#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1maa n GLY 2 N 0.00 0.99 0.08 8.31 0.00 -1.26 -4.90 105.19 108.41 1maa n GLY 2 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1maa n GLY 2 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1maa h ARG 3 N 0.06 0.00 -7.11 1.61 -0.00 -2.11 -3.48 114.38 103.35 1maa h ARG 3 Ca 0.00 0.00 -0.49 0.00 -0.00 0.00 0.00 59.98 59.49 1maa h ARG 3 Cb 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 29.97 30.03 1maa h ARG 3 CO 0.00 0.00 0.40 -2.00 -0.00 0.00 0.00 179.97 178.37 1maa s GLU 4 N -3.22 3.40 0.21 0.08 2.56 -1.26 -4.99 118.70 115.48 1maa s GLU 4 Ca 0.04 1.46 -0.31 0.00 0.00 0.00 0.00 54.97 56.16 1maa s GLU 4 Cb 0.12 -2.03 -0.11 0.00 2.00 0.00 0.00 34.13 34.12 1maa s GLU 4 CO 0.74 -0.78 1.61 0.34 -0.56 0.00 0.00 175.26 176.61 1maa s ASP 5 N -2.07 6.50 0.38 -1.70 -1.08 -1.26 -4.92 116.67 112.52 1maa s ASP 5 Ca 0.69 2.75 0.15 0.00 -0.52 0.00 0.00 52.55 55.63 1maa s ASP 5 Cb -0.20 -2.61 0.77 0.00 -1.46 0.00 0.00 42.92 39.42 1maa s ASP 5 CO 0.28 -0.87 1.82 1.55 0.52 0.00 0.00 175.17 178.47 1maa h PRO 6 N 6.29 0.00 -0.00 4.34 0.13 -1.96 -3.29 132.00 137.52 1maa h PRO 6 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1maa h PRO 6 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1maa h PRO 6 CO 0.89 0.37 -0.02 1.04 -0.23 0.00 0.00 178.00 180.05 1maa n GLN 7 N -3.92 0.11 -0.15 0.86 1.13 -1.26 -3.89 117.38 110.25 1maa n GLN 7 Ca -0.02 -0.01 0.07 0.00 -1.94 0.00 0.00 57.00 55.11 1maa n GLN 7 Cb 0.42 -1.50 0.15 0.00 0.11 0.00 0.00 30.24 29.43 1maa n GLN 7 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1maa n LEU 8 N -1.44 2.88 -4.40 1.08 4.77 -1.24 -4.80 117.00 113.84 1maa n LEU 8 Ca 0.09 -1.64 -0.36 0.00 -0.03 0.00 0.00 56.01 54.07 1maa n LEU 8 Cb 0.32 -0.20 -0.13 0.00 -2.33 0.00 0.00 43.42 41.08 1maa n LEU 8 CO 0.26 0.66 -0.33 -0.22 -1.33 0.00 0.00 177.39 176.44 1maa s LEU 9 N -1.09 3.22 0.02 2.23 1.98 -1.25 -0.21 118.68 123.58 1maa s LEU 9 Ca 0.26 -0.27 0.04 0.00 -2.89 0.00 0.00 54.13 51.28 1maa s LEU 9 Cb 0.15 -1.84 -0.02 0.00 0.66 0.00 0.00 46.19 45.14 1maa s LEU 9 CO 0.20 -0.01 -0.13 -0.69 -1.89 0.00 0.00 176.35 173.84 1maa s VAL 10 N 1.43 1.01 -0.14 1.68 1.01 -0.04 -5.01 120.40 120.34 1maa s VAL 10 Ca 0.05 -0.83 -0.06 0.00 0.00 0.00 0.00 61.98 61.14 1maa s VAL 10 Cb -0.15 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 1maa s VAL 10 CO 0.01 0.06 0.07 -0.60 0.00 0.00 0.00 175.10 174.65 1maa s ARG 11 N -0.87 3.56 0.09 2.72 3.52 -1.26 -0.92 118.95 125.79 1maa s ARG 11 Ca 0.02 -0.29 0.03 0.00 -0.13 0.00 0.00 55.73 55.36 1maa s ARG 11 Cb -0.07 -3.10 -0.04 0.00 -1.56 0.00 0.00 34.95 30.18 1maa s ARG 11 CO 0.01 0.54 -0.09 0.08 -0.81 0.00 0.00 175.30 175.03 1maa s VAL 12 N -0.39 0.86 0.55 7.11 1.01 0.55 -4.86 120.40 125.23 1maa s VAL 12 Ca 0.10 -1.63 0.48 0.00 0.00 0.00 0.00 61.98 60.92 1maa s VAL 12 Cb -0.12 -1.34 0.71 0.00 0.00 0.00 0.00 36.38 35.63 1maa s VAL 12 CO 0.02 -0.60 1.60 -0.09 0.00 0.00 0.00 175.10 176.03 1maa h ARG 13 N 3.55 0.00 0.00 2.72 9.65 -1.97 0.18 114.38 128.51 1maa h ARG 13 Ca -0.37 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.51 1maa h ARG 13 Cb 1.19 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.77 1maa h ARG 13 CO 0.54 0.00 -1.17 0.41 2.80 0.00 0.00 179.97 182.55 1maa n GLY 14 N -1.88 -1.21 0.00 2.80 0.00 -1.26 -4.93 105.19 98.71 1maa n GLY 14 Ca 0.42 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1maa n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maa n GLY 15 N 1.33 -0.96 3.95 -0.02 0.00 0.63 -0.36 105.19 109.75 1maa n GLY 15 Ca 0.01 -1.19 -0.23 0.00 0.00 0.00 0.00 46.02 44.60 1maa n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1maa s GLN 16 N -2.00 3.47 -0.07 1.61 -0.21 -1.24 -0.33 119.66 120.89 1maa s GLN 16 Ca 0.00 -0.52 -0.26 0.00 0.02 0.00 0.00 55.36 54.60 1maa s GLN 16 Cb 0.00 -2.80 0.06 0.00 1.00 0.00 0.00 33.01 31.27 1maa s GLN 16 CO 0.00 0.32 0.59 -0.48 -2.12 0.00 0.00 175.29 173.61 1maa s LEU 17 N -3.96 -0.30 -0.10 2.90 0.05 -0.09 -1.26 118.68 115.92 1maa s LEU 17 Ca 0.37 0.65 0.03 0.00 0.05 0.00 0.00 54.13 55.24 1maa s LEU 17 Cb -0.10 2.21 -0.01 0.00 -2.05 0.00 0.00 46.19 46.25 1maa s LEU 17 CO 0.32 -0.52 -0.21 -0.60 -0.55 0.00 0.00 176.35 174.78 1maa s ARG 18 N -1.02 3.01 0.00 1.48 3.52 0.19 -0.86 118.95 125.27 1maa s ARG 18 Ca -0.10 -0.83 0.00 0.00 -0.13 0.00 0.00 55.73 54.67 1maa s ARG 18 Cb -0.02 -2.36 0.00 0.00 -1.56 0.00 0.00 34.95 31.01 1maa s ARG 18 CO 0.08 0.25 0.00 0.41 -0.81 0.00 0.00 175.30 175.23 1maa n GLY 19 N 3.35 1.77 3.24 8.12 0.00 0.71 -0.48 105.19 121.89 1maa n GLY 19 Ca -0.18 -1.86 -0.13 0.00 0.00 0.00 0.00 46.02 43.84 1maa n GLY 19 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1maa s ILE 20 N 2.55 0.03 -0.24 -0.61 2.07 -0.56 -4.62 121.20 119.82 1maa s ILE 20 Ca 0.00 -0.26 -0.20 0.00 -1.41 0.00 0.00 60.65 58.77 1maa s ILE 20 Cb 0.00 -0.56 -0.02 0.00 0.13 0.00 0.00 42.46 42.01 1maa s ILE 20 CO 0.00 -0.15 0.63 -0.60 -1.91 0.00 0.00 174.94 172.91 1maa s ARG 21 N -0.66 4.14 0.18 3.50 3.52 -1.26 -0.56 118.95 127.80 1maa s ARG 21 Ca -0.08 0.56 0.07 0.00 -0.13 0.00 0.00 55.73 56.16 1maa s ARG 21 Cb -0.04 -3.63 -0.04 0.00 -1.56 0.00 0.00 34.95 29.68 1maa s ARG 21 CO 0.03 -0.37 0.01 -0.51 -0.81 0.00 0.00 175.30 173.65 1maa s LEU 22 N 2.34 3.34 -0.27 -0.88 1.02 0.18 -4.93 118.68 119.48 1maa s LEU 22 Ca 0.27 -0.39 -0.08 0.00 0.02 0.00 0.00 54.13 53.95 1maa s LEU 22 Cb -0.16 -1.99 -0.02 0.00 0.02 0.00 0.00 46.19 44.05 1maa s LEU 22 CO 0.09 0.09 0.10 -0.75 0.02 0.00 0.00 176.35 175.89 1maa s LYS 23 N -2.97 3.51 0.23 1.70 2.36 -1.26 -0.00 119.74 123.31 1maa s LYS 23 Ca 0.28 -0.58 0.05 0.00 -2.55 0.00 0.00 55.97 53.17 1maa s LYS 23 Cb -0.09 -3.40 -0.03 0.00 -1.05 0.00 0.00 37.83 33.25 1maa s LYS 23 CO 0.19 -0.28 0.29 0.00 1.55 0.00 0.00 175.35 177.09 1maa s ALA 24 N 1.61 3.80 0.28 3.13 0.00 0.50 -4.99 121.76 126.08 1maa s ALA 24 Ca 0.05 -1.27 -0.06 0.00 0.00 0.00 0.00 51.96 50.68 1maa s ALA 24 Cb -0.16 -1.58 0.50 0.00 0.00 0.00 0.00 23.12 21.89 1maa s ALA 24 CO 0.04 0.29 1.58 -1.35 0.00 0.00 0.00 175.76 176.32 1maa h PRO 25 N 1.46 0.01 -0.62 0.00 0.11 -1.95 -1.83 132.00 129.17 1maa h PRO 25 Ca -0.50 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1maa h PRO 25 Cb 1.23 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1maa h PRO 25 CO 0.62 0.01 0.00 0.41 -0.21 0.00 0.00 178.00 178.82 1maa n GLY 26 N -1.56 2.81 0.00 -0.55 0.00 -1.26 -5.04 105.19 99.59 1maa n GLY 26 Ca 0.17 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1maa n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maa n GLY 27 N 1.05 -0.59 3.89 -0.02 0.00 -0.69 -5.08 105.19 103.75 1maa n GLY 27 Ca 0.25 -1.32 -0.29 0.00 0.00 0.00 0.00 46.02 44.66 1maa n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1maa s PRO 28 N -1.98 3.07 -0.09 1.61 0.04 -1.26 -0.37 135.00 136.01 1maa s PRO 28 Ca 0.00 0.37 -0.13 0.00 0.04 0.00 0.00 61.00 61.29 1maa s PRO 28 Cb 0.00 -2.12 0.03 0.00 0.04 0.00 0.00 34.50 32.44 1maa s PRO 28 CO 0.00 -0.80 0.33 0.08 0.04 0.00 0.00 177.00 176.65 1maa s VAL 29 N -3.18 0.02 0.06 -0.36 1.01 1.00 -3.43 120.40 115.51 1maa s VAL 29 Ca 0.56 -0.16 -0.14 0.00 0.00 0.00 0.00 61.98 62.24 1maa s VAL 29 Cb -0.11 -0.52 -0.06 0.00 0.00 0.00 0.00 36.38 35.69 1maa s VAL 29 CO 0.50 -0.09 0.45 -0.44 0.00 0.00 0.00 175.10 175.52 1maa s SER 30 N -0.32 6.78 -0.10 3.32 0.01 0.54 0.47 113.70 124.40 1maa s SER 30 Ca -0.04 0.96 -0.04 0.00 1.31 0.00 0.00 55.95 58.14 1maa s SER 30 Cb -0.03 -2.25 0.05 0.00 0.21 0.00 0.00 66.02 64.00 1maa s SER 30 CO 0.02 0.23 0.20 0.00 0.41 0.00 0.00 173.24 174.09 1maa s ALA 31 N -1.27 -0.31 -0.40 1.44 0.00 0.27 -1.14 121.76 120.36 1maa s ALA 31 Ca 0.30 0.70 -0.04 0.00 0.00 0.00 0.00 51.96 52.92 1maa s ALA 31 Cb -0.16 -0.89 0.10 0.00 0.00 0.00 0.00 23.12 22.17 1maa s ALA 31 CO 0.17 -0.59 0.20 -0.06 0.00 0.00 0.00 175.76 175.48 1maa s PHE 32 N 2.33 3.50 -0.10 0.00 0.40 0.71 -1.50 117.98 123.32 1maa s PHE 32 Ca 0.02 -2.16 -0.02 0.00 -0.60 0.00 0.00 56.93 54.17 1maa s PHE 32 Cb -0.12 -3.07 -0.03 0.00 0.51 0.00 0.00 43.02 40.31 1maa s PHE 32 CO -0.07 -0.94 -0.03 -0.51 0.70 0.00 0.00 175.22 174.38 1maa s LEU 33 N 1.22 3.35 0.00 -0.37 1.02 0.18 -0.01 118.68 124.08 1maa s LEU 33 Ca 0.06 0.01 0.00 0.00 0.02 0.00 0.00 54.13 54.21 1maa s LEU 33 Cb -0.23 -1.77 0.00 0.00 0.02 0.00 0.00 46.19 44.21 1maa s LEU 33 CO -0.03 0.31 0.00 0.61 0.02 0.00 0.00 176.35 177.26 1maa n GLY 34 N 2.60 0.64 3.66 -3.19 0.00 -0.86 -3.71 105.19 104.33 1maa n GLY 34 Ca -0.18 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.65 1maa n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1maa s ILE 35 N -2.00 4.57 0.13 -0.61 1.01 -0.43 -4.77 121.20 119.10 1maa s ILE 35 Ca 0.00 1.89 -0.30 0.00 0.00 0.00 0.00 60.65 62.24 1maa s ILE 35 Cb 0.00 -4.25 -0.07 0.00 0.01 0.00 0.00 42.46 38.15 1maa s ILE 35 CO 0.00 -0.20 1.17 -2.16 0.00 0.00 0.00 174.94 173.75 1maa s PRO 36 N 3.32 4.49 0.00 2.79 0.04 -1.26 -0.54 135.00 143.84 1maa s PRO 36 Ca 0.47 1.79 0.06 0.00 0.04 0.00 0.00 61.00 63.36 1maa s PRO 36 Cb -0.16 -3.30 -0.01 0.00 0.04 0.00 0.00 34.50 31.07 1maa s PRO 36 CO 0.09 -0.12 0.46 1.97 0.04 0.00 0.00 177.00 179.43 1maa n PHE 37 N 3.11 0.00 -3.78 0.56 -1.74 -1.19 -4.83 117.46 109.59 1maa n PHE 37 Ca 0.06 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.83 1maa n PHE 37 Cb 0.46 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.38 1maa n PHE 37 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1maa s ALA 38 N -1.14 -0.62 0.10 1.98 0.00 -1.25 -2.34 121.76 118.50 1maa s ALA 38 Ca 0.05 0.01 -0.31 0.00 0.00 0.00 0.00 51.96 51.71 1maa s ALA 38 Cb 0.05 0.24 -0.07 0.00 0.00 0.00 0.00 23.12 23.35 1maa s ALA 38 CO 0.18 -0.36 1.23 -1.21 0.00 0.00 0.00 175.76 175.60 1maa s GLU 39 N -2.21 4.43 -0.42 0.00 0.41 -0.40 -4.54 118.70 115.96 1maa s GLU 39 Ca -0.07 1.85 -0.42 0.00 -0.41 0.00 0.00 54.97 55.91 1maa s GLU 39 Cb -0.02 -3.30 -0.17 0.00 -1.78 0.00 0.00 34.13 28.86 1maa s GLU 39 CO -0.01 -0.24 1.96 -0.35 -0.49 0.00 0.00 175.26 176.12 1maa n PRO 40 N 3.56 0.48 -0.82 0.39 -0.04 -1.26 -4.62 135.00 132.68 1maa n PRO 40 Ca 0.08 0.15 -0.20 0.00 -0.04 0.00 0.00 63.50 63.49 1maa n PRO 40 Cb 0.45 -1.84 -0.05 0.00 -0.04 0.00 0.00 33.50 32.03 1maa n PRO 40 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1maa n PRO 41 N 6.51 2.13 -4.26 0.54 -0.04 -1.26 -4.89 135.00 133.74 1maa n PRO 41 Ca 0.41 -1.33 -0.24 0.00 -0.04 0.00 0.00 63.50 62.30 1maa n PRO 41 Cb 0.05 -2.31 -0.08 0.00 -0.04 0.00 0.00 33.50 31.12 1maa n PRO 41 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1maa s VAL 42 N 2.63 2.71 0.00 0.52 -7.23 -1.26 -4.02 120.40 113.74 1maa s VAL 42 Ca 0.47 -1.87 0.00 0.00 -1.81 0.00 0.00 61.98 58.77 1maa s VAL 42 Cb 0.15 -2.87 0.00 0.00 0.56 0.00 0.00 36.38 34.22 1maa s VAL 42 CO -0.03 -0.18 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 1maa n GLY 43 N -1.03 3.72 0.00 2.32 0.00 -1.26 -1.19 105.19 107.74 1maa n GLY 43 Ca -0.04 0.22 0.13 0.00 0.00 0.00 0.00 46.02 46.34 1maa n GLY 43 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1maa n SER 44 N 9.59 0.00 -0.70 1.61 3.41 -1.26 -2.16 113.62 124.10 1maa n SER 44 Ca 0.00 -0.37 0.12 0.00 -0.26 0.00 0.00 58.87 58.36 1maa n SER 44 Cb 0.00 -0.18 0.35 0.00 -0.26 0.00 0.00 64.21 64.11 1maa n SER 44 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1maa n ARG 45 N -1.18 1.94 -2.19 4.33 5.12 -0.33 -4.86 116.66 119.49 1maa n ARG 45 Ca 0.16 -1.39 -0.42 0.00 -1.93 0.00 0.00 57.85 54.27 1maa n ARG 45 Cb 0.17 -1.45 -0.03 0.00 -1.16 0.00 0.00 32.46 29.99 1maa n ARG 45 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1maa s ARG 46 N -1.84 4.35 0.00 5.56 3.52 -0.92 -2.62 118.95 126.99 1maa s ARG 46 Ca 0.34 2.07 0.00 0.00 -0.13 0.00 0.00 55.73 58.01 1maa s ARG 46 Cb 0.20 -3.23 0.00 0.00 -1.56 0.00 0.00 34.95 30.36 1maa s ARG 46 CO 0.30 -0.36 0.00 1.19 -0.81 0.00 0.00 175.30 175.62 1maa n PHE 47 N 3.41 0.00 -2.03 5.12 3.72 -1.26 -4.90 117.46 121.52 1maa n PHE 47 Ca 0.09 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.17 1maa n PHE 47 Cb 0.42 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.97 1maa n PHE 47 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1maa s MET 48 N 0.00 3.49 0.74 -1.08 -1.94 -1.08 -4.41 119.30 115.03 1maa s MET 48 Ca 0.00 0.99 -0.13 0.00 -1.71 0.00 0.00 55.69 54.84 1maa s MET 48 Cb 0.00 -2.06 0.04 0.00 2.01 0.00 0.00 34.83 34.82 1maa s MET 48 CO 0.00 -0.66 1.13 -2.14 -0.01 0.00 0.00 175.02 173.34 1maa s PRO 49 N -4.48 2.28 0.16 2.03 0.02 -1.26 -4.94 135.00 128.81 1maa s PRO 49 Ca 0.59 1.42 -0.30 0.00 0.02 0.00 0.00 61.00 62.74 1maa s PRO 49 Cb -0.13 -1.88 -0.08 0.00 0.02 0.00 0.00 34.50 32.44 1maa s PRO 49 CO 0.42 -1.66 1.17 -1.25 -0.33 0.00 0.00 177.00 175.35 1maa s PRO 50 N -4.36 4.51 -0.13 5.54 0.04 -1.26 -5.03 135.00 134.31 1maa s PRO 50 Ca 0.67 1.82 -0.05 0.00 0.04 0.00 0.00 61.00 63.47 1maa s PRO 50 Cb -0.22 -3.27 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 1maa s PRO 50 CO 0.48 -0.08 0.07 -1.83 0.04 0.00 0.00 177.00 175.69 1maa s GLU 51 N -0.06 3.44 0.46 4.56 -1.05 -1.26 -5.02 118.70 119.77 1maa s GLU 51 Ca 0.53 -0.29 -0.22 0.00 -0.15 0.00 0.00 54.97 54.84 1maa s GLU 51 Cb -0.31 -3.06 -0.11 0.00 -0.44 0.00 0.00 34.13 30.21 1maa s GLU 51 CO 0.35 0.60 0.64 -2.30 0.95 0.00 0.00 175.26 175.50 1maa n PRO 52 N 2.50 0.71 -1.87 -4.83 -0.02 -1.26 -1.27 135.00 128.97 1maa n PRO 52 Ca -0.18 0.26 -0.42 0.00 -2.02 0.00 0.00 63.50 61.13 1maa n PRO 52 Cb 0.54 -1.67 -0.03 0.00 -0.02 0.00 0.00 33.50 32.32 1maa n PRO 52 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1maa s LYS 53 N -1.81 3.91 0.43 -0.52 2.47 -0.99 -4.01 119.74 119.23 1maa s LYS 53 Ca 0.65 2.17 -0.25 0.00 -1.56 0.00 0.00 55.97 56.98 1maa s LYS 53 Cb -0.55 -4.11 -0.08 0.00 -1.46 0.00 0.00 37.83 31.62 1maa s LYS 53 CO 0.57 -1.19 1.28 1.03 0.16 0.00 0.00 175.35 177.20 1maa s ARG 54 N 4.69 3.82 0.42 4.03 0.52 -1.26 -4.91 118.95 126.26 1maa s ARG 54 Ca 0.82 2.09 -0.25 0.00 -0.52 0.00 0.00 55.73 57.87 1maa s ARG 54 Cb -0.34 -2.62 -0.10 0.00 0.52 0.00 0.00 34.95 32.41 1maa s ARG 54 CO 0.34 -0.59 1.21 -2.30 0.02 0.00 0.00 175.30 173.98 1maa n PRO 55 N -0.14 1.77 -4.45 3.54 -0.02 -1.26 -5.01 135.00 129.44 1maa n PRO 55 Ca 0.05 0.63 -0.25 0.00 -2.02 0.00 0.00 63.50 61.91 1maa n PRO 55 Cb 0.45 -2.30 -0.10 0.00 -0.02 0.00 0.00 33.50 31.52 1maa n PRO 55 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 1maa s TRP 56 N -1.22 2.32 0.18 6.00 -2.14 0.51 -5.02 118.94 119.57 1maa s TRP 56 Ca 0.62 -0.33 0.06 0.00 2.66 0.00 0.00 56.10 59.11 1maa s TRP 56 Cb -0.52 -1.05 -0.04 0.00 -3.10 0.00 0.00 33.47 28.76 1maa s TRP 56 CO 0.57 0.65 0.10 -1.54 -2.66 0.00 0.00 176.95 174.07 1maa s SER 57 N -3.26 5.28 0.00 -2.66 1.04 -1.26 -4.34 113.70 108.50 1maa s SER 57 Ca 0.27 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.47 1maa s SER 57 Cb -0.06 -1.30 0.00 0.00 0.10 0.00 0.00 66.02 64.76 1maa s SER 57 CO 0.14 0.06 0.00 0.61 0.98 0.00 0.00 173.24 175.03 1maa n GLY 58 N -0.39 -2.91 3.42 7.32 0.00 -1.26 -4.82 105.19 106.54 1maa n GLY 58 Ca -0.09 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 1maa n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1maa s VAL 59 N -0.80 4.77 0.19 1.61 1.01 -1.26 -3.67 120.40 122.26 1maa s VAL 59 Ca 0.00 -0.68 -0.30 0.00 0.00 0.00 0.00 61.98 61.00 1maa s VAL 59 Cb 0.00 -3.60 -0.09 0.00 0.00 0.00 0.00 36.38 32.69 1maa s VAL 59 CO 0.00 -0.17 1.30 -0.22 0.00 0.00 0.00 175.10 176.01 1maa s LEU 60 N 1.60 4.41 -0.71 3.92 1.98 -0.39 -4.82 118.68 124.67 1maa s LEU 60 Ca 0.03 2.38 -0.24 0.00 -2.89 0.00 0.00 54.13 53.41 1maa s LEU 60 Cb -0.19 -3.61 0.06 0.00 0.66 0.00 0.00 46.19 43.12 1maa s LEU 60 CO 0.08 -0.52 1.10 -0.62 -1.89 0.00 0.00 176.35 174.49 1maa s ASP 61 N 0.39 6.20 -0.70 3.68 2.15 -1.26 -0.63 116.67 126.50 1maa s ASP 61 Ca 0.57 -0.87 -0.01 0.00 0.43 0.00 0.00 52.55 52.68 1maa s ASP 61 Cb -0.36 -2.47 0.40 0.00 -0.30 0.00 0.00 42.92 40.19 1maa s ASP 61 CO 0.37 -1.57 1.87 0.00 -0.17 0.00 0.00 175.17 175.68 1maa n ALA 62 N 8.28 6.19 0.27 3.66 0.00 0.37 -4.48 120.51 134.80 1maa n ALA 62 Ca 0.01 -3.87 0.10 0.00 0.00 0.00 0.00 53.44 49.69 1maa n ALA 62 Cb 0.47 -1.63 -0.15 0.00 0.00 0.00 0.00 19.45 18.13 1maa n ALA 62 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1maa n THR 63 N -0.69 0.00 -4.26 0.00 -2.24 -1.24 0.51 114.28 106.36 1maa n THR 63 Ca 0.55 -0.35 -0.22 0.00 -2.27 0.00 0.00 64.05 61.76 1maa n THR 63 Cb 0.50 0.29 -0.12 0.00 -2.10 0.00 0.00 70.33 68.90 1maa n THR 63 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1maa s THR 64 N -3.34 1.55 0.51 4.28 -1.32 -1.25 -4.79 115.64 111.28 1maa s THR 64 Ca -0.03 -1.52 -0.22 0.00 -1.21 0.00 0.00 61.69 58.71 1maa s THR 64 Cb 0.14 -1.45 -0.06 0.00 -1.51 0.00 0.00 72.50 69.62 1maa s THR 64 CO 0.88 -0.14 1.28 -0.36 -2.21 0.00 0.00 174.62 174.07 1maa s PHE 65 N -1.31 2.51 0.64 9.09 0.08 -1.26 -3.57 117.98 124.17 1maa s PHE 65 Ca 0.05 1.44 0.07 0.00 0.12 0.00 0.00 56.93 58.61 1maa s PHE 65 Cb -0.09 -3.64 0.11 0.00 -0.57 0.00 0.00 43.02 38.83 1maa s PHE 65 CO 0.04 -2.36 0.88 -0.65 -0.10 0.00 0.00 175.22 173.03 1maa s GLN 66 N -2.82 2.02 0.44 0.44 -1.52 -1.26 -4.91 119.66 112.05 1maa s GLN 66 Ca 0.68 -1.57 -0.21 0.00 -1.95 0.00 0.00 55.36 52.31 1maa s GLN 66 Cb -0.36 -2.54 -0.13 0.00 -0.22 0.00 0.00 33.01 29.76 1maa s GLN 66 CO 0.43 -1.13 0.34 0.09 -0.25 0.00 0.00 175.29 174.77 1maa n ASN 67 N -2.47 -1.77 -4.84 5.90 3.02 -1.26 -4.87 115.26 108.96 1maa n ASN 67 Ca 0.17 0.83 -0.37 0.00 -0.03 0.00 0.00 54.58 55.18 1maa n ASN 67 Cb 0.62 -1.03 -0.06 0.00 -0.61 0.00 0.00 39.78 38.70 1maa n ASN 67 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1maa s VAL 68 N -1.61 4.99 0.32 2.41 1.01 -0.60 -4.77 120.40 122.15 1maa s VAL 68 Ca 0.62 0.79 -0.29 0.00 0.00 0.00 0.00 61.98 63.10 1maa s VAL 68 Cb -0.58 -3.72 -0.11 0.00 0.00 0.00 0.00 36.38 31.97 1maa s VAL 68 CO 0.60 0.47 1.56 0.00 0.00 0.00 0.00 175.10 177.73 1maa n TYR 70 N 1.60 2.06 -3.97 0.00 4.19 -0.89 -4.74 117.16 115.40 1maa n TYR 70 Ca 0.06 0.39 -0.12 0.00 3.31 0.00 0.00 57.90 61.55 1maa n TYR 70 Cb 0.38 -2.50 -0.02 0.00 0.49 0.00 0.00 39.34 37.69 1maa n TYR 70 CO 0.00 0.00 0.00 1.14 0.91 0.00 0.00 176.86 178.91 1maa s GLN 71 N 3.06 1.97 0.28 2.98 -2.07 -1.26 -4.69 119.66 119.92 1maa s GLN 71 Ca 0.94 -1.56 -0.29 0.00 -1.82 0.00 0.00 55.36 52.63 1maa s GLN 71 Cb -0.93 0.51 -0.09 0.00 -1.09 0.00 0.00 33.01 31.41 1maa s GLN 71 CO 0.57 -0.86 0.97 -0.47 -1.32 0.00 0.00 175.29 174.19 1maa s TYR 72 N -2.96 3.81 -0.16 