#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a8i s GLN 2 N 0.00 3.00 0.11 0.00 -2.07 0.16 -4.78 119.66 116.08 3a8i s GLN 2 Ca 0.00 -1.09 0.06 0.00 -1.82 0.00 0.00 55.36 52.51 3a8i s GLN 2 Cb 0.00 -2.70 -0.04 0.00 -1.09 0.00 0.00 33.01 29.18 3a8i s GLN 2 CO 0.00 0.10 -0.05 -0.65 -1.32 0.00 0.00 175.29 173.37 3a8i s GLN 3 N -4.10 2.32 0.80 9.60 -0.21 -1.26 -0.12 119.66 126.70 3a8i s GLN 3 Ca 0.43 -0.98 -0.11 0.00 0.02 0.00 0.00 55.36 54.72 3a8i s GLN 3 Cb -0.08 -2.39 0.09 0.00 1.00 0.00 0.00 33.01 31.63 3a8i s GLN 3 CO 0.29 0.51 1.15 0.95 -2.12 0.00 0.00 175.29 176.07 3a8i s THR 4 N -1.34 2.08 -1.67 -0.19 -4.23 -1.26 -4.92 115.64 104.10 3a8i s THR 4 Ca 0.24 -0.09 0.14 0.00 -1.18 0.00 0.00 61.69 60.80 3a8i s THR 4 Cb -0.11 -2.99 0.30 0.00 1.34 0.00 0.00 72.50 71.05 3a8i s THR 4 CO 0.16 0.00 1.31 -2.65 -0.54 0.00 0.00 174.62 172.90 3a8i n PRO 5 N -3.27 0.29 -0.12 3.99 -0.02 -1.26 -2.80 135.00 131.81 3a8i n PRO 5 Ca 0.09 0.09 0.11 0.00 -2.02 0.00 0.00 63.50 61.78 3a8i n PRO 5 Cb 0.61 -1.50 0.28 0.00 -0.02 0.00 0.00 33.50 32.86 3a8i n PRO 5 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3a8i n LEU 6 N -1.17 2.63 -0.15 2.45 4.77 -1.26 -4.58 117.00 119.69 3a8i n LEU 6 Ca 0.08 -1.09 -0.03 0.00 -0.03 0.00 0.00 56.01 54.94 3a8i n LEU 6 Cb 0.08 -0.16 0.06 0.00 -2.33 0.00 0.00 43.42 41.07 3a8i n LEU 6 CO 0.09 0.55 0.90 0.22 -1.33 0.00 0.00 177.39 177.82 3a8i h TYR 7 N 3.50 0.13 -0.33 -1.77 5.03 -1.90 0.45 116.97 122.08 3a8i h TYR 7 Ca 0.00 0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.30 3a8i h TYR 7 Cb 0.77 0.02 -0.01 0.00 1.55 0.00 0.00 36.73 39.05 3a8i h TYR 7 CO 0.16 -0.02 0.04 1.49 -1.32 0.00 0.00 178.16 178.51 3a8i h GLU 8 N 0.21 0.55 -0.92 1.82 4.81 -1.86 -2.00 114.58 117.20 3a8i h GLU 8 Ca 0.23 -0.16 0.16 0.00 -0.13 0.00 0.00 59.36 59.46 3a8i h GLU 8 Cb 0.31 -0.06 -0.08 0.00 0.63 0.00 0.00 28.75 29.56 3a8i h GLU 8 CO -0.32 0.65 0.59 1.96 -0.73 0.00 0.00 179.01 181.16 3a8i h GLN 9 N 0.37 0.67 -0.04 1.92 1.08 -1.69 -1.87 115.11 115.55 3a8i h GLN 9 Ca 0.10 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.26 3a8i h GLN 9 Cb 0.38 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.66 3a8i h GLN 9 CO 0.01 0.44 0.02 0.45 -0.95 0.00 0.00 178.83 178.80 3a8i h HIS 10 N 0.69 0.05 -0.03 2.96 3.86 -0.23 -1.54 115.15 120.91 3a8i h HIS 10 Ca 0.47 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.68 3a8i h HIS 10 Cb 0.78 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.23 3a8i h HIS 10 CO -0.00 0.12 0.02 1.79 0.86 0.00 0.00 177.93 180.71 3a8i h THR 11 N -0.03 1.04 -0.27 2.45 1.35 -1.19 -1.25 112.91 115.02 3a8i h THR 11 Ca 0.01 -0.10 0.08 0.00 -0.55 0.00 0.00 66.41 65.85 3a8i h THR 11 Cb 0.08 1.05 -0.01 0.00 -1.73 0.00 0.00 68.15 67.54 3a8i h THR 11 CO -0.00 0.03 0.28 -0.07 -0.25 0.00 0.00 175.52 175.50 3a8i h LEU 12 N 0.01 0.00 -0.90 3.87 3.38 -1.34 -1.41 115.31 118.92 3a8i h LEU 12 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3a8i h LEU 12 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3a8i h LEU 12 CO -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 178.44 178.49 3a8i n GLY 14 N 1.20 1.20 3.78 0.00 0.00 -0.53 -4.89 105.19 105.95 3a8i n GLY 14 Ca 0.18 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 3a8i n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a8i s ALA 15 N -2.00 3.00 -0.49 4.61 0.00 -0.56 -4.10 121.76 122.22 3a8i s ALA 15 Ca 0.00 0.81 -0.17 0.00 0.00 0.00 0.00 51.96 52.60 3a8i s ALA 15 Cb 0.00 -3.33 0.07 0.00 0.00 0.00 0.00 23.12 19.86 3a8i s ALA 15 CO 0.00 -0.45 0.49 1.03 0.00 0.00 0.00 175.76 176.83 3a8i s ARG 16 N -2.68 3.03 0.10 0.00 1.81 0.05 -4.80 118.95 116.47 3a8i s ARG 16 Ca 0.62 -1.18 -0.21 0.00 -1.72 0.00 0.00 55.73 53.23 3a8i s ARG 16 Cb -0.25 -4.12 -0.07 0.00 -0.45 0.00 0.00 34.95 30.06 3a8i s ARG 16 CO 0.30 -1.11 0.64 -1.64 -0.68 0.00 0.00 175.30 172.81 3a8i s MET 17 N 2.03 4.33 0.24 3.54 -1.94 -1.26 -0.60 119.30 125.63 3a8i s MET 17 Ca 0.08 0.88 0.02 0.00 -1.71 0.00 0.00 55.69 54.96 3a8i s MET 17 Cb -0.22 -3.25 -0.05 0.00 2.01 0.00 0.00 34.83 33.31 3a8i s MET 17 CO 0.09 0.59 0.05 0.14 -0.01 0.00 0.00 175.02 175.88 3a8i s VAL 18 N -1.04 0.76 -0.51 -6.03 -7.23 -0.04 -4.88 120.40 101.43 3a8i s VAL 18 Ca 0.31 -2.00 -0.23 0.00 -1.81 0.00 0.00 61.98 58.25 3a8i s VAL 18 Cb -0.21 -2.46 0.04 0.00 0.56 0.00 0.00 36.38 34.31 3a8i s VAL 18 CO 0.21 -0.19 0.85 -0.62 -0.31 0.00 0.00 175.10 175.04 3a8i s ASP 19 N -3.29 6.36 -0.39 4.85 -1.08 -1.26 -0.59 116.67 121.26 3a8i s ASP 19 Ca 0.32 -0.32 -0.08 0.00 -0.52 0.00 0.00 52.55 51.96 3a8i s ASP 19 Cb 0.07 -2.40 0.07 0.00 -1.46 0.00 0.00 42.92 39.20 3a8i s ASP 19 CO 0.10 -1.08 0.21 0.12 0.52 0.00 0.00 175.17 175.05 3a8i s PHE 20 N 3.56 3.34 -1.42 -5.34 5.36 0.23 -4.69 117.98 119.01 3a8i s PHE 20 Ca 0.29 -1.58 -0.03 0.00 -0.96 0.00 0.00 56.93 54.65 3a8i s PHE 20 Cb -0.13 -2.79 0.00 0.00 -0.34 0.00 0.00 43.02 39.76 3a8i s PHE 20 CO 0.20 -0.82 0.34 0.72 -1.46 0.00 0.00 175.22 174.19 3a8i n HIS 21 N 4.86 -1.55 -1.02 10.12 8.25 -1.26 -1.04 115.22 133.59 3a8i n HIS 21 Ca -0.10 0.66 -0.01 0.00 -0.26 0.00 0.00 57.72 58.02 3a8i n HIS 21 Cb 0.43 -3.44 -0.00 0.00 1.12 0.00 0.00 29.99 28.10 3a8i n HIS 21 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3a8i n GLY 22 N -2.13 0.48 3.08 -1.41 0.00 -1.26 -4.86 105.19 99.08 3a8i n GLY 22 Ca -0.30 -0.28 -0.27 0.00 0.00 0.00 0.00 46.02 45.17 3a8i n GLY 22 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3a8i s TRP 23 N -1.95 1.79 -0.41 1.61 0.52 -0.20 0.40 118.94 120.70 3a8i s TRP 23 Ca 0.00 -0.70 -0.29 0.00 0.02 0.00 0.00 56.10 55.13 3a8i s TRP 23 Cb 0.00 -1.27 0.01 0.00 -1.15 0.00 0.00 33.47 31.07 3a8i s TRP 23 CO 0.00 -0.33 1.31 -1.64 0.02 0.00 0.00 176.95 176.31 3a8i s MET 24 N 0.60 3.67 0.10 4.98 -1.94 0.83 0.74 119.30 128.30 3a8i s MET 24 Ca -0.15 0.87 0.06 0.00 -1.71 0.00 0.00 55.69 54.76 3a8i s MET 24 Cb -0.16 -3.97 -0.03 0.00 2.01 0.00 0.00 34.83 32.68 3a8i s MET 24 CO 0.05 -1.44 -0.16 -1.64 -0.01 0.00 0.00 175.02 171.82 3a8i s MET 25 N 4.67 0.99 -0.08 2.03 -1.94 0.24 -4.46 119.30 120.75 3a8i s MET 25 Ca 0.56 -1.14 -0.30 0.00 -1.71 0.00 0.00 55.69 53.11 3a8i s MET 25 Cb -0.12 -1.00 -0.04 0.00 2.01 0.00 0.00 34.83 35.68 3a8i s MET 25 CO 0.31 0.21 1.40 -1.25 -0.01 0.00 0.00 175.02 175.68 3a8i s PRO 26 N -2.20 4.24 0.07 2.03 0.04 -1.26 -0.86 135.00 137.06 3a8i s PRO 26 Ca 0.05 1.89 -0.09 0.00 0.04 0.00 0.00 61.00 62.90 3a8i s PRO 26 Cb -0.08 -3.75 -0.27 0.00 0.04 0.00 0.00 34.50 30.44 3a8i s PRO 26 CO 0.03 -0.69 1.13 1.25 0.04 0.00 0.00 177.00 178.77 3a8i h LEU 27 N 9.34 0.63 -7.94 -3.56 5.85 -1.20 -1.47 115.31 116.95 3a8i h LEU 27 Ca -0.34 -0.62 0.20 0.00 0.84 0.00 0.00 57.88 57.96 3a8i h LEU 27 Cb 1.15 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 3a8i h LEU 27 CO 0.94 1.46 0.65 -1.38 -0.34 0.00 0.00 178.44 179.78 3a8i s HIS 28 N -2.81 0.06 -0.32 1.25 -3.43 -1.25 -1.60 115.29 107.19 3a8i s HIS 28 Ca -0.06 -0.40 0.06 0.00 -0.80 0.00 0.00 55.06 53.86 3a8i s HIS 28 Cb 0.06 0.67 0.45 0.00 -1.43 0.00 0.00 32.58 32.34 3a8i s HIS 28 CO 0.91 -0.78 1.19 0.66 -2.00 0.00 0.00 174.74 174.71 3a8i n TYR 29 N -0.74 2.88 0.00 0.38 4.02 -1.26 -0.77 117.16 121.66 3a8i n TYR 29 Ca -0.02 -2.39 0.00 0.00 -0.01 0.00 0.00 57.90 55.48 3a8i n TYR 29 Cb 0.59 -0.32 0.00 0.00 -0.02 0.00 0.00 39.34 39.60 3a8i n TYR 29 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3a8i n GLY 30 N -0.67 2.24 2.77 2.72 0.00 -1.26 -4.77 105.19 106.21 3a8i n GLY 30 Ca 0.43 -0.32 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 3a8i n GLY 30 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3a8i s SER 31 N 0.07 1.53 0.33 1.61 0.15 -1.26 -5.00 113.70 111.13 3a8i s SER 31 Ca 0.00 -0.56 0.01 0.00 0.70 0.00 0.00 55.95 56.11 3a8i s SER 31 Cb 0.00 0.51 0.58 0.00 -1.71 0.00 0.00 66.02 65.41 3a8i s SER 31 CO 0.00 -0.37 1.97 -0.61 1.20 0.00 0.00 173.24 175.43 3a8i h GLN 32 N 8.27 0.91 0.19 5.44 4.15 -1.94 -2.42 115.11 129.72 3a8i h GLN 32 Ca -0.15 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.21 3a8i h GLN 32 Cb 1.10 -0.21 -0.00 0.00 0.21 0.00 0.00 27.48 28.58 3a8i h GLN 32 CO 0.32 0.61 -0.11 0.82 -1.93 0.00 0.00 178.83 178.53 3a8i h ILE 33 N 0.94 0.76 -0.65 2.39 1.08 -1.99 -1.55 117.51 118.49 3a8i h ILE 33 Ca 0.29 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.74 3a8i h ILE 33 Cb 0.01 0.76 -0.03 0.00 -3.07 0.00 0.00 36.82 34.49 3a8i h ILE 33 CO -0.08 0.00 0.32 0.44 -0.69 0.00 0.00 178.15 178.14 3a8i h ASP 34 N -0.30 0.82 -0.55 1.72 3.32 -1.92 -0.84 116.42 118.67 3a8i h ASP 34 Ca -0.02 -0.08 0.01 0.00 0.02 0.00 0.00 57.03 56.96 3a8i h ASP 34 Cb 0.24 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 3a8i h ASP 34 CO 0.02 0.69 0.36 -0.33 -1.72 0.00 0.00 179.24 178.27 3a8i h GLU 35 N 0.91 0.72 -0.47 3.56 5.08 -1.25 0.50 114.58 123.64 3a8i h GLU 35 Ca 0.23 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.50 3a8i h GLU 35 Cb 0.08 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 3a8i h GLU 35 CO -0.03 0.48 0.11 1.25 -1.00 0.00 0.00 179.01 179.81 3a8i h HIS 36 N 0.74 0.79 -0.83 4.33 2.76 -0.93 -2.53 115.15 119.49 3a8i h HIS 36 Ca 0.20 -0.10 -0.04 0.00 -2.20 0.00 0.00 60.37 58.24 3a8i h HIS 36 Cb -0.08 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 28.62 3a8i h HIS 36 CO -0.04 0.72 0.37 1.25 -1.30 0.00 0.00 177.93 178.93 3a8i h HIS 37 N 0.63 1.22 -0.48 5.26 -0.00 -0.41 -2.70 115.15 118.67 3a8i h HIS 37 Ca 0.15 -0.07 -0.06 0.00 -0.00 0.00 0.00 60.37 60.38 3a8i h HIS 37 Cb 0.34 -0.37 -0.02 0.00 -0.00 0.00 0.00 27.41 27.35 3a8i h HIS 37 CO 0.02 0.90 0.05 0.00 -0.00 0.00 0.00 177.93 178.90 3a8i h ALA 38 N 1.20 1.20 -0.38 5.26 0.00 0.40 -2.36 119.26 124.58 3a8i h ALA 38 Ca 0.28 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3a8i h ALA 38 Cb 0.16 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3a8i h ALA 38 CO -0.03 0.53 -0.05 0.28 0.00 0.00 0.00 179.25 179.99 3a8i h VAL 39 N 0.72 1.27 0.00 0.00 2.07 -1.33 0.58 116.25 119.56 3a8i h VAL 39 Ca 0.15 -1.09 -0.07 0.00 0.82 0.00 0.00 66.70 66.51 3a8i h VAL 39 Cb 0.37 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 3a8i h VAL 39 CO 0.01 0.36 -0.32 0.03 0.02 0.00 0.00 177.57 177.68 3a8i h ARG 40 N 0.52 0.00 0.00 1.57 2.47 -1.15 -3.37 114.38 114.41 3a8i h ARG 40 Ca 0.10 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.82 3a8i h ARG 40 Cb 0.54 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 3a8i h ARG 40 CO 0.03 0.32 0.00 0.25 0.56 0.00 0.00 179.97 181.13 3a8i n THR 41 N -3.65 0.00 0.00 2.04 -2.24 -0.92 -4.65 114.28 104.86 3a8i n THR 41 Ca -0.01 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 3a8i n THR 41 Cb 0.43 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 3a8i n THR 41 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3a8i n ASP 42 N -0.50 0.00 -3.62 3.42 2.03 0.16 -4.79 116.55 