0.59 -0.48 -0.11 0.00 0.70 0.00 0.00 55.95 56.65 3h9c s SER 334 Cb -0.63 -0.79 0.11 0.00 -1.71 0.00 0.00 66.02 63.00 3h9c s SER 334 CO 0.59 -0.18 1.77 0.11 1.20 0.00 0.00 173.24 176.74 3h9c h LYS 335 N 8.18 0.97 0.00 5.44 1.57 -1.92 -0.39 116.57 130.42 3h9c h LYS 335 Ca -0.24 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.34 3h9c h LYS 335 Cb 1.12 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.25 3h9c h LYS 335 CO 0.37 0.78 -0.22 0.66 -0.57 0.00 0.00 179.45 180.47 3h9c h SER 336 N 0.93 0.00 0.19 0.86 4.64 -1.94 -1.71 113.55 116.52 3h9c h SER 336 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3h9c h SER 336 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3h9c h SER 336 CO -0.03 0.22 -0.35 0.54 -0.87 0.00 0.00 176.83 176.35 3h9c n ARG 337 N -4.13 0.85 -1.95 4.77 1.74 -1.06 -4.95 116.66 111.94 3h9c n ARG 337 Ca -0.02 -0.56 -0.07 0.00 -0.77 0.00 0.00 57.85 56.43 3h9c n ARG 337 Cb 0.29 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.23 3h9c n ARG 337 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h9c n GLY 338 N 1.37 0.25 0.71 -0.13 0.00 -0.65 -4.92 105.19 101.83 3h9c n GLY 338 Ca 0.11 -0.63 0.08 0.00 0.00 0.00 0.00 46.02 45.58 3h9c n GLY 338 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h9c n THR 339 N -3.77 0.17 -2.79 2.61 -2.24 -0.24 -4.47 114.28 103.55 3h9c n THR 339 Ca -0.08 -0.59 -0.43 0.00 -2.27 0.00 0.00 64.05 60.69 3h9c n THR 339 Cb 0.49 1.20 -0.04 0.00 -2.10 0.00 0.00 70.33 69.89 3h9c n THR 339 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3h9c s PHE 340 N -1.32 2.60 -0.18 4.78 5.36 -1.13 -4.24 117.98 123.85 3h9c s PHE 340 Ca 0.22 -0.47 -0.02 0.00 -0.96 0.00 0.00 56.93 55.70 3h9c s PHE 340 Cb 0.15 -4.38 -0.01 0.00 -0.34 0.00 0.00 43.02 38.44 3h9c s PHE 340 CO 0.21 -1.75 -0.09 0.42 -1.46 0.00 0.00 175.22 172.55 3h9c s ILE 341 N 4.41 3.10 0.43 3.12 1.01 -1.26 -4.91 121.20 127.09 3h9c s ILE 341 Ca 0.26 -0.61 -0.22 0.00 0.00 0.00 0.00 60.65 60.08 3h9c s ILE 341 Cb -0.14 -2.36 -0.10 0.00 0.01 0.00 0.00 42.46 39.87 3h9c s ILE 341 CO 0.10 0.48 0.99 -0.54 0.00 0.00 0.00 174.94 175.97 3h9c s LYS 342 N 1.03 4.14 0.22 2.79 1.02 -1.26 -1.74 119.74 125.94 3h9c s LYS 342 Ca -0.00 1.28 -0.08 0.00 0.02 0.00 0.00 55.97 57.19 3h9c s LYS 342 Cb -0.15 -2.29 0.28 0.00 -0.52 0.00 0.00 37.83 35.15 3h9c s LYS 342 CO -0.01 -0.12 1.82 0.00 -0.92 0.00 0.00 175.35 176.12 3h9c h ALA 343 N 2.07 1.00 -0.84 5.17 0.00 -1.24 -1.10 119.26 124.32 3h9c h ALA 343 Ca -0.49 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 3h9c h ALA 343 Cb 1.20 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 3h9c h ALA 343 CO 0.61 0.13 0.40 0.66 0.00 0.00 0.00 179.25 181.05 3h9c h SER 344 N 0.79 1.10 -0.40 0.00 4.64 -1.94 -2.75 113.55 114.98 3h9c h SER 344 Ca 0.33 -0.14 -0.05 0.00 -0.47 0.00 0.00 61.79 61.46 3h9c h SER 344 Cb 0.19 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 61.98 3h9c h SER 344 CO -0.18 0.93 0.06 0.74 -0.87 0.00 0.00 176.83 177.51 3h9c h THR 345 N 1.19 1.24 -0.62 2.95 2.02 -1.81 -2.97 112.91 114.91 3h9c h THR 345 Ca 0.29 -0.88 0.13 0.00 0.77 0.00 0.00 66.41 66.72 3h9c h THR 345 Cb 0.12 1.03 -0.10 0.00 -1.74 0.00 0.00 68.15 67.46 3h9c h THR 345 CO -0.04 0.30 0.03 -0.25 0.37 0.00 0.00 175.52 175.93 3h9c h TRP 346 N 0.52 0.01 0.00 3.16 2.91 -0.94 -1.33 115.95 120.28 3h9c h TRP 346 Ca 0.12 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.19 3h9c h TRP 346 Cb 0.38 0.09 0.00 0.00 -0.51 0.00 0.00 29.16 29.12 3h9c h TRP 346 CO 0.03 -0.15 0.00 -0.07 -1.03 0.00 0.00 178.44 177.22 3h9c h LEU 347 N 0.14 0.00 -1.19 0.65 3.38 -1.34 -0.10 115.31 116.85 3h9c h LEU 347 Ca 0.33 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.29 3h9c h LEU 347 Cb 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 3h9c h LEU 347 CO -0.51 0.00 -0.04 0.78 0.09 0.00 0.00 178.44 178.75 3h9c h ASN 348 N 0.00 0.00 0.00 -0.43 2.35 -1.23 -3.37 115.58 112.90 3h9c h ASN 348 Ca 0.00 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.58 3h9c h ASN 348 Cb 0.37 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 3h9c h ASN 348 CO 0.00 0.04 -1.64 1.41 -1.65 0.00 0.00 177.43 175.60 3h9c n HIS 349 N -3.15 0.00 -4.30 1.19 8.25 -0.48 -5.07 115.22 111.66 3h9c n HIS 349 Ca 0.01 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.31 3h9c n HIS 349 Cb 0.36 -0.43 -0.10 0.00 1.12 0.00 0.00 29.99 30.94 3h9c n HIS 349 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3h9c s PHE 350 N -2.22 1.43 0.74 4.41 0.40 -0.17 -5.05 117.98 117.52 3h9c s PHE 350 Ca -0.14 -1.00 -0.08 0.00 -0.60 0.00 0.00 56.93 55.12 3h9c s PHE 350 Cb 0.04 -0.83 0.08 0.00 0.51 0.00 0.00 43.02 42.82 3h9c s PHE 350 CO 0.27 -0.15 1.06 0.16 0.70 0.00 0.00 175.22 177.26 3h9c s ASP 351 N -3.26 4.64 0.13 1.36 -4.77 -1.26 -4.14 116.67 109.37 3h9c s ASP 351 Ca 0.28 0.45 -0.11 0.00 -3.30 0.00 0.00 52.55 49.87 3h9c s ASP 351 Cb 0.06 -1.02 -0.07 0.00 -1.09 0.00 0.00 42.92 40.80 3h9c s ASP 351 CO 0.08 -1.73 1.43 0.00 0.70 0.00 0.00 175.17 175.65 3h9c h ALA 352 N -0.73 0.51 -0.77 2.11 0.00 -1.95 -3.26 119.26 115.17 3h9c h ALA 352 Ca -0.44 -0.49 0.10 0.00 0.00 0.00 0.00 54.91 54.07 3h9c h ALA 352 Cb 1.31 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 3h9c h ALA 352 CO 0.59 0.68 0.50 -0.44 0.00 0.00 0.00 179.25 180.58 3h9c h ASP 353 N 0.72 0.61 -0.32 0.00 3.32 -1.92 -1.31 116.42 117.52 3h9c h ASP 353 Ca 0.03 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 3h9c h ASP 353 Cb 1.09 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.51 3h9c h ASP 353 CO 0.11 0.37 0.17 0.77 -1.72 0.00 0.00 179.24 178.94 3h9c h SER 354 N 0.68 0.40 -0.34 6.45 4.64 -1.96 0.69 113.55 124.11 3h9c h SER 354 Ca 0.35 -0.09 -0.16 0.00 -0.47 0.00 0.00 61.79 61.41 3h9c h SER 354 Cb 0.46 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.45 3h9c h SER 354 CO -0.13 0.38 -0.43 0.25 -0.87 0.00 0.00 176.83 176.03 3h9c h LEU 355 N 0.39 0.97 -0.52 5.97 5.85 -1.61 -1.68 115.31 124.68 3h9c h LEU 355 Ca 0.11 -0.49 0.05 0.00 0.84 0.00 0.00 57.88 58.39 3h9c h LEU 355 Cb 0.07 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.78 3h9c h LEU 355 CO -0.02 1.27 0.25 0.03 -0.34 0.00 0.00 178.44 179.63 3h9c h ARG 356 N 0.69 0.47 -0.08 1.25 3.08 -0.93 -1.12 114.38 117.74 3h9c h ARG 356 Ca 0.04 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 3h9c h ARG 356 Cb 1.03 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.97 3h9c h ARG 356 CO 0.10 0.31 0.04 -0.92 -1.07 0.00 0.00 179.97 178.43 3h9c h TYR 357 N 0.49 0.12 -0.17 3.04 3.20 -0.76 -1.65 116.97 121.25 3h9c h TYR 357 Ca 0.24 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 3h9c h TYR 357 Cb 0.17 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 3h9c h TYR 357 CO -0.11 0.22 0.10 -0.92 -1.64 0.00 0.00 178.16 175.81 3h9c h TYR 358 N -0.01 0.22 -0.40 -3.82 5.03 -0.93 -0.17 116.97 116.88 3h9c h TYR 358 Ca 0.03 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.34 3h9c h TYR 358 Cb 0.14 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.33 3h9c h TYR 358 CO -0.02 0.17 0.25 1.88 -1.32 0.00 0.00 178.16 179.12 3h9c h TYR 359 N 0.20 0.51 -1.00 -3.82 0.99 -1.23 -2.73 116.97 109.90 3h9c h TYR 359 Ca 0.06 0.01 0.04 0.00 2.00 0.00 0.00 58.73 60.83 3h9c h TYR 359 Cb 0.01 -0.17 -0.06 0.00 1.00 0.00 0.00 36.73 37.51 3h9c h TYR 359 CO -0.06 0.34 0.65 1.15 -0.00 0.00 0.00 178.16 180.25 3h9c h THR 360 N 0.53 1.17 0.00 -2.88 2.02 -0.80 -0.81 112.91 112.15 3h9c h THR 360 Ca 0.15 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 3h9c h THR 360 Cb -0.03 -0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 