9.60 6.14 -1.25 -5.01 117.35 127.51 1maa s TYR 72 Ca 0.24 1.83 -0.03 0.00 0.64 0.00 0.00 57.07 59.75 1maa s TYR 72 Cb -0.02 -3.02 -0.02 0.00 0.42 0.00 0.00 41.96 39.31 1maa s TYR 72 CO 0.15 0.17 -0.05 0.08 0.64 0.00 0.00 175.55 176.55 1maa s VAL 73 N -1.31 3.68 -0.64 3.14 1.01 -1.26 -4.88 120.40 120.14 1maa s VAL 73 Ca 0.45 -0.42 -0.27 0.00 0.00 0.00 0.00 61.98 61.73 1maa s VAL 73 Cb -0.25 -2.62 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1maa s VAL 73 CO 0.31 0.48 1.55 -0.62 0.00 0.00 0.00 175.10 176.82 1maa s ASP 74 N 0.58 5.79 -0.22 3.32 2.15 -1.26 -4.86 116.67 122.17 1maa s ASP 74 Ca -0.04 0.07 0.15 0.00 0.43 0.00 0.00 52.55 53.16 1maa s ASP 74 Cb -0.15 -2.54 0.81 0.00 -0.30 0.00 0.00 42.92 40.75 1maa s ASP 74 CO 0.03 -2.02 1.74 0.35 -0.17 0.00 0.00 175.17 175.10 1maa n THR 75 N 6.84 2.67 0.19 1.71 -2.24 -1.26 -4.59 114.28 117.59 1maa n THR 75 Ca 0.12 -1.39 -0.14 0.00 -2.27 0.00 0.00 64.05 60.37 1maa n THR 75 Cb 0.50 -0.23 -0.07 0.00 -2.10 0.00 0.00 70.33 68.43 1maa n THR 75 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1maa h LEU 76 N 4.02 -0.77 -6.76 3.22 5.85 -2.00 -3.33 115.31 115.55 1maa h LEU 76 Ca 0.00 0.07 -0.61 0.00 0.84 0.00 0.00 57.88 58.18 1maa h LEU 76 Cb 1.93 0.26 -0.42 0.00 0.37 0.00 0.00 40.66 42.81 1maa h LEU 76 CO 0.46 -0.41 -0.63 -1.22 -0.34 0.00 0.00 178.44 176.31 1maa n TYR 77 N -5.40 2.88 -1.64 1.25 4.01 -1.26 -5.08 117.16 111.91 1maa n TYR 77 Ca -0.09 -4.17 -0.53 0.00 -0.16 0.00 0.00 57.90 52.95 1maa n TYR 77 Cb 0.31 -0.52 -0.06 0.00 -0.31 0.00 0.00 39.34 38.75 1maa n TYR 77 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1maa n PRO 78 N 1.73 1.29 -0.27 -0.72 -0.02 -1.25 -1.24 135.00 134.52 1maa n PRO 78 Ca 0.23 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1maa n PRO 78 Cb 0.38 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1maa n PRO 78 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1maa n GLY 79 N 3.27 1.47 3.67 -1.23 0.00 -1.26 -5.03 105.19 106.09 1maa n GLY 79 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1maa n GLY 79 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1maa s PHE 80 N -2.92 3.41 0.13 1.61 5.36 -0.37 -4.96 117.98 120.24 1maa s PHE 80 Ca 0.00 1.27 -0.29 0.00 -0.96 0.00 0.00 56.93 56.95 1maa s PHE 80 Cb 0.00 -3.04 -0.05 0.00 -0.34 0.00 0.00 43.02 39.59 1maa s PHE 80 CO 0.00 -0.27 1.59 1.49 -1.46 0.00 0.00 175.22 176.58 1maa h GLU 81 N 7.36 -0.48 -0.01 10.12 4.81 -1.95 0.75 114.58 135.18 1maa h GLU 81 Ca -0.28 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1maa h GLU 81 Cb 1.12 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.61 1maa h GLU 81 CO 0.85 -0.32 0.44 0.78 -0.73 0.00 0.00 179.01 180.03 1maa h GLY 82 N -0.50 0.00 0.00 1.92 0.00 -1.93 0.23 103.07 102.79 1maa h GLY 82 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.06 1maa h GLY 82 CO -0.35 0.00 -2.26 2.41 0.00 0.00 0.00 176.54 176.34 1maa n THR 83 N -2.84 1.26 0.14 4.70 -1.04 -0.66 -4.56 114.28 111.27 1maa n THR 83 Ca -0.01 -0.44 -0.00 0.00 -2.04 0.00 0.00 64.05 61.56 1maa n THR 83 Cb 0.48 -1.42 0.19 0.00 -1.82 0.00 0.00 70.33 67.76 1maa n THR 83 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1maa h GLU 84 N -0.23 0.00 0.00 -2.82 4.39 -0.16 -3.02 114.58 112.74 1maa h GLU 84 Ca -0.51 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.19 1maa h GLU 84 Cb 1.69 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.34 1maa h GLU 84 CO -0.15 0.59 0.27 0.00 -1.16 0.00 0.00 179.01 178.56 1maa h MET 85 N 0.00 0.00 -0.00 2.33 -0.00 -0.79 0.29 114.93 116.76 1maa h MET 85 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 1maa h MET 85 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.68 1maa h MET 85 CO 0.08 0.00 -0.49 0.91 -0.00 0.00 0.00 176.91 177.41 1maa n TRP 86 N -2.19 0.00 -1.74 -0.10 7.02 -1.14 -4.81 117.44 114.48 1maa n TRP 86 Ca -0.01 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.15 1maa n TRP 86 Cb 0.30 0.00 0.03 0.00 -2.42 0.00 0.00 31.31 29.22 1maa n TRP 86 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1maa s ASN 87 N -2.05 5.57 0.16 -0.99 0.01 0.10 -4.66 114.94 113.08 1maa s ASN 87 Ca 0.08 1.66 -0.34 0.00 -0.71 0.00 0.00 52.86 53.56 1maa s ASN 87 Cb 0.11 -2.50 -0.15 0.00 0.41 0.00 0.00 41.25 39.12 1maa s ASN 87 CO 0.47 -1.31 1.43 -2.65 -1.51 0.00 0.00 177.10 173.53 1maa n PRO 88 N -2.77 1.76 -0.35 -0.60 -0.02 -1.26 -4.92 135.00 126.85 1maa n PRO 88 Ca 0.08 0.63 0.08 0.00 -2.02 0.00 0.00 63.50 62.27 1maa n PRO 88 Cb 0.53 -2.31 0.22 0.00 -0.02 0.00 0.00 33.50 31.92 1maa n PRO 88 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1maa n ASN 89 N 2.73 3.49 -3.62 2.55 6.94 -1.26 -5.00 115.26 121.10 1maa n ASN 89 Ca 0.16 -2.91 -0.12 0.00 -0.02 0.00 0.00 54.58 51.68 1maa n ASN 89 Cb 0.27 -0.48 -0.05 0.00 -2.36 0.00 0.00 39.78 37.15 1maa n ASN 89 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1maa s ARG 90 N -2.63 1.01 0.06 -3.83 1.81 -1.26 -5.07 118.95 109.04 1maa s ARG 90 Ca 0.38 -0.42 -0.37 0.00 -1.72 0.00 0.00 55.73 53.59 1maa s ARG 90 Cb 0.30 0.45 -0.18 0.00 -0.45 0.00 0.00 34.95 35.07 1maa s ARG 90 CO 0.08 -0.37 1.11 -1.91 -0.68 0.00 0.00 175.30 173.53 1maa n GLU 91 N 0.23 0.42 -2.87 3.54 2.13 -1.26 -4.07 120.64 118.76 1maa n GLU 91 Ca -0.18 0.15 -0.40 0.00 0.66 0.00 0.00 57.16 57.39 1maa n GLU 91 Cb 0.61 -1.65 -0.05 0.00 0.27 0.00 0.00 31.44 30.62 1maa n GLU 91 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1maa s LEU 92 N 0.43 4.49 0.02 4.31 1.43 -1.26 -1.56 118.68 126.54 1maa s LEU 92 Ca 0.85 1.63 -0.25 0.00 -1.03 0.00 0.00 54.13 55.33 1maa s LEU 92 Cb -1.12 -3.40 0.06 0.00 0.03 0.00 0.00 46.19 41.77 1maa s LEU 92 CO 0.54 0.01 0.58 -0.55 0.23 0.00 0.00 176.35 177.16 1maa s SER 93 N -0.19 -0.53 0.23 2.29 0.15 -0.69 -4.90 113.70 110.06 1maa s SER 93 Ca 0.42 0.37 -0.04 0.00 0.70 0.00 0.00 55.95 57.40 1maa s SER 93 Cb -0.22 0.51 0.22 0.00 -1.71 0.00 0.00 66.02 64.82 1maa s SER 93 CO 0.26 -0.68 1.67 -0.33 1.20 0.00 0.00 173.24 175.36 1maa h GLU 94 N 2.86 0.81 -5.79 5.44 5.08 -1.95 -2.38 114.58 118.66 1maa h GLU 94 Ca -0.30 -0.28 -0.37 0.00 -1.00 0.00 0.00 59.36 57.42 1maa h GLU 94 Cb 1.19 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 30.32 1maa h GLU 94 CO 0.40 0.90 0.94 0.34 -1.00 0.00 0.00 179.01 180.59 1maa s ASP 95 N -6.70 5.45 -0.00 1.42 -1.08 -1.26 -4.50 116.67 110.00 1maa s ASP 95 Ca -0.10 -0.93 0.00 0.00 -0.52 0.00 0.00 52.55 51.00 1maa s ASP 95 Cb 0.14 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 39.03 1maa s ASP 95 CO 0.83 -2.48 0.57 0.00 0.52 0.00 0.00 175.17 174.61 1maa s LEU 97 N -0.06 4.39 0.07 0.00 1.43 -1.26 -4.67 118.68 118.58 1maa s LEU 97 Ca 0.00 -2.46 0.00 0.00 -1.03 0.00 0.00 54.13 50.64 1maa s LEU 97 Cb 0.00 -2.49 -0.04 0.00 0.03 0.00 0.00 46.19 43.69 1maa s LEU 97 CO 0.00 -1.05 -0.05 -0.31 0.23 0.00 0.00 176.35 175.17 1maa s TYR 98 N 3.16 0.71 0.28 0.29 2.02 -1.26 -3.14 117.35 119.40 1maa s TYR 98 Ca 0.46 -0.97 0.03 0.00 -0.37 0.00 0.00 57.07 56.22 1maa s TYR 98 Cb -0.00 -0.45 -0.06 0.00 -0.40 0.00 0.00 41.96 41.05 1maa s TYR 98 CO 0.00 -0.25 0.06 -0.48 -1.57 0.00 0.00 175.55 173.31 1maa s LEU 99 N -2.92 1.96 0.01 -1.29 0.05 0.30 -2.34 118.68 114.45 1maa s LEU 99 Ca 0.09 -1.35 0.03 0.00 0.05 0.00 0.00 54.13 52.95 1maa s LEU 99 Cb 0.06 -0.19 -0.01 0.00 -2.05 0.00 0.00 46.19 43.99 1maa s LEU 99 CO -0.07 -0.64 -0.11 0.20 -0.55 0.00 0.00 176.35 175.18 1maa s ASN 100 N -3.38 1.27 -0.03 1.48 0.01 0.59 -1.31 114.94 113.57 1maa s ASN 100 Ca 0.35 -0.28 0.04 0.00 -0.71 0.00 0.00 52.86 52.27 1maa s ASN 100 Cb 0.08 -0.11 -0.01 0.00 0.41 0.00 0.00 41.25 41.62 1maa s ASN 100 CO 0.13 0.07 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.95 1maa s VAL 101 N -0.49 1.29 -0.09 1.60 1.01 0.99 -1.35 120.40 123.35 1maa s VAL 101 Ca 0.02 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1maa s VAL 101 Cb -0.05 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.25 1maa s VAL 101 CO 0.00 0.37 -0.11 0.26 0.00 0.00 0.00 175.10 175.62 1maa s TRP 102 N -0.17 1.59 0.23 5.22 0.51 -0.02 -0.21 118.94 126.10 1maa s TRP 102 Ca 0.02 -0.70 0.03 0.00 -2.12 0.00 0.00 56.10 53.32 1maa s TRP 102 Cb -0.08 -1.21 -0.05 0.00 -0.81 0.00 0.00 33.47 31.32 1maa s TRP 102 CO 0.00 -0.40 0.03 0.95 -0.51 0.00 0.00 176.95 177.02 1maa s THR 103 N 1.07 0.84 0.90 2.01 -4.23 -0.29 -1.07 115.64 114.87 1maa s THR 103 Ca -0.06 -2.01 -0.12 0.00 -1.18 0.00 0.00 61.69 58.32 1maa s THR 103 Cb -0.15 -2.40 0.13 0.00 1.34 0.00 0.00 72.50 71.43 1maa s THR 103 CO -0.01 -0.25 1.10 -2.84 -0.54 0.00 0.00 174.62 172.07 1maa s PRO 104 N -3.92 1.22 -0.17 3.99 0.02 -1.26 -0.34 135.00 134.54 1maa s PRO 104 Ca 0.30 0.67 0.01 0.00 0.02 0.00 0.00 61.00 62.00 1maa s PRO 104 Cb 0.07 -1.82 0.02 0.00 0.02 0.00 0.00 34.50 32.79 1maa s PRO 104 CO 0.09 -2.22 -0.16 -0.47 -0.33 0.00 0.00 177.00 173.91 1maa s TYR 105 N -3.02 2.46 0.85 6.54 6.14 -1.22 -2.85 117.35 126.24 1maa s TYR 105 Ca 0.63 -1.44 -0.12 0.00 0.64 0.00 0.00 57.07 56.78 1maa s TYR 105 Cb -0.17 -1.74 0.10 0.00 0.42 0.00 0.00 41.96 40.57 1maa s TYR 105 CO 0.56 -0.74 1.10 -1.25 0.64 0.00 0.00 175.55 175.86 1maa s PRO 106 N 1.39 1.66 0.24 4.97 0.04 -1.26 -4.65 135.00 137.39 1maa s PRO 106 Ca 0.04 0.66 -0.31 0.00 0.04 0.00 0.00 61.00 61.42 1maa s PRO 106 Cb -0.13 -1.87 -0.13 0.00 0.04 0.00 0.00 34.50 32.41 1maa s PRO 106 CO -0.11 -1.92 1.52 0.54 0.04 0.00 0.00 177.00 177.07 1maa n ARG 107 N -3.64 2.32 -1.57 4.56 1.74 -1.13 -4.88 116.66 114.07 1maa n ARG 107 Ca 0.07 0.83 -0.44 0.00 -0.77 0.00 0.00 57.85 57.54 1maa n ARG 107 Cb 0.56 -2.56 -0.01 0.00 -1.02 0.00 0.00 32.46 29.43 1maa n ARG 107 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1maa n PRO 108 N 2.47 1.18 -0.03 5.56 -0.04 -1.26 -4.95 135.00 137.93 1maa n PRO 108 Ca 0.12 0.42 -0.14 0.00 -0.04 0.00 0.00 63.50 63.85 1maa n PRO 108 Cb 0.33 -1.77 -0.10 0.00 -0.04 0.00 0.00 33.50 31.92 1maa n PRO 108 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1maa h ALA 109 N 1.75 0.09 -2.71 0.55 0.00 -1.94 -3.45 119.26 113.56 1maa h ALA 109 Ca -0.39 -0.40 -0.66 0.00 0.00 0.00 0.00 54.91 53.47 1maa h ALA 109 Cb 1.35 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.07 1maa h ALA 109 CO 0.59 0.06 -0.48 0.45 0.00 0.00 0.00 179.25 179.87 1maa s SER 110 N -6.20 6.38 -0.14 0.00 0.15 -1.26 -5.04 113.70 107.59 1maa s SER 110 Ca -0.15 0.42 -0.34 0.00 0.70 0.00 0.00 55.95 56.59 1maa s SER 110 Cb 0.03 -2.04 -0.11 0.00 -1.71 0.00 0.00 66.02 62.18 1maa s SER 110 CO 0.74 0.35 1.97 -2.65 1.20 0.00 0.00 173.24 174.85 1maa n PRO 111 N 1.55 2.02 -3.96 5.44 -0.02 -1.26 -4.93 135.00 133.83 1maa n PRO 111 Ca -0.16 0.70 -0.27 0.00 -2.02 0.00 0.00 63.50 61.75 1maa n PRO 111 Cb 0.54 -2.70 -0.04 0.00 -0.02 0.00 0.00 33.50 31.29 1maa n PRO 111 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1maa s THR 112 N 5.04 5.20 0.24 3.45 -4.23 0.04 -4.68 115.64 120.70 1maa s THR 112 Ca 0.96 -0.68 -0.30 0.00 -1.18 0.00 0.00 61.69 60.48 1maa s THR 112 Cb -0.67 -3.64 -0.10 0.00 1.34 0.00 0.00 72.50 69.43 1maa s THR 112 CO 0.49 -0.04 1.50 -2.84 -0.54 0.00 0.00 174.62 173.19 1maa s PRO 113 N -3.04 4.23 0.17 3.99 0.02 -1.26 0.66 135.00 139.76 1maa s PRO 113 Ca 0.34 2.37 -0.11 0.00 0.02 0.00 0.00 61.00 63.63 1maa s PRO 113 Cb -0.11 -3.10 -0.07 0.00 0.02 0.00 0.00 34.50 31.24 1maa s PRO 113 CO 0.27 -0.50 0.50 0.08 -0.33 0.00 0.00 177.00 177.03 1maa s VAL 114 N 0.20 4.96 -0.12 3.83 1.01 -0.88 -3.48 120.40 125.92 1maa s VAL 114 Ca 0.62 0.53 0.01 0.00 0.00 0.00 0.00 61.98 63.14 1maa s VAL 114 Cb -0.44 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.30 1maa s VAL 114 CO 0.42 0.11 -0.14 -0.76 0.00 0.00 0.00 175.10 174.73 1maa s LEU 115 N -2.36 1.65 -0.16 3.92 1.43 -0.51 -1.45 118.68 121.19 1maa s LEU 115 Ca 0.41 -0.43 -0.02 0.00 -1.03 0.00 0.00 54.13 53.05 1maa s LEU 115 Cb -0.13 -1.09 -0.02 0.00 0.03 0.00 0.00 46.19 44.98 1maa s LEU 115 CO 0.20 -0.03 -0.09 -0.63 0.23 0.00 0.00 176.35 176.04 1maa s ILE 116 N 1.26 3.33 -0.19 -0.59 1.01 0.41 -1.05 121.20 125.38 1maa s ILE 116 Ca -0.01 -0.55 -0.07 0.00 0.00 0.00 0.00 60.65 60.02 1maa s ILE 116 Cb -0.14 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 1maa s ILE 116 CO -0.06 0.49 0.06 0.86 0.00 0.00 0.00 174.94 176.29 1maa s TRP 117 N 0.65 3.23 -0.26 3.97 -0.11 -0.28 -0.50 118.94 125.64 1maa s TRP 117 Ca -0.05 0.02 -0.02 0.00 1.22 0.00 0.00 56.10 57.27 1maa s TRP 117 Cb -0.15 -2.10 0.03 0.00 -1.50 0.00 0.00 33.47 29.75 1maa s TRP 117 CO 0.02 0.09 -0.04 0.42 -4.62 0.00 0.00 176.95 172.83 1maa s ILE 118 N 0.51 2.97 0.70 5.86 1.01 -0.03 -3.79 121.20 128.44 1maa s ILE 118 Ca 0.03 -1.04 -0.13 0.00 0.00 0.00 0.00 60.65 59.51 1maa s ILE 118 Cb -0.13 -2.53 0.02 0.00 0.01 0.00 0.00 42.46 39.83 1maa s ILE 118 CO 0.01 0.16 1.10 -0.72 0.00 0.00 0.00 174.94 175.49 1maa s TYR 119 N 1.33 2.60 0.00 3.97 -0.85 -1.26 -3.61 117.35 119.53 1maa s TYR 119 Ca -0.00 1.55 0.00 0.00 -0.52 0.00 0.00 57.07 58.10 1maa s TYR 119 Cb -0.17 -3.13 0.00 0.00 0.38 0.00 0.00 41.96 39.04 1maa s TYR 119 CO -0.04 -1.74 0.00 0.41 -1.52 0.00 0.00 175.55 172.67 1maa n GLY 120 N -0.76 0.55 0.28 5.49 0.00 -1.19 -3.11 105.19 106.44 1maa n GLY 120 Ca 0.10 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1maa n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maa n GLY 121 N 4.57 1.38 2.57 -0.02 0.00 -1.26 -4.40 105.19 108.03 1maa n GLY 121 Ca 0.00 -0.14 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 1maa n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maa n GLY 122 N -1.52 -0.50 3.97 -0.02 0.00 -1.26 -2.10 105.19 103.76 1maa n GLY 122 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1maa n GLY 122 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1maa n PHE 123 N -3.37 0.00 0.58 1.61 3.72 -1.26 -4.67 117.46 114.06 1maa n PHE 123 Ca -0.11 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.35 1maa n PHE 123 Cb 0.59 -1.22 -0.01 0.00 -0.94 0.00 0.00 39.48 37.90 1maa n PHE 123 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 1maa n TYR 124 N -2.00 0.00 -3.82 1.38 4.11 -0.95 0.13 117.16 116.02 1maa n TYR 124 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.90 57.82 1maa n TYR 124 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 39.34 39.36 1maa n TYR 124 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.86 175.32 1maa s SER 125 N -1.71 0.01 0.00 9.48 1.04 -0.89 -3.84 113.70 117.79 1maa s SER 125 Ca 0.10 -1.09 0.00 0.00 0.48 0.00 0.00 55.95 55.44 1maa s SER 125 Cb 0.10 0.80 0.00 0.00 0.10 0.00 0.00 66.02 67.02 1maa s SER 125 CO 0.36 -1.59 0.00 0.61 0.98 0.00 0.00 173.24 173.59 1maa n GLY 126 N -0.56 2.51 3.60 7.32 0.00 -1.26 -4.20 105.19 112.60 1maa n GLY 126 Ca -0.08 -2.13 -0.06 0.00 0.00 0.00 0.00 46.02 43.75 1maa n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1maa s ALA 127 N -2.04 -2.02 -0.73 4.61 0.00 -1.26 -4.62 121.76 115.70 1maa s ALA 127 Ca 0.00 1.68 0.26 0.00 0.00 0.00 0.00 51.96 53.90 1maa s ALA 127 Cb 0.00 -0.87 0.74 0.00 0.00 0.00 0.00 23.12 22.99 1maa s ALA 127 CO 0.00 -0.34 1.70 0.00 0.00 0.00 0.00 175.76 177.11 1maa n ALA 128 N 0.48 2.41 0.29 0.00 0.00 -1.26 -3.64 120.51 118.79 1maa n ALA 128 Ca -0.05 -0.07 0.17 0.00 0.00 0.00 0.00 53.44 53.49 1maa n ALA 128 Cb 0.58 -1.41 0.88 0.00 0.00 0.00 0.00 19.45 19.50 1maa n ALA 128 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1maa h SER 129 N 0.00 0.00 -3.35 0.00 0.02 -1.92 -3.45 113.55 104.84 1maa h SER 129 Ca 0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.39 1maa h SER 129 Cb 0.73 0.00 0.10 0.00 0.14 0.00 0.00 62.40 63.37 1maa h SER 129 CO 0.00 0.05 0.65 0.18 -1.14 0.00 0.00 176.83 176.57 1maa n LEU 130 N -3.39 3.91 0.21 5.07 4.77 -1.24 -4.91 117.00 121.42 1maa n LEU 130 Ca -0.02 1.19 0.11 0.00 -0.03 0.00 0.00 56.01 57.27 1maa n LEU 130 Cb 0.19 -1.53 0.68 0.00 -2.33 0.00 0.00 43.42 40.43 1maa n LEU 130 CO 0.26 -0.22 1.10 0.44 -1.33 0.00 0.00 177.39 177.64 1maa h ASP 131 N 3.27 0.00 1.63 -1.43 5.19 -1.88 -0.66 116.42 122.55 1maa h ASP 131 Ca -0.47 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 1maa h ASP 131 Cb 1.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.77 1maa h ASP 131 CO 0.68 0.00 0.00 -0.37 -3.12 0.00 0.00 179.24 176.43 1maa h VAL 132 N 0.00 0.00 -0.88 -1.35 -1.51 -1.91 -3.15 116.25 107.46 1maa h VAL 132 Ca 0.05 -0.81 -0.56 0.00 -1.23 0.00 0.00 66.70 64.15 1maa h VAL 132 Cb 0.21 1.81 -0.26 0.00 -2.13 0.00 0.00 31.29 30.92 1maa h VAL 132 CO -0.00 0.00 0.72 -1.22 -1.23 0.00 0.00 177.57 175.84 1maa n TYR 133 N -3.07 2.80 -2.75 5.19 4.01 -0.25 -4.57 117.16 118.51 1maa n TYR 133 Ca 0.03 -2.48 -0.43 0.00 -0.16 0.00 0.00 57.90 54.86 1maa n TYR 133 Cb 0.45 -1.21 -0.03 0.00 -0.31 0.00 0.00 39.34 38.24 1maa n TYR 133 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1maa s ASP 134 N -1.26 6.72 0.39 7.72 -1.08 -1.19 -4.91 116.67 123.06 1maa s ASP 134 Ca 0.55 0.64 0.13 0.00 -0.52 0.00 0.00 52.55 53.35 1maa s ASP 134 Cb 0.44 -2.49 0.79 0.00 -1.46 0.00 0.00 42.92 40.20 1maa s ASP 134 CO 0.02 -0.91 1.87 1.23 0.52 0.00 0.00 175.17 177.89 1maa h GLY 135 N 10.23 0.00 -0.73 2.66 0.00 -1.92 -3.34 103.07 109.96 1maa h GLY 135 Ca -0.23 0.00 0.18 0.00 0.00 0.00 0.00 47.33 47.28 1maa h GLY 135 CO 1.01 0.00 -0.07 -2.13 0.00 0.00 0.00 176.54 175.35 1maa n ARG 136 N -4.15 -0.06 -0.01 4.80 0.63 -1.26 -1.12 116.66 115.49 1maa n ARG 136 Ca -0.02 1.11 -0.17 0.00 -0.92 0.00 0.00 57.85 57.85 1maa n ARG 136 Cb 0.37 -1.72 -0.09 0.00 0.45 0.00 0.00 32.46 31.47 1maa n ARG 136 CO 0.00 0.00 0.00 0.74 -2.51 0.00 0.00 177.63 175.86 1maa h PHE 137 N 0.00 0.80 -0.54 -0.14 -1.00 -1.77 -1.24 116.94 113.05 1maa h PHE 137 Ca 0.40 -0.38 -0.02 0.00 2.81 0.00 0.00 57.97 60.79 1maa h PHE 137 Cb 0.74 -0.12 -0.03 0.00 3.61 0.00 0.00 35.95 40.16 1maa h PHE 137 CO -0.45 1.18 0.28 1.25 -1.61 0.00 0.00 178.31 178.95 1maa h LEU 138 N 0.20 0.69 0.07 1.54 5.85 -1.37 0.21 115.31 122.51 1maa h LEU 138 Ca -0.06 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 1maa h LEU 138 Cb 1.29 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.14 1maa h LEU 138 CO 0.13 0.61 -0.03 0.00 -0.34 0.00 0.00 178.44 178.80 1maa h ALA 139 N 1.11 -0.10 0.12 1.25 0.00 -1.12 -0.21 119.26 120.31 1maa h ALA 139 Ca 0.19 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1maa h ALA 139 Cb 0.09 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1maa h ALA 139 CO -0.03 -0.46 -0.06 0.37 0.00 0.00 0.00 179.25 179.08 1maa h GLN 140 N -0.28 -0.15 -0.21 0.00 -0.00 -1.14 0.33 115.11 113.66 1maa h GLN 140 Ca -0.01 0.01 -0.11 0.00 -0.00 0.00 0.00 58.65 58.54 1maa h GLN 140 Cb 0.24 0.03 -0.00 0.00 0.00 0.00 0.00 27.48 27.76 1maa h GLN 140 CO 0.02 0.23 -0.32 0.28 0.00 0.00 0.00 178.83 179.04 1maa h VAL 141 N -0.56 1.33 -0.01 2.39 2.07 -0.64 -3.31 116.25 117.51 1maa h VAL 141 Ca -0.02 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 65.98 1maa h VAL 141 Cb 0.45 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1maa h VAL 141 CO 0.03 0.47 -0.55 -0.62 0.02 0.00 0.00 177.57 176.92 1maa n GLU 142 N -4.31 1.47 -1.30 1.57 -0.58 -0.11 -4.99 120.64 112.38 1maa n GLU 142 Ca -0.05 -0.53 -0.08 0.00 -0.42 0.00 0.00 57.16 56.08 1maa n GLU 142 Cb 0.48 -1.33 -0.03 0.00 -0.57 0.00 0.00 31.44 30.00 1maa n GLU 142 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1maa n GLY 143 N 1.30 0.92 3.85 0.62 0.00 0.10 -4.98 105.19 107.00 1maa n GLY 143 Ca 0.06 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 1maa n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1maa s ALA 144 N -2.30 2.83 -0.33 4.61 0.00 -1.21 -4.76 121.76 120.59 1maa s ALA 144 Ca 0.00 -0.11 -0.08 0.00 0.00 0.00 0.00 51.96 51.77 1maa s ALA 144 Cb 0.00 -3.10 0.02 0.00 0.00 0.00 0.00 23.12 20.04 1maa s ALA 144 CO 0.00 -1.07 0.12 0.08 0.00 0.00 0.00 175.76 174.90 1maa s VAL 145 N -3.18 4.11 -0.23 0.00 1.01 -1.23 -4.31 120.40 116.58 1maa s VAL 145 Ca 0.57 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.66 1maa s VAL 145 Cb -0.12 -3.