113.25 3a8i n ASP 42 Ca 0.00 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.27 3a8i n ASP 42 Cb 0.01 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.35 3a8i n ASP 42 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3a8i s ALA 43 N -1.63 -2.10 0.10 -1.67 0.00 0.11 -0.64 121.76 115.94 3a8i s ALA 43 Ca 0.00 2.32 0.03 0.00 0.00 0.00 0.00 51.96 54.31 3a8i s ALA 43 Cb 0.00 -1.63 -0.04 0.00 0.00 0.00 0.00 23.12 21.45 3a8i s ALA 43 CO 0.00 -0.54 -0.08 0.20 0.00 0.00 0.00 175.76 175.34 3a8i s GLY 44 N 1.89 0.83 0.06 0.00 0.00 -0.93 -1.37 107.32 107.80 3a8i s GLY 44 Ca -0.08 -1.32 0.01 0.00 0.00 0.00 0.00 44.72 43.33 3a8i s GLY 44 CO -0.18 -1.41 -0.05 -3.16 0.00 0.00 0.00 173.10 168.29 3a8i s MET 45 N -3.49 0.64 -0.03 2.90 0.23 0.15 -1.59 119.30 118.11 3a8i s MET 45 Ca 0.10 -1.10 0.01 0.00 -1.03 0.00 0.00 55.69 53.68 3a8i s MET 45 Cb 0.02 -0.05 0.01 0.00 -1.53 0.00 0.00 34.83 33.29 3a8i s MET 45 CO -0.02 -0.04 -0.05 -0.06 -2.03 0.00 0.00 175.02 172.82 3a8i s PHE 46 N -3.03 0.70 -0.17 3.16 0.08 0.10 -1.09 117.98 117.72 3a8i s PHE 46 Ca 0.03 -0.17 -0.29 0.00 0.12 0.00 0.00 56.93 56.62 3a8i s PHE 46 Cb 0.01 -0.58 -0.04 0.00 -0.57 0.00 0.00 43.02 41.84 3a8i s PHE 46 CO -0.05 -0.13 1.82 0.34 -0.10 0.00 0.00 175.22 177.09 3a8i s ASP 47 N 0.59 6.18 -0.24 1.36 -1.08 -1.26 -0.83 116.67 121.40 3a8i s ASP 47 Ca -0.08 1.87 0.10 0.00 -0.52 0.00 0.00 52.55 53.92 3a8i s ASP 47 Cb -0.11 -2.53 0.44 0.00 -1.46 0.00 0.00 42.92 39.26 3a8i s ASP 47 CO 0.00 -1.38 1.20 1.33 0.52 0.00 0.00 175.17 176.84 3a8i n VAL 48 N 6.56 2.24 1.35 1.11 0.24 -0.08 -4.73 118.33 125.02 3a8i n VAL 48 Ca 0.21 -3.55 0.10 0.00 -2.04 0.00 0.00 64.34 59.07 3a8i n VAL 48 Cb 0.44 -0.52 0.61 0.00 -1.47 0.00 0.00 33.84 32.91 3a8i n VAL 48 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3a8i n SER 49 N -0.90 0.00 0.14 -1.34 7.64 -1.12 -2.70 113.62 115.34 3a8i n SER 49 Ca 0.28 -0.71 0.12 0.00 1.01 0.00 0.00 58.87 59.58 3a8i n SER 49 Cb 0.82 0.00 0.23 0.00 -1.01 0.00 0.00 64.21 64.25 3a8i n SER 49 CO 0.00 0.00 0.00 1.12 -3.01 0.00 0.00 175.04 173.15 3a8i h HIS 50 N 0.00 0.00 -4.38 1.43 2.07 -1.90 -3.46 115.15 108.91 3a8i h HIS 50 Ca 0.00 0.00 -0.51 0.00 -2.85 0.00 0.00 60.37 57.01 3a8i h HIS 50 Cb 0.00 0.00 0.07 0.00 2.57 0.00 0.00 27.41 30.05 3a8i h HIS 50 CO 0.00 0.00 0.41 -1.64 -3.07 0.00 0.00 177.93 173.63 3a8i s MET 51 N -3.18 3.32 -0.13 5.12 -1.94 -1.10 -4.13 119.30 117.25 3a8i s MET 51 Ca 0.07 0.71 -0.02 0.00 -1.71 0.00 0.00 55.69 54.74 3a8i s MET 51 Cb 0.09 -2.05 -0.03 0.00 2.01 0.00 0.00 34.83 34.86 3a8i s MET 51 CO 0.67 -0.77 -0.06 0.99 -0.01 0.00 0.00 175.02 175.84 3a8i s THR 52 N -3.20 3.72 -0.18 2.05 2.01 -0.94 -4.94 115.64 114.16 3a8i s THR 52 Ca 0.56 -0.43 -0.05 0.00 0.31 0.00 0.00 61.69 62.09 3a8i s THR 52 Cb -0.11 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 3a8i s THR 52 CO 0.54 0.52 -0.01 -0.63 -0.69 0.00 0.00 174.62 174.35 3a8i s ILE 53 N 0.12 4.03 -0.10 1.82 1.01 -1.26 -0.89 121.20 125.93 3a8i s ILE 53 Ca -0.02 -0.30 0.03 0.00 0.00 0.00 0.00 60.65 60.36 3a8i s ILE 53 Cb -0.14 -2.80 0.01 0.00 0.01 0.00 0.00 42.46 39.54 3a8i s ILE 53 CO 0.03 0.46 -0.18 -0.69 0.00 0.00 0.00 174.94 174.56 3a8i s VAL 54 N 0.62 1.69 -0.13 2.92 1.01 0.11 -0.65 120.40 125.97 3a8i s VAL 54 Ca -0.01 -0.78 -0.04 0.00 0.00 0.00 0.00 61.98 61.15 3a8i s VAL 54 Cb -0.14 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 3a8i s VAL 54 CO 0.02 0.48 0.01 -1.81 0.00 0.00 0.00 175.10 173.80 3a8i s ASP 55 N 0.69 5.22 -0.09 3.32 1.11 -0.26 0.45 116.67 127.11 3a8i s ASP 55 Ca -0.12 0.05 0.03 0.00 0.18 0.00 0.00 52.55 52.69 3a8i s ASP 55 Cb -0.16 -1.69 0.01 0.00 1.07 0.00 0.00 42.92 42.15 3a8i s ASP 55 CO 0.03 0.27 -0.17 -0.76 1.18 0.00 0.00 175.17 175.72 3a8i s LEU 56 N -0.23 1.80 -0.01 1.23 1.43 -0.20 0.18 118.68 122.89 3a8i s LEU 56 Ca 0.06 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 3a8i s LEU 56 Cb -0.12 -1.08 0.01 0.00 0.03 0.00 0.00 46.19 45.03 3a8i s LEU 56 CO 0.02 0.07 0.00 -0.13 0.23 0.00 0.00 176.35 176.54 3a8i s ARG 57 N 0.66 0.07 0.00 1.70 0.52 -0.83 -1.09 118.95 119.98 3a8i s ARG 57 Ca -0.14 0.03 0.00 0.00 -0.52 0.00 0.00 55.73 55.10 3a8i s ARG 57 Cb -0.16 -0.15 0.00 0.00 0.52 0.00 0.00 34.95 35.15 3a8i s ARG 57 CO 0.04 -0.04 0.00 0.41 0.02 0.00 0.00 175.30 175.73 3a8i n GLY 58 N 3.42 4.06 0.28 -3.53 0.00 -0.34 -0.83 105.19 108.26 3a8i n GLY 58 Ca -0.17 -1.08 0.16 0.00 0.00 0.00 0.00 46.02 44.92 3a8i n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3a8i h SER 59 N 0.00 0.00 -0.64 1.61 4.64 -1.90 -2.22 113.55 115.04 3a8i h SER 59 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3a8i h SER 59 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3a8i h SER 59 CO 0.00 0.07 0.00 0.54 -0.87 0.00 0.00 176.83 176.57 3a8i n ARG 60 N -3.42 3.13 -0.18 4.77 1.74 -1.26 -4.58 116.66 116.85 3a8i n ARG 60 Ca -0.01 -2.56 -0.09 0.00 -0.77 0.00 0.00 57.85 54.41 3a8i n ARG 60 Cb 0.22 -1.72 0.01 0.00 -1.02 0.00 0.00 32.46 29.96 3a8i n ARG 60 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3a8i h THR 61 N 3.88 1.25 -0.69 0.55 2.02 -1.66 0.59 112.91 118.84 3a8i h THR 61 Ca 0.00 -0.91 -0.05 0.00 0.77 0.00 0.00 66.41 66.22 3a8i h THR 61 Cb 1.17 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 68.40 3a8i h THR 61 CO 0.13 0.33 0.23 -0.09 0.37 0.00 0.00 175.52 176.48 3a8i h ARG 62 N 0.72 1.07 -0.38 6.66 2.43 -1.81 -1.04 114.38 122.02 3a8i h ARG 62 Ca 0.16 -0.22 -0.03 0.00 -0.81 0.00 0.00 59.98 59.07 3a8i h ARG 62 Cb 0.38 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 3a8i h ARG 62 CO 0.01 0.91 0.10 1.49 -1.51 0.00 0.00 179.97 180.97 3a8i h GLU 63 N 1.01 0.61 -0.39 0.20 4.81 -1.70 -1.42 114.58 117.69 3a8i h GLU 63 Ca 0.23 -0.14 0.08 0.00 -0.13 0.00 0.00 59.36 59.39 3a8i h GLU 63 Cb 0.28 -0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.50 3a8i h GLU 63 CO -0.01 0.63 -0.11 0.35 -0.73 0.00 0.00 179.01 179.14 3a8i h PHE 64 N 0.48 -0.25 -0.04 0.92 3.57 -0.44 -2.79 116.94 118.38 3a8i h PHE 64 Ca 0.12 0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.52 3a8i h PHE 64 Cb 0.29 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 3a8i h PHE 64 CO 0.01 -0.19 -0.59 -0.07 -2.23 0.00 0.00 178.31 175.25 3a8i h LEU 65 N -0.02 0.16 -1.27 0.59 3.38 -0.73 0.26 115.31 117.68 3a8i h LEU 65 Ca 0.19 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 3a8i h LEU 65 Cb 0.31 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3a8i h LEU 65 CO -0.41 0.72 -0.33 0.03 0.09 0.00 0.00 178.44 178.54 3a8i h ARG 66 N 0.11 0.00 0.15 1.13 3.08 -1.08 -2.05 114.38 115.72 3a8i h ARG 66 Ca -0.01 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.84 3a8i h ARG 66 Cb 1.07 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.14 3a8i h ARG 66 CO 0.09 0.33 -0.92 -0.92 -1.07 0.00 0.00 179.97 177.48 3a8i h TYR 67 N 0.00 0.59 -0.82 3.04 3.20 -1.18 -3.41 116.97 118.40 3a8i h TYR 67 Ca -0.00 -0.43 -0.02 0.00 3.14 0.00 0.00 58.73 61.41 3a8i h TYR 67 Cb 0.69 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.90 3a8i h TYR 67 CO 0.00 1.35 0.44 1.25 -1.64 0.00 0.00 178.16 179.56 3a8i h LEU 68 N -0.31 1.04 -9.39 2.82 5.85 -0.34 -0.87 115.31 114.10 3a8i h LEU 68 Ca -0.16 -0.11 -0.66 0.00 0.84 0.00 0.00 57.88 57.80 3a8i h LEU 68 Cb 1.71 -0.26 -0.13 0.00 0.37 0.00 0.00 40.66 42.34 3a8i h LEU 68 CO 0.16 0.84 -0.68 -0.76 -0.34 0.00 0.00 178.44 177.67 3a8i s LEU 69 N -9.91 3.35 0.10 2.25 1.43 -0.78 -4.27 118.68 110.84 3a8i s LEU 69 Ca -0.13 -0.21 0.11 0.00 -1.03 0.00 0.00 54.13 52.87 3a8i s LEU 69 Cb 0.16 -2.07 -0.15 0.00 0.03 0.00 0.00 46.19 44.16 3a8i s LEU 69 CO 0.82 0.19 1.09 0.00 0.23 0.00 0.00 176.35 178.68 3a8i h ALA 70 N 3.61 0.57 -2.43 4.21 0.00 -1.79 -3.44 119.26 119.99 3a8i h ALA 70 Ca -0.48 -0.95 -0.47 0.00 0.00 0.00 0.00 54.91 53.01 3a8i h ALA 70 Cb 1.17 0.09 0.13 0.00 0.00 0.00 0.00 17.79 19.18 3a8i h ALA 70 CO 0.57 1.16 0.28 1.21 0.00 0.00 0.00 179.25 182.47 3a8i s ASN 71 N -6.36 3.48 -0.32 0.00 3.84 -1.13 -1.51 114.94 112.94 3a8i s ASN 71 Ca -0.00 1.12 0.01 0.00 0.21 0.00 0.00 52.86 54.19 3a8i s ASN 71 Cb 0.09 -1.75 0.08 0.00 -0.55 0.00 0.00 41.25 39.11 3a8i s ASN 71 CO 0.81 -2.59 0.03 -0.62 -2.79 0.00 0.00 177.10 171.94 3a8i s ASP 72 N -3.83 4.81 0.30 -4.21 3.68 -1.26 -4.79 116.67 111.37 3a8i s ASP 72 Ca 0.64 -1.72 0.21 0.00 2.13 0.00 0.00 52.55 53.80 3a8i s ASP 72 Cb -0.16 -1.67 1.11 0.00 -1.45 0.00 0.00 42.92 40.76 3a8i s ASP 72 CO 0.55 -0.33 1.64 1.33 0.13 0.00 0.00 175.17 178.49 3a8i n VAL 73 N 4.45 1.05 0.25 1.11 0.24 -1.26 -1.59 118.33 122.59 3a8i n VAL 73 Ca -0.06 0.68 0.11 0.00 -2.04 0.00 0.00 64.34 63.03 3a8i n VAL 73 Cb 0.42 -1.67 0.53 0.00 -1.47 0.00 0.00 33.84 31.65 3a8i n VAL 73 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3a8i n ALA 74 N -1.77 1.29 0.45 2.33 0.00 -1.26 -0.26 120.51 121.29 3a8i n ALA 74 Ca -0.01 0.15 0.09 0.00 0.00 0.00 0.00 53.44 53.67 3a8i n ALA 74 Cb 0.05 -1.34 0.39 0.00 0.00 0.00 0.00 19.45 18.56 3a8i n ALA 74 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3a8i n LYS 75 N -2.22 0.09 -3.19 0.00 5.02 -0.62 -4.58 118.16 112.66 3a8i n LYS 75 Ca 0.00 0.33 -0.44 0.00 -2.02 0.00 0.00 58.31 56.18 3a8i n LYS 75 Cb 0.11 -1.67 -0.06 0.00 -0.02 0.00 0.00 35.03 33.40 3a8i n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3a8i s LEU 76 N -3.66 5.27 0.00 -0.35 1.43 0.64 -4.79 118.68 117.22 3a8i s LEU 76 Ca 0.06 -1.19 0.00 0.00 -1.03 0.00 0.00 54.13 51.97 3a8i s LEU 76 Cb 0.09 -2.35 0.00 0.00 0.03 0.00 0.00 46.19 43.96 3a8i s LEU 76 CO 0.32 -0.92 0.00 0.35 0.23 0.00 0.00 176.35 176.33 3a8i n THR 77 N 5.51 0.00 -3.71 5.49 -2.24 -1.26 -5.01 114.28 113.06 3a8i n THR 77 Ca -0.09 -0.14 -0.36 0.00 -2.27 0.00 0.00 64.05 61.19 3a8i n THR 77 Cb 0.44 0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 69.21 3a8i n THR 77 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3a8i s LYS 78 N -1.30 3.91 0.10 -0.78 1.02 -1.26 -5.05 119.74 116.37 3a8i s LYS 78 Ca 0.00 -0.03 -0.36 0.00 0.02 0.00 0.00 55.97 55.60 3a8i s LYS 78 Cb 0.00 -3.32 -0.17 0.00 -0.52 0.00 0.00 37.83 33.82 3a8i s LYS 78 CO 0.00 0.50 1.15 0.45 -0.92 0.00 0.00 175.35 176.53 3a8i n SER 79 N 2.78 0.86 0.00 2.83 2.88 -1.26 -1.48 113.62 120.23 3a8i n SER 79 Ca -0.16 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.52 3a8i n SER 79 Cb 0.53 -1.10 0.00 0.00 -0.75 0.00 0.00 64.21 62.89 3a8i n SER 79 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3a8i n GLY 80 N 2.04 2.30 3.75 0.46 0.00 0.22 -4.89 105.19 109.07 3a8i n GLY 80 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3a8i n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3a8i s LYS 81 N -0.14 4.39 0.15 1.61 2.47 -0.55 0.21 119.74 127.88 3a8i s LYS 81 Ca 0.00 2.11 0.08 0.00 -1.56 0.00 0.00 55.97 56.60 3a8i s LYS 81 Cb 0.00 -3.14 -0.04 0.00 -1.46 0.00 0.00 37.83 33.19 3a8i s LYS 81 CO 0.00 -0.20 -0.07 0.00 0.16 0.00 0.00 175.35 175.24 3a8i s ALA 82 N -0.46 3.02 0.32 3.13 0.00 0.15 -1.23 121.76 126.69 3a8i s ALA 82 Ca 0.53 -1.35 0.03 0.00 0.00 0.00 0.00 51.96 51.18 3a8i s ALA 82 Cb -0.38 -0.87 -0.06 0.00 0.00 0.00 0.00 23.12 21.81 3a8i s ALA 82 CO 0.44 0.55 0.07 -0.48 0.00 0.00 0.00 175.76 176.34 3a8i s LEU 83 N -2.59 2.03 -0.07 0.00 0.05 -0.35 -4.86 118.68 112.89 3a8i s LEU 83 Ca 0.24 -1.41 0.01 0.00 0.05 0.00 0.00 54.13 53.01 3a8i s LEU 83 Cb -0.10 -0.26 -0.03 0.00 -2.05 0.00 0.00 46.19 43.75 3a8i s LEU 83 CO 0.15 -0.67 -0.07 -0.47 -0.55 0.00 0.00 176.35 174.74 3a8i s TYR 84 N -3.39 2.94 0.01 3.48 5.04 -1.26 -2.36 117.35 121.81 3a8i s TYR 84 Ca 0.35 -0.01 -0.11 0.00 -2.44 0.00 0.00 57.07 54.86 3a8i s TYR 84 Cb 0.08 -1.73 0.01 0.00 0.35 0.00 0.00 41.96 40.67 3a8i s TYR 84 CO 0.15 0.30 0.22 0.45 -1.34 0.00 0.00 175.55 175.33 3a8i s SER 85 N -0.71 -0.06 0.30 4.32 0.15 -0.74 -4.81 113.70 112.15 3a8i s SER 85 Ca 0.11 -0.16 -0.09 0.00 0.70 0.00 0.00 55.95 56.51 3a8i s SER 85 Cb -0.11 0.28 -0.07 0.00 -1.71 0.00 0.00 66.02 64.41 3a8i s SER 85 CO 0.02 -0.47 0.63 -0.83 1.20 0.00 0.00 173.24 173.78 3a8i s GLY 86 N -1.62 2.09 -0.19 9.45 0.00 -1.26 -1.58 107.32 114.20 3a8i s GLY 86 Ca -0.11 -0.29 0.01 0.00 0.00 0.00 0.00 44.72 44.33 3a8i s GLY 86 CO 0.01 -0.14 -0.17 -0.29 0.00 0.00 0.00 173.10 172.51 3a8i s MET 87 N -3.29 2.67 0.29 2.90 0.00 -0.46 -2.43 119.30 118.98 3a8i s MET 87 Ca 0.48 -0.89 0.08 0.00 0.00 0.00 0.00 55.69 55.36 3a8i s MET 87 Cb -0.11 -2.55 -0.04 0.00 0.00 0.00 0.00 34.83 32.14 3a8i s MET 87 CO 0.25 -0.30 0.17 -0.51 0.00 0.00 0.00 175.02 174.64 3a8i s LEU 88 N 1.29 3.56 0.71 4.11 1.43 -1.26 -1.24 118.68 127.28 3a8i s LEU 88 Ca 0.02 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 52.67 3a8i s LEU 88 Cb -0.15 -2.10 0.13 0.00 0.03 0.00 0.00 46.19 44.10 3a8i s LEU 88 CO -0.11 -0.15 0.98 0.54 0.23 0.00 0.00 176.35 177.84 3a8i s ASN 89 N -3.85 4.38 0.00 2.29 2.20 0.07 -4.71 114.94 115.32 3a8i s ASN 89 Ca 0.35 -0.55 0.22 0.00 -0.94 0.00 0.00 52.86 51.94 3a8i s ASN 89 Cb -0.06 0.22 1.08 0.00 -2.00 0.00 0.00 41.25 40.49 3a8i s ASN 89 CO 0.24 -1.85 1.71 0.00 -2.94 0.00 0.00 177.10 174.25 3a8i n ALA 90 N -2.76 2.12 0.80 3.54 0.00 -1.26 -1.10 120.51 121.84 3a8i n ALA 90 Ca 0.16 -0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.61 3a8i n ALA 90 Cb 0.61 -1.36 0.48 0.00 0.00 0.00 0.00 19.45 19.19 3a8i n ALA 90 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3a8i n SER 91 N -1.31 0.00 0.00 0.00 3.41 -1.26 -4.46 113.62 109.99 3a8i n SER 91 Ca 0.10 0.41 0.00 0.00 -0.26 0.00 0.00 58.87 59.11 3a8i n SER 91 Cb 0.19 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 3a8i n SER 91 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3a8i n GLY 92 N 0.73 2.48 3.73 5.00 0.00 -0.26 -4.77 105.19 112.10 3a8i n GLY 92 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 3a8i n GLY 92 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3a8i s GLY 93 N -1.86 2.77 -0.30 -0.02 0.00 -1.26 -4.12 107.32 102.53 3a8i s GLY 93 Ca 0.00 1.16 -0.21 0.00 0.00 0.00 0.00 44.72 45.67 3a8i s GLY 93 CO 0.00 1.59 0.66 0.14 0.00 0.00 0.00 173.10 175.49 3a8i s VAL 94 N -1.49 4.91 -0.07 1.40 1.01 -0.78 -0.75 120.40 124.63 3a8i s VAL 94 Ca 0.81 0.93 -0.25 0.00 0.00 0.00 0.00 61.98 63.47 3a8i s VAL 94 Cb -0.36 -4.03 -0.25 0.00 0.00 0.00 0.00 36.38 31.74 3a8i s VAL 94 CO 0.41 -0.16 0.96 0.40 0.00 0.00 0.00 175.10 176.71 3a8i h ILE 95 N 5.55 1.60 -3.29 2.22 2.04 -1.46 -2.15 117.51 122.02 3a8i h ILE 95 Ca -0.26 -2.09 -0.01 0.00 1.00 0.00 0.00 64.86 63.50 3a8i h ILE 95 Cb 1.11 2.95 -0.09 0.00 -0.74 0.00 0.00 36.82 40.05 3a8i h ILE 95 CO 0.82 0.57 0.05 -0.62 0.00 0.00 0.00 178.15 178.97 3a8i s ASP 96 N -6.35 -0.24 0.25 1.72 -1.08 -1.07 -4.91 116.67 104.99 3a8i s ASP 96 Ca -0.16 -0.57 0.09 0.00 -0.52 0.00 0.00 52.55 51.39 3a8i s ASP 96 Cb -0.00 0.61 -0.04 0.00 -1.46 0.00 0.00 42.92 42.03 3a8i s ASP 96 CO 0.74 -1.13 0.01 1.51 0.52 0.00 0.00 175.17 176.81 3a8i s ASP 97 N -2.91 4.62 0.08 -0.34 -4.77 -1.26 -1.36 116.67 110.73 3a8i s ASP 97 Ca 0.12 -0.59 -0.26 0.00 -3.30 0.00 0.00 52.55 48.52 3a8i s ASP 97 Cb -0.02 -0.90 0.09 0.00 -1.09 0.00 0.00 42.92 41.00 3a8i s ASP 97 CO 0.01 0.01 0.74 -1.48 0.70 0.00 0.00 175.17 175.16 3a8i s LEU 98 N -3.57 -0.47 -0.13 2.11 0.05 -0.61 -4.30 118.68 111.76 3a8i s LEU 98 Ca 0.31 0.00 -0.03 0.00 0.05 0.00 0.00 54.13 54.46 3a8i s LEU 98 Cb -0.07 2.32 -0.03 0.00 -2.05 0.00 0.00 46.19 46.35 3a8i s LEU 98 CO 0.20 -0.80 -0.02 -0.63 -0.55 0.00 0.00 176.35 174.56 3a8i s ILE 99 N -3.43 4.11 -0.09 1.48 1.01 -0.83 -1.80 121.20 121.65 3a8i s ILE 99 Ca 0.03 -0.30 0.04 0.00 0.00 0.00 0.00 60.65 60.42 3a8i s ILE 99 Cb -0.01 -2.78 0.00 0.00 0.01 0.00 0.00 42.46 39.69 3a8i s ILE 99 CO -0.11 0.53 -0.21 0.54 0.00 0.00 0.00 174.94 175.69 3a8i s VAL 100 N -0.10 1.83 -0.14 2.92 0.11 -0.99 -0.06 120.40 123.96 3a8i s VAL 100 Ca 0.03 -0.89 -0.01 0.00 -2.93 0.00 0.00 61.98 58.18 3a8i s VAL 100 Cb -0.13 -1.60 -0.02 0.00 -1.53 0.00 0.00 36.38 33.11 3a8i s VAL 100 CO 0.02 0.51 -0.11 -0.31 -3.33 0.00 0.00 175.10 171.88 3a8i s TYR 101 N 0.42 2.86 -0.10 1.54 1.51 0.10 -1.21 117.35 122.47 3a8i s TYR 101 Ca -0.18 -0.62 -0.18 0.00 -1.01 0.00 0.00 57.07 55.08 3a8i s TYR 101 Cb -0.17 -1.89 -0.04 0.00 -0.11 0.00 0.00 41.96 39.75 3a8i s TYR 101 CO 0.08 -0.21 0.49 -0.47 -1.11 0.00 0.00 175.55 174.33 3a8i s TYR 102 N 0.45 3.54 -0.06 2.71 5.04 -0.36 -0.27 117.35 128.40 3a8i s TYR 102 Ca -0.08 0.94 -0.04 0.00 -2.44 0.00 0.00 57.07 55.44 3a8i s TYR 102 Cb -0.15 -2.56 -0.03 0.00 0.35 0.00 0.00 41.96 39.57 3a8i s TYR 102 CO 0.04 0.20 -0.10 1.19 -1.34 0.00 0.00 175.55 175.54 3a8i n PHE 103 N 3.53 0.00 -4.29 4.97 3.72 -0.55 0.73 117.46 125.57 3a8i n PHE 103 Ca -0.07 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.16 3a8i n PHE 103 Cb 0.52 -0.26 -0.09 0.00 -0.94 0.00 0.00 39.48 38.71 3a8i n PHE 103 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3a8i s THR 104 N -2.16 0.17 0.56 4.37 -4.23 -1.08 -4.38 115.64 108.88 3a8i s THR 104 Ca -0.10 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 58.67 3a8i s THR 104 Cb 0.04 -2.50 0.38 0.00 1.34 0.00 0.00 72.50 71.75 3a8i s THR 104 CO 0.13 0.00 2.01 -0.33 -0.54 0.00 0.00 174.62 175.90 3a8i h GLU 105 N 2.29 0.00 -0.40 3.99 4.39 -1.97 -2.27 114.58 120.60 3a8i h GLU 105 Ca -0.32 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.38 3a8i h GLU 105 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 3a8i h GLU 105 CO 0.48 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 178.08 3a8i n ASP 106 N -4.09 3.20 -3.42 1.42 8.00 -1.26 -3.79 116.55 116.61 3a8i n ASP 106 Ca 0.07 -2.10 -0.08 0.00 0.71 0.00 0.00 54.79 53.40 3a8i n ASP 106 Cb 0.52 -0.30 -0.08 0.00 -0.02 0.00 0.00 41.12 41.24 3a8i n ASP 106 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3a8i s PHE 107 N -1.17 -0.90 0.14 1.24 5.36 -0.86 -1.20 117.98 120.59 3a8i s PHE 107 Ca 0.29 1.12 0.04 0.00 -0.96 0.00 0.00 56.93 57.42 3a8i s PHE 107 Cb 0.16 0.16 -0.04 0.00 -0.34 0.00 0.00 43.02 42.95 3a8i s PHE 107 CO 0.18 -0.67 -0.10 -0.06 -1.46 0.00 0.00 175.22 173.10 3a8i s PHE 108 N 2.60 1.25 -0.02 10.12 0.40 -0.25 -1.48 117.98 130.59 3a8i s PHE 108 Ca 0.09 -0.74 0.05 0.00 -0.60 0.00 0.00 56.93 55.74 3a8i s PHE 108 Cb -0.14 -0.64 -0.01 0.00 0.51 0.00 0.00 43.02 42.73 3a8i s PHE 108 CO -0.15 0.08 -0.18 0.50 0.70 0.00 0.00 175.22 176.16 3a8i s ARG 109 N -3.60 1.58 -0.04 0.44 3.52 0.63 -1.03 118.95 120.45 3a8i s ARG 109 Ca 0.15 -0.65 0.05 0.00 -0.13 0.00 0.00 55.73 55.15 3a8i s ARG 109 Cb 0.02 -1.48 -0.02 0.00 -1.56 0.00 0.00 34.95 31.90 3a8i s ARG 109 CO 0.01 0.36 -0.18 -0.51 -0.81 0.00 0.00 175.30 174.17 3a8i s LEU 110 N -0.32 2.54 -0.11 -0.88 1.43 0.17 0.02 118.68 121.54 3a8i s LEU 110 Ca 0.04 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.88 3a8i s LEU 110 Cb -0.08 -1.49 0.02 0.00 0.03 0.00 0.00 46.19 44.66 3a8i s LEU 110 CO 0.00 0.34 -0.15 -0.69 0.23 0.00 0.00 176.35 176.07 3a8i s VAL 111 N -0.70 1.53 0.35 -1.59 1.01 0.91 0.06 120.40 121.97 3a8i s VAL 111 Ca 0.11 -0.66 0.05 0.00 0.00 0.00 0.00 61.98 61.48 3a8i s VAL 111 Cb -0.10 -1.40 -0.07 0.00 0.00 0.00 0.00 36.38 34.80 3a8i s VAL 111 CO 0.00 0.45 0.03 0.68 0.00 0.00 0.00 175.10 176.26 3a8i s VAL 112 N 1.04 1.51 0.92 2.92 -7.23 -0.07 -1.97 120.40 117.52 3a8i s VAL 112 Ca -0.05 -2.01 -0.12 0.00 -1.81 0.00 0.00 61.98 57.99 3a8i s VAL 112 Cb -0.15 -2.85 0.14 0.00 0.56 0.00 0.00 36.38 34.09 3a8i s VAL 112 CO -0.03 -0.02 1.10 0.20 -0.31 0.00 0.00 175.10 176.04 3a8i s ASN 113 N -3.56 3.35 0.04 4.85 0.01 -1.26 -2.22 114.94 116.15 3a8i s ASN 113 Ca 0.36 1.32 -0.17 0.00 -0.71 0.00 0.00 52.86 53.65 3a8i s ASN 113 Cb 0.09 -1.99 -0.21 0.00 0.41 0.00 0.00 41.25 39.55 3a8i s ASN 113 CO 0.16 -2.69 1.17 0.77 -1.51 0.00 0.00 177.10 175.00 3a8i h SER 114 N -1.59 0.70 -0.97 -1.22 4.64 -1.93 -3.15 113.55 110.03 3a8i h SER 114 Ca -0.51 -0.72 0.19 0.00 -0.47 0.00 0.00 61.79 60.29 3a8i h SER 114 Cb 1.30 -0.21 -0.09 0.00 -0.31 0.00 0.00 62.40 63.09 3a8i h SER 114 CO 0.57 1.32 0.61 0.00 -0.87 0.00 0.00 176.83 178.46 3a8i h ALA 115 N 0.40 1.86 -0.02 5.18 0.00 -1.89 -2.79 119.26 121.99 3a8i h ALA 115 Ca -0.08 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3a8i h ALA 115 Cb 1.39 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3a8i h ALA 115 CO 0.14 -0.19 -0.06 0.25 0.00 0.00 0.00 179.25 179.39 3a8i n THR 116 N -4.66 0.00 0.01 0.00 -2.24 -1.22 -4.66 114.28 101.50 3a8i n THR 116 Ca 0.22 -0.40 -0.13 0.00 -2.27 0.00 0.00 64.05 61.47 3a8i n THR 116 Cb 0.61 1.17 -0.07 0.00 -2.10 0.00 0.00 70.33 69.94 3a8i n THR 116 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3a8i h ARG 117 N 3.72 -0.51 -0.36 -0.78 2.43 -1.45 0.23 114.38 117.66 3a8i h ARG 117 Ca 0.00 0.03 -0.16 0.00 -0.81 0.00 0.00 59.98 59.05 3a8i h ARG 117 Cb 0.83 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.49 3a8i h ARG 117 CO 0.00 -0.34 -0.39 0.93 -1.51 0.00 0.00 179.97 178.66 3a8i h GLU 118 N -0.53 0.88 -0.03 0.20 4.39 -1.85 -1.35 114.58 116.29 3a8i h GLU 118 Ca 0.06 -0.46 0.01 0.00 0.34 0.00 0.00 59.36 59.31 3a8i h GLU 118 Cb 0.65 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 3a8i h GLU 118 CO -0.40 1.11 -0.03 -0.22 -1.16 0.00 0.00 179.01 178.31 3a8i h LYS 119 N 0.72 -0.03 -0.73 2.33 3.64 -1.85 -2.01 116.57 118.64 3a8i h LYS 119 Ca 0.06 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 3a8i h LYS 119 Cb 0.98 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.77 3a8i h LYS 119 CO 0.09 -0.02 0.31 -0.44 -2.27 0.00 0.00 179.45 177.12 3a8i h ASP 120 N -0.03 0.97 0.43 4.20 5.19 -0.66 -1.09 116.42 125.42 3a8i h ASP 120 Ca 0.02 -0.13 -0.18 0.00 -0.62 0.00 0.00 57.03 56.12 3a8i h ASP 120 Cb 0.07 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 3a8i h ASP 120 CO -0.06 0.85 -0.78 -0.07 -3.12 0.00 0.00 179.24 176.06 3a8i h LEU 121 N 1.04 0.33 -0.45 1.55 3.38 -1.14 0.30 115.31 120.33 3a8i h LEU 121 Ca 0.25 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3a8i h LEU 121 Cb 0.17 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3a8i h LEU 121 CO -0.03 0.99 0.11 0.28 0.09 0.00 0.00 178.44 179.88 3a8i h SER 122 N 0.17 0.69 -0.39 -0.43 0.02 -1.22 0.46 113.55 112.85 3a8i h SER 122 Ca -0.04 -0.24 -0.04 0.00 -0.84 0.00 0.00 61.79 60.64 3a8i h SER 122 Cb 1.37 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.71 3a8i h SER 122 CO 0.12 0.75 0.07 -0.25 -1.14 0.00 0.00 176.83 176.39 3a8i h TRP 123 N 0.60 0.67 -0.21 3.45 2.91 -0.91 -1.01 115.95 121.46 3a8i h TRP 123 Ca 0.14 -0.09 -0.01 0.00 1.13 0.00 0.00 58.89 60.06 3a8i h TRP 123 Cb 0.33 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.78 3a8i h TRP 123 CO 0.02 0.66 0.08 0.82 -1.03 0.00 0.00 178.44 178.99 3a8i h ILE 124 N 0.49 1.17 -0.31 2.65 2.04 -0.28 -2.15 117.51 121.12 3a8i h ILE 124 Ca 0.12 -0.54 -0.18 0.00 1.00 0.00 0.00 64.86 65.26 3a8i h ILE 124 Cb 0.35 1.