66.18 3h9c h THR 360 CO -0.03 0.23 -0.07 0.00 0.37 0.00 0.00 175.52 176.02 3h9c h ALA 361 N 1.41 1.32 0.00 6.16 0.00 -0.74 -2.94 119.26 124.47 3h9c h ALA 361 Ca 0.40 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.22 3h9c h ALA 361 Cb 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3h9c h ALA 361 CO -0.13 0.09 -1.96 1.63 0.00 0.00 0.00 179.25 178.89 3h9c n LYS 362 N -3.63 0.66 -2.27 0.00 4.76 -0.62 -4.34 118.16 112.71 3h9c n LYS 362 Ca -0.02 -0.17 -0.33 0.00 -2.87 0.00 0.00 58.31 54.92 3h9c n LYS 362 Cb 0.18 -1.54 -0.01 0.00 -1.84 0.00 0.00 35.03 31.82 3h9c n LYS 362 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3h9c s LEU 363 N -4.64 3.67 0.00 -0.35 1.43 -0.41 -4.81 118.68 113.57 3h9c s LEU 363 Ca -0.08 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 3h9c s LEU 363 Cb 0.13 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.80 3h9c s LEU 363 CO 0.90 -1.02 0.19 -1.54 0.23 0.00 0.00 176.35 175.11 3h9c n SER 364 N -1.52 -0.53 -0.18 2.29 3.41 -1.26 -0.46 113.62 115.37 3h9c n SER 364 Ca 0.09 -1.84 0.15 0.00 -0.26 0.00 0.00 58.87 57.01 3h9c n SER 364 Cb 0.52 1.02 0.78 0.00 -0.26 0.00 0.00 64.21 66.28 3h9c n SER 364 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3h9c n SER 365 N -2.02 0.55 -4.99 4.04 3.41 -1.12 -4.77 113.62 108.73 3h9c n SER 365 Ca 0.01 -1.14 -0.19 0.00 -0.26 0.00 0.00 58.87 57.29 3h9c n SER 365 Cb 0.25 -0.01 0.03 0.00 -0.26 0.00 0.00 64.21 64.22 3h9c n SER 365 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3h9c s ARG 366 N -2.04 2.66 -0.47 4.33 0.52 -1.26 -4.94 118.95 117.74 3h9c s ARG 366 Ca 0.43 -1.04 -0.18 0.00 -0.52 0.00 0.00 55.73 54.42 3h9c s ARG 366 Cb 0.22 -2.62 0.05 0.00 0.52 0.00 0.00 34.95 33.11 3h9c s ARG 366 CO 0.37 -0.52 0.52 0.42 0.02 0.00 0.00 175.30 176.11 3h9c s ILE 367 N -2.56 5.02 -0.05 1.52 1.01 -1.26 -4.66 121.20 120.21 3h9c s ILE 367 Ca 0.56 -0.57 -0.13 0.00 0.00 0.00 0.00 60.65 60.51 3h9c s ILE 367 Cb -0.10 -4.18 0.02 0.00 0.01 0.00 0.00 42.46 38.21 3h9c s ILE 367 CO 0.36 -0.64 0.31 -1.81 0.00 0.00 0.00 174.94 173.15 3h9c s ASP 368 N 2.41 -0.23 0.60 3.58 1.01 -1.26 -4.85 116.67 117.92 3h9c s ASP 368 Ca 0.12 0.28 -0.19 0.00 0.71 0.00 0.00 52.55 53.46 3h9c s ASP 368 Cb -0.20 0.44 -0.03 0.00 1.01 0.00 0.00 42.92 44.14 3h9c s ASP 368 CO 0.11 -0.32 1.27 -1.81 0.21 0.00 0.00 175.17 174.63 3h9c s ASP 369 N -0.79 5.04 -0.21 0.27 1.01 -1.26 -3.49 116.67 117.24 3h9c s ASP 369 Ca -0.09 2.55 -0.03 0.00 0.71 0.00 0.00 52.55 55.69 3h9c s ASP 369 Cb -0.04 -2.61 -0.00 0.00 1.01 0.00 0.00 42.92 41.27 3h9c s ASP 369 CO 0.03 -1.71 -0.08 -0.63 0.21 0.00 0.00 175.17 172.99 3h9c s ILE 370 N -1.46 3.11 -0.24 0.77 -1.09 0.52 -4.92 121.20 117.89 3h9c s ILE 370 Ca 0.78 -0.59 -0.12 0.00 -2.23 0.00 0.00 60.65 58.49 3h9c s ILE 370 Cb -0.35 -2.39 -0.05 0.00 -1.58 0.00 0.00 42.46 38.09 3h9c s ILE 370 CO 0.38 0.45 0.23 -0.62 -1.23 0.00 0.00 174.94 174.15 3h9c s ASP 371 N 1.40 6.17 -0.82 3.58 3.68 -1.26 -1.20 116.67 128.22 3h9c s ASP 371 Ca 0.05 0.18 -0.18 0.00 2.13 0.00 0.00 52.55 54.73 3h9c s ASP 371 Cb -0.14 -2.14 0.14 0.00 -1.45 0.00 0.00 42.92 39.33 3h9c s ASP 371 CO -0.05 0.00 0.95 -0.22 0.13 0.00 0.00 175.17 175.98 3h9c s LEU 372 N 1.28 5.47 -0.31 -1.34 2.96 0.22 -4.96 118.68 122.01 3h9c s LEU 372 Ca 0.10 -2.00 -0.23 0.00 -0.22 0.00 0.00 54.13 51.78 3h9c s LEU 372 Cb -0.14 -2.34 -0.00 0.00 0.50 0.00 0.00 46.19 44.21 3h9c s LEU 372 CO 0.06 -0.99 0.77 0.21 -1.32 0.00 0.00 176.35 175.08 3h9c s ASN 373 N 3.29 6.64 0.23 3.68 3.84 -1.26 -0.98 114.94 130.38 3h9c s ASN 373 Ca 0.24 0.63 -0.05 0.00 0.21 0.00 0.00 52.86 53.89 3h9c s ASN 373 Cb -0.11 -2.40 0.22 0.00 -0.55 0.00 0.00 41.25 38.42 3h9c s ASN 373 CO -0.05 -0.60 1.70 -0.07 -2.79 0.00 0.00 177.10 175.29 3h9c h LEU 374 N 9.43 0.86 -0.51 3.21 3.38 -1.96 0.80 115.31 130.52 3h9c h LEU 374 Ca -0.25 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.47 3h9c h LEU 374 Cb 1.10 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 3h9c h LEU 374 CO 0.87 0.94 0.25 -0.33 0.09 0.00 0.00 178.44 180.27 3h9c h GLU 375 N 0.81 0.73 -0.15 1.13 4.39 -2.01 -2.64 114.58 116.85 3h9c h GLU 375 Ca 0.15 -0.10 -0.07 0.00 0.34 0.00 0.00 59.36 59.67 3h9c h GLU 375 Cb 0.53 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 3h9c h GLU 375 CO 0.03 0.60 -0.24 0.22 -1.16 0.00 0.00 179.01 178.46 3h9c h ASP 376 N 0.67 0.25 -0.17 1.42 1.82 -1.83 -2.45 116.42 116.15 3h9c h ASP 376 Ca 0.18 -0.07 0.00 0.00 -0.39 0.00 0.00 57.03 56.74 3h9c h ASP 376 Cb 0.10 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.04 3h9c h ASP 376 CO -0.02 0.50 0.11 0.15 -1.61 0.00 0.00 179.24 178.37 3h9c h PHE 377 N 0.24 0.21 -0.09 0.28 3.57 -0.57 0.23 116.94 120.81 3h9c h PHE 377 Ca 0.04 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 3h9c h PHE 377 Cb 0.56 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 3h9c h PHE 377 CO 0.01 0.13 0.06 0.28 -2.23 0.00 0.00 178.31 176.56 3h9c h VAL 378 N 0.23 1.05 -0.46 1.41 2.07 -1.27 -1.63 116.25 117.65 3h9c h VAL 378 Ca 0.06 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.46 3h9c h VAL 378 Cb -0.03 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3h9c h VAL 378 CO -0.01 0.04 0.30 1.56 0.02 0.00 0.00 177.57 179.48 3h9c h GLN 379 N 0.10 0.61 -0.12 1.57 1.08 -1.14 -2.39 115.11 114.81 3h9c h GLN 379 Ca 0.03 -0.04 -0.15 0.00 -1.45 0.00 0.00 58.65 57.04 3h9c h GLN 379 Cb 0.02 -0.13 0.01 0.00 -0.05 0.00 0.00 27.48 27.32 3h9c h GLN 379 CO -0.01 0.41 -0.50 -0.09 -0.95 0.00 0.00 178.83 177.69 3h9c h ARG 380 N 0.62 0.56 -0.32 1.46 2.43 -0.44 -0.34 114.38 118.34 3h9c h ARG 380 Ca 0.17 -0.44 -0.01 0.00 -0.81 0.00 0.00 59.98 58.89 3h9c h ARG 380 Cb -0.06 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 3h9c h ARG 380 CO -0.04 1.06 0.17 0.28 -1.51 0.00 0.00 179.97 179.94 3h9c h VAL 381 N 0.18 1.14 -0.49 0.20 2.07 -1.31 -0.09 116.25 117.95 3h9c h VAL 381 Ca -0.03 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 3h9c h VAL 381 Cb 1.14 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 3h9c h VAL 381 CO 0.11 0.14 0.15 0.78 0.02 0.00 0.00 177.57 178.76 3h9c h ASN 382 N 0.40 0.71 -0.23 0.57 2.35 -1.39 -0.92 115.58 117.06 3h9c h ASN 382 Ca 0.11 -0.21 -0.07 0.00 -0.55 0.00 0.00 56.30 55.58 3h9c h ASN 382 Cb 0.07 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 3h9c h ASN 382 CO -0.02 0.73 -0.13 0.00 -1.65 0.00 0.00 177.43 176.36 3h9c h ALA 383 N 1.01 0.32 0.04 -0.83 0.00 -0.91 -1.65 119.26 117.24 3h9c h ALA 383 Ca 0.16 -0.31 -0.27 0.00 0.00 0.00 0.00 54.91 54.49 3h9c h ALA 383 Cb 0.28 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3h9c h ALA 383 CO -0.00 0.19 -1.46 -0.44 0.00 0.00 0.00 179.25 177.53 3h9c h ASP 384 N 0.19 0.14 0.00 0.00 3.32 -1.01 -2.65 116.42 116.41 3h9c h ASP 384 Ca 0.05 -0.66 -0.00 0.00 0.02 0.00 0.00 57.03 56.43 3h9c h ASP 384 Cb 0.64 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.14 3h9c h ASP 384 CO 0.04 1.60 -0.04 0.40 -1.72 0.00 0.00 179.24 179.52 3h9c h ILE 385 N -0.66 0.81 0.01 0.35 1.08 -1.32 -2.01 117.51 115.77 3h9c h ILE 385 Ca -0.36 -1.62 -0.00 0.00 -0.39 0.00 0.00 64.86 62.49 3h9c h ILE 385 Cb 1.53 1.55 0.00 0.00 -3.07 0.00 0.00 36.82 36.83 3h9c h ILE 385 CO -0.11 0.28 -0.00 0.58 -0.69 0.00 0.00 178.15 178.20 3h9c h VAL 386 N -1.00 1.33 0.00 1.67 2.07 -1.45 -0.72 116.25 118.16 3h9c h VAL 386 Ca -0.01 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.50 3h9c h VAL 386 Cb 0.48 2.02 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 3h9c h VAL 386 CO -0.00 0.26 -0.90 0.59 0.02 0.00 0.00 177.57 177.54 3h9c n ASN 387 N -4.89 0.64 -0.04 0.57 3.02 -0.63 -2.07 115.26 111.86 3h9c n ASN 387 Ca -0.08 -0.31 -0.08 0.00 -0.03 0.00 0.00 54.58 54.08 3h9c n ASN 387 Cb 0.23 0.69 -0.03 0.00 -0.61 0.00 0.00 39.78 40.06 3h9c n ASN 387 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3h9c n LYS 388 N -1.81 0.31 -0.06 3.52 5.02 -1.00 -4.65 118.16 119.49 3h9c n LYS 388 Ca 0.03 0.12 -0.03 0.00 -2.02 0.00 0.00 58.31 56.42 3h9c n LYS 388 Cb 0.40 -1.03 -0.02 0.00 -0.02 0.00 0.00 35.03 34.36 3h9c n LYS 388 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3h9c h VAL 389 N -0.56 0.19 0.00 -0.18 2.07 -1.39 -3.33 116.25 113.05 3h9c h VAL 389 Ca -0.10 -1.