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.02 1maa s VAL 145 CO 0.54 -0.08 -0.01 -0.22 0.00 0.00 0.00 175.10 175.33 1maa s LEU 146 N 1.49 3.07 0.12 3.92 0.20 -0.23 -1.43 118.68 125.82 1maa s LEU 146 Ca 0.01 -0.33 0.05 0.00 0.69 0.00 0.00 54.13 54.55 1maa s LEU 146 Cb -0.18 -1.80 -0.04 0.00 -0.43 0.00 0.00 46.19 43.74 1maa s LEU 146 CO 0.04 -0.02 0.04 -0.69 -0.29 0.00 0.00 176.35 175.42 1maa s VAL 147 N 1.50 4.12 -0.27 1.68 1.01 -0.22 -0.84 120.40 127.38 1maa s VAL 147 Ca 0.06 -1.07 -0.17 0.00 0.00 0.00 0.00 61.98 60.80 1maa s VAL 147 Cb -0.14 -3.02 0.08 0.00 0.00 0.00 0.00 36.38 33.30 1maa s VAL 147 CO -0.01 0.03 0.68 -0.94 0.00 0.00 0.00 175.10 174.86 1maa s SER 148 N -2.61 -0.91 0.36 3.32 1.04 -0.46 -1.13 113.70 113.31 1maa s SER 148 Ca 0.28 1.48 0.08 0.00 0.48 0.00 0.00 55.95 58.27 1maa s SER 148 Cb -0.11 1.37 -0.07 0.00 0.10 0.00 0.00 66.02 67.31 1maa s SER 148 CO 0.20 -0.24 -0.05 0.00 0.98 0.00 0.00 173.24 174.13 1maa s MET 149 N 1.49 1.84 -0.12 4.02 0.23 -1.25 -0.30 119.30 125.22 1maa s MET 149 Ca -0.09 -1.99 -0.06 0.00 -1.03 0.00 0.00 55.69 52.52 1maa s MET 149 Cb -0.05 -1.59 -0.04 0.00 -1.53 0.00 0.00 34.83 31.62 1maa s MET 149 CO -0.17 0.05 0.11 -0.80 -2.03 0.00 0.00 175.02 172.17 1maa s ASN 150 N -3.62 6.12 0.04 -1.18 -0.87 -0.99 -4.50 114.94 109.94 1maa s ASN 150 Ca 0.33 0.38 0.03 0.00 -1.57 0.00 0.00 52.86 52.03 1maa s ASN 150 Cb 0.06 -1.95 -0.02 0.00 -0.02 0.00 0.00 41.25 39.32 1maa s ASN 150 CO 0.17 0.38 -0.10 -0.72 -2.57 0.00 0.00 177.10 174.26 1maa s TYR 151 N -0.87 0.88 0.50 2.20 -0.85 -1.26 -4.56 117.35 113.38 1maa s TYR 151 Ca 0.14 -0.42 -0.23 0.00 -0.52 0.00 0.00 57.07 56.04 1maa s TYR 151 Cb -0.12 -0.52 -0.07 0.00 0.38 0.00 0.00 41.96 41.64 1maa s TYR 151 CO 0.03 -0.02 1.33 0.54 -1.52 0.00 0.00 175.55 175.91 1maa n ARG 152 N 1.67 1.83 -4.40 -3.49 1.74 -1.26 -4.89 116.66 107.85 1maa n ARG 152 Ca -0.20 0.66 -0.20 0.00 -0.77 0.00 0.00 57.85 57.34 1maa n ARG 152 Cb 0.55 -2.51 -0.10 0.00 -1.02 0.00 0.00 32.46 29.37 1maa n ARG 152 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1maa s VAL 153 N -1.26 1.08 0.00 1.55 -7.23 -1.26 -4.38 120.40 108.90 1maa s VAL 153 Ca 0.67 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.82 1maa s VAL 153 Cb -0.45 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 33.85 1maa s VAL 153 CO 0.53 -0.10 0.00 0.61 -0.31 0.00 0.00 175.10 175.83 1maa n GLY 154 N -0.58 1.16 0.36 2.32 0.00 0.36 -2.53 105.19 106.28 1maa n GLY 154 Ca -0.03 -0.58 0.10 0.00 0.00 0.00 0.00 46.02 45.51 1maa n GLY 154 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1maa h THR 155 N 0.00 0.82 -0.48 2.61 1.35 -1.89 0.36 112.91 115.69 1maa h THR 155 Ca 0.00 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 1maa h THR 155 Cb 0.00 -0.13 -0.02 0.00 -1.73 0.00 0.00 68.15 66.27 1maa h THR 155 CO 0.00 0.16 0.31 -0.26 -0.25 0.00 0.00 175.52 175.48 1maa h PHE 156 N 0.88 0.60 0.00 4.73 0.04 -1.88 -1.50 116.94 119.81 1maa h PHE 156 Ca 0.53 0.01 0.00 0.00 2.80 0.00 0.00 57.97 61.31 1maa h PHE 156 Cb 0.68 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.63 1maa h PHE 156 CO -0.00 0.38 -1.18 0.41 -0.60 0.00 0.00 178.31 177.32 1maa n GLY 157 N -1.21 -1.05 0.00 -1.45 0.00 -0.98 -4.00 105.19 96.49 1maa n GLY 157 Ca 0.02 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1maa n GLY 157 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1maa n PHE 158 N -1.73 0.00 -1.76 1.61 3.72 0.12 -1.15 117.46 118.28 1maa n PHE 158 Ca 0.02 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 1maa n PHE 158 Cb 0.40 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.91 1maa n PHE 158 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1maa s LEU 159 N -0.52 4.40 0.06 4.37 0.20 -0.57 -4.45 118.68 122.17 1maa s LEU 159 Ca 0.00 2.66 0.06 0.00 0.69 0.00 0.00 54.13 57.55 1maa s LEU 159 Cb 0.00 -3.56 -0.03 0.00 -0.43 0.00 0.00 46.19 42.18 1maa s LEU 159 CO 0.00 -0.99 -0.17 0.00 -0.29 0.00 0.00 176.35 174.90 1maa s ALA 160 N 3.21 1.43 -0.51 5.97 0.00 -1.26 -4.21 121.76 126.39 1maa s ALA 160 Ca 0.81 -1.01 0.06 0.00 0.00 0.00 0.00 51.96 51.82 1maa s ALA 160 Cb -0.43 -0.21 0.22 0.00 0.00 0.00 0.00 23.12 22.70 1maa s ALA 160 CO 0.37 0.27 0.54 1.28 0.00 0.00 0.00 175.76 178.22 1maa n LEU 161 N 1.54 1.38 -3.92 0.00 4.32 -0.65 -3.85 117.00 115.82 1maa n LEU 161 Ca -0.19 -4.90 -0.51 0.00 -0.02 0.00 0.00 56.01 50.39 1maa n LEU 161 Cb 0.54 0.08 -0.07 0.00 -1.62 0.00 0.00 43.42 42.35 1maa n LEU 161 CO 0.22 1.98 0.49 -2.65 -1.22 0.00 0.00 177.39 176.21 1maa n PRO 162 N 1.65 0.00 0.00 3.23 -0.02 -1.26 -1.61 135.00 136.99 1maa n PRO 162 Ca 0.25 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1maa n PRO 162 Cb 0.46 -1.30 0.00 0.00 -0.02 0.00 0.00 33.50 32.64 1maa n PRO 162 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1maa n GLY 163 N 1.32 2.24 3.90 -1.23 0.00 -1.26 -5.04 105.19 105.11 1maa n GLY 163 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1maa n GLY 163 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1maa s SER 164 N -1.93 5.39 -0.16 1.61 1.04 -0.63 -5.02 113.70 114.00 1maa s SER 164 Ca 0.00 0.85 -0.23 0.00 0.48 0.00 0.00 55.95 57.05 1maa s SER 164 Cb 0.00 -1.70 -0.23 0.00 0.10 0.00 0.00 66.02 64.18 1maa s SER 164 CO 0.00 -1.28 0.48 0.03 0.98 0.00 0.00 173.24 173.46 1maa h ARG 165 N -0.46 0.05 0.00 4.02 3.08 -1.96 -3.29 114.38 115.81 1maa h ARG 165 Ca -0.45 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.52 1maa h ARG 165 Cb 1.27 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.34 1maa h ARG 165 CO 0.62 1.04 0.00 -0.85 -1.07 0.00 0.00 179.97 179.71 1maa n GLU 166 N -4.41 0.09 -2.79 0.04 0.00 -1.26 -3.96 120.64 108.36 1maa n GLU 166 Ca -0.23 0.39 -0.10 0.00 0.00 0.00 0.00 57.16 57.22 1maa n GLU 166 Cb 0.65 -1.70 0.05 0.00 0.00 0.00 0.00 31.44 30.44 1maa n GLU 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1maa n ALA 167 N -1.64 -0.79 0.36 -1.84 0.00 -1.26 -4.07 120.51 111.26 1maa n ALA 167 Ca 0.02 -1.64 0.12 0.00 0.00 0.00 0.00 53.44 51.94 1maa n ALA 167 Cb 0.16 -1.22 0.51 0.00 0.00 0.00 0.00 19.45 18.90 1maa n ALA 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1maa n PRO 168 N 1.12 0.19 0.00 0.00 -0.04 -1.24 -1.64 135.00 133.40 1maa n PRO 168 Ca 0.09 0.46 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1maa n PRO 168 Cb 0.65 -1.90 0.00 0.00 -0.04 0.00 0.00 33.50 32.21 1maa n PRO 168 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1maa n GLY 169 N -0.21 -1.74 3.34 0.55 0.00 -1.26 -4.63 105.19 101.24 1maa n GLY 169 Ca 0.01 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.50 1maa n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1maa n ASN 170 N -2.31 -1.85 -0.26 1.61 3.02 -1.26 -4.87 115.26 109.34 1maa n ASN 170 Ca 0.00 0.00 0.17 0.00 -0.03 0.00 0.00 54.58 54.72 1maa n ASN 170 Cb 0.00 -2.07 0.46 0.00 -0.61 0.00 0.00 39.78 37.56 1maa n ASN 170 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 1maa h VAL 171 N 0.00 0.72 0.00 2.41 -1.51 -1.84 0.33 116.25 116.35 1maa h VAL 171 Ca 0.00 -0.17 -0.02 0.00 -1.23 0.00 0.00 66.70 65.28 1maa h VAL 171 Cb 0.26 0.17 -0.00 0.00 -2.13 0.00 0.00 31.29 29.58 1maa h VAL 171 CO 0.00 0.09 -0.09 1.23 -1.23 0.00 0.00 177.57 177.57 1maa h GLY 172 N 0.51 0.00 1.52 5.19 0.00 -1.37 0.51 103.07 109.42 1maa h GLY 172 Ca 0.47 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.57 1maa h GLY 172 CO -0.21 0.00 -0.96 1.41 0.00 0.00 0.00 176.54 176.79 1maa h LEU 173 N 0.00 0.56 -0.68 3.11 3.38 -0.63 -2.83 115.31 118.22 1maa h LEU 173 Ca -0.00 -0.45 -0.05 0.00 0.09 0.00 0.00 57.88 57.47 1maa h LEU 173 Cb 0.21 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1maa h LEU 173 CO 0.01 1.25 0.24 -0.07 0.09 0.00 0.00 178.44 179.97 1maa h LEU 174 N 0.24 0.97 -0.18 1.67 3.38 -0.83 -0.84 115.31 119.72 1maa h LEU 174 Ca -0.08 -0.19 0.05 0.00 0.09 0.00 0.00 57.88 57.75 1maa h LEU 174 Cb 1.60 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 42.03 1maa h LEU 174 CO 0.17 0.90 -0.22 0.44 0.09 0.00 0.00 178.44 179.81 1maa h ASP 175 N 0.98 -0.70 -0.74 -0.43 3.32 -0.90 0.42 116.42 118.37 1maa h ASP 175 Ca 0.22 0.12 0.05 0.00 0.02 0.00 0.00 57.03 57.45 1maa h ASP 175 Cb 0.26 0.32 -0.04 0.00 0.22 0.00 0.00 39.33 40.09 1maa h ASP 175 CO -0.01 -0.27 0.49 1.56 -1.72 0.00 0.00 179.24 179.28 1maa h GLN 176 N -0.26 0.81 -0.00 3.56 4.20 -1.18 -0.55 115.11 121.68 1maa h GLN 176 Ca 0.12 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 1maa h GLN 176 Cb 0.43 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 1maa h GLN 176 CO -0.33 0.53 -0.00 -0.09 -0.67 0.00 0.00 178.83 178.28 1maa h ARG 177 N 0.83 0.01 -0.90 1.46 2.43 0.43 -0.86 114.38 117.78 1maa h ARG 177 Ca 0.31 -0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.60 1maa h ARG 177 Cb 0.16 -0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.64 1maa h ARG 177 CO -0.10 0.36 0.58 1.25 -1.51 0.00 0.00 179.97 180.55 1maa h LEU 178 N -0.35 0.74 -0.66 3.80 6.46 0.28 0.50 115.31 126.07 1maa h LEU 178 Ca 0.00 0.03 -0.09 0.00 -0.12 0.00 0.00 57.88 57.71 1maa h LEU 178 Cb 0.36 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.15 1maa h LEU 178 CO 0.00 0.40 0.06 0.00 -0.62 0.00 0.00 178.44 178.28 1maa h ALA 179 N 1.58 0.88 -0.20 1.25 0.00 -0.90 -1.06 119.26 120.81 1maa h ALA 179 Ca 0.44 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1maa h ALA 179 Cb 0.57 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1maa h ALA 179 CO -0.20 0.67 -0.19 -0.07 0.00 0.00 0.00 179.25 179.46 1maa h LEU 180 N 1.02 0.34 -0.02 0.00 4.07 0.13 -1.07 115.31 119.78 1maa h LEU 180 Ca 0.19 -0.09 -0.02 0.00 0.08 0.00 0.00 57.88 58.04 1maa h LEU 180 Cb 0.50 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.15 1maa h LEU 180 CO 0.02 0.55 -0.07 1.56 -1.08 0.00 0.00 178.44 179.42 1maa h GLN 181 N 0.32 0.09 -0.40 1.13 4.20 -0.37 -2.25 115.11 117.83 1maa h GLN 181 Ca 0.06 -0.06 0.08 0.00 0.06 0.00 0.00 58.65 58.78 1maa h GLN 181 Cb 0.52 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.24 1maa h GLN 181 CO 0.03 0.69 -0.04 2.35 -0.67 0.00 0.00 178.83 181.19 1maa h TRP 182 N -0.50 -0.11 -0.64 2.96 7.01 -1.00 0.20 115.95 123.87 1maa h TRP 182 Ca -0.00 0.03 0.08 0.00 2.11 0.00 0.00 58.89 61.11 1maa h TRP 182 Cb 0.70 0.11 -0.04 0.00 -2.10 0.00 0.00 29.16 27.83 1maa h TRP 182 CO 0.14 -0.12 0.42 0.28 -2.79 0.00 0.00 178.44 176.37 1maa h VAL 183 N 0.06 0.94 -0.24 2.65 2.07 -1.21 -0.54 116.25 119.98 1maa h VAL 183 Ca 0.20 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 1maa h VAL 183 Cb 0.29 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1maa h VAL 183 CO -0.37 0.10 0.12 -0.61 0.02 0.00 0.00 177.57 176.83 1maa h GLN 184 N 0.53 0.34 0.07 1.57 5.75 -0.00 -1.41 115.11 121.96 1maa h GLN 184 Ca 0.29 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.74 1maa h GLN 184 Cb 0.43 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.92 1maa h GLN 184 CO -0.09 0.33 -0.03 1.49 -2.65 0.00 0.00 178.83 177.87 1maa h GLU 185 N 0.26 -0.09 0.00 1.69 4.81 -0.83 -3.40 114.58 117.02 1maa h GLU 185 Ca 0.08 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1maa h GLU 185 Cb 0.09 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1maa h GLU 185 CO -0.01 -0.06 0.00 0.09 -0.73 0.00 0.00 179.01 178.30 1maa n ASN 186 N -2.77 0.63 0.30 1.04 3.02 -0.26 -4.02 115.26 113.21 1maa n ASN 186 Ca -0.01 0.63 0.19 0.00 -0.03 0.00 0.00 54.58 55.37 1maa n ASN 186 Cb 0.04 -0.78 0.89 0.00 -0.61 0.00 0.00 39.78 39.32 1maa n ASN 186 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1maa h ILE 187 N 0.00 0.00 -0.41 2.41 6.09 -1.39 -2.01 117.51 122.21 1maa h ILE 187 Ca 0.00 -0.32 -0.05 0.00 -1.37 0.00 0.00 64.86 63.12 1maa h ILE 187 Cb 0.43 1.32 -0.02 0.00 0.47 0.00 0.00 36.82 39.02 1maa h ILE 187 CO 0.00 0.00 0.03 0.00 -3.07 0.00 0.00 178.15 175.11 1maa h ALA 188 N 2.00 1.30 0.00 0.18 0.00 -1.69 0.83 119.26 121.88 1maa h ALA 188 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1maa h ALA 188 Cb 0.32 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1maa h ALA 188 CO 0.00 0.48 0.07 0.00 0.00 0.00 0.00 179.25 179.80 1maa h ALA 189 N 1.43 1.07 -0.00 0.00 0.00 -1.65 0.90 119.26 121.01 1maa h ALA 189 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1maa h ALA 189 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1maa h ALA 189 CO 0.01 -0.07 -0.72 1.19 0.00 0.00 0.00 179.25 179.66 1maa n PHE 190 N -2.99 0.00 0.00 0.00 3.01 -0.69 -4.88 117.46 111.91 1maa n PHE 190 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 1maa n PHE 190 Cb 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.60 1maa n PHE 190 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1maa n GLY 191 N 1.38 1.07 3.86 1.37 0.00 0.31 -4.57 105.19 108.61 1maa n GLY 191 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1maa n GLY 191 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1maa s GLY 192 N -1.80 2.12 -0.44 -0.02 0.00 0.20 -0.78 107.32 106.61 1maa s GLY 192 Ca 0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 44.72 44.56 1maa s GLY 192 CO 0.00 0.18 0.32 -0.35 0.00 0.00 0.00 173.10 173.25 1maa s ASP 193 N -2.79 5.93 0.65 1.64 2.15 0.21 -3.51 116.67 120.96 1maa s ASP 193 Ca 0.54 -1.32 0.35 0.00 0.43 0.00 0.00 52.55 52.55 1maa s ASP 193 Cb -0.10 -2.10 1.89 0.00 -0.30 0.00 0.00 42.92 42.31 1maa s ASP 193 CO 0.25 -0.57 2.09 -0.65 -0.17 0.00 0.00 175.17 176.13 1maa h PRO 194 N 8.59 0.00 -0.70 4.34 0.11 -1.87 0.05 132.00 142.52 1maa h PRO 194 Ca -0.26 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.83 1maa h PRO 194 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1maa h PRO 194 CO 0.80 0.00 0.02 -1.33 -0.21 0.00 0.00 178.00 177.28 1maa n MET 195 N -3.11 3.90 -2.72 1.05 2.81 -1.26 -4.19 117.12 113.59 1maa n MET 195 Ca -0.01 -2.40 -0.03 0.00 -1.81 0.00 0.00 57.70 53.44 1maa n MET 195 Cb 0.28 -2.08 0.09 0.00 -0.71 0.00 0.00 33.22 30.80 1maa n MET 195 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1maa n SER 196 N 0.42 -0.21 -4.72 7.83 2.88 0.00 -4.98 113.62 114.85 1maa n SER 196 Ca 0.22 -2.29 -0.41 0.00 -1.33 0.00 0.00 58.87 55.06 1maa n SER 196 Cb 0.99 0.22 -0.04 0.00 -0.75 0.00 0.00 64.21 64.64 1maa n SER 196 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1maa s VAL 197 N -1.52 4.73 -0.14 2.46 1.01 -1.25 -2.07 120.40 123.62 1maa s VAL 197 Ca 0.20 1.97 -0.00 0.00 0.00 0.00 0.00 61.98 64.15 1maa s VAL 197 Cb 0.40 -4.28 0.03 0.00 0.00 0.00 0.00 36.38 32.54 1maa s VAL 197 CO -0.07 0.25 -0.07 -0.89 0.00 0.00 0.00 175.10 174.32 1maa s THR 198 N 0.51 1.11 0.24 3.92 2.01 -0.53 -1.45 115.64 121.45 1maa s THR 198 Ca 0.48 -0.50 -0.18 0.00 0.31 0.00 0.00 61.69 61.80 1maa s THR 198 Cb -0.22 -1.20 -0.08 0.00 0.01 0.00 0.00 72.50 71.01 1maa s THR 198 CO 0.27 0.24 0.72 -0.76 -0.69 0.00 0.00 174.62 174.41 1maa s LEU 199 N 1.65 4.28 -0.15 4.42 1.43 -0.97 -0.44 118.68 128.91 1maa s LEU 199 Ca 0.03 1.38 -0.12 0.00 -1.03 0.00 0.00 54.13 54.38 1maa s LEU 199 Cb -0.14 -3.68 0.04 0.00 0.03 0.00 0.00 46.19 42.44 1maa s LEU 199 CO -0.08 -0.02 0.39 0.72 0.23 0.00 0.00 176.35 177.59 1maa s PHE 200 N -1.62 -0.45 0.34 0.29 -0.71 0.35 -0.54 117.98 115.64 1maa s PHE 200 Ca 0.45 1.07 -0.03 0.00 -1.04 0.00 0.00 56.93 57.39 1maa s PHE 200 Cb -0.15 0.16 0.00 0.00 -1.21 0.00 0.00 43.02 41.83 1maa s PHE 200 CO 0.20 -0.23 0.48 0.20 -1.34 0.00 0.00 175.22 174.53 1maa s GLY 201 N 0.45 1.46 -0.04 1.99 0.00 -1.12 -0.85 107.32 109.20 1maa s GLY 201 Ca -0.02 -1.50 -0.07 0.00 0.00 0.00 0.00 44.72 43.14 1maa s GLY 201 CO -0.02 -0.98 0.17 1.85 0.00 0.00 0.00 173.10 174.12 1maa s GLU 202 N -3.04 0.32 4.89 2.90 -6.30 -1.24 -2.01 118.70 114.22 1maa s GLU 202 Ca 0.30 0.02 0.00 0.00 -2.50 0.00 0.00 54.97 52.79 1maa s GLU 202 Cb -0.01 0.14 0.00 0.00 0.00 0.00 0.00 34.13 34.27 1maa s GLU 202 CO 0.20 -0.06 0.00 0.45 0.02 0.00 0.00 175.26 175.87 1maa n SER 203 N 2.42 0.00 0.15 -1.70 2.88 -0.81 -0.13 113.62 116.43 1maa n SER 203 Ca -0.16 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.56 1maa n SER 203 Cb 0.58 0.00 0.68 0.00 -0.75 0.00 0.00 64.21 64.72 1maa n SER 203 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1maa h ALA 204 N -0.64 1.96 0.06 -1.46 0.00 -1.84 0.16 119.26 117.49 1maa h ALA 204 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1maa h ALA 204 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1maa h ALA 204 CO 0.00 -0.70 -0.03 0.78 0.00 0.00 0.00 179.25 179.30 1maa h GLY 205 N 0.00 -0.09 1.81 0.00 0.00 -0.47 -1.26 103.07 103.07 1maa h GLY 205 Ca 0.15 0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.47 1maa h GLY 205 CO -0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 176.54 176.38 1maa h ALA 206 N 0.39 1.51 -0.04 3.60 0.00 -0.73 -0.31 119.26 123.68 1maa h ALA 206 Ca -0.01 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1maa h ALA 206 Cb 0.44 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1maa h ALA 206 CO 0.01 0.35 0.02 0.00 0.00 0.00 0.00 179.25 179.63 1maa h ALA 207 N 1.65 0.05 -0.39 0.00 0.00 -1.24 -0.74 119.26 118.59 1maa h ALA 207 Ca 0.05 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1maa h ALA 207 Cb 0.37 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1maa h ALA 207 CO 0.02 -0.40 0.11 0.77 0.00 0.00 0.00 179.25 179.75 1maa h SER 208 N -0.03 0.07 -0.03 0.00 0.02 -0.43 0.78 113.55 113.93 1maa h SER 208 Ca 0.01 0.06 0.04 0.00 -0.84 0.00 0.00 61.79 61.06 1maa h SER 208 Cb 0.10 0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.64 1maa h SER 208 CO -0.00 0.08 -0.33 0.58 -1.14 0.00 0.00 176.83 176.01 1maa h VAL 209 N 0.25 0.28 -0.78 2.27 2.07 -0.85 -0.82 116.25 118.66 1maa h VAL 209 Ca 0.19 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.88 1maa h VAL 209 Cb 0.20 0.28 -0.11 0.00 -1.52 0.00 0.00 31.29 30.14 1maa h VAL 209 CO -0.22 0.00 0.23 1.23 0.02 0.00 0.00 177.57 178.83 1maa h GLY 210 N -0.47 1.16 1.20 2.17 0.00 0.05 0.34 103.07 107.52 1maa h GLY 210 Ca 0.07 -0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.37 1maa h GLY 210 CO -0.29 -0.22 0.43 -0.33 0.00 0.00 0.00 176.54 176.14 1maa h MET 211 N 0.31 0.72 0.00 4.80 2.86 0.47 0.28 114.93 124.37 1maa h MET 211 Ca 0.45 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 58.01 1maa h MET 211 Cb 0.80 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 1maa h MET 211 CO -0.52 0.48 -0.22 0.45 1.06 0.00 0.00 176.91 178.16 1maa h HIS 212 N 0.74 0.00 0.02 -0.22 3.86 0.64 -0.37 115.15 119.82 1maa h HIS 212 Ca 0.27 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.25 1maa h HIS 212 Cb 0.