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 3a8i h ILE 124 CO 0.01 0.17 -0.51 0.71 0.00 0.00 0.00 178.15 178.53 3a8i h THR 125 N 0.18 1.27 -0.07 -0.27 1.35 -0.77 0.27 112.91 114.87 3a8i h THR 125 Ca 0.07 -1.69 0.02 0.00 -0.55 0.00 0.00 66.41 64.25 3a8i h THR 125 Cb 0.20 1.57 -0.02 0.00 -1.73 0.00 0.00 68.15 68.18 3a8i h THR 125 CO -0.00 0.55 -0.03 -0.61 -0.25 0.00 0.00 175.52 175.18 3a8i h GLN 126 N 0.68 -0.03 0.00 4.72 4.15 -1.20 -2.80 115.11 120.63 3a8i h GLN 126 Ca 0.03 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.35 3a8i h GLN 126 Cb 1.11 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.79 3a8i h GLN 126 CO 0.12 -0.02 -0.46 0.45 -1.93 0.00 0.00 178.83 176.99 3a8i h HIS 127 N -0.03 0.00 0.00 3.99 3.86 -1.11 -3.17 115.15 118.69 3a8i h HIS 127 Ca 0.04 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.19 3a8i h HIS 127 Cb 0.08 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 3a8i h HIS 127 CO -0.14 0.46 -0.28 0.00 0.86 0.00 0.00 177.93 178.83 3a8i h ALA 128 N 1.54 0.91 -0.63 2.45 0.00 -0.94 -3.39 119.26 119.20 3a8i h ALA 128 Ca -0.00 -0.26 0.13 0.00 0.00 0.00 0.00 54.91 54.78 3a8i h ALA 128 Cb 1.35 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.99 3a8i h ALA 128 CO 0.06 0.35 -0.04 1.49 0.00 0.00 0.00 179.25 181.12 3a8i h GLU 129 N 0.00 0.08 0.00 0.00 4.81 -1.46 0.28 114.58 118.29 3a8i h GLU 129 Ca -0.00 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3a8i h GLU 129 Cb 0.97 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.33 3a8i h GLU 129 CO 0.04 0.05 -0.00 -1.35 -0.73 0.00 0.00 179.01 177.02 3a8i h PRO 130 N 0.09 0.00 -0.01 0.92 0.11 -1.82 -2.38 132.00 128.91 3a8i h PRO 130 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 3a8i h PRO 130 Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 3a8i h PRO 130 CO -0.57 0.00 -0.26 1.19 -0.21 0.00 0.00 178.00 178.16 3a8i n PHE 131 N -3.30 0.00 -3.65 0.65 3.72 0.97 -4.97 117.46 110.88 3a8i n PHE 131 Ca -0.03 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.13 3a8i n PHE 131 Cb 0.08 -0.14 0.07 0.00 -0.94 0.00 0.00 39.48 38.55 3a8i n PHE 131 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a8i n GLY 132 N 1.34 -0.50 3.80 1.37 0.00 -0.90 -4.59 105.19 105.72 3a8i n GLY 132 Ca 0.12 0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.99 3a8i n GLY 132 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a8i s ILE 133 N -3.34 4.39 -0.37 -0.61 -1.09 -1.26 -4.90 121.20 114.02 3a8i s ILE 133 Ca 0.49 1.55 -0.23 0.00 -2.23 0.00 0.00 60.65 60.24 3a8i s ILE 133 Cb -0.23 -3.93 0.01 0.00 -1.58 0.00 0.00 42.46 36.74 3a8i s ILE 133 CO 0.76 0.16 0.77 -0.70 -1.23 0.00 0.00 174.94 174.69 3a8i s GLU 134 N -2.04 3.71 -0.28 2.79 2.12 -0.01 -4.96 118.70 120.02 3a8i s GLU 134 Ca 0.47 0.23 -0.06 0.00 0.36 0.00 0.00 54.97 55.98 3a8i s GLU 134 Cb -0.17 -3.82 0.01 0.00 0.26 0.00 0.00 34.13 30.40 3a8i s GLU 134 CO 0.22 -0.86 0.04 0.42 -0.54 0.00 0.00 175.26 174.54 3a8i s ILE 135 N 3.07 3.73 -0.14 -3.70 1.01 -1.26 -1.96 121.20 121.94 3a8i s ILE 135 Ca 0.30 -0.72 -0.01 0.00 0.00 0.00 0.00 60.65 60.23 3a8i s ILE 135 Cb -0.13 -2.89 -0.02 0.00 0.01 0.00 0.00 42.46 39.43 3a8i s ILE 135 CO 0.17 0.14 -0.11 -0.89 0.00 0.00 0.00 174.94 174.25 3a8i s THR 136 N 1.47 3.21 -0.29 2.92 2.01 0.13 -4.98 115.64 120.11 3a8i s THR 136 Ca 0.02 -0.60 -0.20 0.00 0.31 0.00 0.00 61.69 61.23 3a8i s THR 136 Cb -0.17 -2.37 -0.01 0.00 0.01 0.00 0.00 72.50 69.96 3a8i s THR 136 CO 0.01 0.51 0.61 -0.69 -0.69 0.00 0.00 174.62 174.37 3a8i s VAL 137 N 0.41 4.97 -1.30 3.82 1.01 -1.26 -1.10 120.40 126.95 3a8i s VAL 137 Ca -0.09 0.89 -0.06 0.00 0.00 0.00 0.00 61.98 62.72 3a8i s VAL 137 Cb -0.15 -3.96 0.07 0.00 0.00 0.00 0.00 36.38 32.33 3a8i s VAL 137 CO 0.05 -0.08 2.55 0.54 0.00 0.00 0.00 175.10 178.16 3a8i n ARG 138 N 5.79 4.22 0.00 2.72 5.12 0.17 -4.62 116.66 130.07 3a8i n ARG 138 Ca -0.02 -3.09 0.10 0.00 -1.93 0.00 0.00 57.85 52.92 3a8i n ARG 138 Cb 0.49 -2.62 0.56 0.00 -1.16 0.00 0.00 32.46 29.73 3a8i n ARG 138 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 3a8i n ASP 139 N 2.04 0.00 0.00 0.55 8.00 -1.26 -2.14 116.55 123.74 3a8i n ASP 139 Ca 0.64 -0.22 0.15 0.00 0.71 0.00 0.00 54.79 56.07 3a8i n ASP 139 Cb 0.28 -0.19 0.82 0.00 -0.02 0.00 0.00 41.12 42.00 3a8i n ASP 139 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3a8i n ASP 140 N -1.19 0.00 -4.39 -2.24 5.75 -1.26 -4.84 116.55 108.37 3a8i n ASP 140 Ca 0.12 -0.50 -0.32 0.00 -0.01 0.00 0.00 54.79 54.08 3a8i n ASP 140 Cb 0.14 -0.16 -0.14 0.00 -1.03 0.00 0.00 41.12 39.92 3a8i n ASP 140 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3a8i s LEU 141 N -2.32 2.50 0.38 -2.12 1.43 -0.91 -1.34 118.68 116.30 3a8i s LEU 141 Ca 0.36 -0.32 0.08 0.00 -1.03 0.00 0.00 54.13 53.21 3a8i s LEU 141 Cb 0.20 -1.50 -0.01 0.00 0.03 0.00 0.00 46.19 44.92 3a8i s LEU 141 CO 0.41 0.29 0.42 -0.44 0.23 0.00 0.00 176.35 177.26 3a8i s SER 142 N -0.42 5.41 -0.13 2.29 0.01 0.14 -4.81 113.70 116.20 3a8i s SER 142 Ca 0.04 -0.51 -0.10 0.00 1.31 0.00 0.00 55.95 56.70 3a8i s SER 142 Cb -0.12 -0.81 0.04 0.00 0.21 0.00 0.00 66.02 65.34 3a8i s SER 142 CO 0.02 -0.56 0.32 -0.32 0.41 0.00 0.00 173.24 173.11 3a8i s MET 143 N -4.15 0.34 -0.09 12.44 1.75 -1.26 -1.04 119.30 127.29 3a8i s MET 143 Ca 0.47 0.52 0.01 0.00 -1.25 0.00 0.00 55.69 55.45 3a8i s MET 143 Cb -0.07 0.09 0.02 0.00 2.84 0.00 0.00 34.83 37.71 3a8i s MET 143 CO 0.29 -0.09 -0.13 0.42 -0.65 0.00 0.00 175.02 174.87 3a8i s ILE 144 N 0.59 1.28 -0.37 10.11 1.01 -0.29 -0.91 121.20 132.62 3a8i s ILE 144 Ca -0.03 -0.52 -0.15 0.00 0.00 0.00 0.00 60.65 59.95 3a8i s ILE 144 Cb -0.05 -1.19 0.00 0.00 0.01 0.00 0.00 42.46 41.23 3a8i s ILE 144 CO -0.04 0.40 0.35 0.00 0.00 0.00 0.00 174.94 175.65 3a8i s ALA 145 N 1.01 3.48 -0.28 9.38 0.00 -0.01 -0.72 121.76 134.62 3a8i s ALA 145 Ca -0.07 -1.40 -0.09 0.00 0.00 0.00 0.00 51.96 50.40 3a8i s ALA 145 Cb -0.15 -2.87 -0.02 0.00 0.00 0.00 0.00 23.12 20.08 3a8i s ALA 145 CO -0.01 -1.25 0.13 0.08 0.00 0.00 0.00 175.76 174.71 3a8i s VAL 146 N 1.94 4.64 -0.01 0.00 1.01 0.46 -0.72 120.40 127.71 3a8i s VAL 146 Ca 0.10 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.87 3a8i s VAL 146 Cb -0.17 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 32.95 3a8i s VAL 146 CO 0.12 0.20 -0.02 -1.10 0.00 0.00 0.00 175.10 174.29 3a8i s GLN 147 N 1.64 0.30 0.00 2.72 -1.52 -0.62 -0.37 119.66 121.81 3a8i s GLN 147 Ca 0.06 -0.06 0.00 0.00 -1.95 0.00 0.00 55.36 53.40 3a8i s GLN 147 Cb -0.16 -0.35 0.00 0.00 -0.22 0.00 0.00 33.01 32.28 3a8i s GLN 147 CO 0.06 0.01 0.00 0.41 -0.25 0.00 0.00 175.29 175.52 3a8i n GLY 148 N 3.36 2.35 0.16 3.09 0.00 -0.14 -2.20 105.19 111.81 3a8i n GLY 148 Ca -0.17 -1.86 0.13 0.00 0.00 0.00 0.00 46.02 44.11 3a8i n GLY 148 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a8i h PRO 149 N 0.00 0.00 -0.18 1.61 0.13 -1.57 -2.60 132.00 129.39 3a8i h PRO 149 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3a8i h PRO 149 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3a8i h PRO 149 CO 0.00 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 177.86 3a8i n ASN 150 N -2.55 2.64 -0.07 1.44 3.02 0.19 -4.70 115.26 115.23 3a8i n ASN 150 Ca 0.04 -1.77 -0.07 0.00 -0.03 0.00 0.00 54.58 52.75 3a8i n ASN 150 Cb 0.39 -0.11 -0.01 0.00 -0.61 0.00 0.00 39.78 39.43 3a8i n ASN 150 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a8i h ALA 151 N 2.97 0.14 -0.52 5.41 0.00 -1.51 -1.86 119.26 123.90 3a8i h ALA 151 Ca 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3a8i h ALA 151 Cb 0.71 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 3a8i h ALA 151 CO 0.00 -0.49 0.13 1.96 0.00 0.00 0.00 179.25 180.84 3a8i h GLN 152 N -0.04 0.78 -0.13 0.00 4.20 -1.84 -0.84 115.11 117.24 3a8i h GLN 152 Ca 0.13 -0.15 -0.22 0.00 0.06 0.00 0.00 58.65 58.47 3a8i h GLN 152 Cb 0.24 -0.12 0.01 0.00 0.30 0.00 0.00 27.48 27.91 3a8i h GLN 152 CO -0.30 0.71 -0.79 0.00 -0.67 0.00 0.00 178.83 177.78 3a8i h ALA 153 N 1.38 0.36 0.04 3.87 0.00 -1.85 0.12 119.26 123.18 3a8i h ALA 153 Ca 0.17 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 3a8i h ALA 153 Cb 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3a8i h ALA 153 CO -0.00 0.70 -0.02 0.87 0.00 0.00 0.00 179.25 180.80 3a8i h LYS 154 N 0.47 -0.05 -0.68 0.00 1.57 -1.02 -2.66 116.57 114.21 3a8i h LYS 154 Ca -0.05 0.00 0.11 0.00 -1.87 0.00 0.00 60.65 58.84 3a8i h LYS 154 Cb 1.41 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 33.65 3a8i h LYS 154 CO 0.16 0.30 0.27 0.00 -0.57 0.00 0.00 179.45 179.61 3a8i h ALA 155 N 0.53 0.92 0.00 3.86 0.00 -1.17 -2.66 119.26 120.73 3a8i h ALA 155 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3a8i h ALA 155 Cb 0.38 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3a8i h ALA 155 CO 0.01 -0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.07 3a8i n ALA 156 N -2.49 1.67 0.46 0.00 0.00 0.03 -0.61 120.51 119.57 3a8i n ALA 156 Ca 0.11 0.08 0.10 0.00 0.00 0.00 0.00 53.44 53.73 3a8i n ALA 156 Cb 0.33 -1.38 0.41 0.00 0.00 0.00 0.00 19.45 18.81 3a8i n ALA 156 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3a8i n THR 157 N -2.21 0.88 0.72 0.00 -2.24 -1.00 -2.31 114.28 108.12 3a8i n THR 157 Ca 0.02 0.22 0.10 0.00 -2.27 0.00 0.00 64.05 62.12 3a8i n THR 157 Cb 0.23 -1.06 -0.12 0.00 -2.10 0.00 0.00 70.33 67.28 3a8i n THR 157 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3a8i n LEU 158 N -1.90 0.72 -4.81 3.22 4.77 0.22 -4.93 117.00 114.29 3a8i n LEU 158 Ca 0.03 -0.34 -0.31 0.00 -0.03 0.00 0.00 56.01 55.36 3a8i n LEU 158 Cb 0.21 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.35 3a8i n LEU 158 CO 0.17 0.17 0.71 -0.36 -1.33 0.00 0.00 177.39 176.76 3a8i s PHE 159 N -3.14 3.04 0.80 -1.77 0.08 -0.98 -5.09 117.98 110.92 3a8i s PHE 159 Ca 0.04 1.40 -0.11 