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.20 3h9c h VAL 389 Cb 0.76 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 3h9c h VAL 389 CO -0.06 0.06 -0.31 0.58 0.02 0.00 0.00 177.57 177.87 3h9c h VAL 390 N -1.00 1.21 -0.96 2.57 2.07 -1.26 -2.15 116.25 116.73 3h9c h VAL 390 Ca -0.01 -1.05 0.20 0.00 0.82 0.00 0.00 66.70 66.66 3h9c h VAL 390 Cb 0.22 1.57 -0.08 0.00 -1.52 0.00 0.00 31.29 31.48 3h9c h VAL 390 CO -0.01 0.30 0.61 -1.13 0.02 0.00 0.00 177.57 177.37 3h9c h ASN 391 N 0.00 0.57 0.04 0.57 -0.00 -1.57 0.09 115.58 115.29 3h9c h ASN 391 Ca -0.00 0.07 -0.05 0.00 -0.00 0.00 0.00 56.30 56.31 3h9c h ASN 391 Cb 0.54 -0.04 -0.01 0.00 -0.00 0.00 0.00 38.32 38.81 3h9c h ASN 391 CO 0.04 0.21 -0.15 -0.07 -0.00 0.00 0.00 177.43 177.46 3h9c h LEU 392 N 0.56 0.21 0.01 0.34 3.38 -1.49 -0.59 115.31 117.73 3h9c h LEU 392 Ca 0.53 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.42 3h9c h LEU 392 Cb 1.08 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 3h9c h LEU 392 CO -0.27 0.39 -0.13 0.00 0.09 0.00 0.00 178.44 178.52 3h9c h ALA 393 N 1.64 0.01 0.00 1.53 0.00 -1.21 -3.35 119.26 117.88 3h9c h ALA 393 Ca 0.04 -0.56 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 3h9c h ALA 393 Cb 0.40 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3h9c h ALA 393 CO 0.02 0.07 -0.21 0.66 0.00 0.00 0.00 179.25 179.79 3h9c h SER 394 N -0.96 0.00 1.29 0.00 4.64 -0.88 -0.22 113.55 117.42 3h9c h SER 394 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3h9c h SER 394 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3h9c h SER 394 CO -0.01 0.21 -0.45 0.08 -0.87 0.00 0.00 176.83 175.80 3h9c h ARG 395 N 0.00 0.00 0.00 4.77 0.11 -1.29 -3.39 114.38 114.57 3h9c h ARG 395 Ca -0.00 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 59.95 3h9c h ARG 395 Cb 0.46 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.52 3h9c h ARG 395 CO 0.03 0.00 -1.57 0.09 0.10 0.00 0.00 179.97 178.62 3h9c n ASN 396 N -2.52 2.83 -0.02 0.08 3.02 -0.93 -4.72 115.26 113.00 3h9c n ASN 396 Ca 0.03 0.00 -0.07 0.00 -0.03 0.00 0.00 54.58 54.51 3h9c n ASN 396 Cb 0.49 0.85 0.12 0.00 -0.61 0.00 0.00 39.78 40.63 3h9c n ASN 396 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h9c h ALA 397 N 0.51 0.90 -0.34 5.41 0.00 -1.25 -3.10 119.26 121.40 3h9c h ALA 397 Ca -0.19 -0.41 0.03 0.00 0.00 0.00 0.00 54.91 54.34 3h9c h ALA 397 Cb 1.33 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 3h9c h ALA 397 CO 0.01 0.63 0.15 0.78 0.00 0.00 0.00 179.25 180.82 3h9c h GLY 398 N 1.03 0.44 1.00 0.00 0.00 -1.83 0.08 103.07 103.79 3h9c h GLY 398 Ca 0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 3h9c h GLY 398 CO 0.07 0.07 0.39 0.74 0.00 0.00 0.00 176.54 177.81 3h9c h PHE 399 N 0.32 0.84 -0.22 5.60 0.05 -1.85 0.11 116.94 121.79 3h9c h PHE 399 Ca 0.14 -0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.93 3h9c h PHE 399 Cb 0.07 -0.28 -0.01 0.00 2.00 0.00 0.00 35.95 37.74 3h9c h PHE 399 CO -0.11 0.57 0.15 0.82 -0.18 0.00 0.00 178.31 179.56 3h9c h ILE 400 N 0.87 1.06 -0.38 -0.55 1.08 -1.37 -0.24 117.51 117.97 3h9c h ILE 400 Ca 0.23 -0.10 -0.03 0.00 -0.39 0.00 0.00 64.86 64.57 3h9c h ILE 400 Cb -0.03 0.73 -0.02 0.00 -3.07 0.00 0.00 36.82 34.44 3h9c h ILE 400 CO -0.04 0.05 0.14 0.78 -0.69 0.00 0.00 178.15 178.39 3h9c h ASN 401 N 0.30 0.54 0.60 1.72 2.35 -0.68 -0.90 115.58 119.51 3h9c h ASN 401 Ca 0.08 -0.19 -0.28 0.00 -0.55 0.00 0.00 56.30 55.36 3h9c h ASN 401 Cb -0.03 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 3h9c h ASN 401 CO -0.02 0.58 -1.41 0.11 -1.65 0.00 0.00 177.43 175.04 3h9c h LYS 402 N 0.47 0.16 0.00 0.81 1.57 -0.69 -3.26 116.57 115.63 3h9c h LYS 402 Ca 0.13 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 3h9c h LYS 402 Cb 0.22 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3h9c h LYS 402 CO -0.01 1.01 -1.17 0.54 -0.57 0.00 0.00 179.45 179.26 3h9c n ARG 403 N -3.38 1.44 -0.26 3.15 1.74 -0.11 -4.65 116.66 114.59 3h9c n ARG 403 Ca -0.12 -0.07 0.05 0.00 -0.77 0.00 0.00 57.85 56.95 3h9c n ARG 403 Cb 1.02 -1.20 0.08 0.00 -1.02 0.00 0.00 32.46 31.34 3h9c n ARG 403 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3h9c n PHE 404 N -1.67 0.00 -1.76 -1.55 3.01 -0.77 -4.99 117.46 109.73 3h9c n PHE 404 Ca -0.00 -0.55 -0.19 0.00 1.01 0.00 0.00 57.45 57.71 3h9c n PHE 404 Cb 0.27 -0.10 -0.06 0.00 -0.01 0.00 0.00 39.48 39.57 3h9c n PHE 404 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 3h9c n ASP 405 N -0.80 -5.30 0.00 4.37 8.00 -1.09 -1.40 116.55 120.33 3h9c n ASP 405 Ca 0.09 0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.93 3h9c n ASP 405 Cb 0.66 -4.43 0.00 0.00 -0.02 0.00 0.00 41.12 37.33 3h9c n ASP 405 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h9c n GLY 406 N -0.76 0.67 3.62 0.44 0.00 -0.41 -4.93 105.19 103.82 3h9c n GLY 406 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 3h9c n GLY 406 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h9c s VAL 407 N -2.43 5.03 0.56 1.61 1.01 -0.49 -0.53 120.40 125.15 3h9c s VAL 407 Ca 0.00 0.06 -0.16 0.00 0.00 0.00 0.00 61.98 61.88 3h9c s VAL 407 Cb 0.00 -3.32 -0.05 0.00 0.00 0.00 0.00 36.38 33.00 3h9c s VAL 407 CO 0.00 0.38 1.04 -0.76 0.00 0.00 0.00 175.10 175.75 3h9c s LEU 408 N 0.94 3.57 0.83 3.92 1.43 -0.04 -4.88 118.68 124.45 3h9c s LEU 408 Ca 0.06 1.76 -0.14 0.00 -1.03 0.00 0.00 54.13 54.78 3h9c s LEU 408 Cb -0.13 -4.53 0.02 0.00 0.03 0.00 0.00 46.19 41.58 3h9c s LEU 408 CO 0.03 -0.97 0.68 0.00 0.23 0.00 0.00 176.35 176.32 3h9c n ALA 409 N -1.78 -1.47 0.67 4.21 0.00 -1.26 -2.45 120.51 118.42 3h9c n ALA 409 Ca 0.08 -0.39 0.13 0.00 0.00 0.00 0.00 53.44 53.26 3h9c n ALA 409 Cb 0.53 -1.94 0.41 0.00 0.00 0.00 0.00 19.45 18.45 3h9c n ALA 409 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3h9c n SER 410 N -1.49 0.71 -3.96 0.00 7.64 -1.26 -1.48 113.62 113.78 3h9c n SER 410 Ca 0.10 0.53 -0.09 0.00 1.01 0.00 0.00 58.87 60.42 3h9c n SER 410 Cb 0.51 -0.69 -0.09 0.00 -1.01 0.00 0.00 64.21 62.93 3h9c n SER 410 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3h9c s GLU 411 N -3.09 0.64 0.16 1.43 8.01 -1.26 -4.62 118.70 119.96 3h9c s GLU 411 Ca 0.11 -0.92 -0.31 0.00 0.01 0.00 0.00 54.97 53.86 3h9c s GLU 411 Cb 0.13 0.24 -0.09 0.00 -4.31 0.00 0.00 34.13 30.11 3h9c s GLU 411 CO 0.60 -0.16 1.40 -0.51 0.01 0.00 0.00 175.26 176.60 3h9c s LEU 412 N -2.48 4.38 0.27 1.80 1.43 -1.26 -4.93 118.68 117.88 3h9c s LEU 412 Ca 0.00 2.43 0.01 0.00 -1.03 0.00 0.00 54.13 55.54 3h9c s LEU 412 Cb 0.02 -3.60 0.37 0.00 0.03 0.00 0.00 46.19 43.02 3h9c s LEU 412 CO -0.07 -0.66 1.70 0.00 0.23 0.00 0.00 176.35 177.55 3h9c h ALA 413 N 6.27 1.06 -2.46 4.21 0.00 -1.97 -3.38 119.26 122.99 3h9c h ALA 413 Ca -0.43 -0.35 -0.59 0.00 0.00 0.00 0.00 54.91 53.53 3h9c h ALA 413 Cb 1.21 -0.12 -0.39 0.00 0.00 0.00 0.00 17.79 18.49 3h9c h ALA 413 CO 0.84 0.57 -0.93 0.34 0.00 0.00 0.00 179.25 180.08 3h9c s ASP 