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.61 1maa h HIS 212 CO -0.00 0.22 -0.98 0.82 0.86 0.00 0.00 177.93 178.85 1maa h ILE 213 N 0.00 1.41 -0.02 2.45 2.04 -0.26 -3.20 117.51 119.93 1maa h ILE 213 Ca -0.00 -2.51 0.00 0.00 1.00 0.00 0.00 64.86 63.34 1maa h ILE 213 Cb 0.77 2.48 0.00 0.00 -0.74 0.00 0.00 36.82 39.33 1maa h ILE 213 CO 0.03 0.75 0.00 0.18 0.00 0.00 0.00 178.15 179.11 1maa n LEU 214 N -3.72 1.35 -4.21 1.44 4.32 -0.33 -4.77 117.00 111.08 1maa n LEU 214 Ca -0.07 -0.45 -0.34 0.00 -0.02 0.00 0.00 56.01 55.13 1maa n LEU 214 Cb 0.86 -0.00 -0.15 0.00 -1.62 0.00 0.00 43.42 42.51 1maa n LEU 214 CO 0.51 0.23 -0.44 -0.55 -1.22 0.00 0.00 177.39 175.92 1maa s SER 215 N -1.99 3.87 0.15 -1.43 0.15 -0.19 -4.77 113.70 109.49 1maa s SER 215 Ca 0.39 -0.61 -0.29 0.00 0.70 0.00 0.00 55.95 56.14 1maa s SER 215 Cb 0.21 -1.62 -0.04 0.00 -1.71 0.00 0.00 66.02 62.86 1maa s SER 215 CO 0.34 -0.04 1.56 0.25 1.20 0.00 0.00 173.24 176.55 1maa h LEU 216 N 8.02 -1.63 -0.35 3.45 7.12 -1.85 -1.96 115.31 128.11 1maa h LEU 216 Ca -0.41 0.24 0.07 0.00 0.13 0.00 0.00 57.88 57.91 1maa h LEU 216 Cb 1.14 0.70 -0.07 0.00 -0.53 0.00 0.00 40.66 41.90 1maa h LEU 216 CO 0.61 -0.38 -0.09 -0.65 -0.13 0.00 0.00 178.44 177.80 1maa h PRO 217 N -0.33 -0.01 -0.02 5.25 0.11 -1.96 0.79 132.00 135.83 1maa h PRO 217 Ca 0.12 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.24 1maa h PRO 217 Cb 0.58 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.70 1maa h PRO 217 CO -0.61 -0.01 0.02 0.77 -0.21 0.00 0.00 178.00 177.96 1maa h SER 218 N -0.01 0.00 0.44 -2.05 0.02 -1.72 -2.90 113.55 107.33 1maa h SER 218 Ca 0.17 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1maa h SER 218 Cb 0.26 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 1maa h SER 218 CO -0.36 0.00 -0.09 -0.09 -1.14 0.00 0.00 176.83 175.15 1maa h ARG 219 N 0.00 0.00 -0.81 3.45 2.43 -0.06 -2.67 114.38 116.72 1maa h ARG 219 Ca 0.01 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.03 1maa h ARG 219 Cb 0.06 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 29.52 1maa h ARG 219 CO -0.00 0.09 0.19 -1.13 -1.51 0.00 0.00 179.97 177.61 1maa n SER 220 N -3.48 4.19 0.00 -3.80 3.41 -1.09 -4.01 113.62 108.84 1maa n SER 220 Ca -0.01 -2.89 0.00 0.00 -0.26 0.00 0.00 58.87 55.70 1maa n SER 220 Cb 0.24 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 1maa n SER 220 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1maa n LEU 221 N 0.01 1.42 -3.82 1.04 4.77 -1.01 -5.07 117.00 114.35 1maa n LEU 221 Ca 0.30 -1.42 -0.06 0.00 -0.03 0.00 0.00 56.01 54.80 1maa n LEU 221 Cb 1.12 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.21 1maa n LEU 221 CO 0.33 0.36 0.60 0.72 -1.33 0.00 0.00 177.39 178.06 1maa s PHE 222 N -0.65 -0.09 0.00 -1.77 -0.71 -1.26 -4.88 117.98 108.62 1maa s PHE 222 Ca 0.00 -0.36 0.00 0.00 -1.04 0.00 0.00 56.93 55.53 1maa s PHE 222 Cb 0.00 0.71 0.00 0.00 -1.21 0.00 0.00 43.02 42.52 1maa s PHE 222 CO 0.00 -1.13 0.00 0.72 -1.34 0.00 0.00 175.22 173.47 1maa n HIS 223 N -0.50 0.00 -4.36 3.49 8.25 -0.53 -4.96 115.22 116.60 1maa n HIS 223 Ca -0.05 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.22 1maa n HIS 223 Cb 0.60 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.60 1maa n HIS 223 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1maa s ARG 224 N -1.28 1.44 -0.05 -0.41 0.52 -1.16 -4.31 118.95 113.70 1maa s ARG 224 Ca 0.00 -1.76 -0.24 0.00 -0.52 0.00 0.00 55.73 53.20 1maa s ARG 224 Cb 0.00 -0.62 0.05 0.00 0.52 0.00 0.00 34.95 34.90 1maa s ARG 224 CO 0.00 -0.16 0.54 0.00 0.02 0.00 0.00 175.30 175.70 1maa s ALA 225 N -3.45 -1.40 -0.09 2.13 0.00 -1.10 -2.29 121.76 115.56 1maa s ALA 225 Ca 0.33 1.00 0.01 0.00 0.00 0.00 0.00 51.96 53.29 1maa s ALA 225 Cb 0.07 -0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.16 1maa s ALA 225 CO 0.12 -0.32 -0.09 0.08 0.00 0.00 0.00 175.76 175.54 1maa s VAL 226 N -1.11 1.01 -0.32 0.00 1.01 0.29 -1.18 120.40 120.10 1maa s VAL 226 Ca -0.11 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1maa s VAL 226 Cb -0.02 -0.99 0.08 0.00 0.00 0.00 0.00 36.38 35.44 1maa s VAL 226 CO 0.07 0.35 0.03 -0.76 0.00 0.00 0.00 175.10 174.79 1maa s LEU 227 N 1.28 4.30 -0.28 3.92 1.02 0.88 -2.80 118.68 126.99 1maa s LEU 227 Ca -0.03 -1.66 -0.12 0.00 0.02 0.00 0.00 54.13 52.34 1maa s LEU 227 Cb -0.14 -1.69 -0.05 0.00 0.02 0.00 0.00 46.19 44.34 1maa s LEU 227 CO -0.03 -0.33 0.22 -1.10 0.02 0.00 0.00 176.35 175.12 1maa s GLN 228 N 1.12 3.91 -1.36 1.70 -0.21 -0.85 -2.10 119.66 121.87 1maa s GLN 228 Ca 0.01 -0.31 -0.11 0.00 0.02 0.00 0.00 55.36 54.97 1maa s GLN 228 Cb -0.20 -3.67 0.01 0.00 1.00 0.00 0.00 33.01 30.14 1maa s GLN 228 CO -0.04 -0.22 0.41 0.43 -2.12 0.00 0.00 175.29 173.75 1maa n SER 229 N 5.10 -1.55 0.00 5.90 7.64 -0.12 -1.92 113.62 128.67 1maa n SER 229 Ca -0.13 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.59 1maa n SER 229 Cb 0.52 -2.37 0.00 0.00 -1.01 0.00 0.00 64.21 61.35 1maa n SER 229 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1maa n GLY 230 N -2.14 0.74 3.30 0.23 0.00 -1.26 -2.00 105.19 104.06 1maa n GLY 230 Ca -0.24 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.13 1maa n GLY 230 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1maa s THR 231 N -2.00 0.08 0.15 2.61 -4.23 -1.26 -4.49 115.64 106.50 1maa s THR 231 Ca 0.00 -0.63 0.02 0.00 -1.18 0.00 0.00 61.69 59.91 1maa s THR 231 Cb 0.00 -1.17 -0.17 0.00 1.34 0.00 0.00 72.50 72.50 1maa s THR 231 CO 0.00 -0.35 1.34 1.55 -0.54 0.00 0.00 174.62 176.62 1maa h PRO 232 N 2.44 0.17 -7.55 3.99 0.13 -1.81 -3.39 132.00 125.99 1maa h PRO 232 Ca -0.34 -0.21 -0.46 0.00 -0.87 0.00 0.00 66.00 64.12 1maa h PRO 232 Cb 1.25 0.07 0.11 0.00 0.13 0.00 0.00 31.00 32.55 1maa h PRO 232 CO 0.48 0.99 0.35 0.54 -0.23 0.00 0.00 178.00 180.12 1maa s ASN 233 N -6.92 4.27 0.00 1.44 4.22 -1.26 -4.56 114.94 112.13 1maa s ASN 233 Ca -0.02 0.51 0.00 0.00 -2.14 0.00 0.00 52.86 51.21 1maa s ASN 233 Cb 0.10 -0.94 0.00 0.00 1.28 0.00 0.00 41.25 41.69 1maa s ASN 233 CO 0.83 -2.00 0.00 0.61 -2.04 0.00 0.00 177.10 174.50 1maa n GLY 234 N -3.28 2.34 0.23 0.45 0.00 -1.26 -4.70 105.19 98.96 1maa n GLY 234 Ca 0.10 -2.05 0.08 0.00 0.00 0.00 0.00 46.02 44.15 1maa n GLY 234 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1maa h PRO 235 N 0.00 0.00 0.00 1.61 0.13 -1.88 -3.37 132.00 128.49 1maa h PRO 235 Ca 0.00 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.03 1maa h PRO 235 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1maa h PRO 235 CO 0.00 0.22 -1.61 -2.67 -0.23 0.00 0.00 178.00 173.71 1maa n TRP 236 N -3.83 0.00 0.26 1.56 4.27 -1.26 -4.72 117.44 113.72 1maa n TRP 236 Ca -0.02 0.00 0.15 0.00 -3.89 0.00 0.00 57.50 53.74 1maa n TRP 236 Cb 0.32 -0.39 0.73 0.00 -1.36 0.00 0.00 31.31 30.61 1maa n TRP 236 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1maa h ALA 237 N 0.72 1.00 -2.60 -1.67 0.00 -1.84 -3.43 119.26 111.44 1maa h ALA 237 Ca -0.15 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 1maa h ALA 237 Cb 1.13 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.79 1maa h ALA 237 CO 0.01 0.00 -0.30 0.95 0.00 0.00 0.00 179.25 179.91 1maa s THR 238 N -3.65 0.10 0.06 0.00 -4.23 -1.26 -3.92 115.64 102.74 1maa s THR 238 Ca -0.01 -1.16 0.01 0.00 -1.18 0.00 0.00 61.69 59.35 1maa s THR 238 Cb 0.09 -1.50 -0.03 0.00 1.34 0.00 0.00 72.50 72.40 1maa s THR 238 CO 0.32 -0.47 -0.06 0.68 -0.54 0.00 0.00 174.62 174.55 1maa s VAL 239 N -3.89 0.52 0.91 2.29 -7.23 -0.65 -4.97 120.40 107.37 1maa s VAL 239 Ca 0.09 -1.44 -0.11 0.00 -1.81 0.00 0.00 61.98 58.71 1maa s VAL 239 Cb 0.04 -1.05 0.14 0.00 0.56 0.00 0.00 36.38 36.07 1maa s VAL 239 CO -0.07 -0.63 1.11 -0.94 -0.31 0.00 0.00 175.10 174.26 1maa s SER 240 N -2.23 3.08 0.29 4.85 1.04 -1.26 -1.85 113.70 117.62 1maa s SER 240 Ca -0.01 1.96 0.12 0.00 0.48 0.00 0.00 55.95 58.49 1maa s SER 240 Cb -0.03 -2.49 0.39 0.00 0.10 0.00 0.00 66.02 64.00 1maa s SER 240 CO -0.03 -2.96 1.62 0.00 0.98 0.00 0.00 173.24 172.86 1maa h ALA 241 N -1.77 0.97 -0.21 5.32 0.00 -1.95 -0.99 119.26 120.63 1maa h ALA 241 Ca -0.46 -0.54 -0.15 0.00 0.00 0.00 0.00 54.91 53.77 1maa h ALA 241 Cb 1.27 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1maa h ALA 241 CO 0.46 0.73 -0.45 0.78 0.00 0.00 0.00 179.25 180.77 1maa h GLY 242 N 1.92 0.73 0.77 0.00 0.00 -1.92 -2.13 103.07 102.44 1maa h GLY 242 Ca -0.01 -0.89 -0.01 0.00 0.00 0.00 0.00 47.33 46.43 1maa h GLY 242 CO 0.08 0.79 -0.10 -2.09 0.00 0.00 0.00 176.54 175.22 1maa h GLU 243 N 0.37 -0.27 -0.97 4.80 4.57 -1.90 0.91 114.58 122.09 1maa h GLU 243 Ca 0.00 0.02 0.24 0.00 -1.18 0.00 0.00 59.36 58.44 1maa h GLU 243 Cb 1.06 0.06 -0.13 0.00 -0.16 0.00 0.00 28.75 29.58 1maa h GLU 243 CO 0.10 -0.00 0.54 0.00 -1.18 0.00 0.00 179.01 178.47 1maa h ALA 244 N 0.22 1.70 -0.03 2.92 0.00 -1.20 0.49 119.26 123.36 1maa h ALA 244 Ca -0.03 0.14 -0.20 0.00 0.00 0.00 0.00 54.91 54.81 1maa h ALA 244 Cb 0.39 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1maa h ALA 244 CO 0.05 -0.30 -0.85 -0.09 0.00 0.00 0.00 179.25 178.06 1maa h ARG 245 N 0.52 0.36 0.13 0.00 2.43 -1.10 -1.48 114.38 115.25 1maa h ARG 245 Ca 0.62 -0.35 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1maa h ARG 245 Cb 1.19 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1maa h ARG 245 CO -0.49 1.02 -0.13 -0.09 -1.51 0.00 0.00 179.97 178.77 1maa h ARG 246 N 0.22 -0.28 -0.12 0.20 2.43 0.25 -1.07 114.38 116.01 1maa h ARG 246 Ca -0.05 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1maa h ARG 246 Cb 1.47 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 31.07 1maa h ARG 246 CO 0.14 -0.18 0.07 0.00 -1.51 0.00 0.00 179.97 178.49 1maa h ARG 247 N -0.29 0.16 -0.95 0.20 3.08 -1.13 -0.52 114.38 114.93 1maa h ARG 247 Ca 0.00 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.08 1maa h ARG 247 Cb 0.27 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.23 1maa h ARG 247 CO -0.04 0.18 0.62 0.00 -1.07 0.00 0.00 179.97 179.66 1maa h ALA 248 N 0.97 1.29 -0.09 0.04 0.00 -1.18 0.32 119.26 120.61 1maa h ALA 248 Ca 0.04 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.74 1maa h ALA 248 Cb 0.07 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1maa h ALA 248 CO -0.01 0.46 -0.69 1.15 0.00 0.00 0.00 179.25 180.15 1maa h THR 249 N 1.17 1.37 0.41 0.00 2.02 -0.96 -1.82 112.91 115.09 1maa h THR 249 Ca 0.39 -2.09 -0.02 0.00 0.77 0.00 0.00 66.41 65.47 1maa h THR 249 Cb 0.07 2.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 1maa h THR 249 CO -0.14 0.63 -0.20 0.25 0.37 0.00 0.00 175.52 176.43 1maa h LEU 250 N 0.28 -0.46 -1.06 2.58 5.85 -0.25 -2.14 115.31 120.11 1maa h LEU 250 Ca -0.02 -0.12 0.15 0.00 0.84 0.00 0.00 57.88 58.73 1maa h LEU 250 Cb 1.26 0.12 -0.09 0.00 0.37 0.00 0.00 40.66 42.32 1maa h LEU 250 CO 0.12 -0.10 0.62 0.25 -0.34 0.00 0.00 178.44 178.99 1maa h LEU 251 N -0.87 0.84 -1.06 2.25 6.46 -0.41 0.24 115.31 122.76 1maa h LEU 251 Ca -0.06 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.76 1maa h LEU 251 Cb 0.55 -0.10 -0.04 0.00 -0.73 0.00 0.00 40.66 40.34 1maa h LEU 251 CO 0.09 0.40 0.47 0.00 -0.62 0.00 0.00 178.44 178.78 1maa h ALA 252 N 1.58 1.29 -0.28 1.25 0.00 -1.23 -2.34 119.26 119.53 1maa h ALA 252 Ca 0.52 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 55.19 1maa h ALA 252 Cb 0.67 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1maa h ALA 252 CO -0.29 0.59 -0.35 -0.09 0.00 0.00 0.00 179.25 179.11 1maa h ARG 253 N 1.13 0.72 -0.00 0.00 2.43 0.07 0.43 114.38 119.17 1maa h ARG 253 Ca 0.29 -0.41 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1maa h ARG 253 Cb -0.01 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1maa h ARG 253 CO -0.05 1.03 0.00 -0.07 -1.51 0.00 0.00 179.97 179.37 1maa h LEU 254 N 0.46 0.00 -3.20 3.80 3.38 -0.47 -0.36 115.31 118.92 1maa h LEU 254 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1maa h LEU 254 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1maa h LEU 254 CO 0.08 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.94 1maa n VAL 255 N -3.32 1.99 -1.19 1.22 0.24 -0.98 -4.95 118.33 111.33 1maa n VAL 255 Ca -0.03 -1.50 0.00 0.00 -2.04 0.00 0.00 64.34 60.77 1maa n VAL 255 Cb 0.08 -0.02 0.00 0.00 -1.47 0.00 0.00 33.84 32.43 1maa n VAL 255 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1maa n GLY 256 N 0.18 0.93 0.00 7.63 0.00 -0.14 -5.05 105.19 108.73 1maa n GLY 256 Ca 0.21 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1maa n GLY 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1maa n ASN 265 N -1.07 -7.06 -0.34 0.00 2.85 -1.26 -4.86 115.26 103.53 1maa n ASN 265 Ca 0.00 0.93 0.20 0.00 -0.11 0.00 0.00 54.58 55.60 1maa n ASN 265 Cb 0.00 -1.83 0.44 0.00 1.24 0.00 0.00 39.78 39.64 1maa n ASN 265 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 1maa h ASP 266 N 4.84 0.57 0.30 1.20 5.19 -2.01 -2.04 116.42 124.47 1maa h ASP 266 Ca -0.04 0.12 -0.01 0.00 -0.62 0.00 0.00 57.03 56.47 1maa h ASP 266 Cb 0.20 0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.74 1maa h ASP 266 CO 0.00 0.08 -0.15 0.74 -3.12 0.00 0.00 179.24 176.80 1maa h THR 267 N 0.49 0.73 0.00 0.35 2.02 -2.02 -2.19 112.91 112.29 1maa h THR 267 Ca 0.63 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 67.43 1maa h THR 267 Cb 1.39 0.93 -0.00 0.00 -1.74 0.00 0.00 68.15 68.73 1maa h THR 267 CO -0.41 0.08 -0.04 -0.08 0.37 0.00 0.00 175.52 175.44 1maa h GLU 268 N -0.61 0.00 -0.00 6.66 4.81 -1.86 -0.79 114.58 122.79 1maa h GLU 268 Ca -0.04 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.10 1maa h GLU 268 Cb 0.44 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.83 1maa h GLU 268 CO 0.07 0.04 -0.33 1.25 -0.73 0.00 0.00 179.01 179.31 1maa h LEU 269 N 0.00 0.29 -0.80 1.64 6.46 -1.27 -2.78 115.31 118.85 1maa h LEU 269 Ca -0.00 -0.77 -0.07 0.00 -0.12 0.00 0.00 57.88 56.92 1maa h LEU 269 Cb 0.08 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 39.89 1maa h LEU 269 CO 0.00 1.02 0.10 0.40 -0.62 0.00 0.00 178.44 179.35 1maa h ILE 270 N -0.41 1.25 -0.71 4.05 1.08 -1.02 -0.92 117.51 120.85 1maa h ILE 270 Ca -0.04 -0.99 0.05 0.00 -0.39 0.00 0.00 64.86 63.49 1maa h ILE 270 Cb 1.07 0.67 -0.05 0.00 -3.07 0.00 0.00 36.82 35.44 1maa h ILE 270 CO 0.06 0.37 0.42 0.00 -0.69 0.00 0.00 178.15 178.31 1maa h ALA 271 N 1.16 0.95 -0.49 1.87 0.00 -1.20 0.59 119.26 122.14 1maa h ALA 271 Ca 0.19 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1maa h ALA 271 Cb 0.41 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1maa h ALA 271 CO 0.01 0.14 0.03 0.00 0.00 0.00 0.00 179.25 179.43 1maa h LEU 273 N 0.72 0.00 -0.05 0.00 3.38 0.10 -1.46 115.31 118.00 1maa h LEU 273 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1maa h LEU 273 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1maa h LEU 273 CO 0.02 0.08 0.00 0.54 0.09 0.00 0.00 178.44 179.17 1maa n ARG 274 N -3.74 0.20 0.11 1.13 1.74 0.08 -2.90 116.66 113.27 1maa n ARG 274 Ca -0.02 0.19 0.12 0.00 -0.77 0.00 0.00 57.85 57.36 1maa n ARG 274 Cb 0.18 -1.74 0.11 0.00 -1.02 0.00 0.00 32.46 29.98 1maa n ARG 274 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 1maa h THR 275 N 0.00 0.00 -3.51 0.55 1.35 -1.21 -3.47 112.91 106.62 1maa h THR 275 Ca 0.00 -0.78 -0.52 0.00 -0.55 0.00 0.00 66.41 64.56 1maa h THR 275 Cb 0.66 1.41 0.02 0.00 -1.73 0.00 0.00 68.15 68.50 1maa h THR 275 CO 0.00 0.00 0.55 -0.13 -0.25 0.00 0.00 175.52 175.69 1maa s ARG 276 N -3.25 4.50 0.49 4.72 1.81 -1.14 -4.98 118.95 121.10 1maa s ARG 276 Ca 0.04 1.87 -0.23 0.00 -1.72 0.00 0.00 55.73 55.69 1maa s ARG 276 Cb 0.10 -3.24 -0.08 0.00 -0.45 0.00 0.00 34.95 31.29 1maa s ARG 276 CO 0.74 -0.06 1.16 -2.30 -0.68 0.00 0.00 175.30 174.15 1maa n PRO 277 N 2.41 1.51 -0.27 3.54 -0.02 -1.26 -4.86 135.00 136.05 1maa n PRO 277 Ca 0.04 0.55 0.15 0.00 -2.02 0.00 0.00 63.50 62.22 1maa n PRO 277 Cb 0.45 -2.30 0.43 0.00 -0.02 0.00 0.00 33.50 32.06 1maa n PRO 277 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1maa h ALA 278 N 1.45 1.97 -0.02 3.55 0.00 -1.97 -1.38 119.26 122.86 1maa h ALA 278 Ca -0.48 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.27 1maa h ALA 278 Cb 1.32 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1maa h ALA 278 CO 0.56 -0.24 -0.80 0.37 0.00 0.00 0.00 179.25 179.14 1maa h GLN 279 N 0.58 0.25 -0.76 0.00 5.75 -1.99 -2.57 115.11 116.36 1maa h GLN 279 Ca 0.47 -0.24 0.15 0.00 -0.15 0.00 0.00 58.65 58.89 1maa h GLN 279 Cb 0.92 0.06 -0.10 0.00 1.07 0.00 0.00 27.48 29.43 1maa h GLN 279 CO -0.21 0.93 0.28 0.22 -2.65 0.00 0.00 178.83 177.39 1maa h ASP 280 N 0.15 0.22 0.31 -0.69 1.82 -1.60 0.31 116.42 116.95 1maa h ASP 280 Ca -0.04 0.12 -0.02 0.00 -0.39 0.00 0.00 57.03 56.71 1maa h ASP 280 Cb 1.40 0.11 0.00 0.00 0.68 0.00 0.00 39.33 41.52 1maa h ASP 280 CO 0.13 0.07 -0.15 -0.07 -1.61 0.00 0.00 179.24 177.60 1maa h LEU 281 N 0.40 -0.36 -1.27 2.28 4.07 -1.42 -2.90 115.31 116.12 1maa h LEU 281 Ca 0.42 -0.13 0.09 0.00 0.08 0.00 0.00 57.88 58.34 1maa h LEU 281 Cb 0.67 0.09 -0.06 0.00 1.08 0.00 0.00 40.66 42.45 1maa h LEU 281 CO -0.43 -0.06 0.55 0.58 -1.08 0.00 0.00 178.44 177.99 1maa h VAL 282 N -0.66 0.98 -0.70 1.22 2.07 -0.90 -0.25 116.25 118.00 1maa h VAL 282 Ca -0.04 