0.00 0.12 0.00 0.00 56.93 58.38 3a8i s PHE 159 Cb 0.15 -2.92 0.10 0.00 -0.57 0.00 0.00 43.02 39.78 3a8i s PHE 159 CO 0.87 -1.35 1.15 0.54 -0.10 0.00 0.00 175.22 176.33 3a8i s ASN 160 N -3.78 4.29 0.23 1.36 2.20 -1.26 -4.89 114.94 113.10 3a8i s ASN 160 Ca 0.59 0.50 -0.06 0.00 -0.94 0.00 0.00 52.86 52.95 3a8i s ASN 160 Cb -0.14 -0.94 0.39 0.00 -2.00 0.00 0.00 41.25 38.56 3a8i s ASN 160 CO 0.55 -1.99 1.72 0.44 -2.94 0.00 0.00 177.10 174.88 3a8i h ASP 161 N -1.01 0.17 -0.94 3.54 3.32 -1.98 -1.25 116.42 118.27 3a8i h ASP 161 Ca -0.45 0.11 0.09 0.00 0.02 0.00 0.00 57.03 56.80 3a8i h ASP 161 Cb 1.30 0.11 -0.07 0.00 0.22 0.00 0.00 39.33 40.89 3a8i h ASP 161 CO 0.57 0.07 0.58 0.00 -1.72 0.00 0.00 179.24 178.73 3a8i h ALA 162 N 1.52 1.34 -0.11 3.45 0.00 -2.00 -1.49 119.26 121.97 3a8i h ALA 162 Ca 0.38 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.24 3a8i h ALA 162 Cb 0.56 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3a8i h ALA 162 CO -0.40 0.27 -0.13 1.96 0.00 0.00 0.00 179.25 180.94 3a8i h GLN 163 N 0.99 0.29 -0.97 0.00 4.20 -1.72 -1.48 115.11 116.43 3a8i h GLN 163 Ca 0.43 -0.16 0.03 0.00 0.06 0.00 0.00 58.65 59.01 3a8i h GLN 163 Cb 0.31 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.05 3a8i h GLN 163 CO -0.22 0.71 0.63 0.00 -0.67 0.00 0.00 178.83 179.29 3a8i h ARG 164 N -0.12 1.21 -0.41 1.46 3.08 -1.10 -2.60 114.38 115.90 3a8i h ARG 164 Ca 0.02 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 3a8i h ARG 164 Cb 0.67 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 3a8i h ARG 164 CO 0.03 0.80 0.14 0.37 -1.07 0.00 0.00 179.97 180.24 3a8i h GLN 165 N 1.25 0.63 -0.99 0.04 4.15 -1.17 -1.06 115.11 117.96 3a8i h GLN 165 Ca 0.38 -0.13 0.14 0.00 0.77 0.00 0.00 58.65 59.81 3a8i h GLN 165 Cb -0.05 -0.09 -0.09 0.00 0.21 0.00 0.00 27.48 27.46 3a8i h GLN 165 CO -0.11 0.61 0.62 0.00 -1.93 0.00 0.00 178.83 178.02 3a8i h ALA 166 N 0.99 1.62 -0.25 3.38 0.00 -1.01 -2.80 119.26 121.18 3a8i h ALA 166 Ca 0.13 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3a8i h ALA 166 Cb 0.23 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3a8i h ALA 166 CO -0.01 0.10 0.00 1.33 0.00 0.00 0.00 179.25 180.67 3a8i n VAL 167 N -4.64 0.36 -1.79 0.00 0.24 -1.00 -4.88 118.33 106.62 3a8i n VAL 167 Ca 0.20 -0.68 -0.42 0.00 -2.04 0.00 0.00 64.34 61.40 3a8i n VAL 167 Cb 0.43 1.10 -0.03 0.00 -1.47 0.00 0.00 33.84 33.87 3a8i n VAL 167 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3a8i s GLU 168 N -1.47 4.16 -1.15 7.34 2.12 -0.42 -1.16 118.70 128.11 3a8i s GLU 168 Ca 0.31 2.52 0.00 0.00 0.36 0.00 0.00 54.97 58.16 3a8i s GLU 168 Cb 0.19 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 31.16 3a8i s GLU 168 CO 0.27 -0.77 0.00 0.41 -0.54 0.00 0.00 175.26 174.63 3a8i n GLY 169 N 4.07 1.12 3.74 -1.50 0.00 -1.26 -4.94 105.19 106.42 3a8i n GLY 169 Ca 0.16 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3a8i n GLY 169 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3a8i s MET 170 N -2.78 4.23 0.60 1.61 1.75 -0.31 -4.99 119.30 119.42 3a8i s MET 170 Ca 0.00 2.36 -0.05 0.00 -1.25 0.00 0.00 55.69 56.75 3a8i s MET 170 Cb 0.00 -3.11 0.02 0.00 2.84 0.00 0.00 34.83 34.58 3a8i s MET 170 CO 0.00 -0.51 0.89 0.15 -0.65 0.00 0.00 175.02 174.91 3a8i s LYS 171 N 0.07 2.77 0.54 4.11 1.02 -1.26 -5.01 119.74 121.99 3a8i s LYS 171 Ca 0.63 -0.15 -0.21 0.00 0.02 0.00 0.00 55.97 56.26 3a8i s LYS 171 Cb -0.43 -2.29 -0.06 0.00 -0.52 0.00 0.00 37.83 34.53 3a8i s LYS 171 CO 0.40 -0.76 1.21 -2.30 -0.92 0.00 0.00 175.35 172.98 3a8i n PRO 172 N -2.59 1.43 -3.03 -1.68 -0.02 -1.26 -3.61 135.00 124.25 3a8i n PRO 172 Ca 0.05 0.53 -0.12 0.00 -2.02 0.00 0.00 63.50 61.94 3a8i n PRO 172 Cb 0.58 -2.39 0.06 0.00 -0.02 0.00 0.00 33.50 31.73 3a8i n PRO 172 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3a8i n PHE 173 N -1.15 -1.68 -4.19 6.00 3.01 0.41 -4.92 117.46 114.95 3a8i n PHE 173 Ca 0.11 0.69 -0.15 0.00 1.01 0.00 0.00 57.45 59.12 3a8i n PHE 173 Cb 0.45 -4.21 -0.11 0.00 -0.01 0.00 0.00 39.48 35.59 3a8i n PHE 173 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3a8i s PHE 174 N -3.27 1.11 -0.00 1.38 0.08 -1.24 -0.68 117.98 115.37 3a8i s PHE 174 Ca 0.06 -0.65 0.00 0.00 0.12 0.00 0.00 56.93 56.46 3a8i s PHE 174 Cb -0.01 -0.60 0.00 0.00 -0.57 0.00 0.00 43.02 41.84 3a8i s PHE 174 CO 0.55 0.02 -0.01 0.20 -0.10 0.00 0.00 175.22 175.88 3a8i s GLY 175 N -2.50 0.05 0.00 4.36 0.00 0.13 -0.66 107.32 108.70 3a8i s GLY 175 Ca 0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 44.72 44.75 3a8i s GLY 175 CO 0.00 0.02 0.03 0.54 0.00 0.00 0.00 173.10 173.69 3a8i s VAL 176 N 0.05 0.05 -0.09 1.40 0.11 0.43 -4.36 120.40 118.00 3a8i s VAL 176 Ca -0.00 -0.44 -0.17 0.00 -2.93 0.00 0.00 61.98 58.44 3a8i s VAL 176 Cb -0.01 -0.19 -0.05 0.00 -1.53 0.00 0.00 36.38 34.60 3a8i s VAL 176 CO -0.00 -0.24 0.44 -1.58 -3.33 0.00 0.00 175.10 170.39 3a8i s GLN 177 N -0.73 4.23 -0.28 1.54 2.00 -1.26 -0.28 119.66 124.87 3a8i s GLN 177 Ca -0.08 0.41 -0.03 0.00 -2.00 0.00 0.00 55.36 53.66 3a8i s GLN 177 Cb -0.05 -3.38 0.11 0.00 0.80 0.00 0.00 33.01 30.49 3a8i s GLN 177 CO -0.00 0.31 0.19 0.00 -0.50 0.00 0.00 175.29 175.29 3a8i s ALA 178 N 0.15 0.18 0.00 1.58 0.00 0.66 -4.99 121.76 119.33 3a8i s ALA 178 Ca 0.24 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.47 3a8i s ALA 178 Cb -0.15 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.43 3a8i s ALA 178 CO 0.11 -1.65 0.00 0.41 0.00 0.00 0.00 175.76 174.63 3a8i n GLY 179 N 5.28 2.05 0.00 0.00 0.00 -1.26 -2.57 105.19 108.69 3a8i n GLY 179 Ca -0.05 -0.56 0.13 0.00 0.00 0.00 0.00 46.02 45.54 3a8i n GLY 179 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3a8i n ASP 180 N 2.21 0.00 -4.79 1.61 8.00 -1.26 -4.80 116.55 117.52 3a8i n ASP 180 Ca 0.00 -0.35 -0.37 0.00 0.71 0.00 0.00 54.79 54.79 3a8i n ASP 180 Cb 0.00 -0.19 -0.07 0.00 -0.02 0.00 0.00 41.12 40.84 3a8i n ASP 180 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3a8i s LEU 181 N -2.39 4.33 -0.27 0.64 1.43 -1.06 -4.41 118.68 116.95 3a8i s LEU 181 Ca 0.31 0.57 -0.09 0.00 -1.03 0.00 0.00 54.13 53.89 3a8i s LEU 181 Cb 0.18 -2.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 3a8i s LEU 181 CO 0.38 0.23 0.12 0.12 0.23 0.00 0.00 176.35 177.43 3a8i s PHE 182 N -0.25 3.14 -0.15 0.29 5.36 -0.35 -0.25 117.98 125.77 3a8i s PHE 182 Ca 0.17 -0.34 0.02 0.00 -0.96 0.00 0.00 56.93 55.81 3a8i s PHE 182 Cb -0.13 -2.30 0.02 0.00 -0.34 0.00 0.00 43.02 40.26 3a8i s PHE 182 CO 0.05 -0.34 -0.19 0.42 -1.46 0.00 0.00 175.22 173.71 3a8i s ILE 183 N 1.65 1.85 -0.03 3.12 1.01 0.61 -1.25 121.20 128.15 3a8i s ILE 183 Ca 0.06 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.90 3a8i s ILE 183 Cb -0.16 -1.67 0.01 0.00 0.01 0.00 0.00 42.46 40.65 3a8i s ILE 183 CO 0.06 0.51 -0.08 0.00 0.00 0.00 0.00 174.94 175.43 3a8i s ALA 184 N 1.11 0.83 -1.39 9.38 0.00 -0.28 -0.43 121.76 130.98 3a8i s ALA 184 Ca -0.01 -0.26 -0.11 0.00 0.00 0.00 0.00 51.96 51.58 3a8i s ALA 184 Cb -0.14 -0.36 0.09 0.00 0.00 0.00 0.00 23.12 22.71 3a8i s ALA 184 CO -0.07 0.10 2.17 0.25 0.00 0.00 0.00 175.76 178.22 3a8i n THR 185 N 3.52 4.10 -4.00 0.00 -2.24 0.16 -0.92 114.28 114.89 3a8i n THR 185 Ca -0.20 -3.68 -0.10 0.00 -2.27 0.00 0.00 64.05 57.80 3a8i n THR 185 Cb 0.53 -2.45 -0.11 0.00 -2.10 0.00 0.00 70.33 66.20 3a8i n THR 185 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3a8i s THR 186 N 1.47 0.19 0.03 4.28 -4.23 -1.26 -0.44 115.64 115.67 3a8i s THR 186 Ca 0.47 -0.99 -0.24 0.00 -1.18 0.00 0.00 61.69 59.75 3a8i s THR 186 Cb 0.13 -0.40 0.08 0.00 1.34 0.00 0.00 72.50 73.65 3a8i s THR 186 CO -0.05 -0.51 1.08 0.61 -0.54 0.00 0.00 174.62 175.21 3a8i n GLY 187 N 1.48 0.37 1.14 3.99 0.00 -1.26 -3.11 105.19 107.81 3a8i n GLY 187 Ca -0.23 -1.05 0.05 0.00 0.00 0.00 0.00 46.02 44.79 3a8i n GLY 187 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3a8i n TYR 188 N -0.77 0.00 0.00 1.61 9.36 -1.26 -4.83 117.16 121.27 3a8i n TYR 188 Ca 0.02 -0.88 0.00 0.00 3.32 0.00 0.00 57.90 60.37 3a8i n TYR 188 Cb 0.52 -0.19 0.00 0.00 -0.63 0.00 0.00 39.34 39.04 3a8i n TYR 188 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 3a8i n THR 189 N -0.13 0.00 -0.49 2.97 -2.24 -1.26 -3.63 114.28 109.50 3a8i n THR 189 Ca 0.11 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 3a8i n THR 189 Cb 0.97 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 3a8i n THR 189 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a8i n GLY 190 N 1.39 0.75 3.70 3.38 0.00 -1.26 -4.59 105.19 108.55 3a8i n GLY 190 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 3a8i n GLY 190 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3a8i s GLU 191 N -0.51 2.14 0.92 1.61 0.41 -1.26 -3.57 118.70 118.45 3a8i s GLU 191 Ca 0.00 -1.91 -0.12 0.00 -0.41 0.00 0.00 54.97 52.53 3a8i s GLU 191 Cb 0.00 -1.89 0.15 0.00 -1.78 0.00 0.00 34.13 30.61 3a8i s GLU 191 CO 0.00 -0.08 1.12 0.00 -0.49 0.00 0.00 175.26 175.82 3a8i s ALA 192 N -2.62 1.61 0.00 5.21 0.00 -1.26 -4.78 121.76 119.92 3a8i s ALA 192 Ca 0.39 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.89 3a8i s ALA 192 Cb 0.05 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 20.11 3a8i s ALA 192 CO 0.21 -2.38 0.00 0.41 0.00 0.00 0.00 175.76 174.00 3a8i n GLY 193 N -1.92 0.17 3.28 0.00 0.00 -1.26 -0.97 105.19 104.49 3a8i n GLY 193 Ca 0.06 -1.45 -0.24 0.00 0.00 0.00 0.00 46.02 44.40 3a8i n GLY 193 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a8i s TYR 194 N -1.79 1.75 -0.18 1.61 2.02 0.50 -4.33 117.35 116.93 3a8i s TYR 194 Ca 0.00 -0.42 -0.08 0.00 -0.37 0.00 0.00 57.07 56.20 3a8i s TYR 194 Cb 0.00 -0.96 -0.04 0.00 -0.40 0.00 0.00 41.96 40.56 3a8i s TYR 194 CO 0.00 0.20 0.07 -1.21 -1.57 0.00 0.00 175.55 173.03 3a8i s GLU 195 N -1.90 3.99 -0.21 -0.62 2.02 -0.10 -0.41 118.70 121.47 3a8i s GLU 195 Ca 0.06 -0.33 -0.01 0.00 0.02 0.00 0.00 54.97 54.71 3a8i s GLU 195 Cb -0.10 -3.22 0.02 0.00 0.10 0.00 0.00 34.13 30.92 3a8i s GLU 195 CO 0.04 0.28 -0.13 0.42 0.02 0.00 0.00 175.26 175.90 3a8i s ILE 196 N 0.35 2.57 -0.16 -1.63 1.01 0.10 -1.13 121.20 122.31 3a8i s ILE 196 Ca 0.03 -0.87 -0.08 0.00 0.00 0.00 0.00 60.65 59.74 3a8i s ILE 196 Cb -0.12 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 3a8i s ILE 196 CO -0.00 0.41 0.10 0.00 0.00 0.00 0.00 174.94 175.45 3a8i s ALA 197 N 1.34 3.59 0.23 9.38 0.00 -0.38 -1.14 121.76 134.78 3a8i s ALA 197 Ca 0.04 -0.71 -0.16 0.00 0.00 0.00 0.00 51.96 51.13 3a8i s ALA 197 Cb -0.14 -1.97 0.01 0.00 0.00 0.00 0.00 23.12 21.02 3a8i s ALA 197 CO -0.08 0.31 0.53 -0.48 0.00 0.00 0.00 175.76 176.04 3a8i s LEU 198 N -0.08 0.15 0.48 0.00 2.34 -0.21 -1.22 118.68 120.15 3a8i s LEU 198 Ca 0.08 -0.71 -0.24 0.00 0.06 0.00 0.00 54.13 53.33 3a8i s LEU 198 Cb -0.12 2.06 -0.07 0.00 -0.56 0.00 0.00 46.19 47.51 3a8i s LEU 198 CO 0.01 -1.14 1.33 -2.84 -1.06 0.00 0.00 176.35 172.65 