414 N -6.81 1.87 0.41 0.00 3.68 -1.26 -4.98 116.67 109.58 3h9c s ASP 414 Ca -0.07 -3.10 0.07 0.00 2.13 0.00 0.00 52.55 51.58 3h9c s ASP 414 Cb 0.14 -0.56 0.86 0.00 -1.45 0.00 0.00 42.92 41.90 3h9c s ASP 414 CO 0.80 -0.17 2.06 -0.65 0.13 0.00 0.00 175.17 177.33 3h9c h PRO 415 N 5.70 0.53 -0.50 4.34 0.11 -2.00 -1.98 132.00 138.20 3h9c h PRO 415 Ca 0.24 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.29 3h9c h PRO 415 Cb 0.90 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.87 3h9c h PRO 415 CO 0.40 0.36 0.20 1.96 -0.21 0.00 0.00 178.00 180.71 3h9c h GLN 416 N 0.54 0.74 -0.62 1.05 4.20 -1.97 -0.64 115.11 118.41 3h9c h GLN 416 Ca 0.15 -0.13 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 3h9c h GLN 416 Cb -0.05 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.58 3h9c h GLN 416 CO -0.03 0.66 0.19 1.25 -0.67 0.00 0.00 178.83 180.22 3h9c h LEU 417 N 0.66 0.92 -0.79 1.46 5.85 -1.88 -1.91 115.31 119.62 3h9c h LEU 417 Ca 0.17 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.71 3h9c h LEU 417 Cb 0.19 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 3h9c h LEU 417 CO -0.01 0.89 0.50 0.22 -0.34 0.00 0.00 178.44 179.70 3h9c h TYR 418 N 0.90 0.94 -0.67 1.25 3.20 -1.04 -1.90 116.97 119.66 3h9c h TYR 418 Ca 0.20 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.06 3h9c h TYR 418 Cb 0.31 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 3h9c h TYR 418 CO 0.02 0.54 0.28 -0.22 -1.64 0.00 0.00 178.16 177.14 3h9c h LYS 419 N 0.98 0.97 -0.84 1.82 3.64 -0.80 -0.95 116.57 121.38 3h9c h LYS 419 Ca 0.32 -0.15 0.09 0.00 -1.27 0.00 0.00 60.65 59.64 3h9c h LYS 419 Cb 0.02 -0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 31.60 3h9c h LYS 419 CO -0.12 0.78 0.49 1.15 -2.27 0.00 0.00 179.45 179.49 3h9c h THR 420 N 0.96 0.92 -0.26 1.00 2.02 -0.57 0.16 112.91 117.15 3h9c h THR 420 Ca 0.23 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 67.06 3h9c h THR 420 Cb 0.16 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.59 3h9c h THR 420 CO -0.02 0.15 -0.07 -0.26 0.37 0.00 0.00 175.52 175.68 3h9c h PHE 421 N 0.82 0.57 0.00 3.16 0.04 -0.79 -3.14 116.94 117.61 3h9c h PHE 421 Ca 0.41 -0.13 -0.12 0.00 2.80 0.00 0.00 57.97 60.93 3h9c h PHE 421 Cb 0.36 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.36 3h9c h PHE 421 CO -0.05 0.73 -0.59 1.79 -0.60 0.00 0.00 178.31 179.59 3h9c h THR 422 N 0.24 1.22 0.00 -1.55 1.35 -0.94 -2.86 112.91 110.37 3h9c h THR 422 Ca 0.06 -2.17 -0.01 0.00 -0.55 0.00 0.00 66.41 63.74 3h9c h THR 422 Cb 0.55 2.24 -0.00 0.00 -1.73 0.00 0.00 68.15 69.21 3h9c h THR 422 CO 0.03 0.58 -0.07 0.44 -0.25 0.00 0.00 175.52 176.25 3h9c h ASP 423 N 0.00 0.00 0.81 5.36 3.45 -0.68 -2.33 116.42 123.03 3h9c h ASP 423 Ca -0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.45 3h9c h ASP 423 Cb 1.20 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.97 3h9c h ASP 423 CO 0.08 0.07 0.00 0.00 -1.57 0.00 0.00 179.24 177.81 3h9c n ALA 424 N -2.24 2.07 -0.35 3.45 0.00 -1.08 -3.91 120.51 118.45 3h9c n ALA 424 Ca -0.02 -0.08 0.01 0.00 0.00 0.00 0.00 53.44 53.35 3h9c n ALA 424 Cb 0.18 -1.38 0.15 0.00 0.00 0.00 0.00 19.45 18.40 3h9c n ALA 424 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h9c h ALA 425 N 2.81 1.30 -0.05 0.00 0.00 -1.57 -1.68 119.26 120.08 3h9c h ALA 425 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3h9c h ALA 425 Cb 0.40 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3h9c h ALA 425 CO 0.00 0.44 0.02 1.49 0.00 0.00 0.00 179.25 181.20 3h9c h GLU 426 N 1.16 0.08 -0.51 0.00 4.81 -1.82 0.35 114.58 118.64 3h9c h GLU 426 Ca 0.40 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.51 3h9c h GLU 426 Cb 0.10 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 3h9c h GLU 426 CO -0.15 0.23 -0.12 -0.24 -0.73 0.00 0.00 179.01 178.00 3h9c h VAL 427 N -0.10 1.27 -0.29 0.32 3.04 -1.77 -0.58 116.25 118.14 3h9c h VAL 427 Ca 0.02 -1.26 -0.06 0.00 -1.01 0.00 0.00 66.70 64.39 3h9c h VAL 427 Cb 0.19 1.00 -0.01 0.00 -2.01 0.00 0.00 31.29 30.46 3h9c h VAL 427 CO -0.00 0.44 -0.05 0.40 -1.01 0.00 0.00 177.57 177.35 3h9c h ILE 428 N 0.85 1.28 -0.87 3.17 2.04 -1.20 -1.21 117.51 121.57 3h9c h ILE 428 Ca 0.13 -1.06 -0.02 0.00 1.00 0.00 0.00 64.86 64.91 3h9c h ILE 428 Cb 0.67 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 38.09 3h9c h ILE 428 CO 0.05 0.34 0.45 1.23 0.00 0.00 0.00 178.15 180.22 3h9c h GLY 429 N 0.31 1.31 1.43 5.37 0.00 -0.84 -0.71 103.07 109.94 3h9c h GLY 429 Ca 0.08 -0.62 -0.03 0.00 0.00 0.00 0.00 47.33 46.75 3h9c h GLY 429 CO 0.03 0.59 0.16 -2.09 0.00 0.00 0.00 176.54 175.23 3h9c h GLU 430 N 1.22 0.73 -0.39 4.80 4.57 -0.93 0.57 114.58 125.15 3h9c h GLU 430 Ca 0.30 -0.12 -0.10 0.00 -1.18 0.00 0.00 59.36 58.27 3h9c h GLU 430 Cb 0.07 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.52 3h9c h GLU 430 CO -0.04 0.63 -0.14 0.00 -1.18 0.00 0.00 179.01 178.27 3h9c h ALA 431 N 1.47 0.54 -0.45 2.92 0.00 -0.34 -0.77 119.26 122.62 3h9c h ALA 431 Ca 0.17 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h9c h ALA 431 Cb 0.20 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3h9c h ALA 431 CO -0.01 0.44 0.28 -1.49 0.00 0.00 0.00 179.25 178.47 3h9c h TRP 432 N 0.58 0.59 -0.64 0.00 -0.00 -0.77 -0.18 115.95 115.53 3h9c h TRP 432 Ca 0.09 0.00 0.03 0.00 -0.00 0.00 0.00 58.89 59.01 3h9c h TRP 432 Cb 0.67 -0.19 -0.04 0.00 -0.00 0.00 0.00 29.16 29.60 3h9c h TRP 432 CO 0.05 0.41 0.40 1.49 -0.00 0.00 0.00 178.44 180.79 3h9c h GLU 433 N 0.60 0.76 -0.08 0.49 4.57 -0.69 -2.26 114.58 117.97 3h9c h GLU 433 Ca 0.16 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 3h9c h GLU 433 Cb -0.01 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.41 3h9c h GLU 433 CO -0.03 0.50 0.00 -1.13 -1.18 0.00 0.00 179.01 177.17 3h9c n SER 434 N -4.71 0.99 -0.59 1.04 3.41 -0.31 -4.90 113.62 108.55 3h9c n SER 434 Ca 0.06 -1.51 -0.08 0.00 -0.26 0.00 0.00 58.87 57.08 3h9c n SER 434 Cb 0.08 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 63.95 3h9c n SER 434 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h9c n ARG 435 N -0.16 -0.73 -1.94 4.33 1.74 -0.85 -4.64 116.66 114.40 3h9c n ARG 435 Ca 0.17 0.71 -0.41 0.00 -0.77 0.00 0.00 57.85 57.55 3h9c n ARG 435 Cb 0.24 -4.58 -0.00 0.00 -1.02 0.00 0.00 32.46 27.09 3h9c n ARG 435 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3h9c n GLU 436 N -2.38 3.67 -0.22 5.56 -0.58 -0.13 -2.79 120.64 123.78 3h9c n GLU 436 Ca -0.08 -3.07 -0.08 0.00 -0.42 0.00 0.00 57.16 53.52 3h9c n GLU 436 Cb 0.30 -2.93 0.03 0.00 -0.57 0.00 0.00 31.44 28.28 3h9c n GLU 436 CO 0.00 0.00 0.00 0.74 -0.48 0.00 0.00 177.13 177.39 3h9c h PHE 437 N 5.42 0.95 -0.92 -0.32 0.05 -1.73 -1.74 116.94 118.65 3h9c h PHE 437 Ca 0.59 -0.09 0.01 0.00 3.82 0.00 0.00 57.97 62.30 3h9c h PHE 437 Cb 0.50 -0.28 -0.05 0.00 2.00 0.00 0.00 35.95 38.13 3h9c h PHE 437 CO 1.49 0.77 0.60 0.78 -0.18 0.00 0.00 178.31 181.77 3h9c h GLY 438 N 0.85 1.31 0.91 -1.45 0.00 -0.71 -0.85 103.07 103.13 3h9c h GLY 438 Ca 0.20 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 3h9c h GLY 438 CO -0.01 0.49 0.10 1.70 0.00 0.00 0.00 176.54 178.83 3h9c h LYS 439 N 1.26 0.34 -0.31 4.80 3.64 -1.71 -0.85 116.57 123.74 3h9c h LYS 439 Ca 0.34 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.71 3h9c h LYS 439 Cb -0.12 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.59 3h9c h LYS 439 CO -0.07 0.36 0.02 0.00 -2.27 0.00 0.00 179.45 177.49 3h9c h ALA 440 N 0.96 0.30 -0.72 5.00 0.00 -0.78 -1.04 119.26 122.97 3h9c h ALA 440 Ca 0.08 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 