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1maa h VAL 282 Cb 0.46 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 1maa h VAL 282 CO 0.07 0.15 0.45 0.44 0.02 0.00 0.00 177.57 178.70 1maa h ASP 283 N 0.83 0.81 -0.02 0.57 3.32 -0.35 -3.05 116.42 118.54 1maa h ASP 283 Ca 0.38 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1maa h ASP 283 Cb 0.38 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1maa h ASP 283 CO -0.15 0.60 -0.17 1.41 -1.72 0.00 0.00 179.24 179.21 1maa n HIS 284 N -4.42 0.00 0.30 4.55 8.25 -0.58 -4.57 115.22 118.75 1maa n HIS 284 Ca 0.07 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.69 1maa n HIS 284 Cb 0.05 0.00 0.94 0.00 1.12 0.00 0.00 29.99 32.10 1maa n HIS 284 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1maa h GLU 285 N 3.50 0.00 0.00 -0.41 4.11 -0.97 -2.25 114.58 118.56 1maa h GLU 285 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1maa h GLU 285 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1maa h GLU 285 CO 0.00 0.00 -0.47 0.91 0.07 0.00 0.00 179.01 179.53 1maa n TRP 286 N -3.76 0.54 0.26 2.06 7.02 -1.26 -3.92 117.44 118.39 1maa n TRP 286 Ca -0.03 0.16 0.15 0.00 -1.02 0.00 0.00 57.50 56.76 1maa n TRP 286 Cb 0.09 -0.66 0.65 0.00 -2.42 0.00 0.00 31.31 28.97 1maa n TRP 286 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1maa h HIS 287 N 0.00 0.00 -0.00 -5.99 3.86 -1.72 -3.15 115.15 108.15 1maa h HIS 287 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1maa h HIS 287 Cb 0.71 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.18 1maa h HIS 287 CO 0.00 0.07 -0.07 1.33 0.86 0.00 0.00 177.93 180.12 1maa n VAL 288 N -3.21 0.00 -1.76 2.45 0.24 -1.25 -4.88 118.33 109.91 1maa n VAL 288 Ca 0.00 -0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.88 1maa n VAL 288 Cb 0.32 -0.38 -0.00 0.00 -1.47 0.00 0.00 33.84 32.31 1maa n VAL 288 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1maa n LEU 289 N -1.44 4.51 0.16 1.34 4.77 -1.19 -4.84 117.00 120.30 1maa n LEU 289 Ca 0.08 1.22 0.04 0.00 -0.03 0.00 0.00 56.01 57.33 1maa n LEU 289 Cb 0.32 -1.59 0.11 0.00 -2.33 0.00 0.00 43.42 39.93 1maa n LEU 289 CO 0.27 0.02 0.55 1.55 -1.33 0.00 0.00 177.39 178.45 1maa h PRO 290 N 2.92 0.00 -4.19 3.23 0.13 -1.94 -3.48 132.00 128.67 1maa h PRO 290 Ca -0.50 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.48 1maa h PRO 290 Cb 1.25 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.24 1maa h PRO 290 CO 0.64 0.43 -0.50 -0.65 -0.23 0.00 0.00 178.00 177.70 1maa s GLN 291 N -3.10 1.05 -0.42 0.86 -0.21 -1.26 -5.09 119.66 111.49 1maa s GLN 291 Ca 0.03 -1.33 -0.28 0.00 0.02 0.00 0.00 55.36 53.80 1maa s GLN 291 Cb 0.08 0.31 -0.00 0.00 1.00 0.00 0.00 33.01 34.39 1maa s GLN 291 CO 0.72 -0.34 1.57 -2.00 -2.12 0.00 0.00 175.29 173.12 1maa s GLU 292 N -4.02 3.40 0.34 2.91 2.12 -1.26 -4.92 118.70 117.27 1maa s GLU 292 Ca 0.22 1.02 -0.01 0.00 0.36 0.00 0.00 54.97 56.56 1maa s GLU 292 Cb 0.05 -4.12 -0.00 0.00 0.26 0.00 0.00 34.13 30.32 1maa s GLU 292 CO 0.02 -1.79 0.44 -1.54 -0.54 0.00 0.00 175.26 171.84 1maa s SER 293 N 5.00 1.06 0.01 -1.70 1.04 -1.26 -4.50 113.70 113.35 1maa s SER 293 Ca 0.67 -1.54 -0.05 0.00 0.48 0.00 0.00 55.95 55.51 1maa s SER 293 Cb -0.16 0.64 -0.00 0.00 0.10 0.00 0.00 66.02 66.60 1maa s SER 293 CO 0.31 -1.25 0.09 0.27 0.98 0.00 0.00 173.24 173.64 1maa s ILE 294 N -3.12 0.09 -1.22 -1.02 -4.36 -1.17 -4.86 121.20 105.53 1maa s ILE 294 Ca 0.32 -0.72 -0.06 0.00 -0.26 0.00 0.00 60.65 59.94 1maa s ILE 294 Cb 0.00 -0.37 0.01 0.00 1.25 0.00 0.00 42.46 43.34 1maa s ILE 294 CO 0.22 -0.39 0.75 0.33 0.24 0.00 0.00 174.94 176.08 1maa n PHE 295 N 1.56 -2.03 -3.67 1.37 -0.00 -1.26 -4.82 117.46 108.62 1maa n PHE 295 Ca -0.23 0.64 -0.17 0.00 -0.00 0.00 0.00 57.45 57.70 1maa n PHE 295 Cb 0.56 -4.16 -0.15 0.00 -0.00 0.00 0.00 39.48 35.72 1maa n PHE 295 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.76 177.26 1maa s ARG 296 N -5.80 0.04 0.04 -4.13 6.06 -1.26 -4.66 118.95 109.24 1maa s ARG 296 Ca 0.37 0.57 0.03 0.00 -2.50 0.00 0.00 55.73 54.21 1maa s ARG 296 Cb -0.16 -0.26 -0.04 0.00 0.06 0.00 0.00 34.95 34.54 1maa s ARG 296 CO 0.46 -0.31 -0.01 -0.06 -2.50 0.00 0.00 175.30 172.88 1maa s PHE 297 N 2.30 3.02 0.07 5.12 0.08 -1.26 -5.02 117.98 122.29 1maa s PHE 297 Ca 0.03 0.02 -0.35 0.00 0.12 0.00 0.00 56.93 56.76 1maa s PHE 297 Cb -0.12 -1.61 -0.19 0.00 -0.57 0.00 0.00 43.02 40.53 1maa s PHE 297 CO -0.06 0.46 1.60 0.77 -0.10 0.00 0.00 175.22 177.89 1maa h SER 298 N 3.97 -0.99 -3.69 1.36 0.02 -1.90 -3.40 113.55 108.92 1maa h SER 298 Ca -0.48 0.05 -0.68 0.00 -0.84 0.00 0.00 61.79 59.84 1maa h SER 298 Cb 1.17 0.28 -0.36 0.00 0.14 0.00 0.00 62.40 63.62 1maa h SER 298 CO 0.58 -0.65 -0.68 -0.36 -1.14 0.00 0.00 176.83 174.57 1maa s PHE 299 N -6.01 3.51 0.36 3.45 0.40 -1.26 -4.99 117.98 113.44 1maa s PHE 299 Ca -0.18 -2.46 0.02 0.00 -0.60 0.00 0.00 56.93 53.71 1maa s PHE 299 Cb 0.03 -2.63 -0.01 0.00 0.51 0.00 0.00 43.02 40.92 1maa s PHE 299 CO 0.61 -0.91 0.09 1.33 0.70 0.00 0.00 175.22 177.04 1maa n VAL 300 N 4.46 0.00 -1.80 -0.44 0.24 -1.26 -4.51 118.33 115.03 1maa n VAL 300 Ca -0.05 -1.96 -0.42 0.00 -2.04 0.00 0.00 64.34 59.87 1maa n VAL 300 Cb 0.42 0.62 -0.03 0.00 -1.47 0.00 0.00 33.84 33.38 1maa n VAL 300 CO 0.00 0.00 0.00 -2.84 -2.14 0.00 0.00 176.83 171.85 1maa s PRO 301 N -3.34 4.16 0.22 7.34 0.02 -1.25 -4.78 135.00 137.36 1maa s PRO 301 Ca 0.12 2.49 -0.12 0.00 0.02 0.00 0.00 61.00 63.51 1maa s PRO 301 Cb 0.01 -3.55 -0.07 0.00 0.02 0.00 0.00 34.50 30.90 1maa s PRO 301 CO 0.09 -0.79 0.59 0.54 -0.33 0.00 0.00 177.00 177.10 1maa s VAL 302 N 2.55 4.85 -0.79 3.83 0.11 -1.26 -1.64 120.40 128.04 1maa s VAL 302 Ca 0.78 0.71 -0.21 0.00 -2.93 0.00 0.00 61.98 60.32 1maa s VAL 302 Cb -0.44 -3.67 0.10 0.00 -1.53 0.00 0.00 36.38 30.84 1maa s VAL 302 CO 0.34 0.03 1.04 -0.69 -3.33 0.00 0.00 175.10 172.50 1maa s VAL 303 N -1.71 4.50 -1.50 2.04 1.01 -0.77 -4.74 120.40 119.23 1maa s VAL 303 Ca 0.45 -0.92 0.24 0.00 0.00 0.00 0.00 61.98 61.76 1maa s VAL 303 Cb -0.13 -4.73 0.06 0.00 0.00 0.00 0.00 36.38 31.58 1maa s VAL 303 CO 0.20 -1.49 1.31 -0.90 0.00 0.00 0.00 175.10 174.22 1maa n ASP 304 N 7.22 1.11 -0.83 3.32 5.75 -1.25 -4.08 116.55 127.78 1maa n ASP 304 Ca 0.09 -0.89 -0.09 0.00 -0.01 0.00 0.00 54.79 53.90 1maa n ASP 304 Cb 0.47 0.39 -0.02 0.00 -1.03 0.00 0.00 41.12 40.93 1maa n ASP 304 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1maa n GLY 305 N 1.43 0.60 0.38 6.12 0.00 0.20 -4.84 105.19 109.07 1maa n GLY 305 Ca 0.08 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1maa n GLY 305 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1maa n ASP 306 N 0.44 0.00 -0.13 1.61 -0.08 -1.26 -4.57 116.55 112.56 1maa n ASP 306 Ca -0.10 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.09 1maa n ASP 306 Cb 0.42 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.87 1maa n ASP 306 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1maa h PHE 307 N 0.00 0.61 -3.60 -0.67 3.04 -1.92 -3.34 116.94 111.06 1maa h PHE 307 Ca 0.00 -0.06 -0.70 0.00 3.98 0.00 0.00 57.97 61.19 1maa h PHE 307 Cb 0.00 -0.17 -0.31 0.00 2.56 0.00 0.00 35.95 38.02 1maa h PHE 307 CO 0.00 0.58 -0.58 -0.51 -2.02 0.00 0.00 178.31 175.78 1maa s LEU 308 N -9.69 4.66 0.23 0.59 1.43 -1.26 -4.55 118.68 110.08 1maa s LEU 308 Ca -0.13 -1.50 -0.08 0.00 -1.03 0.00 0.00 54.13 51.39 1maa s LEU 308 Cb 0.10 -1.84 0.20 0.00 0.03 0.00 0.00 46.19 44.67 1maa s LEU 308 CO 0.76 -0.42 1.86 0.77 0.23 0.00 0.00 176.35 179.55 1maa h SER 309 N 8.16 1.08 -1.28 2.29 4.64 -1.81 0.57 113.55 127.19 1maa h SER 309 Ca -0.20 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1maa h SER 309 Cb 1.07 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1maa h SER 309 CO 0.65 0.85 0.00 -0.67 -0.87 0.00 0.00 176.83 176.78 1maa n ASP 310 N -4.38 0.15 -4.86 4.97 -0.08 -1.26 -4.26 116.55 106.82 1maa n ASP 310 Ca 0.09 -0.61 -0.31 0.00 -1.51 0.00 0.00 54.79 52.45 1maa n ASP 310 Cb 0.08 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.50 1maa n ASP 310 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1maa s THR 311 N -1.50 4.66 0.40 5.18 -4.23 -1.26 -4.84 115.64 114.05 1maa s THR 311 Ca 0.00 0.93 0.13 0.00 -1.18 0.00 0.00 61.69 61.57 1maa s THR 311 Cb 0.00 -3.73 0.34 0.00 1.34 0.00 0.00 72.50 70.45 1maa s THR 311 CO 0.00 -0.61 1.91 -0.65 -0.54 0.00 0.00 174.62 174.73 1maa h PRO 312 N 1.07 0.49 0.09 3.99 0.11 -1.98 0.28 132.00 136.05 1maa h PRO 312 Ca -0.47 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 1maa h PRO 312 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1maa h PRO 312 CO 0.63 0.33 -0.04 1.49 -0.21 0.00 0.00 178.00 180.19 1maa h GLU 313 N 0.51 -0.11 0.31 1.05 4.57 -1.91 0.12 114.58 119.12 1maa h GLU 313 Ca 0.38 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.57 1maa h GLU 313 Cb 0.75 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.33 1maa h GLU 313 CO -0.14 0.06 -0.37 0.00 -1.18 0.00 0.00 179.01 177.39 1maa h ALA 314 N 0.64 -0.76 -0.97 2.92 0.00 -1.38 -2.81 119.26 116.90 1maa h ALA 314 Ca -0.01 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.87 1maa h ALA 314 Cb 0.22 0.55 -0.07 0.00 0.00 0.00 0.00 17.79 18.48 1maa h ALA 314 CO 0.02 -0.97 0.61 -0.07 0.00 0.00 0.00 179.25 178.84 1maa h LEU 315 N -0.72 0.94 -0.04 0.00 4.07 -0.36 -1.73 115.31 117.46 1maa h LEU 315 Ca -0.02 0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1maa h LEU 315 Cb 0.67 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.25 1maa h LEU 315 CO -0.10 0.55 0.00 2.30 -1.08 0.00 0.00 178.44 180.12 1maa n ILE 316 N -4.59 0.32 0.05 1.22 -5.35 0.39 -2.91 119.36 108.50 1maa n ILE 316 Ca 0.16 -0.05 0.09 0.00 -0.27 0.00 0.00 62.75 62.68 1maa n ILE 316 Cb 0.26 -0.61 -0.07 0.00 -1.74 0.00 0.00 39.64 37.48 1maa n ILE 316 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1maa n ASN 317 N -1.78 0.58 -3.24 7.28 4.13 -0.71 -4.60 115.26 116.93 1maa n ASN 317 Ca 0.06 0.23 -0.25 0.00 1.68 0.00 0.00 54.58 56.31 1maa n ASN 317 Cb 0.35 0.86 -0.07 0.00 -1.54 0.00 0.00 39.78 39.37 1maa n ASN 317 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1maa n THR 318 N -2.60 -0.24 -3.76 3.41 -2.24 -0.87 -5.08 114.28 102.90 1maa n THR 318 Ca -0.04 -4.18 -0.11 0.00 -2.27 0.00 0.00 64.05 57.46 1maa n THR 318 Cb 0.62 -1.97 -0.07 0.00 -2.10 0.00 0.00 70.33 66.81 1maa n THR 318 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1maa s GLY 319 N -1.33 -0.09 -0.26 3.38 0.00 -1.19 -4.80 107.32 103.03 1maa s GLY 319 Ca 0.36 -0.13 -0.13 0.00 0.00 0.00 0.00 44.72 44.82 1maa s GLY 319 CO -0.10 -0.34 0.29 -0.35 0.00 0.00 0.00 173.10 172.60 1maa s ASP 320 N -2.29 6.19 -0.18 1.64 2.15 -1.26 -4.88 116.67 118.05 1maa s ASP 320 Ca -0.02 0.21 0.15 0.00 0.43 0.00 0.00 52.55 53.32 1maa s ASP 320 Cb 0.00 -2.17 0.44 0.00 -0.30 0.00 0.00 42.92 40.90 1maa s ASP 320 CO -0.06 -0.08 1.19 0.49 -0.17 0.00 0.00 175.17 176.54 1maa n PHE 321 N 4.93 0.68 -0.00 -5.34 3.72 -0.69 -4.86 117.46 115.89 1maa n PHE 321 Ca -0.11 -1.46 -0.09 0.00 -0.05 0.00 0.00 57.45 55.74 1maa n PHE 321 Cb 0.51 -0.24 0.07 0.00 -0.94 0.00 0.00 39.48 38.88 1maa n PHE 321 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1maa h GLN 322 N 1.41 0.58 -0.54 -1.08 7.50 -1.74 0.15 115.11 121.39 1maa h GLN 322 Ca -0.00 -0.34 0.00 0.00 0.50 0.00 0.00 58.65 58.81 1maa h GLN 322 Cb 1.36 0.03 0.00 0.00 0.05 0.00 0.00 27.48 28.92 1maa h GLN 322 CO 0.19 0.94 0.00 -0.40 -1.50 0.00 0.00 178.83 178.06 1maa n ASP 323 N -3.98 0.74 -4.49 1.46 5.75 -1.26 -4.63 116.55 110.13 1maa n ASP 323 Ca -0.03 -2.02 -0.33 0.00 -0.01 0.00 0.00 54.79 52.40 1maa n ASP 323 Cb 0.57 -0.28 -0.13 0.00 -1.03 0.00 0.00 41.12 40.26 1maa n ASP 323 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1maa s LEU 324 N -0.54 2.85 -0.12 -2.12 0.20 -1.14 -4.97 118.68 112.84 1maa s LEU 324 Ca 0.03 -0.16 0.02 0.00 0.69 0.00 0.00 54.13 54.70 1maa s LEU 324 Cb 0.02 -1.60 0.01 0.00 -0.43 0.00 0.00 46.19 44.19 1maa s LEU 324 CO 0.01 0.33 -0.18 -1.10 -0.29 0.00 0.00 176.35 175.12 1maa s GLN 325 N -0.62 2.58 0.03 1.98 1.11 -1.26 -1.01 119.66 122.48 1maa s GLN 325 Ca 0.09 -0.70 0.05 0.00 0.01 0.00 0.00 55.36 54.81 1maa s GLN 325 Cb -0.11 -2.13 -0.02 0.00 -1.01 0.00 0.00 33.01 29.74 1maa s GLN 325 CO 0.01 -0.03 -0.14 0.08 0.01 0.00 0.00 175.29 175.23 1maa s VAL 326 N 0.87 1.10 -0.20 1.09 1.01 0.35 -2.69 120.40 121.92 1maa s VAL 326 Ca -0.08 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.00 1maa s VAL 326 Cb -0.15 -0.98 0.03 0.00 0.00 0.00 0.00 36.38 35.28 1maa s VAL 326 CO -0.01 0.06 -0.18 -0.22 0.00 0.00 0.00 175.10 174.76 1maa s LEU 327 N -0.97 2.42 0.07 3.92 0.20 -0.33 -0.56 118.68 123.44 1maa s LEU 327 Ca 0.02 -0.79 0.06 0.00 0.69 0.00 0.00 54.13 54.11 1maa s LEU 327 Cb -0.07 -1.50 -0.03 0.00 -0.43 0.00 0.00 46.19 44.15 1maa s LEU 327 CO 0.01 -0.04 -0.16 0.68 -0.29 0.00 0.00 176.35 176.55 1maa s VAL 328 N 1.26 1.27 0.08 1.68 -7.23 0.70 -0.08 120.40 118.08 1maa s VAL 328 Ca 0.02 -1.33 -0.08 0.00 -1.81 0.00 0.00 61.98 58.79 1maa s VAL 328 Cb -0.14 -1.19 0.03 0.00 0.56 0.00 0.00 36.38 35.63 1maa s VAL 328 CO -0.11 -0.15 0.38 0.61 -0.31 0.00 0.00 175.10 175.52 1maa n GLY 329 N 1.31 1.12 3.46 2.32 0.00 -0.89 -1.54 105.19 110.97 1maa n GLY 329 Ca -0.20 -1.02 -0.15 0.00 0.00 0.00 0.00 46.02 44.64 1maa n GLY 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1maa s VAL 330 N -2.42 0.01 0.27 1.61 0.11 -0.81 -0.94 120.40 118.22 1maa s VAL 330 Ca 0.08 -0.06 -0.06 0.00 -2.93 0.00 0.00 61.98 59.01 1maa s VAL 330 Cb -0.01 -0.99 -0.06 0.00 -1.53 0.00 0.00 36.38 33.79 1maa s VAL 330 CO 0.02 -0.03 0.55 0.68 -3.33 0.00 0.00 175.10 172.99 1maa s VAL 331 N -2.28 5.01 0.49 2.04 -7.23 -1.26 0.14 120.40 117.31 1maa s VAL 331 Ca -0.06 0.16 0.24 0.00 -1.81 0.00 0.00 61.98 60.51 1maa s VAL 331 Cb -0.01 -3.70 0.41 0.00 0.56 0.00 0.00 36.38 33.65 1maa s VAL 331 CO 0.00 -0.25 1.92 0.50 -0.31 0.00 0.00 175.10 176.96 1maa h LYS 332 N 1.92 0.17 -2.10 4.82 3.64 -0.98 -3.25 116.57 120.79 1maa h LYS 332 Ca -0.47 -0.01 -0.56 0.00 -1.27 0.00 0.00 60.65 58.34 1maa h LYS 332 Cb 1.18 -0.04 -0.41 0.00 -0.41 0.00 0.00 32.23 32.56 1maa h LYS 332 CO 0.67 0.11 -0.92 -0.25 -2.27 0.00 0.00 179.45 176.79 1maa n ASP 333 N -4.39 1.97 0.27 4.20 9.92 -0.75 -4.91 116.55 122.86 1maa n ASP 333 Ca 0.15 -3.13 0.14 0.00 -0.53 0.00 0.00 54.79 51.42 1maa n ASP 333 Cb 0.72 -0.63 0.83 0.00 -0.64 0.00 0.00 41.12 41.40 1maa n ASP 333 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1maa h GLU 334 N 3.63 0.00 0.16 -1.24 4.39 -1.74 -3.29 114.58 116.48 1maa h GLU 334 Ca 0.12 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.54 1maa h GLU 334 Cb 0.78 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.45 1maa h GLU 334 CO 0.63 0.00 -1.32 0.78 -1.16 0.00 0.00 179.01 177.94 1maa h GLY 335 N 0.00 0.40 -0.30 -3.84 0.00 -1.86 -3.39 103.07 94.07 1maa h GLY 335 Ca 0.02 -1.01 0.03 0.00 0.00 0.00 0.00 47.33 46.36 1maa h GLY 335 CO -0.00 0.89 -0.18 -1.14 0.00 0.00 0.00 176.54 176.11 1maa n SER 336 N -3.88 -0.32 -0.24 0.19 3.41 -1.24 -1.05 113.62 110.49 1maa n SER 336 Ca -0.20 0.84 0.07 0.00 -0.26 0.00 0.00 58.87 59.32 1maa n SER 336 Cb 0.95 -0.22 0.15 0.00 -0.26 0.00 0.00 64.21 64.83 1maa n SER 336 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1maa n TYR 337 N -3.69 0.34 0.16 7.33 4.19 -1.26 -0.66 117.16 123.57 1maa n TYR 337 Ca 0.01 0.83 0.03 0.00 3.31 0.00 0.00 57.90 62.07 1maa n TYR 337 Cb 0.08 -0.96 0.23 0.00 0.49 0.00 0.00 39.34 39.18 1maa n TYR 337 CO 0.00 0.00 0.00 0.74 0.91 0.00 0.00 176.86 178.51 1maa h PHE 338 N 0.00 0.00 -0.22 2.98 -1.00 -1.38 -3.22 116.94 114.10 1maa h PHE 338 Ca 0.37 0.00 0.02 0.00 2.81 0.00 0.00 57.97 61.17 1maa h PHE 338 Cb 0.68 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.22 1maa h PHE 338 CO -0.44 0.49 0.09 -0.07 -1.61 0.00 0.00 178.31 176.78 1maa h LEU 339 N 0.00 0.11 -1.64 1.54 3.38 -0.90 -1.80 115.31 116.01 1maa h LEU 339 Ca -0.00 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.04 1maa h LEU 339 Cb 1.06 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1maa h LEU 339 CO 0.06 0.10 0.53 0.58 0.09 0.00 0.00 178.44 179.80 1maa h VAL 340 N 0.20 0.10 0.00 1.22 2.07 -1.60 -0.52 116.25 117.72 1maa h VAL 340 Ca 0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1maa h VAL 340 Cb 0.05 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1maa h VAL 340 CO -0.08 0.00 -0.80 -1.22 0.02 0.00 0.00 177.57 175.48 1maa n TYR 341 N -3.09 0.18 -0.02 1.57 4.02 -0.68 -4.78 117.16 114.35 1maa n TYR 341 Ca 0.03 0.05 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 1maa n TYR 341 Cb 0.62 -0.34 0.00 0.00 -0.02 0.00 0.00 39.34 39.60 1maa n TYR 341 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1maa n GLY 342 N 1.43 0.02 3.56 2.72 0.00 -0.34 -5.07 105.19 107.50 1maa n GLY 342 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1maa n GLY 342 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1maa s VAL 343 N 0.00 4.58 0.16 1.61 1.01 -0.40 -5.00 120.40 122.37 1maa s VAL 343 Ca 0.00 0.61 -0.34 0.00 0.00 0.00 0.00 61.98 62.25 1maa s VAL 343 Cb 0.00 -4.36 -0.14 0.00 0.00 0.00 0.00 36.38 31.88 1maa s VAL 343 CO 0.00 -0.74 1.56 -2.65 0.00 0.00 0.00 175.10 173.27 1maa n PRO 344 N 6.87 2.11 0.00 2.72 -0.02 -1.26 -2.49 135.00 142.92 1maa n PRO 344 Ca 0.04 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1maa n PRO 344 Cb 0.48 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 1maa n PRO 344 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1maa n GLY 345 N 3.33 0.80 3.42 -1.23 0.00 -1.26 -4.90 105.19 105.35 1maa n GLY 345 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1maa n GLY 345 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1maa s PHE 346 N -2.00 2.85 0.02 1.61 0.08 -1.04 -4.50 117.98 115.00 1maa s PHE 346 Ca 0.00 -0.47 -0.18 0.00 0.12 0.00 0.00 56.93 56.40 1maa s PHE 346 Cb 0.00 -1.83 0.03 0.00 -0.57 0.00 0.00 43.02 40.65 1maa s PHE 346 CO 0.00 -0.09 0.39 0.45 -0.10 0.00 0.00 175.22 175.87 1maa s SER 347 N 0.14 -0.27 0.46 1.36 0.15 -1.26 -4.60 113.70 109.68 1maa s SER 347 Ca -0.05 0.05 0.25 0.00 0.70 0.00 0.00 55.95 56.90 1maa s SER 347 Cb -0.15 0.40 0.53 0.00 -1.71 0.00 0.00 66.02 65.09 1maa s SER 347 CO 0.04 -0.60 1.68 0.07 1.20 0.00 0.00 173.24 175.63 1maa h LYS 348 N 3.25 0.00 0.01 5.44 2.10 -1.99 -3.35 116.57 122.04 1maa h LYS 348 Ca -0.31 0.00 -0.26 0.00 -2.00 0.00 0.00 60.65 58.08 1maa h LYS 348 Cb 1.19 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.54 1maa h LYS 348 CO 0.43 0.02 -1.04 -0.44 -2.00 0.00 0.00 179.45 176.41 