3a8i s PRO 199 N -3.95 3.55 0.29 1.48 0.02 -1.26 0.27 135.00 135.40 3a8i s PRO 199 Ca 0.15 2.20 0.02 0.00 0.02 0.00 0.00 61.00 63.39 3a8i s PRO 199 Cb -0.02 -2.49 0.70 0.00 0.02 0.00 0.00 34.50 32.72 3a8i s PRO 199 CO 0.04 -0.85 1.67 -0.91 -0.33 0.00 0.00 177.00 176.62 3a8i h ASN 200 N 2.03 0.12 0.54 2.53 2.35 -1.53 -1.44 115.58 120.19 3a8i h ASN 200 Ca -0.50 0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.42 3a8i h ASN 200 Cb 1.27 0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.85 3a8i h ASN 200 CO 0.60 -0.10 0.00 -1.84 -1.65 0.00 0.00 177.43 174.44 3a8i n GLU 201 N -5.16 0.21 -0.00 0.81 0.00 -1.26 -2.37 120.64 112.87 3a8i n GLU 201 Ca 0.21 0.09 0.09 0.00 0.00 0.00 0.00 57.16 57.55 3a8i n GLU 201 Cb 0.66 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.48 3a8i n GLU 201 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3a8i n LYS 202 N -1.36 0.77 -0.20 3.44 5.02 -0.57 -4.70 118.16 120.55 3a8i n LYS 202 Ca 0.09 -0.07 -0.04 0.00 -2.02 0.00 0.00 58.31 56.26 3a8i n LYS 202 Cb 0.21 -1.41 0.06 0.00 -0.02 0.00 0.00 35.03 33.87 3a8i n LYS 202 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3a8i h ALA 203 N 2.24 0.76 -0.29 7.82 0.00 -1.14 -1.99 119.26 126.67 3a8i h ALA 203 Ca 0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3a8i h ALA 203 Cb 0.62 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3a8i h ALA 203 CO 0.00 0.06 -0.11 0.00 0.00 0.00 0.00 179.25 179.20 3a8i h ALA 204 N 1.27 1.29 -0.60 0.00 0.00 -1.83 -0.61 119.26 118.78 3a8i h ALA 204 Ca 0.24 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3a8i h ALA 204 Cb 0.06 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3a8i h ALA 204 CO -0.12 0.47 0.21 -0.44 0.00 0.00 0.00 179.25 179.37 3a8i h ASP 205 N 0.44 0.86 -0.34 0.00 3.32 -1.74 -0.03 116.42 118.94 3a8i h ASP 205 Ca 0.08 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 56.87 3a8i h ASP 205 Cb 0.46 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 3a8i h ASP 205 CO 0.03 0.82 -0.08 0.15 -1.72 0.00 0.00 179.24 178.44 3a8i h PHE 206 N 0.85 0.73 -0.18 4.55 3.57 -0.71 -1.08 116.94 124.67 3a8i h PHE 206 Ca 0.20 -0.15 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 3a8i h PHE 206 Cb 0.25 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 3a8i h PHE 206 CO 0.02 0.81 0.11 2.35 -2.23 0.00 0.00 178.31 179.37 3a8i h TRP 207 N 0.43 0.24 -0.49 0.41 2.91 -1.04 -0.08 115.95 118.34 3a8i h TRP 207 Ca 0.09 -0.00 0.10 0.00 1.13 0.00 0.00 58.89 60.20 3a8i h TRP 207 Cb 0.57 -0.08 -0.09 0.00 -0.51 0.00 0.00 29.16 29.05 3a8i h TRP 207 CO 0.05 0.19 -0.10 0.00 -1.03 0.00 0.00 178.44 177.55 3a8i h ARG 208 N 0.22 0.02 -0.54 2.65 3.08 -0.73 -1.44 114.38 117.64 3a8i h ARG 208 Ca 0.07 -0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.14 3a8i h ARG 208 Cb 0.02 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 3a8i h ARG 208 CO -0.01 0.01 0.32 0.00 -1.07 0.00 0.00 179.97 179.22 3a8i h ALA 209 N 1.48 0.69 -0.65 0.04 0.00 -0.79 -2.40 119.26 117.63 3a8i h ALA 209 Ca 0.24 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.18 3a8i h ALA 209 Cb 0.36 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 3a8i h ALA 209 CO -0.49 0.03 0.38 -0.07 0.00 0.00 0.00 179.25 179.10 3a8i h LEU 210 N 0.63 0.58 0.05 0.00 3.38 -0.54 -1.04 115.31 118.37 3a8i h LEU 210 Ca 0.22 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 3a8i h LEU 210 Cb 0.03 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3a8i h LEU 210 CO -0.10 0.39 -0.02 0.58 0.09 0.00 0.00 178.44 179.38 3a8i h VAL 211 N 0.71 1.05 -0.96 1.22 2.07 -1.11 0.40 116.25 119.63 3a8i h VAL 211 Ca 0.28 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.51 3a8i h VAL 211 Cb 0.12 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 3a8i h VAL 211 CO -0.15 0.08 0.63 -0.08 0.02 0.00 0.00 177.57 178.07 3a8i h GLU 212 N -0.20 1.25 0.00 1.57 4.22 -1.37 -0.96 114.58 119.10 3a8i h GLU 212 Ca -0.01 -0.08 0.00 0.00 0.08 0.00 0.00 59.36 59.36 3a8i h GLU 212 Cb 0.17 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.14 3a8i h GLU 212 CO 0.01 0.83 0.00 0.00 -2.18 0.00 0.00 179.01 177.67 3a8i n ALA 213 N -2.36 2.06 -0.05 2.92 0.00 -0.40 -4.84 120.51 117.83 3a8i n ALA 213 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3a8i n ALA 213 Cb 0.02 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.26 3a8i n ALA 213 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a8i n GLY 214 N -0.03 1.04 3.59 0.00 0.00 -0.37 -4.94 105.19 104.49 3a8i n GLY 214 Ca 0.10 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 3a8i n GLY 214 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a8i s VAL 215 N -2.00 5.23 0.03 1.61 1.01 0.10 -4.70 120.40 121.67 3a8i s VAL 215 Ca 0.00 0.14 -0.25 0.00 0.00 0.00 0.00 61.98 61.87 3a8i s VAL 215 Cb 0.00 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 3a8i s VAL 215 CO 0.00 0.28 0.78 -0.75 0.00 0.00 0.00 175.10 175.41 3a8i s LYS 216 N 1.58 4.50 0.18 2.72 2.20 -0.47 -4.05 119.74 126.40 3a8i s LYS 216 Ca 0.07 1.07 -0.31 0.00 -0.36 0.00 0.00 55.97 56.44 3a8i s LYS 216 Cb -0.15 -3.38 -0.09 0.00 -1.51 0.00 0.00 37.83 32.69 3a8i s LYS 216 CO 0.09 0.23 1.47 -2.14 -0.36 0.00 0.00 175.35 174.63 3a8i s PRO 217 N 0.14 4.27 0.00 4.03 0.02 -1.26 0.32 135.00 142.51 3a8i s PRO 217 Ca 0.39 2.26 0.03 0.00 0.02 0.00 0.00 61.00 63.70 3a8i s PRO 217 Cb -0.20 -3.16 -0.01 0.00 0.02 0.00 0.00 34.50 31.15 3a8i s PRO 217 CO 0.23 -0.48 -0.10 0.00 -0.33 0.00 0.00 177.00 176.32 3a8i n GLY 219 N 2.63 3.17 0.32 0.00 0.00 -1.26 -4.43 105.19 105.62 3a8i n GLY 219 Ca -0.15 -2.18 0.16 0.00 0.00 0.00 0.00 46.02 43.85 3a8i n GLY 219 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3a8i h LEU 220 N 0.00 0.00 0.10 0.99 3.38 -1.12 -0.76 115.31 117.91 3a8i h LEU 220 Ca -0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3a8i h LEU 220 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3a8i h LEU 220 CO 0.03 0.00 -0.05 1.23 0.09 0.00 0.00 178.44 179.74 3a8i h GLY 221 N 0.00 -0.14 1.55 0.83 0.00 -1.57 0.09 103.07 103.83 3a8i h GLY 221 Ca 0.06 0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.37 3a8i h GLY 221 CO -0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 176.54 176.39 3a8i h ALA 222 N 0.22 1.23 -0.41 3.60 0.00 -1.74 -1.26 119.26 120.91 3a8i h ALA 222 Ca -0.01 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.65 3a8i h ALA 222 Cb 0.48 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3a8i h ALA 222 CO 0.02 0.50 0.24 -0.09 0.00 0.00 0.00 179.25 179.92 3a8i h ARG 223 N 0.50 0.47 -0.04 0.00 2.43 -0.92 0.24 114.38 117.06 3a8i h ARG 223 Ca 0.10 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3a8i h ARG 223 Cb 0.48 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.92 3a8i h ARG 223 CO 0.03 0.31 0.02 0.22 -1.51 0.00 0.00 179.97 179.04 3a8i h ASP 224 N 0.48 0.05 -0.58 -3.80 3.58 -0.40 -1.42 116.42 114.33 3a8i h ASP 224 Ca 0.16 -0.10 0.07 0.00 0.42 0.00 0.00 57.03 57.59 3a8i h ASP 224 Cb 0.01 -0.01 -0.06 0.00 1.72 0.00 0.00 39.33 40.99 3a8i h ASP 224 CO -0.08 0.13 0.26 0.74 -2.88 0.00 0.00 179.24 177.42 3a8i h THR 225 N -0.03 0.86 -0.44 2.25 2.02 -0.73 -1.47 112.91 115.37 3a8i h THR 225 Ca 0.01 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 3a8i h THR 225 Cb 0.09 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 3a8i h THR 225 CO -0.00 0.09 0.20 -0.07 0.37 0.00 0.00 175.52 176.10 3a8i h LEU 226 N 0.48 0.58 -0.80 2.58 3.38 -0.35 -1.78 115.31 119.40 3a8i h LEU 226 Ca 0.28 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 3a8i h LEU 226 Cb 0.27 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3a8i h LEU 226 CO -0.24 0.56 -0.48 0.08 0.09 0.00 0.00 178.44 178.45 3a8i h ARG 227 N 0.56 0.29 -0.05 1.13 -0.00 -0.85 -2.09 114.38 113.36 3a8i h ARG 227 Ca 0.15 -0.16 -0.01 0.00 -0.00 0.00 0.00 59.98 59.96 3a8i h ARG 227 Cb 0.14 0.01 -0.00 0.00 -0.00 0.00 0.00 29.97 30.12 3a8i h ARG 227 CO -0.02 0.71 -0.00 1.25 -0.00 0.00 0.00 179.97 181.91 3a8i h LEU 228 N 0.23 0.09 -0.81 0.08 5.85 -0.94 -1.57 115.31 118.25 3a8i h LEU 228 Ca 0.01 -0.33 0.15 0.00 0.84 0.00 0.00 57.88 58.55 3a8i h LEU 228 Cb 0.93 -0.02 -0.09 0.00 0.37 0.00 0.00 40.66 41.84 3a8i h LEU 228 CO 0.08 0.40 0.38 -0.33 -0.34 0.00 0.00 178.44 178.63 3a8i h GLU 229 N -0.22 0.53 0.00 1.25 5.08 -1.36 0.14 114.58 119.99 3a8i h GLU 229 Ca 0.01 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3a8i h GLU 229 Cb 0.36 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3a8i h GLU 229 CO 0.00 0.35 0.00 0.00 -1.00 0.00 0.00 179.01 178.36 3a8i n ALA 230 N -2.46 2.16 -1.67 3.43 0.00 -0.79 -0.70 120.51 120.48 3a8i n ALA 230 Ca 0.16 -0.09 -0.10 0.00 0.00 0.00 0.00 53.44 53.41 3a8i n ALA 230 Cb 0.43 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.61 3a8i n ALA 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a8i n GLY 231 N 0.13 0.66 3.88 0.00 0.00 0.48 -4.73 105.19 105.61 3a8i n GLY 231 Ca 0.11 -0.53 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 3a8i n GLY 231 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3a8i s MET 232 N -3.54 3.46 0.45 1.61 -1.94 -0.63 -4.83 119.30 113.88 3a8i s MET 232 Ca 0.00 -0.12 -0.22 0.00 -1.71 0.00 0.00 55.69 53.64 3a8i s MET 232 Cb 0.00 -3.18 -0.09 0.00 2.01 0.00 0.00 34.83 33.57 3a8i s MET 232 CO 0.00 0.76 1.05 -0.80 -0.01 0.00 0.00 175.02 176.02 3a8i s ASN 233 N -1.13 6.52 -0.30 3.03 0.01 -1.26 -4.52 114.94 117.28 3a8i s ASN 233 Ca 0.17 1.99 -0.08 0.00 -0.71 0.00 0.00 52.86 54.23 3a8i s ASN 233 Cb -0.12 -2.57 0.01 0.00 0.41 0.00 0.00 41.25 38.97 3a8i s ASN 233 CO 0.06 -0.66 0.10 -0.22 -1.51 0.00 0.00 177.10 174.87 3a8i s LEU 234 N -3.10 3.94 0.20 0.60 2.96 -1.26 -5.02 118.68 117.00 3a8i s LEU 234 Ca 0.63 -0.69 -0.32 0.00 -0.22 0.00 0.00 54.13 53.53 3a8i s LEU 234 Cb -0.19 -1.91 -0.15 0.00 0.50 0.00 0.00 46.19 44.44 3a8i s LEU 234 CO 0.24 -0.20 1.29 0.00 -1.32 0.00 0.00 176.35 176.36 3a8i n TYR 235 N 4.89 1.72 0.00 5.38 9.36 -1.26 -1.42 117.16 135.84 3a8i n TYR 235 Ca -0.14 0.55 0.00 0.00 3.32 0.00 0.00 57.90 61.63 3a8i n TYR 235 Cb 0.48 -2.37 0.00 0.00 -0.63 0.00 0.00 39.34 36.82 3a8i n TYR 235 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3a8i n GLY 236 N 2.16 3.38 0.82 2.98 0.00 0.17 -4.83 105.19 109.87 3a8i n GLY 236 Ca 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.14 3a8i n GLY 236 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3a8i n GLN 237 N -1.64 0.08 0.22 1.61 6.02 -0.50 -4.71 117.38 118.45 3a8i n GLN 237 Ca 0.00 0.03 0.09 0.00 -0.01 0.00 0.00 57.00 57.11 3a8i n GLN 237 Cb 0.00 -0.51 0.45 0.00 1.02 0.00 0.00 30.24 31.20 3a8i n GLN 237 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 3a8i h GLU 238 N -0.15 0.00 -3.08 -1.09 3.07 -1.57 -3.45 114.58 108.31 3a8i h GLU 238 Ca 0.00 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 3a8i h GLU 238 Cb 0.15 