3h9c h ALA 440 Cb 0.14 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3h9c h ALA 440 CO -0.01 -0.39 0.30 0.28 0.00 0.00 0.00 179.25 179.44 3h9c h VAL 441 N 0.12 1.25 -0.62 0.00 2.07 -1.03 -0.47 116.25 117.56 3h9c h VAL 441 Ca 0.15 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.92 3h9c h VAL 441 Cb 0.19 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 3h9c h VAL 441 CO -0.23 0.31 0.41 0.03 0.02 0.00 0.00 177.57 178.10 3h9c h ARG 442 N 1.03 0.81 -0.54 1.57 3.08 -0.79 0.90 114.38 120.44 3h9c h ARG 442 Ca 0.24 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.20 3h9c h ARG 442 Cb 0.19 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3h9c h ARG 442 CO -0.02 0.54 0.17 1.49 -1.07 0.00 0.00 179.97 181.08 3h9c h GLU 443 N 0.83 0.84 -0.50 0.04 4.57 -0.81 -0.76 114.58 118.78 3h9c h GLU 443 Ca 0.23 -0.18 -0.06 0.00 -1.18 0.00 0.00 59.36 58.18 3h9c h GLU 443 Cb -0.09 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.36 3h9c h GLU 443 CO -0.05 0.76 0.09 0.82 -1.18 0.00 0.00 179.01 179.45 3h9c h ILE 444 N 0.75 1.25 -0.00 2.32 2.04 -0.68 -2.17 117.51 121.01 3h9c h ILE 444 Ca 0.17 -0.90 -0.11 0.00 1.00 0.00 0.00 64.86 65.02 3h9c h ILE 444 Cb 0.27 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 3h9c h ILE 444 CO -0.01 0.32 -0.53 0.24 0.00 0.00 0.00 178.15 178.17 3h9c h MET 445 N 0.70 0.00 -0.71 2.37 2.86 -0.69 -0.18 114.93 119.28 3h9c h MET 445 Ca 0.15 -0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.72 3h9c h MET 445 Cb 0.38 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.01 3h9c h MET 445 CO 0.01 0.54 0.18 0.00 1.06 0.00 0.00 176.91 178.69 3h9c h ALA 446 N 1.46 0.93 -0.60 6.32 0.00 -0.96 -0.11 119.26 126.30 3h9c h ALA 446 Ca -0.01 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 3h9c h ALA 446 Cb 0.94 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 3h9c h ALA 446 CO 0.07 0.65 0.23 -0.07 0.00 0.00 0.00 179.25 180.12 3h9c h LEU 447 N 1.06 0.85 -1.22 0.00 3.38 -0.88 -1.88 115.31 116.61 3h9c h LEU 447 Ca 0.22 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3h9c h LEU 447 Cb 0.36 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 3h9c h LEU 447 CO 0.00 0.80 0.45 0.00 0.09 0.00 0.00 178.44 179.78 3h9c h ALA 448 N 1.08 1.42 -0.59 1.53 0.00 -0.60 -0.34 119.26 121.76 3h9c h ALA 448 Ca 0.20 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3h9c h ALA 448 Cb 0.23 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3h9c h ALA 448 CO -0.01 0.51 0.30 -0.44 0.00 0.00 0.00 179.25 179.61 3h9c h ASP 449 N 1.00 0.76 -0.84 0.00 3.45 -0.66 -1.04 116.42 119.09 3h9c h ASP 449 Ca 0.26 -0.11 -0.02 0.00 0.43 0.00 0.00 57.03 57.59 3h9c h ASP 449 Cb -0.06 -0.19 -0.04 0.00 -0.56 0.00 0.00 39.33 38.47 3h9c h ASP 449 CO -0.05 0.66 0.46 -0.07 -1.57 0.00 0.00 179.24 178.66 3h9c h LEU 450 N 0.81 1.06 -0.43 1.55 3.38 -0.52 -0.38 115.31 120.77 3h9c h LEU 450 Ca 0.21 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 3h9c h LEU 450 Cb 0.08 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3h9c h LEU 450 CO -0.03 0.86 0.05 0.00 0.09 0.00 0.00 178.44 179.41 3h9c h ALA 451 N 1.31 0.58 -0.03 1.53 0.00 -0.67 -0.67 119.26 121.31 3h9c h ALA 451 Ca 0.30 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 3h9c h ALA 451 Cb 0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3h9c h ALA 451 CO -0.05 0.32 -0.53 -0.91 0.00 0.00 0.00 179.25 178.08 3h9c h ASN 452 N 0.58 0.10 -0.60 0.00 2.35 -0.98 -1.64 115.58 115.40 3h9c h ASN 452 Ca 0.13 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.79 3h9c h ASN 452 Cb 0.41 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.72 3h9c h ASN 452 CO 0.01 0.62 0.23 -0.09 -1.65 0.00 0.00 177.43 176.55 3h9c h ARG 453 N 0.07 0.90 -0.04 0.81 2.43 -0.90 -0.79 114.38 116.87 3h9c h ARG 453 Ca -0.00 -0.17 0.01 0.00 -0.81 0.00 0.00 59.98 59.01 3h9c h ARG 453 Cb 0.97 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 3h9c h ARG 453 CO 0.07 0.78 -0.04 -0.92 -1.51 0.00 0.00 179.97 178.35 3h9c h TYR 454 N 0.83 -0.09 -0.61 2.20 3.20 -0.69 0.35 116.97 122.16 3h9c h TYR 454 Ca 0.20 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.08 3h9c h TYR 454 Cb 0.22 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.51 3h9c h TYR 454 CO 0.01 -0.06 0.40 0.28 -1.64 0.00 0.00 178.16 177.15 3h9c h VAL 455 N -0.05 1.14 -0.92 1.81 2.07 -1.11 -1.52 116.25 117.67 3h9c h VAL 455 Ca 0.03 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.29 3h9c h VAL 455 Cb 0.09 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.08 3h9c h VAL 455 CO -0.07 0.15 0.61 0.44 0.02 0.00 0.00 177.57 178.71 3h9c h ASP 456 N 0.81 1.04 -0.17 0.57 3.32 -0.91 0.69 116.42 121.77 3h9c h ASP 456 Ca 0.23 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 3h9c h ASP 456 Cb -0.08 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.20 3h9c h ASP 456 CO -0.06 0.75 0.04 -0.33 -1.72 0.00 0.00 179.24 177.92 3h9c h GLU 457 N 1.23 0.36 0.00 3.56 5.08 -0.33 -2.76 114.58 121.71 3h9c h GLU 457 Ca 0.35 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.61 3h9c h GLU 457 Cb -0.11 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 3h9c h GLU 457 CO -0.09 0.35 -0.97 1.96 -1.00 0.00 0.00 179.01 179.27 3h9c h GLN 458 N 0.36 0.00 -6.01 2.33 1.08 -0.58 -3.49 115.11 108.80 3h9c h GLN 458 Ca 0.09 0.00 -0.36 0.00 -1.45 0.00 0.00 58.65 56.93 3h9c h GLN 458 Cb 0.17 0.00 0.10 0.00 -0.05 0.00 0.00 27.48 27.70 3h9c h GLN 458 CO -0.00 0.10 -0.84 0.00 -0.95 0.00 0.00 178.83 177.14 3h9c n ALA 459 N -2.23 -2.55 0.29 3.87 0.00 0.17 -4.69 120.51 115.36 3h9c n ALA 459 Ca -0.02 -0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.41 3h9c n ALA 459 Cb 0.63 -4.07 0.83 0.00 0.00 0.00 0.00 19.45 16.84 3h9c n ALA 459 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3h9c h PRO 460 N -1.40 0.00 0.00 0.00 0.13 -1.90 0.39 132.00 129.22 3h9c h PRO 460 Ca -0.59 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 3h9c h PRO 460 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 3h9c h PRO 460 CO 0.45 0.01 0.00 0.11 -0.23 0.00 0.00 178.00 178.34 3h9c h TRP 461 N 0.00 0.00 0.00 1.56 0.09 -1.94 -0.07 115.95 115.59 3h9c h TRP 461 Ca -0.00 0.00 -0.25 0.00 0.09 0.00 0.00 58.89 58.73 3h9c h TRP 461 Cb 0.02 0.00 -0.04 0.00 0.08 0.00 0.00 29.16 29.22 3h9c h TRP 461 CO 0.00 0.00 -1.38 0.28 0.09 0.00 0.00 178.44 177.43 3h9c n VAL 462 N -2.69 1.53 -0.28 0.12 0.31 0.02 -4.39 118.33 112.95 3h9c n VAL 462 Ca 0.01 -0.06 0.11 0.00 -0.01 0.00 0.00 64.34 64.39 3h9c n VAL 462 Cb 0.24 -2.04 0.35 0.00 -0.91 0.00 0.00 33.84 31.48 3h9c n VAL 462 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3h9c h VAL 463 N -1.00 0.86 0.00 2.52 2.07 -1.09 -2.20 116.25 117.42 3h9c h VAL 463 Ca -0.37 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 3h9c h VAL 463 Cb 1.31 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3h9c h VAL 463 CO -0.23 0.14 -0.06 0.00 0.02 0.00 0.00 177.57 177.44 3h9c h ALA 464 N 1.59 1.39 -0.02 1.67 0.00 -1.21 -2.37 119.26 120.32 3h9c h ALA 464 Ca 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3h9c h ALA 464 Cb 0.66 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3h9c h ALA 464 CO -0.21 0.07 -0.29 0.36 0.00 0.00 0.00 179.25 179.19 3h9c n LYS 465 N -3.73 1.55 -3.68 0.00 2.85 -0.83 -4.94 118.16 109.38 3h9c n LYS 465 Ca -0.02 -1.25 -0.35 0.00 -1.05 0.00 0.00 58.31 55.63 3h9c n LYS 465 Cb 0.16 -1.47 -0.08 0.00 -0.65 0.00 0.00 35.03 32.99 3h9c n LYS 465 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 3h9c s GLN 466 N -2.31 4.20 0.28 -1.58 -0.21 -0.89 -5.04 119.66 