1maa h ASP 349 N 0.00 0.89 -1.79 7.07 3.32 -2.00 -3.37 116.42 120.54 1maa h ASP 349 Ca -0.00 -0.75 0.00 0.00 0.02 0.00 0.00 57.03 56.30 1maa h ASP 349 Cb 0.92 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1maa h ASP 349 CO 0.00 1.53 0.00 -0.46 -1.72 0.00 0.00 179.24 178.59 1maa n ASN 350 N -3.87 0.50 -1.03 6.45 0.23 -1.26 -5.02 115.26 111.27 1maa n ASN 350 Ca -0.11 -0.02 0.12 0.00 -0.53 0.00 0.00 54.58 54.03 1maa n ASN 350 Cb 0.88 0.00 0.24 0.00 -2.08 0.00 0.00 39.78 38.83 1maa n ASN 350 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1maa n GLU 351 N -0.01 2.34 -4.06 -3.83 1.02 -1.26 -4.90 120.64 109.94 1maa n GLU 351 Ca 0.00 -2.03 -0.41 0.00 -0.02 0.00 0.00 57.16 54.70 1maa n GLU 351 Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 29.93 1maa n GLU 351 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1maa n SER 352 N 1.25 -3.18 -4.60 1.62 7.64 -1.26 -4.92 113.62 110.17 1maa n SER 352 Ca 0.18 -1.24 -0.41 0.00 1.01 0.00 0.00 58.87 58.41 1maa n SER 352 Cb 0.55 -1.97 -0.07 0.00 -1.01 0.00 0.00 64.21 61.72 1maa n SER 352 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1maa s LEU 353 N -7.30 4.15 0.39 -3.43 2.01 -1.26 -4.70 118.68 108.53 1maa s LEU 353 Ca 0.38 0.42 0.08 0.00 0.01 0.00 0.00 54.13 55.01 1maa s LEU 353 Cb -0.20 -2.81 -0.03 0.00 0.01 0.00 0.00 46.19 43.17 1maa s LEU 353 CO 0.96 -0.48 0.32 0.27 1.01 0.00 0.00 176.35 178.44 1maa s ILE 354 N 2.60 2.93 0.36 -0.59 -0.00 -1.24 -5.01 121.20 120.25 1maa s ILE 354 Ca 0.25 -1.39 -0.07 0.00 -0.00 0.00 0.00 60.65 59.44 1maa s ILE 354 Cb -0.15 -3.05 -0.05 0.00 -0.00 0.00 0.00 42.46 39.20 1maa s ILE 354 CO 0.12 -0.07 0.66 -0.94 -0.00 0.00 0.00 174.94 174.71 1maa s SER 355 N -4.06 6.44 0.59 4.36 1.04 -1.26 -4.09 113.70 116.72 1maa s SER 355 Ca 0.45 0.87 0.29 0.00 0.48 0.00 0.00 55.95 58.04 1maa s SER 355 Cb -0.04 -2.21 1.69 0.00 0.10 0.00 0.00 66.02 65.56 1maa s SER 355 CO 0.27 -0.32 2.13 -0.09 0.98 0.00 0.00 173.24 176.21 1maa h ARG 356 N 1.30 0.00 -0.38 4.02 2.43 -1.88 -0.22 114.38 119.66 1maa h ARG 356 Ca -0.48 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 58.60 1maa h ARG 356 Cb 1.19 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 1maa h ARG 356 CO 0.64 0.00 -0.17 0.00 -1.51 0.00 0.00 179.97 178.93 1maa h ALA 357 N 1.81 0.99 -0.01 2.80 0.00 -1.98 -0.11 119.26 122.77 1maa h ALA 357 Ca 0.07 -0.34 -0.23 0.00 0.00 0.00 0.00 54.91 54.41 1maa h ALA 357 Cb 0.39 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 18.04 1maa h ALA 357 CO -0.00 0.60 -0.89 1.96 0.00 0.00 0.00 179.25 180.91 1maa h GLN 358 N 0.63 0.62 -0.84 0.00 4.20 -1.44 -1.96 115.11 116.33 1maa h GLN 358 Ca 0.10 -0.66 0.04 0.00 0.06 0.00 0.00 58.65 58.20 1maa h GLN 358 Cb 0.64 0.18 -0.05 0.00 0.30 0.00 0.00 27.48 28.55 1maa h GLN 358 CO 0.05 1.26 0.53 0.35 -0.67 0.00 0.00 178.83 180.34 1maa h PHE 359 N 0.25 0.99 -0.14 2.96 3.57 -1.07 0.37 116.94 123.88 1maa h PHE 359 Ca -0.11 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.39 1maa h PHE 359 Cb 1.56 -0.32 -0.00 0.00 2.79 0.00 0.00 35.95 39.97 1maa h PHE 359 CO 0.12 0.55 -0.01 -0.07 -2.23 0.00 0.00 178.31 176.67 1maa h LEU 360 N 1.01 0.24 -1.58 0.59 4.07 -1.01 -2.50 115.31 116.14 1maa h LEU 360 Ca 0.34 -0.32 -0.05 0.00 0.08 0.00 0.00 57.88 57.94 1maa h LEU 360 Cb 0.06 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 1maa h LEU 360 CO -0.13 0.50 -0.22 0.00 -1.08 0.00 0.00 178.44 177.51 1maa h ALA 361 N 0.75 1.37 0.00 1.53 0.00 -0.89 -2.82 119.26 119.20 1maa h ALA 361 Ca 0.04 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 1maa h ALA 361 Cb 0.38 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1maa h ALA 361 CO 0.01 0.28 -0.52 0.78 0.00 0.00 0.00 179.25 179.80 1maa h GLY 362 N 0.98 0.00 2.00 0.00 0.00 -0.13 -3.01 103.07 102.91 1maa h GLY 362 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1maa h GLY 362 CO 0.03 0.00 -0.25 -2.08 0.00 0.00 0.00 176.54 174.24 1maa h VAL 363 N 0.00 0.71 0.00 4.60 2.07 -1.18 0.83 116.25 123.28 1maa h VAL 363 Ca -0.01 -1.08 -0.07 0.00 0.82 0.00 0.00 66.70 66.37 1maa h VAL 363 Cb 1.31 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 1maa h VAL 363 CO 0.07 0.24 -0.31 0.03 0.02 0.00 0.00 177.57 177.62 1maa h ARG 364 N 0.00 0.00 0.17 1.57 2.47 -1.57 0.00 114.38 117.02 1maa h ARG 364 Ca -0.00 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.49 1maa h ARG 364 Cb 0.66 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 29.01 1maa h ARG 364 CO 0.03 0.31 -1.02 0.82 0.56 0.00 0.00 179.97 180.67 1maa h ILE 365 N 0.00 1.42 -0.15 2.04 1.08 -1.28 -3.11 117.51 117.50 1maa h ILE 365 Ca -0.00 -2.56 -0.13 0.00 -0.39 0.00 0.00 64.86 61.78 1maa h ILE 365 Cb 1.22 3.13 -0.01 0.00 -3.07 0.00 0.00 36.82 38.09 1maa h ILE 365 CO 0.04 0.74 -0.45 1.23 -0.69 0.00 0.00 178.15 179.01 1maa h GLY 366 N -0.21 0.40 -6.02 5.37 0.00 -0.82 -3.10 103.07 98.69 1maa h GLY 366 Ca -0.18 -0.42 -0.58 0.00 0.00 0.00 0.00 47.33 46.15 1maa h GLY 366 CO 0.17 0.37 -0.76 -0.62 0.00 0.00 0.00 176.54 175.71 1maa n VAL 367 N -3.99 1.59 0.21 4.60 0.31 -0.02 -4.82 118.33 116.20 1maa n VAL 367 Ca -0.02 -4.95 0.16 0.00 -0.01 0.00 0.00 64.34 59.53 1maa n VAL 367 Cb 0.53 -1.88 0.81 0.00 -0.91 0.00 0.00 33.84 32.40 1maa n VAL 367 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1maa h PRO 368 N 3.91 0.00 0.00 5.55 0.13 -1.65 -1.50 132.00 138.45 1maa h PRO 368 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1maa h PRO 368 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1maa h PRO 368 CO 0.73 0.00 -0.17 0.00 -0.23 0.00 0.00 178.00 178.33 1maa n GLN 369 N -3.92 0.07 -2.22 0.86 0.00 -1.26 -4.91 117.38 106.00 1maa n GLN 369 Ca 0.01 0.04 -0.36 0.00 0.00 0.00 0.00 57.00 56.70 1maa n GLN 369 Cb 0.29 -1.57 0.00 0.00 0.00 0.00 0.00 30.24 28.96 1maa n GLN 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1maa s ALA 370 N -3.03 2.78 0.44 2.61 0.00 -0.56 -5.05 121.76 118.94 1maa s ALA 370 Ca 0.12 0.90 0.00 0.00 0.00 0.00 0.00 51.96 52.98 1maa s ALA 370 Cb 0.17 -3.39 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 1maa s ALA 370 CO 0.60 -0.79 0.66 -1.54 0.00 0.00 0.00 175.76 174.68 1maa s SER 371 N -1.57 5.92 0.43 0.00 1.04 -1.26 -4.84 113.70 113.42 1maa s SER 371 Ca 0.70 0.34 0.17 0.00 0.48 0.00 0.00 55.95 57.63 1maa s SER 371 Cb -0.27 -1.64 1.08 0.00 0.10 0.00 0.00 66.02 65.29 1maa s SER 371 CO 0.31 -0.63 1.91 0.44 0.98 0.00 0.00 173.24 176.25 1maa h ASP 372 N 0.45 0.37 0.05 7.02 5.19 -1.97 0.38 116.42 127.91 1maa h ASP 372 Ca -0.47 0.03 -0.00 0.00 -0.62 0.00 0.00 57.03 55.97 1maa h ASP 372 Cb 1.25 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.71 1maa h ASP 372 CO 0.58 0.18 -0.02 0.25 -3.12 0.00 0.00 179.24 177.11 1maa h LEU 373 N 0.39 -0.05 -0.44 1.55 5.85 -1.97 -0.42 115.31 120.22 1maa h LEU 373 Ca 0.39 -0.54 0.07 0.00 0.84 0.00 0.00 57.88 58.64 1maa h LEU 373 Cb 0.95 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.93 1maa h LEU 373 CO -0.12 0.54 0.07 0.00 -0.34 0.00 0.00 178.44 178.58 1maa h ALA 374 N 0.21 0.47 -0.48 1.25 0.00 -1.61 0.10 119.26 119.20 1maa h ALA 374 Ca -0.01 0.10 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1maa h ALA 374 Cb 0.59 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 1maa h ALA 374 CO 0.01 -0.33 0.09 0.00 0.00 0.00 0.00 179.25 179.01 1maa h ALA 375 N 1.35 0.53 0.00 0.00 0.00 -0.24 0.23 119.26 121.12 1maa h ALA 375 Ca 0.22 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 1maa h ALA 375 Cb 0.28 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1maa h ALA 375 CO -0.30 -0.32 -0.19 1.49 0.00 0.00 0.00 179.25 179.93 1maa h GLU 376 N 0.22 0.00 -0.15 0.00 4.81 0.19 0.72 114.58 120.37 1maa h GLU 376 Ca 0.24 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1maa h GLU 376 Cb 0.32 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1maa h GLU 376 CO -0.32 0.19 0.02 0.00 -0.73 0.00 0.00 179.01 178.17 1maa h ALA 377 N 1.81 0.20 0.01 2.92 0.00 0.18 0.43 119.26 124.80 1maa h ALA 377 Ca -0.00 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1maa h ALA 377 Cb 0.34 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1maa h ALA 377 CO 0.02 -0.14 -0.06 0.28 0.00 0.00 0.00 179.25 179.35 1maa h VAL 378 N 0.02 0.85 -0.25 0.00 2.07 0.04 -1.75 116.25 117.23 1maa h VAL 378 Ca 0.04 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.61 1maa h VAL 378 Cb 0.30 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 30.87 1maa h VAL 378 CO 0.00 0.00 -0.06 0.58 0.02 0.00 0.00 177.57 178.12 1maa h VAL 379 N -0.11 0.76 -0.70 2.57 2.07 -0.77 -0.98 116.25 119.08 1maa h VAL 379 Ca 0.02 -0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.68 1maa h VAL 379 Cb 0.13 0.75 -0.09 0.00 -1.52 0.00 0.00 31.29 30.56 1maa h VAL 379 CO -0.06 0.00 0.23 0.25 0.02 0.00 0.00 177.57 178.01 1maa h LEU 380 N 0.01 0.16 -0.01 2.57 5.85 -0.59 -1.57 115.31 121.72 1maa h LEU 380 Ca 0.12 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 1maa h LEU 380 Cb 0.18 0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.33 1maa h LEU 380 CO -0.25 0.05 0.01 -0.74 -0.34 0.00 0.00 178.44 177.17 1maa h HIS 381 N 0.36 0.02 -0.08 1.25 2.76 -0.32 -3.19 115.15 115.95 1maa h HIS 381 Ca 0.38 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.55 1maa h HIS 381 Cb 0.59 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.54 1maa h HIS 381 CO -0.21 0.19 0.00 0.66 -1.30 0.00 0.00 177.93 177.28 1maa n TYR 382 N -4.99 0.10 -3.59 5.26 4.01 -0.57 -4.87 117.16 112.51 1maa n TYR 382 Ca -0.07 -0.05 -0.34 0.00 -0.16 0.00 0.00 57.90 57.27 1maa n TYR 382 Cb 0.11 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.09 1maa n TYR 382 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1maa s THR 383 N -1.90 5.11 -0.43 -0.72 2.01 -0.61 -4.87 115.64 114.22 1maa s THR 383 Ca 0.29 0.41 -0.13 0.00 0.31 0.00 0.00 61.69 62.57 1maa s THR 383 Cb 0.15 -3.64 0.06 0.00 0.01 0.00 0.00 72.50 69.08 1maa s THR 383 CO 0.23 0.27 0.31 -0.62 -0.69 0.00 0.00 174.62 174.12 1maa s ASP 384 N -1.81 5.91 0.00 3.53 2.15 -1.26 -4.95 116.67 120.23 1maa s ASP 384 Ca 0.33 -1.28 0.21 0.00 0.43 0.00 0.00 52.55 52.24 1maa s ASP 384 Cb -0.14 -2.09 1.10 0.00 -0.30 0.00 0.00 42.92 41.49 1maa s ASP 384 CO 0.18 -0.55 1.67 0.79 -0.17 0.00 0.00 175.17 177.10 1maa n TRP 385 N 5.07 0.00 0.03 -5.34 7.02 -1.26 -0.73 117.44 122.23 1maa n TRP 385 Ca -0.11 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.28 1maa n TRP 385 Cb 0.44 -0.23 -0.13 0.00 -2.42 0.00 0.00 31.31 28.97 1maa n TRP 385 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1maa h LEU 386 N 0.00 0.05 -5.77 -0.99 6.46 -2.05 -3.38 115.31 109.62 1maa h LEU 386 Ca 0.00 -0.06 -0.44 0.00 -0.12 0.00 0.00 57.88 57.25 1maa h LEU 386 Cb 0.16 -0.02 -0.34 0.00 -0.73 0.00 0.00 40.66 39.74 1maa h LEU 386 CO 0.00 1.05 -1.01 1.41 -0.62 0.00 0.00 178.44 179.28 1maa n HIS 387 N -3.25 -0.68 0.16 1.25 8.25 -1.08 -4.98 115.22 114.89 1maa n HIS 387 Ca -0.08 -3.34 0.02 0.00 -0.26 0.00 0.00 57.72 54.05 1maa n HIS 387 Cb 0.99 0.07 0.09 0.00 1.12 0.00 0.00 29.99 32.26 1maa n HIS 387 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1maa n PRO 388 N 0.64 0.04 -0.01 -0.41 -0.04 0.09 -2.21 135.00 133.11 1maa n PRO 388 Ca 0.20 0.28 0.07 0.00 -0.04 0.00 0.00 63.50 64.01 1maa n PRO 388 Cb 0.63 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.47 1maa n PRO 388 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1maa n GLU 389 N -1.32 0.54 -1.54 0.54 -0.58 -1.26 -4.82 120.64 112.20 1maa n GLU 389 Ca 0.02 -0.14 -0.53 0.00 -0.42 0.00 0.00 57.16 56.09 1maa n GLU 389 Cb 0.03 -1.38 -0.07 0.00 -0.57 0.00 0.00 31.44 29.45 1maa n GLU 389 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1maa n ASP 390 N -2.08 2.33 0.15 1.62 2.03 -0.94 -4.65 116.55 115.01 1maa n ASP 390 Ca -0.04 0.67 0.03 0.00 0.52 0.00 0.00 54.79 55.97 1maa n ASP 390 Cb 0.45 -1.23 0.42 0.00 -0.72 0.00 0.00 41.12 40.04 1maa n ASP 390 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1maa h PRO 391 N 10.51 0.15 0.83 -0.67 0.13 -1.92 -1.38 132.00 139.66 1maa h PRO 391 Ca -0.34 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.71 1maa h PRO 391 Cb 1.32 -0.02 0.01 0.00 0.13 0.00 0.00 31.00 32.43 1maa h PRO 391 CO 1.00 0.31 -0.40 1.15 -0.23 0.00 0.00 178.00 179.83 1maa h THR 392 N 0.15 0.00 -0.76 1.56 2.02 -1.88 0.62 112.91 114.61 1maa h THR 392 Ca 0.03 -0.17 0.11 0.00 0.77 0.00 0.00 66.41 67.14 1maa h THR 392 Cb 0.37 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.73 1maa h THR 392 CO 0.02 0.00 0.50 -0.74 0.37 0.00 0.00 175.52 175.67 1maa h HIS 393 N -1.29 0.67 -0.46 3.16 -0.00 -1.93 -1.21 115.15 114.10 1maa h HIS 393 Ca -0.11 0.02 -0.14 0.00 -0.00 0.00 0.00 60.37 60.14 1maa h HIS 393 Cb 0.85 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 28.03 1maa h HIS 393 CO 0.00 0.30 -0.25 -0.07 -0.00 0.00 0.00 177.93 177.91 1maa h LEU 394 N 0.62 1.01 0.50 0.26 3.38 -1.04 0.14 115.31 120.17 1maa h LEU 394 Ca 0.35 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1maa h LEU 394 Cb 0.55 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1maa h LEU 394 CO -0.13 1.19 -0.24 -0.09 0.09 0.00 0.00 178.44 179.26 1maa h ARG 395 N 0.83 -0.65 -0.66 1.13 1.12 0.01 -1.23 114.38 114.93 1maa h ARG 395 Ca 0.10 0.04 0.13 0.00 -1.11 0.00 0.00 59.98 59.14 1maa h ARG 395 Cb 0.83 0.15 -0.09 0.00 -0.01 0.00 0.00 29.97 30.85 1maa h ARG 395 CO 0.07 -0.35 0.16 -0.44 -3.11 0.00 0.00 179.97 176.30 1maa h ASP 396 N -0.89 0.03 -0.83 -3.80 3.32 -1.25 -1.25 116.42 111.75 1maa h ASP 396 Ca -0.07 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1maa h ASP 396 Cb 0.60 0.16 -0.04 0.00 0.22 0.00 0.00 39.33 40.27 1maa h ASP 396 CO 0.11 0.01 0.52 0.00 -1.72 0.00 0.00 179.24 178.16 1maa h ALA 397 N 1.53 1.05 -0.30 3.45 0.00 -0.90 -1.27 119.26 122.81 1maa h ALA 397 Ca 0.35 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 1maa h ALA 397 Cb 0.55 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1maa h ALA 397 CO -0.44 0.49 -0.04 1.98 0.00 0.00 0.00 179.25 181.25 1maa h MET 398 N 1.13 0.46 -0.07 0.00 1.85 -0.06 -0.66 114.93 117.58 1maa h MET 398 Ca 0.30 -0.10 -0.01 0.00 -0.61 0.00 0.00 59.70 59.27 1maa h MET 398 Cb -0.08 -0.07 -0.00 0.00 0.43 0.00 0.00 31.60 31.88 1maa h MET 398 CO -0.06 0.52 -0.01 1.03 -0.40 0.00 0.00 176.91 177.99 1maa h SER 399 N 0.44 0.13 -0.91 1.39 0.87 -0.83 -3.10 113.55 111.54 1maa h SER 399 Ca 0.09 -0.36 0.07 0.00 -1.23 0.00 0.00 61.79 60.36 1maa h SER 399 Cb 0.35 -0.04 -0.06 0.00 -0.44 0.00 0.00 62.40 62.21 1maa h SER 399 CO 0.01 0.46 0.59 0.00 -0.53 0.00 0.00 176.83 177.36 1maa h ALA 400 N 0.67 1.53 -0.05 6.23 0.00 -0.70 0.12 119.26 127.07 1maa h ALA 400 Ca 0.02 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1maa h ALA 400 Cb 0.40 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1maa h ALA 400 CO 0.01 0.33 -0.09 0.28 0.00 0.00 0.00 179.25 179.78 1maa h VAL 401 N 1.01 0.77 -0.45 0.00 2.07 -1.09 0.39 116.25 118.95 1maa h VAL 401 Ca 0.40 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.81 1maa h VAL 401 Cb 0.24 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1maa h VAL 401 CO -0.16 0.00 -0.16 0.58 0.02 0.00 0.00 177.57 177.86 1maa h VAL 402 N -0.13 1.27 0.09 2.57 2.07 -1.28 -0.08 116.25 120.76 1maa h VAL 402 Ca 0.05 -1.27 -0.00 0.00 0.82 0.00 0.00 66.70 66.30 1maa h VAL 402 Cb 0.20 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1maa h VAL 402 CO -0.12 0.43 -0.04 1.23 0.02 0.00 0.00 177.57 179.09 1maa h GLY 403 N 0.96 -0.13 1.02 2.17 0.00 -0.63 -2.30 103.07 104.16 1maa h GLY 403 Ca 0.12 0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.43 1maa h GLY 403 CO 0.05 -0.05 0.09 -0.55 0.00 0.00 0.00 176.54 176.08 1maa h ASP 404 N -0.51 0.90 -0.01 0.19 5.19 -0.19 0.76 116.42 122.75 1maa h ASP 404 Ca -0.01 -0.26 -0.00 0.00 -0.62 0.00 0.00 57.03 56.13 1maa h ASP 404 Cb 0.43 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 39.70 1maa h ASP 404 CO 0.02 0.94 -0.00 -0.74 -3.12 0.00 0.00 179.24 176.34 1maa h HIS 405 N 0.83 0.02 0.00 4.55 -0.00 -1.06 -1.11 115.15 118.38 1maa h HIS 405 Ca 0.17 -0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.44 1maa h HIS 405 Cb 0.42 -0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.81 1maa h HIS 405 CO 0.03 0.36 -1.05 -0.91 -0.00 0.00 0.00 177.93 176.35 1maa h ASN 406 N -0.33 0.00 0.00 3.26 2.35 -1.44 -3.41 115.58 116.02 1maa h ASN 406 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1maa h ASN 406 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 1maa h ASN 406 CO 0.00 0.37 0.00 0.52 -1.65 0.00 0.00 177.43 176.67 1maa n VAL 407 N -2.90 0.21 -0.21 2.81 0.31 0.12 -4.78 118.33 113.89 1maa n VAL 407 Ca -0.04 0.07 0.02 0.00 -0.01 0.00 0.00 64.34 64.37 1maa n VAL 407 Cb 0.72 -0.68 0.12 0.00 -0.91 0.00 0.00 33.84 33.10 1maa n VAL 407 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1maa h VAL 408 N 0.00 0.63 0.01 2.52 2.07 -1.30 -1.51 116.25 118.67 1maa h VAL 408 Ca 0.00 -0.10 -0.19 0.00 0.82 0.00 0.00 66.70 67.23 1maa h VAL 408 Cb 0.00 0.32 0.02 0.00 -1.52 0.00 0.00 31.29 30.11 1maa h VAL 408 CO 0.00 0.05 -0.76 0.00 0.02 0.00 0.00 177.57 176.88 1maa h PRO 410 N 0.05 0.00 0.04 0.00 0.11 -1.69 0.31 132.00 130.81 1maa h PRO 410 Ca -0.10 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.01 1maa h PRO 410 Cb 1.