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 27.96 3a8i h GLU 238 CO 0.00 0.25 0.17 0.00 -1.40 0.00 0.00 179.01 178.03 3a8i s MET 239 N -3.69 1.46 0.00 2.33 0.23 -1.26 -4.67 119.30 113.71 3a8i s MET 239 Ca 0.00 -0.73 0.00 0.00 -1.03 0.00 0.00 55.69 53.93 3a8i s MET 239 Cb 0.11 0.58 0.00 0.00 -1.53 0.00 0.00 34.83 33.98 3a8i s MET 239 CO 0.65 -0.65 0.00 -0.40 -2.03 0.00 0.00 175.02 172.59 3a8i n ASP 240 N -0.39 0.00 0.27 -1.18 5.68 -1.26 0.46 116.55 120.13 3a8i n ASP 240 Ca -0.11 -0.29 0.18 0.00 -0.50 0.00 0.00 54.79 54.07 3a8i n ASP 240 Cb 0.62 0.00 0.97 0.00 -1.14 0.00 0.00 41.12 41.58 3a8i n ASP 240 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3a8i h GLU 241 N 0.00 0.00 -0.01 0.11 3.07 -1.71 -0.39 114.58 115.66 3a8i h GLU 241 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3a8i h GLU 241 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3a8i h GLU 241 CO 0.00 0.00 -0.55 0.25 -1.40 0.00 0.00 179.01 177.31 3a8i n THR 242 N -2.76 0.00 -4.50 1.13 -2.24 -1.26 -4.12 114.28 100.52 3a8i n THR 242 Ca -0.02 -0.14 -0.33 0.00 -2.27 0.00 0.00 64.05 61.28 3a8i n THR 242 Cb 0.08 0.91 -0.15 0.00 -2.10 0.00 0.00 70.33 69.07 3a8i n THR 242 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3a8i s ILE 243 N -2.66 2.98 0.59 2.28 -1.09 -0.22 -4.96 121.20 118.12 3a8i s ILE 243 Ca 0.17 -0.67 -0.17 0.00 -2.23 0.00 0.00 60.65 57.75 3a8i s ILE 243 Cb 0.18 -2.28 -0.03 0.00 -1.58 0.00 0.00 42.46 38.75 3a8i s ILE 243 CO 0.64 0.50 1.08 -0.55 -1.23 0.00 0.00 174.94 175.39 3a8i s SER 244 N 0.74 5.63 0.45 3.58 0.15 -1.26 -2.92 113.70 120.07 3a8i s SER 244 Ca -0.05 1.95 0.16 0.00 0.70 0.00 0.00 55.95 58.71 3a8i s SER 244 Cb -0.15 -2.55 1.03 0.00 -1.71 0.00 0.00 66.02 62.64 3a8i s SER 244 CO 0.01 -1.27 1.98 1.55 1.20 0.00 0.00 173.24 176.71 3a8i h PRO 245 N 0.58 0.00 -0.84 5.44 0.13 -1.95 -2.11 132.00 133.26 3a8i h PRO 245 Ca -0.48 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.79 3a8i h PRO 245 Cb 1.24 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.30 3a8i h PRO 245 CO 0.56 0.20 0.54 -0.07 -0.23 0.00 0.00 178.00 179.01 3a8i h LEU 246 N 0.00 0.59 -1.71 1.56 3.38 -1.92 -0.44 115.31 116.77 3a8i h LEU 246 Ca -0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3a8i h LEU 246 Cb 0.38 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3a8i h LEU 246 CO 0.03 0.31 0.00 0.00 0.09 0.00 0.00 178.44 178.87 3a8i n ALA 247 N -2.46 2.55 -2.15 1.53 0.00 -0.80 -4.15 120.51 115.05 3a8i n ALA 247 Ca 0.16 -0.81 0.05 0.00 0.00 0.00 0.00 53.44 52.84 3a8i n ALA 247 Cb 0.45 -0.98 0.09 0.00 0.00 0.00 0.00 19.45 19.01 3a8i n ALA 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a8i n ALA 248 N 0.71 2.78 -3.93 0.00 0.00 -0.56 -3.88 120.51 115.63 3a8i n ALA 248 Ca 0.15 -2.63 -0.30 0.00 0.00 0.00 0.00 53.44 50.66 3a8i n ALA 248 Cb 0.43 -0.59 0.02 0.00 0.00 0.00 0.00 19.45 19.30 3a8i n ALA 248 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3a8i n ASN 249 N -0.11 -4.17 -0.19 0.00 5.15 -1.19 -4.85 115.26 109.90 3a8i n ASN 249 Ca 0.10 -0.81 0.02 0.00 -0.60 0.00 0.00 54.58 53.29 3a8i n ASN 249 Cb 0.97 -3.76 0.06 0.00 -0.53 0.00 0.00 39.78 36.51 3a8i n ASN 249 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 3a8i n MET 250 N -4.61 2.86 0.09 1.20 2.81 -0.28 -4.70 117.12 114.48 3a8i n MET 250 Ca 0.00 -1.74 0.04 0.00 -1.81 0.00 0.00 57.70 54.18 3a8i n MET 250 Cb 0.54 -1.12 0.44 0.00 -0.71 0.00 0.00 33.22 32.36 3a8i n MET 250 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 3a8i h GLY 251 N 0.57 0.36 2.00 3.03 0.00 -1.85 -1.21 103.07 105.98 3a8i h GLY 251 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 3a8i h GLY 251 CO 0.01 0.16 -0.04 0.11 0.00 0.00 0.00 176.54 176.78 3a8i h TRP 252 N 0.34 0.00 -0.01 5.60 5.08 -1.93 -2.45 115.95 122.58 3a8i h TRP 252 Ca 0.08 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.05 3a8i h TRP 252 Cb 0.14 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.30 3a8i h TRP 252 CO 0.00 0.04 -0.17 0.25 -1.28 0.00 0.00 178.44 177.29 3a8i n THR 253 N -3.40 0.00 -2.74 0.12 -2.24 -0.46 -4.84 114.28 100.72 3a8i n THR 253 Ca -0.02 -0.18 -0.43 0.00 -2.27 0.00 0.00 64.05 61.15 3a8i n THR 253 Cb 0.17 0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.86 3a8i n THR 253 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3a8i s ILE 254 N -2.32 4.66 -1.19 2.28 -1.09 -0.92 -2.84 121.20 119.78 3a8i s ILE 254 Ca 0.29 1.69 -0.11 0.00 -2.23 0.00 0.00 60.65 60.29 3a8i s ILE 254 Cb 0.20 -4.29 0.21 0.00 -1.58 0.00 0.00 42.46 37.00 3a8i s ILE 254 CO 0.45 -0.29 1.46 0.00 -1.23 0.00 0.00 174.94 175.33 3a8i n ALA 255 N 6.46 4.36 -0.24 9.38 0.00 -0.57 -4.85 120.51 135.05 3a8i n ALA 255 Ca 0.09 -4.41 0.03 0.00 0.00 0.00 0.00 53.44 49.16 3a8i n ALA 255 Cb 0.47 -2.84 0.26 0.00 0.00 0.00 0.00 19.45 17.34 3a8i n ALA 255 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 3a8i h TRP 256 N 6.60 0.95 -3.19 0.00 4.06 -1.94 -3.41 115.95 119.02 3a8i h TRP 256 Ca 0.29 0.02 -0.64 0.00 2.06 0.00 0.00 58.89 60.63 3a8i h TRP 256 Cb 0.80 -0.32 -0.14 0.00 -1.00 0.00 0.00 29.16 28.50 3a8i h TRP 256 CO 1.04 0.54 -0.56 -1.21 -3.56 0.00 0.00 178.44 174.69 3a8i s GLU 257 N -5.84 3.68 0.32 0.49 0.41 -1.26 -3.34 118.70 113.16 3a8i s GLU 257 Ca -0.11 -0.32 -0.27 0.00 -0.41 0.00 0.00 54.97 53.86 3a8i s GLU 257 Cb 0.19 -3.12 -0.09 0.00 -1.78 0.00 0.00 34.13 29.32 3a8i s GLU 257 CO 0.79 0.44 0.99 -1.25 -0.49 0.00 0.00 175.26 175.74 3a8i s PRO 258 N -0.12 4.54 0.50 0.39 0.04 -1.26 -5.05 135.00 134.03 3a8i s PRO 258 Ca 0.07 1.46 0.24 0.00 0.04 0.00 0.00 61.00 62.81 3a8i s PRO 258 Cb -0.12 -2.87 1.30 0.00 0.04 0.00 0.00 34.50 32.85 3a8i s PRO 258 CO 0.01 0.21 2.04 0.00 0.04 0.00 0.00 177.00 179.30 3a8i h ALA 259 N 3.26 1.37 -0.07 8.56 0.00 -1.92 -1.94 119.26 128.53 3a8i h ALA 259 Ca -0.47 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.31 3a8i h ALA 259 Cb 1.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3a8i h ALA 259 CO 0.65 0.19 0.00 -0.40 0.00 0.00 0.00 179.25 179.69 3a8i n ASP 260 N -3.81 0.67 -4.49 0.00 5.75 -1.26 -4.66 116.55 108.75 3a8i n ASP 260 Ca -0.02 -1.53 -0.43 0.00 -0.01 0.00 0.00 54.79 52.80 3a8i n ASP 260 Cb 0.25 -0.04 -0.04 0.00 -1.03 0.00 0.00 41.12 40.26 3a8i n ASP 260 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 3a8i s ARG 261 N -1.92 3.22 0.34 0.11 3.52 -0.73 -5.03 118.95 118.47 3a8i s ARG 261 Ca 0.30 -0.53 -0.26 0.00 -0.13 0.00 0.00 55.73 55.10 3a8i s ARG 261 Cb 0.15 -4.14 -0.09 0.00 -1.56 0.00 0.00 34.95 29.31 3a8i s ARG 261 CO 0.23 -1.65 1.05 0.34 -0.81 0.00 0.00 175.30 174.47 3a8i s ASP 262 N 3.23 7.02 0.05 -2.12 2.15 -1.26 -5.00 116.67 120.74 3a8i s ASP 262 Ca 0.26 2.10 -0.05 0.00 0.43 0.00 0.00 52.55 55.29 3a8i s ASP 262 Cb -0.14 -2.60 -0.01 0.00 -0.30 0.00 0.00 42.92 39.86 3a8i s ASP 262 CO 0.15 -0.31 0.09 0.72 -0.17 0.00 0.00 175.17 175.65 3a8i s PHE 263 N -1.46 0.24 0.11 -5.34 -0.12 -1.26 -4.05 117.98 106.10 3a8i s PHE 263 Ca 0.52 -0.61 -0.31 0.00 -0.05 0.00 0.00 56.93 56.48 3a8i s PHE 263 Cb -0.25 -0.17 -0.08 0.00 -0.63 0.00 0.00 43.02 41.89 3a8i s PHE 263 CO 0.32 -0.40 1.41 0.42 -0.05 0.00 0.00 175.22 176.93 3a8i s ILE 264 N -3.03 3.27 0.00 -4.49 1.01 -0.33 -1.70 121.20 115.93 3a8i s ILE 264 Ca -0.01 0.89 0.00 0.00 0.00 0.00 0.00 60.65 61.53 3a8i s ILE 264 Cb 0.01 -3.57 0.00 0.00 0.01 0.00 0.00 42.46 38.91 3a8i s ILE 264 CO -0.07 0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.55 3a8i n GLY 265 N 3.54 0.90 0.10 6.18 0.00 -1.24 -4.43 105.19 110.24 3a8i n GLY 265 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 3a8i n GLY 265 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3a8i h ARG 266 N 3.54 0.09 -0.37 1.61 2.43 -1.66 -1.47 114.38 118.55 3a8i h ARG 266 Ca 0.00 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.23 3a8i h ARG 266 Cb 0.00 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.47 3a8i h ARG 266 CO 0.00 0.06 0.01 0.93 -1.51 0.00 0.00 179.97 179.46 3a8i h GLU 267 N 0.09 0.12 -0.48 0.20 5.08 -1.91 0.25 114.58 117.93 3a8i h GLU 267 Ca 0.09 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.36 3a8i h GLU 267 Cb 0.10 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3a8i h GLU 267 CO -0.14 0.08 -0.02 0.00 -1.00 0.00 0.00 179.01 177.93 3a8i h ALA 268 N 1.32 0.65 -0.86 3.43 0.00 -1.74 -2.67 119.26 119.38 3a8i h ALA 268 Ca 0.18 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 3a8i h ALA 268 Cb 0.25 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 3a8i h ALA 268 CO -0.29 0.47 0.41 -0.07 0.00 0.00 0.00 179.25 179.76 3a8i h LEU 269 N 0.71 1.12 -0.23 0.00 4.07 -0.41 -1.99 115.31 118.58 3a8i h LEU 269 Ca 0.13 -0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3a8i h LEU 269 Cb 0.54 -0.29 -0.01 0.00 1.08 0.00 0.00 40.66 41.98 3a8i h LEU 269 CO 0.03 0.95 0.15 -0.33 -1.08 0.00 0.00 178.44 178.15 3a8i h GLU 270 N 1.22 0.31 -0.53 1.13 4.39 -0.28 -0.42 114.58 120.39 3a8i h GLU 270 Ca 0.29 -0.02 0.06 0.00 0.34 0.00 0.00 59.36 60.03 3a8i h GLU 270 Cb 0.12 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.65 3a8i h GLU 270 CO -0.04 0.22 0.24 0.28 -1.16 0.00 0.00 179.01 178.55 3a8i h VAL 271 N 0.30 0.90 -0.53 3.13 2.07 -1.42 -2.60 116.25 118.10 3a8i h VAL 271 Ca 0.08 -0.16 -0.07 0.00 0.82 0.00 0.00 66.70 67.37 3a8i h VAL 271 Cb -0.01 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 3a8i h VAL 271 CO -0.02 0.08 0.03 1.56 0.02 0.00 0.00 177.57 179.25 3a8i h GLN 272 N 0.45 0.87 -0.64 1.57 4.20 -0.87 -2.77 115.11 117.93 3a8i h GLN 272 Ca 0.24 -0.23 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 3a8i h GLN 272 Cb 0.21 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 3a8i h GLN 272 CO -0.20 0.85 0.19 -0.09 -0.67 0.00 0.00 178.83 178.91 3a8i h ARG 273 N 0.82 1.00 -0.75 1.46 2.43 -0.91 0.36 114.38 118.80 3a8i h ARG 273 Ca 0.16 -0.22 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3a8i h ARG 273 Cb 0.44 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 3a8i h ARG 273 CO 0.02 0.88 0.45 1.49 -1.51 0.00 0.00 179.97 181.30 3a8i h GLU 274 N 0.93 1.02 0.00 0.20 4.81 -1.33 -3.29 114.58 116.92 3a8i h GLU 274 Ca 0.20 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 3a8i h GLU 274 Cb 0.31 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.48 3a8i h GLU 274 CO -0.00 0.72 -1.10 0.72 -0.73 0.00 0.00 179.01 178.62 3a8i n HIS 275 N -4.50 0.00 0.00 0.92 8.25 -1.06 -5.09 115.22 113.73 3a8i n HIS 275 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 3a8i n HIS 275 Cb 0.06 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.04 3a8i n HIS 275 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3a8i n GLY 276 N 1.45 1.35 3.32 -1.41 0.00 0.13 -5.09 105.19 104.92 3a8i n GLY 276 Ca 0.01 -1.82 -0.16 0.00 0.00 0.00 0.00 46.02 44.05 3a8i n GLY 276 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3a8i s THR 277 N -3.00 0.54 1.08 2.61 -4.23 -1.26 -4.86 