114.12 3h9c s GLN 466 Ca 0.23 -0.14 -0.30 0.00 0.02 0.00 0.00 55.36 55.17 3h9c s GLN 466 Cb 0.19 -3.42 -0.12 0.00 1.00 0.00 0.00 33.01 30.66 3h9c s GLN 466 CO 0.47 0.29 1.56 -1.91 -2.12 0.00 0.00 175.29 173.58 3h9c n GLU 467 N 3.51 2.57 -0.97 2.91 4.07 -1.26 -2.76 120.64 128.70 3h9c n GLU 467 Ca -0.15 0.91 0.00 0.00 -0.06 0.00 0.00 57.16 57.86 3h9c n GLU 467 Cb 0.52 -2.67 0.00 0.00 -0.06 0.00 0.00 31.44 29.23 3h9c n GLU 467 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3h9c n GLY 468 N 2.13 0.60 2.05 8.31 0.00 -1.26 -4.91 105.19 112.11 3h9c n GLY 468 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 3h9c n GLY 468 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h9c n ARG 469 N -2.28 3.48 -0.11 1.61 1.74 -1.11 -4.61 116.66 115.38 3h9c n ARG 469 Ca 0.00 -3.09 -0.05 0.00 -0.77 0.00 0.00 57.85 53.94 3h9c n ARG 469 Cb 0.04 -2.21 0.02 0.00 -1.02 0.00 0.00 32.46 29.29 3h9c n ARG 469 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3h9c h ASP 470 N 2.38 -0.12 -0.75 0.55 3.45 -1.89 -1.43 116.42 118.62 3h9c h ASP 470 Ca 0.33 0.08 -0.00 0.00 0.43 0.00 0.00 57.03 57.87 3h9c h ASP 470 Cb 2.44 0.14 -0.04 0.00 -0.56 0.00 0.00 39.33 41.31 3h9c h ASP 470 CO 0.81 -0.02 0.46 0.00 -1.57 0.00 0.00 179.24 178.92 3h9c h ALA 471 N 1.31 0.96 -0.58 3.45 0.00 -2.00 -0.89 119.26 121.51 3h9c h ALA 471 Ca 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3h9c h ALA 471 Cb 0.24 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3h9c h ALA 471 CO -0.29 0.42 0.33 -0.44 0.00 0.00 0.00 179.25 179.26 3h9c h ASP 472 N 1.03 0.71 -0.27 0.00 3.45 -1.78 -1.16 116.42 118.40 3h9c h ASP 472 Ca 0.27 -0.08 -0.02 0.00 0.43 0.00 0.00 57.03 57.63 3h9c h ASP 472 Cb -0.05 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.52 3h9c h ASP 472 CO -0.05 0.58 0.10 0.25 -1.57 0.00 0.00 179.24 178.56 3h9c h LEU 473 N 0.78 0.38 -1.06 1.55 5.85 -0.57 -0.78 115.31 121.46 3h9c h LEU 473 Ca 0.20 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.76 3h9c h LEU 473 Cb 0.02 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 3h9c h LEU 473 CO -0.03 0.45 0.62 -0.61 -0.34 0.00 0.00 178.44 178.53 3h9c h GLN 474 N 0.29 1.25 -0.01 1.25 4.15 -1.02 -1.42 115.11 119.60 3h9c h GLN 474 Ca 0.09 -0.08 -0.00 0.00 0.77 0.00 0.00 58.65 59.43 3h9c h GLN 474 Cb 0.19 -0.28 -0.00 0.00 0.21 0.00 0.00 27.48 27.60 3h9c h GLN 474 CO -0.01 0.83 0.00 0.00 -1.93 0.00 0.00 178.83 177.73 3h9c h ALA 475 N 1.40 0.01 -0.02 3.38 0.00 -0.72 -0.93 119.26 122.39 3h9c h ALA 475 Ca 0.34 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 3h9c h ALA 475 Cb -0.14 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3h9c h ALA 475 CO -0.07 -0.42 0.01 0.82 0.00 0.00 0.00 179.25 179.59 3h9c h ILE 476 N -0.14 1.04 -0.37 0.00 2.04 -0.93 -1.49 117.51 117.65 3h9c h ILE 476 Ca 0.00 -0.10 -0.11 0.00 1.00 0.00 0.00 64.86 65.65 3h9c h ILE 476 Cb 0.15 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 3h9c h ILE 476 CO -0.00 0.03 -0.22 0.00 0.00 0.00 0.00 178.15 177.96 3h9c h SER 478 N 0.63 0.93 -0.27 0.00 0.02 -1.06 -1.92 113.55 111.87 3h9c h SER 478 Ca 0.09 -0.26 -0.01 0.00 -0.84 0.00 0.00 61.79 60.77 3h9c h SER 478 Cb 0.71 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 3h9c h SER 478 CO 0.05 1.00 0.15 -0.03 -1.14 0.00 0.00 176.83 176.86 3h9c h MET 479 N 0.86 0.38 -0.81 3.45 -1.53 -0.83 -0.62 114.93 115.83 3h9c h MET 479 Ca 0.15 -0.05 0.07 0.00 -3.44 0.00 0.00 59.70 56.44 3h9c h MET 479 Cb 0.56 -0.07 -0.06 0.00 -0.55 0.00 0.00 31.60 31.47 3h9c h MET 479 CO 0.03 0.34 0.48 0.78 0.14 0.00 0.00 176.91 178.68 3h9c h GLY 480 N 0.32 1.22 1.34 1.39 0.00 -1.10 -1.06 103.07 105.17 3h9c h GLY 480 Ca 0.10 -0.34 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 3h9c h GLY 480 CO -0.01 0.21 -0.16 -2.22 0.00 0.00 0.00 176.54 174.36 3h9c h ILE 481 N 0.87 1.26 -0.43 2.60 2.04 -1.00 -1.14 117.51 121.70 3h9c h ILE 481 Ca 0.36 -1.24 -0.07 0.00 1.00 0.00 0.00 64.86 64.91 3h9c h ILE 481 Cb 0.22 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 3h9c h ILE 481 CO -0.19 0.42 -0.03 0.78 0.00 0.00 0.00 178.15 179.13 3h9c h ASN 482 N 0.69 0.69 -0.55 1.72 2.35 -0.58 -0.21 115.58 119.70 3h9c h ASN 482 Ca 0.11 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.61 3h9c h ASN 482 Cb 0.65 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.81 3h9c h ASN 482 CO 0.05 0.78 0.02 -0.07 -1.65 0.00 0.00 177.43 176.55 3h9c h LEU 483 N 0.67 0.96 -0.55 1.61 3.38 -0.84 -2.47 115.31 118.07 3h9c h LEU 483 Ca 0.13 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.87 3h9c h LEU 483 Cb 0.45 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 3h9c h LEU 483 CO 0.02 1.00 0.35 0.15 0.09 0.00 0.00 178.44 180.05 3h9c h PHE 484 N 0.91 0.65 -0.51 1.13 3.57 -0.81 -1.28 116.94 120.61 3h9c h PHE 484 Ca 0.17 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.78 3h9c h PHE 484 Cb 0.50 -0.22 -0.07 0.00 2.79 0.00 0.00 35.95 38.95 3h9c h PHE 484 CO 0.03 0.39 0.10 -0.09 -2.23 0.00 0.00 178.31 176.51 3h9c h ARG 485 N 0.70 0.23 -0.16 1.11 1.12 -0.72 -0.15 114.38 116.51 3h9c h ARG 485 Ca 0.21 -0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 59.05 3h9c h ARG 485 Cb -0.03 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 29.87 3h9c h ARG 485 CO -0.07 0.15 0.04 0.28 -3.11 0.00 0.00 179.97 177.26 3h9c h VAL 486 N 0.23 1.19 -0.84 0.20 2.07 -1.05 -2.32 116.25 115.74 3h9c h VAL 486 Ca 0.26 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 3h9c h VAL 486 Cb 0.35 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 3h9c h VAL 486 CO -0.34 0.18 0.49 -0.07 0.02 0.00 0.00 177.57 177.86 3h9c h LEU 487 N 0.06 1.03 -1.58 2.57 3.38 -0.84 -1.52 115.31 118.41 3h9c h LEU 487 Ca 0.05 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3h9c h LEU 487 Cb 0.25 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3h9c h LEU 487 CO -0.00 0.81 -0.19 0.24 0.09 0.00 0.00 178.44 179.38 3h9c h MET 488 N 1.17 0.00 -0.19 1.13 2.86 -0.99 -1.27 114.93 117.64 3h9c h MET 488 Ca 0.30 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.87 3h9c h MET 488 Cb -0.02 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 3h9c h MET 488 CO -0.05 0.19 -0.14 1.15 1.06 0.00 0.00 176.91 179.12 3h9c h THR 489 N 0.00 1.32 0.00 2.22 2.02 -0.72 -0.62 112.91 117.14 3h9c h THR 489 Ca -0.00 -1.26 -0.05 0.00 0.77 0.00 0.00 66.41 65.87 3h9c h THR 489 Cb 0.51 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.65 3h9c h THR 489 CO 0.03 0.38 -0.22 1.88 0.37 0.00 0.00 175.52 177.96 3h9c h TYR 490 N 0.10 0.00 -0.02 3.16 0.99 -1.00 -2.57 116.97 117.64 3h9c h TYR 490 Ca 0.04 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.77 3h9c h TYR 490 Cb 0.66 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.39 3h9c h TYR 490 CO 0.07 0.22 -0.12 1.28 -0.00 0.00 0.00 178.16 179.61 3h9c n LEU 491 N -4.21 1.72 -0.34 3.88 4.77 -0.51 -4.50 117.00 117.81 3h9c n LEU 491 Ca -0.02 -0.56 0.05 0.00 -0.03 0.00 0.00 56.01 55.44 3h9c n LEU 491 Cb 0.28 -0.03 0.20 0.00 -2.33 0.00 0.00 43.42 41.54 3h9c n LEU 491 CO 0.36 0.30 1.21 0.50 -1.33 0.00 0.00 177.39 178.43 3h9c h LYS 492 N 2.50 0.93 0.00 3.23 3.64 -0.68 0.27 116.57 126.47 3h9c h LYS 492 Ca 0.00 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 3h9c h LYS 492 Cb 0.63 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 3h9c h LYS 492 CO 0.00 0.62 -0.07 -1.35 -2.27 0.00 0.00 179.45 176.38 3h9c h PRO 493 N 0.96 0.00 0.11 1.90 0.11 -1.80 -3.25 132.00 130.04 3h9c h PRO 493 Ca 0.45 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 66.21 3h9c h PRO 493 Cb 0.38 