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.57 1maa h PRO 410 CO 0.15 0.00 -0.02 0.28 -0.21 0.00 0.00 178.00 178.20 1maa h VAL 411 N 0.00 1.27 -0.85 3.15 2.07 -1.27 -0.38 116.25 120.25 1maa h VAL 411 Ca 0.05 -1.06 0.08 0.00 0.82 0.00 0.00 66.70 66.60 1maa h VAL 411 Cb 0.22 1.97 -0.06 0.00 -1.52 0.00 0.00 31.29 31.90 1maa h VAL 411 CO -0.00 0.27 0.55 0.00 0.02 0.00 0.00 177.57 178.41 1maa h ALA 412 N 0.40 1.63 0.62 1.67 0.00 -0.42 0.52 119.26 123.69 1maa h ALA 412 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1maa h ALA 412 Cb 0.48 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1maa h ALA 412 CO 0.01 0.21 -0.30 0.37 0.00 0.00 0.00 179.25 179.54 1maa h GLN 413 N 0.87 -0.80 -0.62 0.00 5.75 -0.38 -1.76 115.11 118.17 1maa h GLN 413 Ca 0.38 0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.97 1maa h GLN 413 Cb 0.32 0.18 -0.05 0.00 1.07 0.00 0.00 27.48 29.01 1maa h GLN 413 CO -0.15 -0.51 0.36 1.25 -2.65 0.00 0.00 178.83 177.14 1maa h LEU 414 N -0.92 0.56 -0.52 -2.39 5.85 0.08 -0.95 115.31 117.02 1maa h LEU 414 Ca -0.09 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.69 1maa h LEU 414 Cb 0.67 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 1maa h LEU 414 CO 0.14 0.38 0.28 0.00 -0.34 0.00 0.00 178.44 178.90 1maa h ALA 415 N 1.29 0.66 -0.05 1.25 0.00 0.06 -0.28 119.26 122.19 1maa h ALA 415 Ca 0.26 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1maa h ALA 415 Cb 0.09 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1maa h ALA 415 CO -0.14 -0.06 0.02 0.78 0.00 0.00 0.00 179.25 179.86 1maa h GLY 416 N 0.54 0.09 1.04 0.00 0.00 -0.59 0.13 103.07 104.28 1maa h GLY 416 Ca 0.22 -0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.45 1maa h GLY 416 CO -0.14 0.04 0.27 3.21 0.00 0.00 0.00 176.54 179.92 1maa h ARG 417 N -0.07 1.14 0.29 4.80 2.47 -1.04 0.18 114.38 122.14 1maa h ARG 417 Ca 0.02 -0.23 -0.01 0.00 -1.26 0.00 0.00 59.98 58.50 1maa h ARG 417 Cb 0.16 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 28.31 1maa h ARG 417 CO -0.00 0.95 -0.14 -0.07 0.56 0.00 0.00 179.97 181.27 1maa h LEU 418 N 1.09 -0.33 -0.45 3.04 4.07 -0.97 -1.59 115.31 120.16 1maa h LEU 418 Ca 0.24 -0.14 0.07 0.00 0.08 0.00 0.00 57.88 58.13 1maa h LEU 418 Cb 0.26 0.09 -0.06 0.00 1.08 0.00 0.00 40.66 42.03 1maa h LEU 418 CO -0.01 -0.03 0.11 0.00 -1.08 0.00 0.00 178.44 177.42 1maa h ALA 419 N -0.02 0.51 -0.23 1.53 0.00 -0.84 -1.62 119.26 118.58 1maa h ALA 419 Ca -0.04 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1maa h ALA 419 Cb 0.45 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1maa h ALA 419 CO 0.07 -0.29 0.08 0.00 0.00 0.00 0.00 179.25 179.10 1maa h ALA 420 N 1.33 1.70 -0.94 0.00 0.00 -0.58 -3.10 119.26 117.67 1maa h ALA 420 Ca 0.22 -0.08 -0.63 0.00 0.00 0.00 0.00 54.91 54.42 1maa h ALA 420 Cb 0.27 -0.10 -0.31 0.00 0.00 0.00 0.00 17.79 17.65 1maa h ALA 420 CO -0.27 0.24 0.57 1.04 0.00 0.00 0.00 179.25 180.83 1maa n GLN 421 N -4.42 2.77 0.00 0.00 6.02 -0.61 -4.91 117.38 116.23 1maa n GLN 421 Ca 0.00 -3.40 0.00 0.00 -0.01 0.00 0.00 57.00 53.59 1maa n GLN 421 Cb 0.14 -2.27 0.00 0.00 1.02 0.00 0.00 30.24 29.13 1maa n GLN 421 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1maa n GLY 422 N -0.91 2.78 3.60 1.08 0.00 -1.17 -1.70 105.19 108.87 1maa n GLY 422 Ca 0.59 -0.38 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 1maa n GLY 422 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1maa n ALA 423 N 0.00 -0.81 -3.17 4.61 0.00 0.50 -4.26 120.51 117.38 1maa n ALA 423 Ca 0.00 -0.38 -0.39 0.00 0.00 0.00 0.00 53.44 52.66 1maa n ALA 423 Cb 0.00 -2.10 -0.11 0.00 0.00 0.00 0.00 19.45 17.24 1maa n ALA 423 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1maa s ARG 424 N -3.83 2.64 0.00 0.00 3.00 -0.18 -4.46 118.95 116.12 1maa s ARG 424 Ca 0.69 -1.29 0.02 0.00 -1.00 0.00 0.00 55.73 54.15 1maa s ARG 424 Cb -0.28 -3.65 -0.04 0.00 0.00 0.00 0.00 34.95 30.98 1maa s ARG 424 CO 0.56 -0.80 -0.02 0.08 0.00 0.00 0.00 175.30 175.12 1maa s VAL 425 N 1.44 4.01 -0.08 7.11 1.01 -1.26 -0.50 120.40 132.14 1maa s VAL 425 Ca 0.01 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.37 1maa s VAL 425 Cb -0.21 -2.78 0.01 0.00 0.00 0.00 0.00 36.38 33.40 1maa s VAL 425 CO 0.03 0.38 -0.16 -0.31 0.00 0.00 0.00 175.10 175.04 1maa s TYR 426 N -1.06 1.85 0.12 5.22 2.02 0.28 -0.20 117.35 125.57 1maa s TYR 426 Ca 0.19 -0.71 0.08 0.00 -0.37 0.00 0.00 57.07 56.26 1maa s TYR 426 Cb -0.11 -1.29 -0.04 0.00 -0.40 0.00 0.00 41.96 40.12 1maa s TYR 426 CO 0.10 -0.32 -0.19 0.00 -1.57 0.00 0.00 175.55 173.56 1maa s ALA 427 N 0.53 1.82 0.21 3.71 0.00 -1.25 -0.21 121.76 126.56 1maa s ALA 427 Ca -0.16 -1.32 -0.11 0.00 0.00 0.00 0.00 51.96 50.37 1maa s ALA 427 Cb -0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 1maa s ALA 427 CO 0.06 0.29 0.38 1.52 0.00 0.00 0.00 175.76 178.00 1maa s TYR 428 N -1.55 0.41 -0.10 0.00 -0.85 -0.59 -1.42 117.35 113.26 1maa s TYR 428 Ca 0.09 -0.76 -0.02 0.00 -0.52 0.00 0.00 57.07 55.86 1maa s TYR 428 Cb -0.08 0.05 0.04 0.00 0.38 0.00 0.00 41.96 42.34 1maa s TYR 428 CO 0.05 -0.86 0.04 -1.50 -1.52 0.00 0.00 175.55 171.76 1maa s ILE 429 N -4.00 0.18 -0.32 -3.49 2.07 -0.12 -1.93 121.20 113.59 1maa s ILE 429 Ca 0.21 0.07 -0.29 0.00 -1.41 0.00 0.00 60.65 59.24 1maa s ILE 429 Cb 0.01 -0.49 0.02 0.00 0.13 0.00 0.00 42.46 42.13 1maa s ILE 429 CO 0.05 0.08 1.05 0.12 -1.91 0.00 0.00 174.94 174.34 1maa s PHE 430 N 2.04 3.14 -0.58 3.50 5.36 0.38 -0.89 117.98 130.94 1maa s PHE 430 Ca 0.04 1.15 0.06 0.00 -0.96 0.00 0.00 56.93 57.21 1maa s PHE 430 Cb -0.13 -3.67 0.11 0.00 -0.34 0.00 0.00 43.02 38.98 1maa s PHE 430 CO -0.06 -0.77 0.94 0.39 -1.46 0.00 0.00 175.22 174.26 1maa n GLU 431 N 6.84 1.57 -3.52 10.12 1.02 0.92 -0.55 120.64 137.04 1maa n GLU 431 Ca 0.11 -1.37 -0.38 0.00 -0.02 0.00 0.00 57.16 55.50 1maa n GLU 431 Cb 0.47 -1.12 -0.06 0.00 -0.02 0.00 0.00 31.44 30.71 1maa n GLU 431 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1maa s HIS 432 N -0.77 3.64 -0.30 -0.32 2.46 -1.23 -4.93 115.29 113.84 1maa s HIS 432 Ca 0.10 0.87 -0.12 0.00 0.47 0.00 0.00 55.06 56.37 1maa s HIS 432 Cb 0.06 -2.30 -0.04 0.00 -0.13 0.00 0.00 32.58 30.17 1maa s HIS 432 CO 0.08 0.52 0.25 0.50 -2.47 0.00 0.00 174.74 173.62 1maa s ARG 433 N -0.59 3.84 -0.06 2.88 3.52 -1.26 -4.88 118.95 122.40 1maa s ARG 433 Ca 0.22 -0.32 -0.35 0.00 -0.13 0.00 0.00 55.73 55.15 1maa s ARG 433 Cb -0.15 -3.70 -0.12 0.00 -1.56 0.00 0.00 34.95 29.41 1maa s ARG 433 CO 0.10 -0.28 1.82 0.00 -0.81 0.00 0.00 175.30 176.14 1maa n ALA 434 N 5.15 0.86 0.14 6.12 0.00 -1.26 -4.82 120.51 126.70 1maa n ALA 434 Ca -0.12 0.32 0.18 0.00 0.00 0.00 0.00 53.44 53.81 1maa n ALA 434 Cb 0.51 -2.46 0.76 0.00 0.00 0.00 0.00 19.45 18.27 1maa n ALA 434 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1maa h SER 435 N 8.55 0.00 -0.34 0.00 4.64 -1.96 0.21 113.55 124.66 1maa h SER 435 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1maa h SER 435 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1maa h SER 435 CO 0.94 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 177.25 1maa n THR 436 N -4.00 0.57 -2.17 2.95 -2.24 -1.26 -4.95 114.28 103.18 1maa n THR 436 Ca 0.04 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.92 1maa n THR 436 Cb 0.42 0.15 -0.03 0.00 -2.10 0.00 0.00 70.33 68.77 1maa n THR 436 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1maa s LEU 437 N -1.04 4.38 0.00 3.22 2.96 0.75 -4.93 118.68 124.02 1maa s LEU 437 Ca 0.23 2.35 0.25 0.00 -0.22 0.00 0.00 54.13 56.75 1maa s LEU 437 Cb 0.13 -3.59 0.56 0.00 0.50 0.00 0.00 46.19 43.78 1maa s LEU 437 CO 0.15 -0.64 1.44 0.35 -1.32 0.00 0.00 176.35 176.33 1maa n THR 438 N 3.75 0.00 -3.25 3.68 -2.24 -1.26 -4.92 114.28 110.04 1maa n THR 438 Ca 0.11 -0.19 -0.34 0.00 -2.27 0.00 0.00 64.05 61.35 1maa n THR 438 Cb 0.42 0.69 -0.06 0.00 -2.10 0.00 0.00 70.33 69.28 1maa n THR 438 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1maa s TRP 439 N -2.42 3.52 0.52 4.78 0.52 -1.26 -4.85 118.94 119.75 1maa s TRP 439 Ca 0.24 1.15 -0.20 0.00 0.02 0.00 0.00 56.10 57.31 1maa s TRP 439 Cb 0.19 -2.45 -0.09 0.00 -1.15 0.00 0.00 33.47 29.97 1maa s TRP 439 CO 0.51 0.29 0.69 -0.35 0.02 0.00 0.00 176.95 178.11 1maa n PRO 440 N 0.31 0.74 0.29 4.98 -0.04 -1.26 -4.85 135.00 135.17 1maa n PRO 440 Ca -0.01 0.28 0.18 0.00 -0.04 0.00 0.00 63.50 63.90 1maa n PRO 440 Cb 0.52 -1.81 0.97 0.00 -0.04 0.00 0.00 33.50 33.15 1maa n PRO 440 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1maa h LEU 441 N 0.62 0.00 -1.37 1.53 5.85 -1.93 -1.91 115.31 118.10 1maa h LEU 441 Ca -0.45 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.21 1maa h LEU 441 Cb 1.38 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 1maa h LEU 441 CO 0.50 0.00 -0.32 4.11 -0.34 0.00 0.00 178.44 182.40 1maa h TRP 442 N 0.00 0.00 0.00 1.25 5.08 -1.93 -2.25 115.95 118.11 1maa h TRP 442 Ca 0.02 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.99 1maa h TRP 442 Cb 0.17 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.33 1maa h TRP 442 CO 0.00 0.32 0.00 -1.33 -1.28 0.00 0.00 178.44 176.15 1maa n MET 443 N -4.06 0.09 0.00 0.12 2.81 -0.72 -4.96 117.12 110.40 1maa n MET 443 Ca -0.02 0.15 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 1maa n MET 443 Cb 0.37 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.38 1maa n MET 443 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1maa n GLY 444 N 0.44 3.63 3.29 3.03 0.00 -0.85 -3.58 105.19 111.16 1maa n GLY 444 Ca 0.06 0.01 -0.45 0.00 0.00 0.00 0.00 46.02 45.64 1maa n GLY 444 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1maa s VAL 445 N 0.00 5.32 1.12 1.61 1.01 -1.26 -4.93 120.40 123.27 1maa s VAL 445 Ca 0.00 -2.67 -0.17 0.00 0.00 0.00 0.00 61.98 59.14 1maa s VAL 445 Cb 0.00 -4.30 0.25 0.00 0.00 0.00 0.00 36.38 32.33 1maa s VAL 445 CO 0.00 -1.02 1.13 -2.16 0.00 0.00 0.00 175.10 173.05 1maa s PRO 446 N -0.04 -0.58 -0.16 2.72 0.04 -1.23 -1.81 135.00 133.93 1maa s PRO 446 Ca 0.19 0.03 -0.31 0.00 0.04 0.00 0.00 61.00 60.95 1maa s PRO 446 Cb -0.12 -1.66 -0.08 0.00 0.04 0.00 0.00 34.50 32.68 1maa s PRO 446 CO -0.08 -3.30 2.10 1.58 0.04 0.00 0.00 177.00 177.34 1maa n HIS 447 N -4.49 2.09 0.00 0.56 -0.00 -1.25 -2.61 115.22 109.52 1maa n HIS 447 Ca 0.11 -0.09 0.00 0.00 -0.00 0.00 0.00 57.72 57.75 1maa n HIS 447 Cb 0.59 -2.70 0.00 0.00 -0.00 0.00 0.00 29.99 27.88 1maa n HIS 447 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1maa n GLY 448 N 5.38 0.69 1.59 1.57 0.00 -1.26 -4.98 105.19 108.18 1maa n GLY 448 Ca 0.28 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.20 1maa n GLY 448 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1maa n TYR 449 N -1.61 1.14 -0.00 1.61 4.02 -1.07 -2.67 117.16 118.58 1maa n TYR 449 Ca 0.00 -1.30 -0.00 0.00 -0.01 0.00 0.00 57.90 56.59 1maa n TYR 449 Cb 0.00 -0.65 -0.00 0.00 -0.02 0.00 0.00 39.34 38.67 1maa n TYR 449 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 1maa n GLU 450 N 0.20 3.24 -0.18 -0.72 0.00 -1.26 -4.72 120.64 117.20 1maa n GLU 450 Ca 0.22 0.00 -0.06 0.00 0.00 0.00 0.00 57.16 57.33 1maa n GLU 450 Cb 0.77 -1.01 0.00 0.00 0.00 0.00 0.00 31.44 31.21 1maa n GLU 450 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 1maa h ILE 451 N 0.00 0.20 0.00 3.84 2.04 -1.91 0.17 117.51 121.85 1maa h ILE 451 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1maa h ILE 451 Cb 1.02 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1maa h ILE 451 CO 0.00 0.00 0.15 1.05 0.00 0.00 0.00 178.15 179.35 1maa h GLU 452 N -0.18 0.00 0.09 2.37 4.11 -1.80 -0.84 114.58 118.33 1maa h GLU 452 Ca 0.22 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 59.34 1maa h GLU 452 Cb 0.54 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 1maa h GLU 452 CO -0.64 0.00 -1.64 0.74 0.07 0.00 0.00 179.01 177.55 1maa h PHE 453 N 0.00 0.35 -0.74 2.06 -1.00 -1.00 -2.06 116.94 114.55 1maa h PHE 453 Ca 0.00 -0.26 0.04 0.00 2.81 0.00 0.00 57.97 60.56 1maa h PHE 453 Cb 0.31 -0.01 -0.05 0.00 3.61 0.00 0.00 35.95 39.80 1maa h PHE 453 CO 0.00 1.64 0.46 0.82 -1.61 0.00 0.00 178.31 179.62 1maa h ILE 454 N -0.31 1.07 0.00 -0.55 1.08 -0.85 -1.18 117.51 116.77 1maa h ILE 454 Ca -0.37 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 63.80 1maa h ILE 454 Cb 1.77 0.12 0.00 0.00 -3.07 0.00 0.00 36.82 35.64 1maa h ILE 454 CO 0.00 0.16 0.00 0.49 -0.69 0.00 0.00 178.15 178.11 1maa n PHE 455 N -4.67 0.00 -0.79 1.37 3.01 -0.41 -4.53 117.46 111.45 1maa n PHE 455 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.55 1maa n PHE 455 Cb 0.12 -0.49 0.00 0.00 -0.01 0.00 0.00 39.48 39.10 1maa n PHE 455 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1maa n GLY 456 N 0.55 0.58 0.39 1.37 0.00 -0.45 -3.99 105.19 103.63 1maa n GLY 456 Ca 0.05 -0.24 0.18 0.00 0.00 0.00 0.00 46.02 46.01 1maa n GLY 456 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1maa h LEU 457 N 0.00 0.53 -0.09 0.99 4.07 -1.60 -1.05 115.31 118.16 1maa h LEU 457 Ca 0.00 0.07 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1maa h LEU 457 Cb 0.00 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.72 1maa h LEU 457 CO 0.00 0.17 0.02 -2.65 -1.08 0.00 0.00 178.44 174.91 1maa n PRO 458 N -4.62 0.01 0.24 1.13 -0.02 -1.26 -1.36 135.00 129.11 1maa n PRO 458 Ca 0.22 0.49 0.13 0.00 -2.02 0.00 0.00 63.50 62.33 1maa n PRO 458 Cb 0.72 -1.55 0.33 0.00 -0.02 0.00 0.00 33.50 32.98 1maa n PRO 458 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1maa h LEU 459 N 0.00 0.00 -8.70 2.45 3.38 -1.50 -3.42 115.31 107.53 1maa h LEU 459 Ca 0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 1maa h LEU 459 Cb 0.05 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.71 1maa h LEU 459 CO 0.00 0.02 0.75 -0.62 0.09 0.00 0.00 178.44 178.67 1maa s ASP 460 N -6.05 6.57 0.57 -0.43 -1.08 -0.47 -4.82 116.67 110.97 1maa s ASP 460 Ca 0.05 0.30 0.32 0.00 -0.52 0.00 0.00 52.55 52.70 1maa s ASP 460 Cb 0.06 -2.50 1.75 0.00 -1.46 0.00 0.00 42.92 40.78 1maa s ASP 460 CO 0.63 -1.14 2.18 1.55 0.52 0.00 0.00 175.17 178.91 1maa h PRO 461 N 9.12 0.00 -0.64 4.34 0.13 -1.87 -1.26 132.00 141.81 1maa h PRO 461 Ca -0.23 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.96 1maa h PRO 461 Cb 1.07 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.16 1maa h PRO 461 CO 1.07 0.05 0.43 1.03 -0.23 0.00 0.00 178.00 180.35 1maa h SER 462 N 0.00 0.56 -3.89 1.44 0.87 -1.95 -3.40 113.55 107.17 1maa h SER 462 Ca -0.00 0.00 -0.47 0.00 -1.23 0.00 0.00 61.79 60.09 1maa h SER 462 Cb 0.19 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 1maa h SER 462 CO 0.01 0.36 0.32 -0.76 -0.53 0.00 0.00 176.83 176.23 1maa s LEU 463 N -9.58 4.27 -0.06 2.23 1.43 -0.48 -4.97 118.68 111.52 1maa s LEU 463 Ca -0.09 1.77 0.00 0.00 -1.03 0.00 0.00 54.13 54.78 1maa s LEU 463 Cb 0.19 -4.07 0.07 0.00 0.03 0.00 0.00 46.19 42.41 1maa s LEU 463 CO 0.76 -0.11 1.40 0.59 0.23 0.00 0.00 176.35 179.22 1maa n ASN 464 N 0.36 3.93 -4.24 2.29 5.03 -1.26 -4.92 115.26 116.44 1maa n ASN 464 Ca 0.02 -2.32 -0.29 0.00 0.87 0.00 0.00 54.58 52.86 1maa n ASN 464 Cb 0.51 -0.73 0.19 0.00 -1.02 0.00 0.00 39.78 38.73 1maa n ASN 464 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1maa s TYR 465 N -0.41 1.45 0.50 3.10 2.02 -1.26 -4.80 117.35 117.95 1maa s TYR 465 Ca 0.07 0.59 0.05 0.00 -0.37 0.00 0.00 57.07 57.41 1maa s TYR 465 Cb 0.06 -3.58 0.03 0.00 -0.40 0.00 0.00 41.96 38.07 1maa s TYR 465 CO 0.01 -3.09 0.69 0.95 -1.57 0.00 0.00 175.55 172.54 1maa s THR 466 N -3.29 2.75 0.13 -0.71 -4.23 -1.26 -4.98 115.64 104.05 1maa s THR 466 Ca 0.69 -0.85 -0.15 0.00 -1.18 0.00 0.00 61.69 60.21 1maa s THR 466 Cb -0.10 -2.90 -0.00 0.00 1.34 0.00 0.00 72.50 70.83 1maa s THR 466 CO 0.55 0.00 1.63 0.74 -0.54 0.00 0.00 174.62 177.00 1maa h THR 467 N 0.31 1.23 -0.66 3.99 2.02 -1.97 -2.07 112.91 115.77 1maa h THR 467 Ca -0.40 -0.81 0.04 0.00 0.77 0.00 0.00 66.41 66.01 1maa h THR 467 Cb 1.29 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 68.61 1maa h THR 467 CO 0.47 0.28 0.40 -0.33 0.37 0.00 0.00 175.52 176.71 1maa h GLU 468 N 0.54 0.75 -0.03 6.66 5.08 -1.99 -1.81 114.58 123.78 1maa h GLU 468 Ca 0.13 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1maa h GLU 468 Cb 0.32 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1maa h GLU 468 CO 0.00 0.50 -0.13 0.93 -1.00 0.00 0.00 179.01 179.31 1maa h GLU 469 N 0.78 0.04 -0.03 2.33 5.08 -1.88 0.37 114.58 121.26 1maa h GLU 469 Ca 0.27 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.60 1maa h GLU 469 Cb 0.06 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1maa h GLU 469 CO -0.12 0.18 -0.10 -0.09 -1.00 0.00 0.00 179.01 177.88 1maa h ARG 470 N 0.04 0.13 -0.94 2.33 2.43 -0.65 -1.38 114.38 116.34 1maa h ARG 470 Ca 0.01 -0.09 0.05 0.00 -0.81 0.00 0.00 59.98 59.14 1maa h ARG 470 Cb 0.26 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.77 1maa h ARG 470 CO 0.02 0.71 0.62 0.82 -1.51 0.00 0.00 179.97 180.62 1maa h ILE 471 N -0.43 1.12 0.22 1.20 2.04 -1.07 -1.88 117.51 118.71 1maa h ILE 471 Ca -0.00 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1maa h ILE 471 Cb 0.71 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 1maa h ILE 471 CO 0.02 0.21 -0.11 0.15 0.00 0.00 0.00 178.15 178.42 1maa h PHE 472 N 1.14 -0.28 -0.92 1.37 3.57 -0.91 -1.96 116.94 118.95 1maa h PHE 472 Ca 0.39 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 62.02 1maa h PHE 472 Cb 0.09 0.09 -0.08 0.00 2.79 0.00 0.00 35.95 38.85 1maa h PHE 472 CO -0.00 -0.04 0.59 0.00 -2.23 0.00 0.00 178.31 176.63 1maa h ALA 473 N 0.25 1.74 0.06 2.41 0.00 -0.77 0.38 119.26 123.33 1maa h ALA 473 Ca -0.03 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1maa h ALA 473 Cb 0.36 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1maa h ALA 473 CO 0.05 0.01 -0.03 1.96 0.00 0.00 0.00 179.25 181.24 1maa h GLN 474 N 0.78 -0.08 -0.83 0.00 4.20 -1.18 0.38 115.11 118.37 1maa h GLN 474 Ca 0.46 0.01 0.13 0.00 0.06 0.00 0.00 58.65 59.31 1maa h GLN 474 Cb 0.66 0.02 -0.09 0.00 0.30 0.00 0.00 27.48 28.37 1maa h GLN 474 CO -0.23 0.05 0.44 -0.09 -0.67 0.00 0.00 178.83 178.33 1maa h ARG 475 N -0.19 0.65 -0.34 1.46 2.43 -0.19 0.14 114.38 118.34 1maa h ARG 475 Ca -0.01 -0.04 -0.17 0.00 -0.81 0.00 0.00 59.98 58.95 1maa h ARG 475 Cb 0.17 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1maa h ARG 475 CO 0.01 0.43 -0.45 -0.07 -1.51 0.00 0.00 179.97 178.38 1maa h LEU 476 N 0.66 0.96 -1.42 3.80 3.38 -0.85 -1.51 115.31 120.33 1maa h LEU 476 Ca 0.43 -0.47 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1maa h LEU 476 Cb 0.55 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1maa h LEU 476 CO -0.32 1.27 -0.20 0.24 0.09 0.00 0.00 178.44 179.51 1maa h MET 477 N 0.71 0.13 -0.08 1.13 2.86 0.09 -0.64 114.93 119.12 1maa h MET 477 Ca 0.04 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 1maa h MET 477 Cb 1.05 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.69 1maa h MET 477 CO 0.11 0.33 -0.05 0.87 1.06 0.00 0.00 176.91 179.22 1maa h LYS 478 N 0.12 0.18 0.23 1.72 1.79 -0.61 -1.65 116.57 118.34 1maa h LYS 478 Ca 0.02 -0.09 0.01 0.00 -2.18 0.00 0.00 60.65 58.41 1maa h LYS 478 Cb 0.43 -0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.04 1maa h LYS 478 CO 0.03 0.57 -0.51 1.88 -1.08 0.00 0.00 179.45 180.34 1maa h TYR 479 N -0.20 -1.46 0.05 -1.35 0.05 -0.72 0.36 116.97 113.70 1maa h TYR 479 Ca 0.02 0.03 0.02 0.00 0.05 0.00 0.00 58.73 58.85 1maa h TYR 479 Cb 0.52 0.61 -0.03 0.00 1.01 0.00 0.00 36.73 38.84 1maa h TYR 479 CO 0.07 -0.61 -0.19 -1.49 -1.05 0.00 0.00 178.16 174.89 1maa h TRP 480 N -0.82 -0.50 -0.16 4.88 -0.00 -1.18 -1.47 115.95 116.71 1maa h TRP 480 Ca -0.02 0.01 -0.00 0.00 -0.00 0.00 0.00 58.89 58.88 1maa h TRP 480 Cb 0.79 0.21 -0.01 0.00 -0.00 0.00 0.00 29.16 30.15 1maa h TRP 480 CO -0.39 -0.28 0.08 1.79 -0.00 0.00 0.00 178.44 