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.48 3h9c h PRO 493 CO -0.24 0.07 -1.90 0.28 -0.21 0.00 0.00 178.00 176.00 3h9c h VAL 494 N 0.00 0.72 -2.38 3.15 2.07 -1.29 -3.39 116.25 115.14 3h9c h VAL 494 Ca -0.00 -2.44 -0.59 0.00 0.82 0.00 0.00 66.70 64.48 3h9c h VAL 494 Cb 0.23 2.54 -0.41 0.00 -1.52 0.00 0.00 31.29 32.13 3h9c h VAL 494 CO 0.01 0.83 -0.75 0.18 0.02 0.00 0.00 177.57 177.86 3h9c n LEU 495 N -3.43 2.29 -0.28 2.57 4.77 -0.70 -4.54 117.00 117.69 3h9c n LEU 495 Ca -0.28 -5.10 -0.03 0.00 -0.03 0.00 0.00 56.01 50.57 3h9c n LEU 495 Cb 1.05 -0.26 0.13 0.00 -2.33 0.00 0.00 43.42 42.01 3h9c n LEU 495 CO 0.45 1.97 1.13 -0.65 -1.33 0.00 0.00 177.39 178.95 3h9c h PRO 496 N 4.59 1.14 -0.01 3.23 0.11 -1.85 -0.44 132.00 138.77 3h9c h PRO 496 Ca 0.17 -0.15 -0.11 0.00 0.11 0.00 0.00 66.00 66.01 3h9c h PRO 496 Cb 0.76 -0.21 0.01 0.00 0.11 0.00 0.00 31.00 31.67 3h9c h PRO 496 CO 0.67 0.86 -0.44 0.87 -0.21 0.00 0.00 178.00 179.76 3h9c h LYS 497 N 1.14 0.31 -0.93 1.05 1.79 -1.94 -1.67 116.57 116.33 3h9c h LYS 497 Ca 0.28 -0.32 0.08 0.00 -2.18 0.00 0.00 60.65 58.51 3h9c h LYS 497 Cb 0.08 0.09 -0.07 0.00 -1.58 0.00 0.00 32.23 30.76 3h9c h LYS 497 CO -0.04 1.01 0.60 1.25 -1.08 0.00 0.00 179.45 181.19 3h9c h LEU 498 N -0.26 0.89 -0.64 2.94 5.85 -1.90 -1.61 115.31 120.58 3h9c h LEU 498 Ca -0.05 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3h9c h LEU 498 Cb 1.16 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 3h9c h LEU 498 CO 0.09 0.54 0.41 0.74 -0.34 0.00 0.00 178.44 179.88 3h9c h THR 499 N 0.99 1.17 -0.73 1.05 2.02 -0.93 0.12 112.91 116.60 3h9c h THR 499 Ca 0.42 -0.33 0.01 0.00 0.77 0.00 0.00 66.41 67.28 3h9c h THR 499 Cb 0.31 0.25 -0.04 0.00 -1.74 0.00 0.00 68.15 66.92 3h9c h THR 499 CO -0.18 0.17 0.48 -0.33 0.37 0.00 0.00 175.52 176.03 3h9c h GLU 500 N 0.87 0.94 -0.53 6.66 5.08 -0.49 0.12 114.58 127.22 3h9c h GLU 500 Ca 0.23 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.44 3h9c h GLU 500 Cb -0.08 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 28.94 3h9c h GLU 500 CO -0.05 0.62 -0.04 0.00 -1.00 0.00 0.00 179.01 178.54 3h9c h ARG 501 N 0.97 0.94 -0.73 2.33 3.08 -0.75 -1.41 114.38 118.81 3h9c h ARG 501 Ca 0.28 -0.30 -0.06 0.00 0.07 0.00 0.00 59.98 59.97 3h9c h ARG 501 Cb -0.08 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 3h9c h ARG 501 CO -0.07 0.96 0.24 0.00 -1.07 0.00 0.00 179.97 180.02 3h9c h ALA 502 N 1.09 0.96 -0.44 0.04 0.00 -0.22 -1.89 119.26 118.80 3h9c h ALA 502 Ca 0.15 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 3h9c h ALA 502 Cb 0.56 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3h9c h ALA 502 CO 0.03 0.63 -0.10 0.93 0.00 0.00 0.00 179.25 180.75 3h9c h GLU 503 N 1.08 0.78 -0.44 0.00 5.08 -0.46 0.04 114.58 120.67 3h9c h GLU 503 Ca 0.24 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 3h9c h GLU 503 Cb 0.29 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 3h9c h GLU 503 CO -0.01 0.85 0.19 0.00 -1.00 0.00 0.00 179.01 179.04 3h9c h ALA 504 N 1.18 0.57 -0.21 3.43 0.00 -1.05 -0.49 119.26 122.69 3h9c h ALA 504 Ca 0.12 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h9c h ALA 504 Cb 0.57 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3h9c h ALA 504 CO 0.04 0.16 0.13 0.35 0.00 0.00 0.00 179.25 179.92 3h9c h PHE 505 N 0.57 0.28 -0.00 0.00 3.57 -1.05 -3.06 116.94 117.25 3h9c h PHE 505 Ca 0.15 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.65 3h9c h PHE 505 Cb 0.16 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.81 3h9c h PHE 505 CO -0.00 0.22 -0.02 1.28 -2.23 0.00 0.00 178.31 177.55 3h9c n LEU 506 N -4.91 0.03 -3.51 0.59 4.77 -0.02 -0.69 117.00 113.25 3h9c n LEU 506 Ca -0.03 0.44 -0.25 0.00 -0.03 0.00 0.00 56.01 56.13 3h9c n LEU 506 Cb 0.05 -0.45 0.04 0.00 -2.33 0.00 0.00 43.42 40.73 3h9c n LEU 506 CO 0.34 0.01 0.11 0.59 -1.33 0.00 0.00 177.39 177.11 3h9c n ASN 507 N -1.46 -5.60 -3.55 -1.43 3.02 -0.22 -4.77 115.26 101.26 3h9c n ASN 507 Ca 0.08 -0.52 -0.17 0.00 -0.03 0.00 0.00 54.58 53.93 3h9c n ASN 507 Cb 0.32 -4.47 -0.06 0.00 -0.61 0.00 0.00 39.78 34.96 3h9c n ASN 507 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3h9c s THR 508 N -3.23 0.00 0.28 3.41 -1.32 -1.03 -5.07 115.64 108.68 3h9c s THR 508 Ca 0.52 -0.03 -0.29 0.00 -1.21 0.00 0.00 61.69 60.67 3h9c s THR 508 Cb -0.24 -0.97 -0.10 0.00 -1.51 0.00 0.00 72.50 69.68 3h9c s THR 508 CO 0.64 -0.02 1.08 -0.70 -2.21 0.00 0.00 174.62 173.42 3h9c s GLU 509 N -1.02 4.66 -0.31 7.08 2.12 -1.26 -4.49 118.70 125.47 3h9c s GLU 509 Ca -0.10 1.77 -0.21 0.00 0.36 0.00 0.00 54.97 56.80 3h9c s GLU 509 Cb -0.01 -3.19 -0.01 0.00 0.26 0.00 0.00 34.13 31.19 3h9c s GLU 509 CO 0.09 0.24 0.65 -0.51 -0.54 0.00 0.00 175.26 175.18 3h9c s LEU 510 N -1.44 4.15 0.18 2.70 1.43 -1.26 -5.05 118.68 119.39 3h9c s LEU 510 Ca 0.44 0.41 0.09 0.00 -1.03 0.00 0.00 54.13 54.04 3h9c s LEU 510 Cb -0.31 -2.84 -0.04 0.00 0.03 0.00 0.00 46.19 43.03 3h9c s LEU 510 CO 0.40 -0.51 -0.08 0.42 0.23 0.00 0.00 176.35 176.81 3h9c s THR 511 N 2.66 3.29 0.17 5.49 -4.23 -1.26 -5.03 115.64 116.73 3h9c s THR 511 Ca 0.26 -1.62 -0.14 0.00 -1.18 0.00 0.00 61.69 59.01 3h9c s THR 511 Cb -0.15 -2.64 0.06 0.00 1.34 0.00 0.00 72.50 71.11 3h9c s THR 511 CO 0.12 -0.11 1.77 -0.25 -0.54 0.00 0.00 174.62 175.61 3h9c h TRP 512 N 2.85 0.37 0.00 3.99 2.91 -1.93 -2.43 115.95 121.71 3h9c h TRP 512 Ca -0.47 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 59.56 3h9c h TRP 512 Cb 1.20 -0.10 -0.00 0.00 -0.51 0.00 0.00 29.16 29.75 3h9c h TRP 512 CO 0.65 0.17 -0.08 -0.44 -1.03 0.00 0.00 178.44 177.70 3h9c h ASP 513 N 0.41 0.00 0.08 2.65 3.45 -1.96 -3.32 116.42 117.72 3h9c h ASP 513 Ca 0.20 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.65 3h9c h ASP 513 Cb 0.14 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 38.91 3h9c h ASP 513 CO -0.16 0.08 -0.03 1.23 -1.57 0.00 0.00 179.24 178.79 3h9c h GLY 514 N 3.45 0.00 2.00 2.75 0.00 -1.83 -2.38 103.07 107.06 3h9c h GLY 514 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h9c h GLY 514 CO 0.01 0.00 0.00 0.16 0.00 0.00 0.00 176.54 176.71 3h9c h ILE 515 N 0.00 0.00 0.00 2.60 3.07 -1.66 -1.01 117.51 120.51 3h9c h ILE 515 Ca -0.00 -0.05 0.00 0.00 1.55 0.00 0.00 64.86 66.36 3h9c h ILE 515 Cb 0.08 0.76 0.00 0.00 -0.27 0.00 0.00 36.82 37.39 3h9c h ILE 515 CO 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.10 3h9c n GLN 516 N -2.59 0.07 -3.92 0.16 1.13 -0.90 -4.25 117.38 107.08 3h9c n GLN 516 Ca -0.02 0.22 -0.33 0.00 -1.94 0.00 0.00 57.00 54.93 3h9c n GLN 516 Cb 0.08 -1.61 -0.14 0.00 0.11 0.00 0.00 30.24 28.68 3h9c n GLN 516 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3h9c s GLN 517 N -3.07 1.79 0.91 -1.09 1.11 -0.38 -5.12 119.66 113.81 3h9c s GLN 517 Ca 0.09 -1.79 -0.11 0.00 0.01 0.00 0.00 55.36 53.56 3h9c s GLN 517 Cb 0.12 -3.34 0.14 0.00 -1.01 0.00 0.00 33.01 28.92 3h9c s GLN 517 CO 0.39 -0.95 1.09 -1.25 0.01 0.00 0.00 175.29 174.58 3h9c s PRO 518 N 1.03 1.11 -0.39 2.91 0.04 -1.26 -4.94 135.00 133.50 3h9c s PRO 518 Ca 0.08 0.90 -0.27 0.00 0.04 0.00 0.00 61.00 61.75 3h9c s PRO 518 Cb -0.21 -1.79 0.02 0.00 0.04 0.00 0.00 34.50 32.57 3h9c s PRO 518 CO -0.06 -2.36 0.98 -0.51 0.04 0.00 0.00 177.00 175.09 3h9c s LEU 519 N -6.32 3.93 -0.03 -3.56 1.43 -1.26 -5.02 118.68 107.85 3h9c s LEU 519 Ca 0.64 0.59 0.04 0.00 -1.03 0.00 0.00 54.13 54.37 3h9c s LEU 519 Cb -0.19 -3.35 -0.00 0.00 0.03 0.00 0.00 46.19 42.68 3h9c s LEU 519 CO 0.58 -0.94 -0.14 -0.76 0.23 0.00 0.00 176.35 175.31 3h9c s LEU 520 N 3.69 1.88 -1.34 1.79 1.43 -1.26 -4.78 118.68 120.08 3h9c s LEU 520 