179.64 1maa h THR 481 N -0.34 1.11 -0.99 1.49 1.35 -1.15 0.26 112.91 114.64 1maa h THR 481 Ca 0.04 -0.32 0.20 0.00 -0.55 0.00 0.00 66.41 65.78 1maa h THR 481 Cb 0.38 1.05 -0.10 0.00 -1.73 0.00 0.00 68.15 67.75 1maa h THR 481 CO -0.14 0.11 0.62 0.78 -0.25 0.00 0.00 175.52 176.63 1maa h ASN 482 N 0.14 0.65 0.06 5.36 2.35 -0.15 0.55 115.58 124.53 1maa h ASN 482 Ca 0.05 0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1maa h ASN 482 Cb 0.10 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1maa h ASN 482 CO -0.01 0.22 -0.03 0.15 -1.65 0.00 0.00 177.43 176.11 1maa h PHE 483 N 0.63 -0.08 -0.03 1.19 3.57 -0.64 0.15 116.94 121.73 1maa h PHE 483 Ca 0.56 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 62.06 1maa h PHE 483 Cb 1.05 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.82 1maa h PHE 483 CO -0.00 0.45 0.05 0.00 -2.23 0.00 0.00 178.31 176.57 1maa h ALA 484 N 0.19 1.41 0.01 2.41 0.00 0.10 1.27 119.26 124.64 1maa h ALA 484 Ca -0.01 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.67 1maa h ALA 484 Cb 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1maa h ALA 484 CO 0.01 -0.07 -1.25 -0.09 0.00 0.00 0.00 179.25 177.86 1maa h ARG 485 N 0.00 0.01 -0.00 0.00 2.43 0.07 -3.44 114.38 113.44 1maa h ARG 485 Ca 0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1maa h ARG 485 Cb 0.11 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1maa h ARG 485 CO -0.00 1.01 -0.05 0.25 -1.51 0.00 0.00 179.97 179.67 1maa n THR 486 N -4.40 0.00 -0.91 0.20 -2.24 0.53 -5.00 114.28 102.46 1maa n THR 486 Ca -0.31 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 1maa n THR 486 Cb 0.69 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.95 1maa n THR 486 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1maa n GLY 487 N 0.52 0.53 2.98 3.38 0.00 0.43 -4.99 105.19 108.05 1maa n GLY 487 Ca 0.01 -0.11 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 1maa n GLY 487 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1maa s ASP 488 N -2.10 0.44 0.00 1.61 -1.08 -1.25 -4.92 116.67 109.36 1maa s ASP 488 Ca 0.00 0.48 0.13 0.00 -0.52 0.00 0.00 52.55 52.64 1maa s ASP 488 Cb 0.00 0.75 0.59 0.00 -1.46 0.00 0.00 42.92 42.80 1maa s ASP 488 CO 0.00 -0.26 1.37 -0.81 0.52 0.00 0.00 175.17 175.99 1maa n PRO 489 N 5.35 0.08 -2.57 4.34 -0.04 -1.26 -3.22 135.00 137.68 1maa n PRO 489 Ca -0.06 0.23 -0.38 0.00 -0.04 0.00 0.00 63.50 63.26 1maa n PRO 489 Cb 0.50 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.41 1maa n PRO 489 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1maa s ASN 490 N -2.81 7.00 -0.25 3.54 0.01 -1.26 -4.25 114.94 116.92 1maa s ASN 490 Ca 0.09 2.06 -0.28 0.00 -0.71 0.00 0.00 52.86 54.01 1maa s ASN 490 Cb 0.08 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.11 1maa s ASN 490 CO 0.21 -0.32 2.07 1.51 -1.51 0.00 0.00 177.10 179.06 1maa s ASP 491 N -1.40 5.62 0.05 -1.22 1.47 -1.26 -4.88 116.67 115.04 1maa s ASP 491 Ca 0.53 1.71 -0.15 0.00 1.18 0.00 0.00 52.55 55.82 1maa s ASP 491 Cb -0.24 -2.52 -0.06 0.00 -0.34 0.00 0.00 42.92 39.77 1maa s ASP 491 CO 0.30 -1.86 1.24 -0.65 0.68 0.00 0.00 175.17 174.88 1maa h PRO 492 N 14.24 -0.27 0.29 2.11 0.11 -1.93 -3.35 132.00 143.20 1maa h PRO 492 Ca -0.39 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 1maa h PRO 492 Cb 1.21 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1maa h PRO 492 CO 0.98 -0.18 -0.14 0.00 -0.21 0.00 0.00 178.00 178.45 1maa h ARG 493 N -0.28 -0.37 -5.56 1.05 -0.00 -2.05 -3.41 114.38 103.76 1maa h ARG 493 Ca 0.01 0.03 -0.22 0.00 -0.50 0.00 0.00 59.98 59.29 1maa h ARG 493 Cb 0.31 0.08 -0.01 0.00 0.00 0.00 0.00 29.97 30.35 1maa h ARG 493 CO -0.16 -0.25 0.64 0.16 0.00 0.00 0.00 179.97 180.37 1maa s ASP 494 N -3.54 4.45 0.00 7.04 1.47 -1.26 -4.75 116.67 120.08 1maa s ASP 494 Ca -0.06 0.08 -0.03 0.00 1.18 0.00 0.00 52.55 53.73 1maa s ASP 494 Cb 0.01 -2.54 -0.12 0.00 -0.34 0.00 0.00 42.92 39.92 1maa s ASP 494 CO 0.17 -3.25 2.67 0.54 0.68 0.00 0.00 175.17 175.97 1maa n ARG 495 N 8.90 1.41 0.00 2.11 1.74 -1.26 -4.61 116.66 124.96 1maa n ARG 495 Ca 0.40 -0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1maa n ARG 495 Cb 0.47 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.44 1maa n ARG 495 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1maa n LYS 496 N 1.99 0.00 0.00 5.56 4.01 -1.26 -4.96 118.16 123.49 1maa n LYS 496 Ca 0.19 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.99 1maa n LYS 496 Cb 0.67 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.19 1maa n LYS 496 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1maa n SER 497 N 0.00 0.00 -4.67 4.39 2.88 -1.26 -5.01 113.62 109.95 1maa n SER 497 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 1maa n SER 497 Cb 0.00 -0.07 -0.03 0.00 -0.75 0.00 0.00 64.21 63.36 1maa n SER 497 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1maa s PRO 498 N -0.36 4.30 -0.18 -1.46 0.04 -1.26 -5.02 135.00 131.06 1maa s PRO 498 Ca 0.00 1.16 -0.06 0.00 0.04 0.00 0.00 61.00 62.14 1maa s PRO 498 Cb 0.00 -3.59 -0.04 0.00 0.04 0.00 0.00 34.50 30.91 1maa s PRO 498 CO 0.00 -0.42 0.03 -1.14 0.04 0.00 0.00 177.00 175.52 1maa s GLN 499 N 2.44 3.85 -0.51 4.56 2.00 -1.26 -4.93 119.66 125.82 1maa s GLN 499 Ca 0.41 -0.41 -0.26 0.00 -2.00 0.00 0.00 55.36 53.11 1maa s GLN 499 Cb -0.16 -3.14 0.03 0.00 0.80 0.00 0.00 33.01 30.54 1maa s GLN 499 CO 0.11 0.22 0.98 -0.46 -0.50 0.00 0.00 175.29 175.64 1maa s TRP 500 N 0.50 2.83 0.37 1.67 -0.11 -1.26 -4.99 118.94 117.95 1maa s TRP 500 Ca 0.01 0.28 -0.17 0.00 1.22 0.00 0.00 56.10 57.43 1maa s TRP 500 Cb -0.13 -4.10 -0.10 0.00 -1.50 0.00 0.00 33.47 27.64 1maa s TRP 500 CO 0.01 -1.25 0.83 -1.25 -4.62 0.00 0.00 176.95 170.67 1maa s PRO 501 N 4.01 4.09 0.47 5.86 0.04 -1.26 -4.88 135.00 143.33 1maa s PRO 501 Ca 0.36 0.85 -0.23 0.00 0.04 0.00 0.00 61.00 62.03 1maa s PRO 501 Cb -0.10 -2.32 -0.07 0.00 0.04 0.00 0.00 34.50 32.04 1maa s PRO 501 CO 0.24 0.07 1.19 -2.14 0.04 0.00 0.00 177.00 176.40 1maa s PRO 502 N -3.10 3.66 0.00 0.56 0.02 -1.26 -4.67 135.00 130.22 1maa s PRO 502 Ca 0.57 1.84 -0.30 0.00 0.02 0.00 0.00 61.00 63.13 1maa s PRO 502 Cb -0.10 -2.38 -0.04 0.00 0.02 0.00 0.00 34.50 32.00 1maa s PRO 502 CO 0.16 -0.65 1.20 -0.47 -0.33 0.00 0.00 177.00 176.91 1maa s TYR 503 N -1.51 3.31 0.09 6.54 5.04 0.72 -4.51 117.35 127.02 1maa s TYR 503 Ca 0.65 1.26 0.08 0.00 -2.44 0.00 0.00 57.07 56.62 1maa s TYR 503 Cb -0.30 -3.42 -0.03 0.00 0.35 0.00 0.00 41.96 38.56 1maa s TYR 503 CO 0.36 -1.29 -0.22 0.95 -1.34 0.00 0.00 175.55 174.01 1maa s THR 504 N 1.63 1.81 0.40 4.34 -4.23 -1.26 -4.37 115.64 113.96 1maa s THR 504 Ca 0.57 -1.49 0.10 0.00 -1.18 0.00 0.00 61.69 59.69 1maa s THR 504 Cb -0.27 -1.61 0.18 0.00 1.34 0.00 0.00 72.50 72.14 1maa s THR 504 CO 0.26 0.05 1.96 0.71 -0.54 0.00 0.00 174.62 177.05 1maa h THR 505 N 4.12 1.15 0.56 3.99 1.35 -1.91 0.67 112.91 122.84 1maa h THR 505 Ca -0.46 -0.62 -0.03 0.00 -0.55 0.00 0.00 66.41 64.75 1maa h THR 505 Cb 1.17 1.08 0.01 0.00 -1.73 0.00 0.00 68.15 68.68 1maa h THR 505 CO 0.41 0.20 -0.27 0.00 -0.25 0.00 0.00 175.52 175.61 1maa h ALA 506 N 1.69 -0.87 0.00 6.62 0.00 -2.00 -3.37 119.26 121.32 1maa h ALA 506 Ca 0.06 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1maa h ALA 506 Cb 0.27 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1maa h ALA 506 CO 0.01 -0.82 -1.00 0.00 0.00 0.00 0.00 179.25 177.44 1maa h ALA 507 N -1.39 0.59 -6.40 0.00 0.00 -1.96 -3.49 119.26 106.61 1maa h ALA 507 Ca -0.08 -0.25 -0.48 0.00 0.00 0.00 0.00 54.91 54.10 1maa h ALA 507 Cb 0.57 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 1maa h ALA 507 CO 0.13 0.28 -0.84 1.04 0.00 0.00 0.00 179.25 179.85 1maa n GLN 508 N -2.80 -4.07 -3.51 0.00 6.02 0.23 -4.27 117.38 108.98 1maa n GLN 508 Ca -0.02 0.49 -0.37 0.00 -0.01 0.00 0.00 57.00 57.09 1maa n GLN 508 Cb 0.64 -4.94 -0.06 0.00 1.02 0.00 0.00 30.24 26.90 1maa n GLN 508 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 1maa s GLN 509 N -6.47 3.87 0.23 -1.09 -2.07 -1.26 -0.16 119.66 112.71 1maa s GLN 509 Ca 0.22 0.34 -0.03 0.00 -1.82 0.00 0.00 55.36 54.07 1maa s GLN 509 Cb -0.12 -3.11 -0.03 0.00 -1.09 0.00 0.00 33.01 28.66 1maa s GLN 509 CO 0.87 0.62 0.24 1.52 -1.32 0.00 0.00 175.29 177.22 1maa s TYR 510 N -1.23 1.04 0.23 9.60 1.13 0.05 -3.54 117.35 124.63 1maa s TYR 510 Ca 0.29 -1.26 0.10 0.00 -1.41 0.00 0.00 57.07 54.79 1maa s TYR 510 Cb -0.16 -0.38 -0.05 0.00 -1.10 0.00 0.00 41.96 40.28 1maa s TYR 510 CO 0.16 -0.77 -0.19 0.14 -2.51 0.00 0.00 175.55 172.37 1maa s VAL 511 N -3.99 2.18 -0.36 -3.49 -7.23 -0.51 -0.49 120.40 106.52 1maa s VAL 511 Ca 0.35 -2.24 -0.18 0.00 -1.81 0.00 0.00 61.98 58.09 1maa s VAL 511 Cb 0.04 -2.15 0.00 0.00 0.56 0.00 0.00 36.38 34.83 1maa s VAL 511 CO 0.13 -0.40 0.53 -0.94 -0.31 0.00 0.00 175.10 174.11 1maa s SER 512 N -3.24 6.32 -0.64 4.85 1.04 -0.61 -0.94 113.70 120.48 1maa s SER 512 Ca 0.25 -0.07 -0.17 0.00 0.48 0.00 0.00 55.95 56.44 1maa s SER 512 Cb -0.04 -2.27 0.14 0.00 0.10 0.00 0.00 66.02 63.94 1maa s SER 512 CO 0.11 -0.51 0.67 -0.76 0.98 0.00 0.00 173.24 173.73 1maa s LEU 513 N 2.43 5.90 0.00 2.42 1.02 -0.07 -4.15 118.68 126.23 1maa s LEU 513 Ca 0.19 -1.83 0.00 0.00 0.02 0.00 0.00 54.13 52.51 1maa s LEU 513 Cb -0.15 -2.26 -0.00 0.00 0.02 0.00 0.00 46.19 43.80 1maa s LEU 513 CO 0.14 -0.92 0.19 -0.46 0.02 0.00 0.00 176.35 175.31 1maa n ASN 514 N 5.54 -0.52 0.06 2.29 0.23 -1.26 -0.06 115.26 121.53 1maa n ASN 514 Ca -0.05 -1.84 0.02 0.00 -0.53 0.00 0.00 54.58 52.18 1maa n ASN 514 Cb 0.43 1.01 0.37 0.00 -2.08 0.00 0.00 39.78 39.51 1maa n ASN 514 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 1maa h LEU 515 N 0.00 0.36-10.41 -4.53 3.38 -1.93 -3.43 115.31 98.74 1maa h LEU 515 Ca -0.11 -0.06 -0.48 0.00 0.09 0.00 0.00 57.88 57.32 1maa h LEU 515 Cb 0.51 -0.09 0.13 0.00 0.09 0.00 0.00 40.66 41.29 1maa h LEU 515 CO 0.16 0.43 0.30 -0.54 0.09 0.00 0.00 178.44 178.87 1maa s LYS 516 N -4.97 1.59 1.13 1.13 1.02 -1.26 -5.02 119.74 113.37 1maa s LYS 516 Ca -0.07 0.58 -0.13 0.00 0.02 0.00 0.00 55.97 56.37 1maa s LYS 516 Cb 0.16 -1.87 0.26 0.00 -0.52 0.00 0.00 37.83 35.86 1maa s LYS 516 CO 0.74 -1.95 0.99 -2.30 -0.92 0.00 0.00 175.35 171.91 1maa n PRO 517 N -3.64 -2.11 -1.77 -1.68 -0.02 -1.26 -4.89 135.00 119.62 1maa n PRO 517 Ca 0.07 -0.58 -0.41 0.00 -2.02 0.00 0.00 63.50 60.56 1maa n PRO 517 Cb 0.57 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1maa n PRO 517 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1maa n LEU 518 N -4.68 4.75 -4.05 2.45 4.77 -1.26 -4.87 117.00 114.11 1maa n LEU 518 Ca 0.04 1.21 -0.24 0.00 -0.03 0.00 0.00 56.01 56.99 1maa n LEU 518 Cb 0.54 -1.61 -0.16 0.00 -2.33 0.00 0.00 43.42 39.86 1maa n LEU 518 CO 0.55 0.06 -0.47 -0.70 -1.33 0.00 0.00 177.39 175.51 1maa s GLU 519 N -2.15 1.54 -0.07 3.23 2.12 -1.26 -4.83 118.70 117.29 1maa s GLU 519 Ca 0.55 -0.44 -0.18 0.00 0.36 0.00 0.00 54.97 55.25 1maa s GLU 519 Cb -0.48 -1.32 -0.05 0.00 0.26 0.00 0.00 34.13 32.54 1maa s GLU 519 CO 0.63 0.11 0.49 0.08 -0.54 0.00 0.00 175.26 176.03 1maa s VAL 520 N 0.36 5.09 -0.01 3.70 1.01 -1.26 -1.57 120.40 127.72 1maa s VAL 520 Ca -0.09 1.01 0.04 0.00 0.00 0.00 0.00 61.98 62.94 1maa s VAL 520 Cb -0.13 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 1maa s VAL 520 CO 0.02 0.40 -0.12 -0.13 0.00 0.00 0.00 175.10 175.27 1maa s ARG 521 N 0.10 0.98 -0.12 2.72 0.52 0.36 -4.98 118.95 118.52 1maa s ARG 521 Ca 0.27 -0.45 -0.04 0.00 -0.52 0.00 0.00 55.73 54.98 1maa s ARG 521 Cb -0.16 -0.95 -0.04 0.00 0.52 0.00 0.00 34.95 34.32 1maa s ARG 521 CO 0.13 0.26 0.03 1.03 0.02 0.00 0.00 175.30 176.77 1maa s ARG 522 N -0.33 3.40 -0.02 3.54 0.52 -1.26 -0.77 118.95 124.02 1maa s ARG 522 Ca 0.04 -0.36 -0.02 0.00 -0.52 0.00 0.00 55.73 54.88 1maa s ARG 522 Cb -0.05 -2.98 0.01 0.00 0.52 0.00 0.00 34.95 32.45 1maa s ARG 522 CO -0.00 0.55 0.03 0.41 0.02 0.00 0.00 175.30 176.31 1maa n GLY 523 N 2.65 -3.37 3.49 -3.53 0.00 0.77 -4.90 105.19 100.30 1maa n GLY 523 Ca -0.18 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 1maa n GLY 523 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1maa s LEU 524 N -0.12 4.55 -1.36 0.99 2.96 -1.26 -4.11 118.68 120.34 1maa s LEU 524 Ca -0.04 -1.93 -0.06 0.00 -0.22 0.00 0.00 54.13 51.88 1maa s LEU 524 Cb 0.00 -2.46 0.02 0.00 0.50 0.00 0.00 46.19 44.26 1maa s LEU 524 CO 0.10 -1.18 1.00 -1.14 -1.32 0.00 0.00 176.35 173.81 1maa n ARG 525 N 7.25 -6.46 -0.01 1.98 3.00 -1.26 -4.79 116.66 116.38 1maa n ARG 525 Ca 0.28 0.73 -0.14 0.00 -0.00 0.00 0.00 57.85 58.72 1maa n ARG 525 Cb 0.49 -5.64 -0.09 0.00 0.00 0.00 0.00 32.46 27.22 1maa n ARG 525 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1maa h ALA 526 N 0.95 -0.81 -0.72 5.13 0.00 -1.93 0.31 119.26 122.19 1maa h ALA 526 Ca -0.59 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.26 1maa h ALA 526 Cb 1.36 0.95 -0.03 0.00 0.00 0.00 0.00 17.79 20.07 1maa h ALA 526 CO 0.57 -1.05 0.36 1.96 0.00 0.00 0.00 179.25 181.10 1maa h GLN 527 N -0.56 1.02 -0.44 0.00 7.50 -1.95 -2.27 115.11 118.42 1maa h GLN 527 Ca 0.05 -0.14 -0.15 0.00 0.50 0.00 0.00 58.65 58.91 1maa h GLN 527 Cb 0.67 -0.19 -0.01 0.00 0.05 0.00 0.00 27.48 28.00 1maa h GLN 527 CO -0.43 0.79 -0.30 1.15 -1.50 0.00 0.00 178.83 178.54 1maa h THR 528 N 1.00 1.27 0.00 -0.54 2.02 -1.89 -2.90 112.91 111.86 1maa h THR 528 Ca 0.25 -1.47 -0.02 0.00 0.77 0.00 0.00 66.41 65.94 1maa h THR 528 Cb 0.09 1.25 -0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1maa h THR 528 CO -0.03 0.50 -0.09 0.00 0.37 0.00 0.00 175.52 176.27 1maa h ALA 530 N 1.91 0.88 0.31 0.00 0.00 -1.22 0.46 119.26 121.61 1maa h ALA 530 Ca -0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1maa h ALA 530 Cb 0.75 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1maa h ALA 530 CO 0.01 0.63 -0.15 0.35 0.00 0.00 0.00 179.25 180.10 1maa h PHE 531 N 0.76 -0.39 -0.04 0.00 3.57 -1.18 -0.16 116.94 119.50 1maa h PHE 531 Ca 0.12 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 1maa h PHE 531 Cb 0.67 0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.53 1maa h PHE 531 CO 0.04 -0.22 -0.03 -1.49 -2.23 0.00 0.00 178.31 174.39 1maa h TRP 532 N -0.45 0.11 -0.03 0.41 4.06 -1.20 0.39 115.95 119.23 1maa h TRP 532 Ca -0.04 -0.03 -0.03 0.00 2.06 0.00 0.00 58.89 60.85 1maa h TRP 532 Cb 0.34 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.48 1maa h TRP 532 CO -0.05 0.50 -0.10 -0.91 -3.56 0.00 0.00 178.44 174.33 1maa h ASN 533 N -0.32 0.13 0.00 -3.49 2.35 -0.13 -3.36 115.58 110.77 1maa h ASN 533 Ca 0.01 -0.63 -0.13 0.00 -0.55 0.00 0.00 56.30 55.01 1maa h ASN 533 Cb 0.48 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 1maa h ASN 533 CO 0.01 0.74 -0.82 0.03 -1.65 0.00 0.00 177.43 175.74 1maa h ARG 534 N -0.46 0.00 0.00 0.81 3.08 -1.17 -3.43 114.38 113.21 1maa h ARG 534 Ca -0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.98 1maa h ARG 534 Cb 0.73 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 1maa h ARG 534 CO 0.02 0.67 -0.65 0.35 -1.07 0.00 0.00 179.97 179.29 1maa h PHE 535 N -1.00 0.00 -1.09 3.04 3.57 -1.21 -3.40 116.94 116.85 1maa h PHE 535 Ca -0.19 0.00 0.37 0.00 3.53 0.00 0.00 57.97 61.68 1maa h PHE 535 Cb 0.97 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.56 1maa h PHE 535 CO 0.03 0.43 0.64 1.25 -2.23 0.00 0.00 178.31 178.44 1maa h LEU 536 N -1.00 0.39 -1.00 0.59 6.46 -0.39 0.18 115.31 120.54 1maa h LEU 536 Ca -0.09 0.19 -0.09 0.00 -0.12 0.00 0.00 57.88 57.77 1maa h LEU 536 Cb 0.69 0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.77 1maa h LEU 536 CO -0.06 -0.22 -0.21 1.55 -0.62 0.00 0.00 178.44 178.89 1maa h PRO 537 N 0.18 0.48 -0.07 5.25 0.13 -1.78 0.37 132.00 136.55 1maa h PRO 537 Ca 0.78 -0.16 -0.01 0.00 -0.87 0.00 0.00 66.00 65.73 1maa h PRO 537 Cb 2.05 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 33.14 1maa h PRO 537 CO -0.59 0.66 -0.01 0.87 -0.23 0.00 0.00 178.00 178.70 1maa h LYS 538 N 0.43 0.13 -0.99 0.86 1.57 -0.87 0.27 116.57 117.98 1maa h LYS 538 Ca 0.07 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1maa h LYS 538 Cb 0.60 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.85 1maa h LYS 538 CO 0.04 0.45 0.65 1.25 -0.57 0.00 0.00 179.45 181.27 1maa h LEU 539 N -0.20 1.09 -0.31 2.94 6.46 -1.23 -0.29 115.31 123.76 1maa h LEU 539 Ca 0.02 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 1maa h LEU 539 Cb 0.40 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 40.07 1maa h LEU 539 CO 0.01 0.75 0.20 -0.07 -0.62 0.00 0.00 178.44 178.71 1maa h LEU 540 N 1.26 0.36 -0.66 2.25 -0.00 0.22 -1.77 115.31 116.97 1maa h LEU 540 Ca 0.39 -0.02 -0.14 0.00 -0.00 0.00 0.00 57.88 58.11 1maa h LEU 540 Cb -0.02 -0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 40.54 1maa h LEU 540 CO -0.11 0.28 -0.49 0.77 -0.00 0.00 0.00 178.44 178.88 1maa h SER 541 N 0.42 0.48 0.43 -0.43 4.64 -0.55 -1.32 113.55 117.22 1maa h SER 541 Ca 0.11 -0.24 -0.02 0.00 -0.47 0.00 0.00 61.79 61.17 1maa h SER 541 Cb -0.03 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 61.92 1maa h SER 541 CO -0.02 0.90 -0.21 0.00 -0.87 0.00 0.00 176.83 176.62 1maa h ALA 542 N 1.12 -0.58 -0.00 5.18 0.00 -0.87 -2.77 119.26 121.33 1maa h ALA 542 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1maa h ALA 542 Cb 0.99 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1maa h ALA 542 CO 0.09 -0.73 0.00 0.25 0.00 0.00 0.00 179.25 178.85 1maa n THR 543 N -5.27 0.01 -1.85 0.00 -2.24 -0.68 -4.14 114.28 100.10 1maa n THR 543 Ca -0.11 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.24 1maa n THR 543 Cb 0.28 -0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.46 1maa n THR 543 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1maa s ASP 544 N -1.06 6.55 -1.47 3.42 1.11 -0.50 -3.19 116.67 121.53 1maa s ASP 544 Ca 0.03 2.51 -0.02 0.00 0.18 0.00 0.00 52.55 55.25 1maa s ASP 544 Cb 0.02 -2.55 0.02 0.00 1.07 0.00 0.00 42.92 41.48 1maa s ASP 544 CO 0.02 -0.95 0.39 0.35 1.18 0.00 0.00 175.17 176.16 1maa n THR 545 N 5.11 -2.45 -2.14 -1.27 -2.24 -1.26 -4.28 114.28 105.74 1maa n THR 545 Ca 0.17 -0.44 -0.01 0.00 -2.27 0.00 0.00 64.05 61.50 1maa n THR 545 Cb 0.41 -2.24 0.00 0.00 -2.10 0.00 0.00 70.33 66.40 1maa n THR 545 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1maa n LEU 546 N -4.43 -5.04 0.00 3.22 -0.00 -1.19 -5.24 117.00 104.32 1maa n LEU 546 Ca -0.27 0.57 0.00 0.00 -0.00 0.00 0.00 56.01 56.32 1maa n LEU 546 Cb 0.67 -2.20 0.00 0.00 -0.00 0.00 0.00 43.42 41.89 1maa n LEU 546 CO 0.78 -1.48 0.00 0.47 -0.00 0.00 0.00 177.39 177.16