Ca 0.41 -0.28 -0.04 0.00 -1.03 0.00 0.00 54.13 53.19 3h9c s LEU 520 Cb -0.11 -0.78 0.02 0.00 0.03 0.00 0.00 46.19 45.35 3h9c s LEU 520 CO 0.21 0.12 0.86 0.61 0.23 0.00 0.00 176.35 178.38 3h9c n GLY 521 N 3.15 -0.37 2.94 -3.19 0.00 -0.55 -4.93 105.19 102.25 3h9c n GLY 521 Ca -0.18 0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 3h9c n GLY 521 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3h9c s HIS 522 N -3.51 0.92 -0.09 1.61 5.04 -1.24 -4.89 115.29 113.14 3h9c s HIS 522 Ca 0.19 -0.28 -0.28 0.00 -1.54 0.00 0.00 55.06 53.15 3h9c s HIS 522 Cb -0.09 -0.74 -0.02 0.00 0.04 0.00 0.00 32.58 31.77 3h9c s HIS 522 CO 0.79 -0.19 0.93 0.21 -2.34 0.00 0.00 174.74 174.15 3h9c s LYS 523 N 0.70 4.43 0.32 2.88 2.47 -1.26 -0.86 119.74 128.42 3h9c s LYS 523 Ca -0.11 1.26 0.08 0.00 -1.56 0.00 0.00 55.97 55.64 3h9c s LYS 523 Cb -0.14 -3.52 -0.03 0.00 -1.46 0.00 0.00 37.83 32.68 3h9c s LYS 523 CO 0.01 -0.22 0.21 0.14 0.16 0.00 0.00 175.35 175.66 3h9c s VAL 524 N 1.69 3.50 0.14 4.02 -7.23 0.31 -4.61 120.40 118.22 3h9c s VAL 524 Ca 0.46 -1.51 0.05 0.00 -1.81 0.00 0.00 61.98 59.17 3h9c s VAL 524 Cb -0.18 -3.13 -0.04 0.00 0.56 0.00 0.00 36.38 33.59 3h9c s VAL 524 CO 0.19 -0.21 0.09 0.20 -0.31 0.00 0.00 175.10 175.05 3h9c s ASN 525 N -3.91 5.34 0.68 4.85 0.01 0.13 -4.75 114.94 117.28 3h9c s ASN 525 Ca 0.38 -0.16 -0.14 0.00 -0.71 0.00 0.00 52.86 52.23 3h9c s ASN 525 Cb -0.05 -1.35 0.01 0.00 0.41 0.00 0.00 41.25 40.27 3h9c s ASN 525 CO 0.25 0.10 1.11 -2.84 -1.51 0.00 0.00 177.10 174.21 3h9c s PRO 526 N -2.85 2.72 0.05 -0.60 0.02 -1.26 -4.74 135.00 128.34 3h9c s PRO 526 Ca 0.29 1.36 -0.03 0.00 0.02 0.00 0.00 61.00 62.65 3h9c s PRO 526 Cb -0.10 -1.94 -0.03 0.00 0.02 0.00 0.00 34.50 32.44 3h9c s PRO 526 CO 0.22 -1.31 0.01 -0.59 -0.33 0.00 0.00 177.00 175.00 3h9c s PHE 527 N -2.42 0.43 0.00 6.54 -0.71 -1.26 -4.90 117.98 115.66 3h9c s PHE 527 Ca 0.66 -0.93 0.00 0.00 -1.04 0.00 0.00 56.93 55.62 3h9c s PHE 527 Cb -0.20 -0.31 0.00 0.00 -1.21 0.00 0.00 43.02 41.30 3h9c s PHE 527 CO 0.44 -0.40 0.01 1.17 -1.34 0.00 0.00 175.22 175.09 3h9c n LYS 528 N 0.18 0.00 -3.63 1.99 3.00 -1.26 -4.94 118.16 113.50 3h9c n LYS 528 Ca -0.15 0.00 -0.19 0.00 -0.00 0.00 0.00 58.31 57.98 3h9c n LYS 528 Cb 0.61 -0.22 -0.16 0.00 0.00 0.00 0.00 35.03 35.26 3h9c n LYS 528 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3h9c s ALA 529 N -3.19 -0.07 0.31 3.14 0.00 -1.26 -5.04 121.76 115.65 3h9c s ALA 529 Ca 0.00 0.36 0.07 0.00 0.00 0.00 0.00 51.96 52.39 3h9c s ALA 529 Cb 0.00 -0.92 0.51 0.00 0.00 0.00 0.00 23.12 22.72 3h9c s ALA 529 CO 0.00 -0.75 1.74 -0.07 0.00 0.00 0.00 175.76 176.68 3h9c h LEU 530 N 8.37 0.24 -6.80 0.00 3.38 -1.97 -3.44 115.31 115.10 3h9c h LEU 530 Ca -0.14 -0.09 0.12 0.00 0.09 0.00 0.00 57.88 57.86 3h9c h LEU 530 Cb 1.13 -0.07 -0.22 0.00 0.09 0.00 0.00 40.66 41.59 3h9c h LEU 530 CO 0.19 0.59 0.02 -0.47 0.09 0.00 0.00 178.44 178.86 3h9c s TYR 531 N -4.24 -1.07 0.32 1.13 5.04 -1.26 -4.92 117.35 112.35 3h9c s TYR 531 Ca -0.05 1.86 -0.04 0.00 -2.44 0.00 0.00 57.07 56.40 3h9c s TYR 531 Cb 0.14 0.64 -0.05 0.00 0.35 0.00 0.00 41.96 43.04 3h9c s TYR 531 CO 0.76 -0.53 0.57 -0.80 -1.34 0.00 0.00 175.55 174.22 3h9c s ASN 532 N 2.70 6.40 0.65 4.32 0.01 -1.26 -4.84 114.94 122.93 3h9c s ASN 532 Ca -0.05 0.69 -0.16 0.00 -0.71 0.00 0.00 52.86 52.63 3h9c s ASN 532 Cb -0.09 -2.13 -0.00 0.00 0.41 0.00 0.00 41.25 39.43 3h9c s ASN 532 CO -0.18 -0.25 1.16 -0.13 -1.51 0.00 0.00 177.10 176.19 3h9c s ARG 533 N -3.79 2.72 0.43 -0.60 0.52 -1.26 -4.97 118.95 112.01 3h9c s ARG 533 Ca 0.44 1.61 0.07 0.00 -0.52 0.00 0.00 55.73 57.32 3h9c s ARG 533 Cb -0.10 -1.92 -0.05 0.00 0.52 0.00 0.00 34.95 33.40 3h9c s ARG 533 CO 0.32 -1.35 0.15 0.96 0.02 0.00 0.00 175.30 175.40 3h9c s ILE 534 N -2.02 2.12 0.19 1.52 -4.36 -1.26 -5.12 121.20 112.27 3h9c s ILE 534 Ca 0.72 -1.75 -0.09 0.00 -0.26 0.00 0.00 60.65 59.26 3h9c s ILE 534 Cb -0.25 -2.88 -0.01 0.00 1.25 0.00 0.00 42.46 40.57 3h9c s ILE 534 CO 0.39 0.00 0.32 1.51 0.24 0.00 0.00 174.94 177.40 3h9c s ASP 535 N -3.90 0.02 0.54 4.36 3.84 -1.26 -4.96 116.67 115.30 3h9c s ASP 535 Ca 0.37 -0.96 0.31 0.00 -0.00 0.00 0.00 52.55 52.27 3h9c s ASP 535 Cb 0.04 0.47 1.43 0.00 -1.38 0.00 0.00 42.92 43.48 3h9c s ASP 535 CO 0.20 -0.96 2.02 0.24 -0.00 0.00 0.00 175.17 176.68 3h9c h MET 536 N 2.47 0.00 -0.71 2.11 2.86 -1.98 -1.81 114.93 117.87 3h9c h MET 536 Ca -0.31 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.31 3h9c h MET 536 Cb 1.24 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.86 3h9c h MET 536 CO 0.45 0.08 0.36 0.00 1.06 0.00 0.00 176.91 178.86 3h9c h ARG 537 N 0.00 1.00 -0.45 1.72 3.08 -1.99 0.15 114.38 117.89 3h9c h ARG 537 Ca -0.00 -0.13 -0.11 0.00 0.07 0.00 0.00 59.98 59.81 3h9c h ARG 537 Cb 0.46 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 3h9c h ARG 537 CO 0.01 0.76 -0.17 1.96 -1.07 0.00 0.00 179.97 181.46 3h9c h GLN 538 N 1.00 0.86 -0.41 0.04 4.20 -1.75 -1.70 115.11 117.34 3h9c h GLN 538 Ca 0.25 -0.33 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 3h9c h GLN 538 Cb 0.08 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 3h9c h GLN 538 CO -0.03 0.97 0.18 0.28 -0.67 0.00 0.00 178.83 179.55 3h9c h VAL 539 N 0.76 1.19 -0.76 -0.54 2.07 -1.32 -1.12 116.25 116.53 3h9c h VAL 539 Ca 0.11 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 67.07 3h9c h VAL 539 Cb 0.70 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 3h9c h VAL 539 CO 0.05 0.21 0.50 -0.33 0.02 0.00 0.00 177.57 178.02 3h9c h GLU 540 N 0.52 1.01 -0.39 1.57 5.08 -0.76 -1.19 114.58 120.42 3h9c h GLU 540 Ca 0.14 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.31 3h9c h GLU 540 Cb 0.16 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3h9c h GLU 540 CO -0.01 0.67 -0.25 0.00 -1.00 0.00 0.00 179.01 178.42 3h9c h ALA 541 N 1.51 0.81 -0.43 3.43 0.00 -0.96 -1.28 119.26 122.34 3h9c h ALA 541 Ca 0.28 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3h9c h ALA 541 Cb -0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3h9c h ALA 541 CO -0.06 0.65 0.22 1.25 0.00 0.00 0.00 179.25 181.31 3h9c h LEU 542 N 0.70 0.55 -0.29 0.00 5.85 -0.53 -0.81 115.31 120.77 3h9c h LEU 542 Ca 0.09 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 3h9c h LEU 542 Cb 0.78 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 3h9c h LEU 542 CO 0.06 0.50 0.06 0.58 -0.34 0.00 0.00 178.44 179.30 3h9c h VAL 543 N 0.56 1.22 -0.77 1.05 2.07 -1.12 -2.22 116.25 117.04 3h9c h VAL 543 Ca 0.15 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.93 3h9c h VAL 543 Cb 0.08 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 3h9c h VAL 543 CO -0.02 0.24 0.50 -0.08 0.02 0.00 0.00 177.57 178.24 3h9c h GLU 544 N 0.30 1.02 0.00 1.57 4.57 -1.11 -1.65 114.58 119.27 3h9c h GLU 544 Ca 0.09 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 3h9c h GLU 544 Cb 0.31 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 3h9c h GLU 544 CO 0.00 0.68 0.00 0.00 -1.18 0.00 0.00 179.01 178.51 3h9c h ALA 545 N 1.28 1.00 0.00 2.92 0.00 -0.96 -2.80 119.26 120.70 3h9c h ALA 545 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3h9c h ALA 545 Cb -0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3h9c h ALA 545 CO -0.06 0.00 -0.85 0.43 0.00 0.00 0.00 179.25 178.77 3h9c n SER 546 N -2.91 0.64 0.00 0.00 7.64 -0.66 -5.09 113.62 113.25 3h9c n SER 546 Ca 0.00 -0.31 0.10 0.00 1.01 0.00 0.00 58.87 59.68 3h9c n SER 546 Cb 0.24 0.63 0.60 0.00 -1.01 0.00 0.00 64.21 64.68 3h9c n SER 546 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32