115.64 106.52 3a8i s THR 277 Ca 0.00 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.35 3a8i s THR 277 Cb 0.00 -2.63 0.12 0.00 1.34 0.00 0.00 72.50 71.32 3a8i s THR 277 CO 0.00 0.00 0.31 -0.62 -0.54 0.00 0.00 174.62 173.77 3a8i n GLU 278 N -0.46 -1.36 -4.12 3.99 1.02 -1.26 -4.43 120.64 114.02 3a8i n GLU 278 Ca 0.00 -0.37 -0.15 0.00 -0.02 0.00 0.00 57.16 56.62 3a8i n GLU 278 Cb 0.66 -1.84 -0.12 0.00 -0.02 0.00 0.00 31.44 30.12 3a8i n GLU 278 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3a8i s LYS 279 N -3.69 0.56 -0.26 3.49 -0.14 0.38 -3.85 119.74 116.23 3a8i s LYS 279 Ca 0.59 -0.62 -0.15 0.00 -1.36 0.00 0.00 55.97 54.42 3a8i s LYS 279 Cb -0.17 -0.42 -0.04 0.00 -1.68 0.00 0.00 37.83 35.53 3a8i s LYS 279 CO 0.66 0.09 0.39 -1.17 -0.76 0.00 0.00 175.35 174.56 3a8i s LEU 280 N -1.17 4.06 0.29 3.17 2.96 -1.25 -1.02 118.68 125.71 3a8i s LEU 280 Ca -0.05 0.35 0.08 0.00 -0.22 0.00 0.00 54.13 54.29 3a8i s LEU 280 Cb -0.08 -2.47 -0.06 0.00 0.50 0.00 0.00 46.19 44.09 3a8i s LEU 280 CO 0.00 -0.17 -0.08 0.68 -1.32 0.00 0.00 176.35 175.46 3a8i s VAL 281 N 1.96 1.86 0.18 1.68 -7.23 0.13 -4.49 120.40 114.49 3a8i s VAL 281 Ca 0.16 -2.17 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 3a8i s VAL 281 Cb -0.16 -2.47 -0.04 0.00 0.56 0.00 0.00 36.38 34.28 3a8i s VAL 281 CO 0.09 -0.30 0.34 -0.83 -0.31 0.00 0.00 175.10 174.10 3a8i s GLY 282 N -3.48 1.68 0.13 2.32 0.00 -0.31 -0.10 107.32 107.56 3a8i s GLY 282 Ca 0.30 -0.97 0.08 0.00 0.00 0.00 0.00 44.72 44.13 3a8i s GLY 282 CO 0.13 -0.95 -0.18 1.08 0.00 0.00 0.00 173.10 173.18 3a8i s LEU 283 N -3.38 2.36 -0.05 0.66 1.43 0.24 -0.45 118.68 119.50 3a8i s LEU 283 Ca 0.36 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 3a8i s LEU 283 Cb -0.11 -0.78 0.02 0.00 0.03 0.00 0.00 46.19 45.36 3a8i s LEU 283 CO 0.29 -0.02 -0.03 -0.69 0.23 0.00 0.00 176.35 176.13 3a8i s VAL 284 N -1.65 0.47 -0.21 -1.59 1.01 -0.47 -0.98 120.40 116.98 3a8i s VAL 284 Ca 0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 61.98 62.02 3a8i s VAL 284 Cb -0.08 -0.53 0.02 0.00 0.00 0.00 0.00 36.38 35.79 3a8i s VAL 284 CO 0.05 0.22 -0.13 -0.32 0.00 0.00 0.00 175.10 174.92 3a8i s MET 285 N 1.14 2.98 0.16 2.72 1.75 -0.07 -1.61 119.30 126.37 3a8i s MET 285 Ca -0.08 -0.86 0.14 0.00 -1.25 0.00 0.00 55.69 53.65 3a8i s MET 285 Cb -0.14 -2.77 -0.07 0.00 2.84 0.00 0.00 34.83 34.69 3a8i s MET 285 CO -0.01 -0.27 1.15 1.79 -0.65 0.00 0.00 175.02 177.03 3a8i h THR 286 N 5.99 0.86 -4.29 10.11 1.35 -1.85 -2.96 112.91 122.13 3a8i h THR 286 Ca -0.40 -2.35 -0.50 0.00 -0.55 0.00 0.00 66.41 62.61 3a8i h THR 286 Cb 1.13 2.35 0.06 0.00 -1.73 0.00 0.00 68.15 69.96 3a8i h THR 286 CO 0.61 0.49 0.39 -1.83 -0.25 0.00 0.00 175.52 174.93 3a8i s GLU 287 N -2.89 3.50 0.75 4.72 1.03 -1.26 -4.93 118.70 119.62 3a8i s GLU 287 Ca 0.01 0.92 -0.15 0.00 0.03 0.00 0.00 54.97 55.78 3a8i s GLU 287 Cb 0.08 -2.07 0.05 0.00 -0.80 0.00 0.00 34.13 31.40 3a8i s GLU 287 CO 0.78 -0.65 1.24 0.15 -1.33 0.00 0.00 175.26 175.45 3a8i s LYS 288 N -4.69 1.95 0.00 -4.83 -0.14 -1.26 -4.89 119.74 105.88 3a8i s LYS 288 Ca 0.58 1.86 0.00 0.00 -1.36 0.00 0.00 55.97 57.06 3a8i s LYS 288 Cb -0.12 -1.80 0.00 0.00 -1.68 0.00 0.00 37.83 34.23 3a8i s LYS 288 CO 0.46 -2.01 0.00 0.41 -0.76 0.00 0.00 175.35 173.45 3a8i n GLY 289 N 0.63 3.74 3.23 -3.33 0.00 -1.26 -5.09 105.19 103.11 3a8i n GLY 289 Ca 0.14 -1.76 -0.36 0.00 0.00 0.00 0.00 46.02 44.04 3a8i n GLY 289 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a8i s VAL 290 N -2.54 3.31 -0.20 1.61 1.01 -1.26 -4.92 120.40 117.41 3a8i s VAL 290 Ca 0.00 -1.11 -0.27 0.00 0.00 0.00 0.00 61.98 60.61 3a8i s VAL 290 Cb 0.00 -2.80 -0.00 0.00 0.00 0.00 0.00 36.38 33.57 3a8i s VAL 290 CO 0.00 -0.01 0.91 -0.76 0.00 0.00 0.00 175.10 175.24 3a8i s LEU 291 N 1.35 4.14 0.16 3.92 1.43 -1.26 -5.01 118.68 123.40 3a8i s LEU 291 Ca -0.02 1.23 0.07 0.00 -1.03 0.00 0.00 54.13 54.39 3a8i s LEU 291 Cb -0.18 -3.34 -0.04 0.00 0.03 0.00 0.00 46.19 42.65 3a8i s LEU 291 CO -0.00 -0.51 -0.15 -0.60 0.23 0.00 0.00 176.35 175.31 3a8i s ARG 292 N 2.61 1.18 0.12 1.70 3.52 -1.26 -4.12 118.95 122.71 3a8i s ARG 292 Ca 0.40 -1.40 -0.35 0.00 -0.13 0.00 0.00 55.73 54.25 3a8i s ARG 292 Cb -0.16 -1.05 -0.16 0.00 -1.56 0.00 0.00 34.95 32.01 3a8i s ARG 292 CO 0.10 0.19 1.25 0.09 -0.81 0.00 0.00 175.30 176.12 3a8i n ASN 293 N 0.14 1.46 0.00 -2.12 3.02 -1.26 -2.71 115.26 113.79 3a8i n ASN 293 Ca -0.12 1.13 0.00 0.00 -0.03 0.00 0.00 54.58 55.56 3a8i n ASN 293 Cb 0.58 -1.19 0.00 0.00 -0.61 0.00 0.00 39.78 38.56 3a8i n ASN 293 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3a8i n GLU 294 N 2.16 0.00 -2.04 3.52 1.02 0.81 -4.97 120.64 121.14 3a8i n GLU 294 Ca 0.17 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.91 3a8i n GLU 294 Cb 0.21 -1.92 -0.01 0.00 -0.02 0.00 0.00 31.44 29.70 3a8i n GLU 294 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3a8i s LEU 295 N 0.00 4.31 0.45 -4.62 1.02 -1.10 -4.68 118.68 114.05 3a8i s LEU 295 Ca 0.00 2.72 -0.23 0.00 0.02 0.00 0.00 54.13 56.64 3a8i s LEU 295 Cb 0.00 -3.77 -0.08 0.00 0.02 0.00 0.00 46.19 42.36 3a8i s LEU 295 CO 0.00 -0.73 1.14 -2.84 0.02 0.00 0.00 176.35 173.94 3a8i s PRO 296 N -2.05 3.85 -0.12 1.29 0.02 -1.26 -0.94 135.00 135.78 3a8i s PRO 296 Ca 0.53 1.73 0.01 0.00 0.02 0.00 0.00 61.00 63.29 3a8i s PRO 296 Cb -0.40 -2.44 0.02 0.00 0.02 0.00 0.00 34.50 31.69 3a8i s PRO 296 CO 0.52 -0.47 -0.14 0.08 -0.33 0.00 0.00 177.00 176.66 3a8i s VAL 297 N -1.56 1.50 -0.01 3.83 1.01 -0.45 -2.64 120.40 122.08 3a8i s VAL 297 Ca 0.62 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 62.04 3a8i s VAL 297 Cb -0.27 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 3a8i s VAL 297 CO 0.34 0.44 -0.19 -0.13 0.00 0.00 0.00 175.10 175.56 3a8i s ARG 298 N 1.19 1.51 0.26 2.72 0.52 -0.47 0.15 118.95 124.83 3a8i s ARG 298 Ca -0.02 -0.66 -0.08 0.00 -0.52 0.00 0.00 55.73 54.45 3a8i s ARG 298 Cb -0.14 -1.46 -0.01 0.00 0.52 0.00 0.00 34.95 33.86 3a8i s ARG 298 CO -0.05 0.40 0.41 -0.59 0.02 0.00 0.00 175.30 175.49 3a8i s PHE 299 N -0.43 0.70 -0.08 -0.53 -0.71 -0.97 -1.36 117.98 114.59 3a8i s PHE 299 Ca 0.07 -1.00 0.07 0.00 -1.04 0.00 0.00 56.93 55.03 3a8i s PHE 299 Cb -0.07 -0.03 -0.10 0.00 -1.21 0.00 0.00 43.02 41.61 3a8i s PHE 299 CO -0.01 -0.96 0.03 2.41 -1.34 0.00 0.00 175.22 175.35 3a8i n THR 300 N -0.40 0.55 -0.25 -4.49 -1.04 -1.26 -0.14 114.28 107.25 3a8i n THR 300 Ca -0.00 -0.34 0.01 0.00 -2.04 0.00 0.00 64.05 61.68 3a8i n THR 300 Cb 0.63 -0.78 -0.01 0.00 -1.82 0.00 0.00 70.33 68.35 3a8i n THR 300 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 3a8i n ASP 301 N -2.30 -1.35 -0.27 8.00 5.75 -1.25 -1.85 116.55 123.28 3a8i n ASP 301 Ca -0.13 0.28 -0.06 0.00 -0.01 0.00 0.00 54.79 54.87 3a8i n ASP 301 Cb 0.76 -0.35 0.06 0.00 -1.03 0.00 0.00 41.12 40.56 3a8i n ASP 301 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3a8i h ALA 302 N -0.08 0.97 0.00 2.12 0.00 -1.90 -2.71 119.26 117.66 3a8i h ALA 302 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3a8i h ALA 302 Cb 0.19 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3a8i h ALA 302 CO 0.01 0.62 0.00 1.04 0.00 0.00 0.00 179.25 180.91 3a8i n GLN 303 N -4.30 0.38 -1.00 0.00 6.02 -1.26 -4.84 117.38 112.37 3a8i n GLN 303 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 3a8i n GLN 303 Cb 0.20 -1.32 0.00 0.00 1.02 0.00 0.00 30.24 30.14 3a8i n GLN 303 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3a8i n GLY 304 N -0.20 0.51 3.70 1.08 0.00 -1.02 -5.06 105.19 104.20 3a8i n GLY 304 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 3a8i n GLY 304 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a8i s ASN 305 N -2.06 6.34 0.25 1.61 0.01 -0.77 -4.96 114.94 115.36 3a8i s ASN 305 Ca 0.00 0.39 -0.30 0.00 -0.71 0.00 0.00 52.86 52.24 3a8i s ASN 305 Cb 0.00 -2.17 -0.09 0.00 0.41 0.00 0.00 41.25 39.40 3a8i s ASN 305 CO 0.00 0.05 0.94 -1.58 -1.51 0.00 0.00 177.10 175.00 3a8i s GLN 306 N 0.84 4.83 0.09 -0.60 0.74 -1.24 -3.80 119.66 120.51 3a8i s GLN 306 Ca 0.14 1.48 0.02 0.00 0.05 0.00 0.00 55.36 57.05 3a8i s GLN 306 Cb -0.13 -3.23 -0.04 0.00 1.10 0.00 0.00 33.01 30.71 3a8i s GLN 306 CO 0.04 0.49 -0.07 -1.01 -0.55 0.00 0.00 175.29 174.19 3a8i s HIS 307 N -1.22 0.89 -0.06 1.67 3.76 0.80 -4.98 115.29 116.15 3a8i s HIS 307 Ca 0.42 -0.79 0.01 0.00 -0.15 0.00 0.00 55.06 54.54 3a8i s HIS 307 Cb -0.25 -0.51 0.02 0.00 1.11 0.00 0.00 32.58 32.95 3a8i s HIS 307 CO 0.31 -0.10 -0.05 -2.00 -0.85 0.00 0.00 174.74 172.05 3a8i s GLU 308 N -3.27 0.98 0.00 1.40 2.12 -1.26 -2.30 118.70 116.37 3a8i s GLU 308 Ca 0.07 -0.12 0.00 0.00 0.36 0.00 0.00 54.97 55.28 3a8i s GLU 308 Cb 0.01 -1.02 0.00 0.00 0.26 0.00 0.00 34.13 33.38 3a8i s GLU 308 CO -0.03 -0.13 0.00 0.41 -0.54 0.00 0.00 175.26 174.97 3a8i n GLY 309 N 4.31 6.34 3.27 -1.50 0.00 0.41 -4.56 105.19 113.46 3a8i n GLY 309 Ca -0.20 -2.09 -0.14 0.00 0.00 0.00 0.00 46.02 43.60 3a8i n GLY 309 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3a8i s ILE 310 N 0.46 0.03 -0.01 -0.61 2.07 0.08 -1.33 121.20 121.88 3a8i s ILE 310 Ca 0.00 -0.27 -0.30 0.00 -1.41 0.00 0.00 60.65 58.67 3a8i s ILE 310 Cb 0.00 -0.61 -0.04 0.00 0.13 0.00 0.00 42.46 41.93 3a8i s ILE 310 CO 0.00 -0.15 1.27 -0.63 -1.91 0.00 0.00 174.94 173.52 3a8i s ILE 311 N -0.76 4.02 -0.08 2.00 1.01 -0.12 -1.09 121.20 126.18 3a8i s ILE 311 Ca -0.08 1.39 -0.10 0.00 0.00 0.00 0.00 60.65 61.86 3a8i s ILE 311 Cb -0.04 -3.90 -0.29 0.00 0.01 0.00 0.00 42.46 38.25 3a8i s ILE 311 CO 0.03 0.02 0.55 0.71 0.00 0.00 0.00 174.94 176.25 3a8i h THR 312 N 4.87 0.82 -3.05 2.92 1.35 -1.17 0.23 112.91 118.88 3a8i h THR 312 Ca -0.37 -2.44 -0.16 0.00 -0.55 0.00 0.00 66.41 62.89 3a8i h THR 312 Cb 1.18 2.66 -0.26 0.00 -1.73 0.00 0.00 68.15 70.00 3a8i h THR 312 CO 0.87 0.87 -0.40 -0.44 -0.25 0.00 0.00 175.52 176.18 3a8i s SER 313 N -7.20 -0.29 0.04 5.36 0.01 -1.21 -4.62 113.70 105.79 3a8i s SER 313 Ca -0.19 0.56 0.08 0.00 1.31 0.00 0.00 55.95 57.72 3a8i s SER 313 Cb 0.06 0.56 -0.03 0.00 0.21 0.00 0.00 66.02 66.82 3a8i s SER 313 CO 0.82 -0.10 -0.24 -0.83 0.41 0.00 0.00 173.24 173.29 3a8i s GLY 314 N 0.28 1.28 0.10 3.44 0.00 -1.26 -0.44 107.32 110.72 3a8i s GLY 314 Ca -0.01 -1.17 -0.10 0.00 0.00 0.00 0.00 44.72 43.44 3a8i s GLY 314 CO -0.01 -1.06 0.25 -1.08 0.00 0.00 0.00 173.10 171.19 3a8i s THR 315 N -0.78 0.12 -0.24 0.90 -1.32 -0.63 -4.83 115.64 108.85 3a8i s THR 315 Ca 0.10 -1.05 -0.27 0.00 -1.21 0.00 0.00 61.69 59.26 3a8i s THR 315 Cb -0.09 -1.33 0.00 0.00 -1.51 0.00 0.00 72.50 69.57 3a8i s THR 315 CO 0.02 -0.55 0.95 0.12 -2.21 0.00 0.00 174.62 172.95 3a8i s PHE 316 N -3.85 3.31 -0.41 9.09 5.36 -1.26 -0.45 117.98 129.77 3a8i s PHE 316 Ca 0.05 1.30 -0.25 0.00 -0.96 0.00 0.00 56.93 57.07 3a8i s PHE 316 Cb 0.04 -3.21 0.02 0.00 -0.34 0.00 0.00 43.02 39.53 3a8i s PHE 316 CO -0.11 -0.47 0.91 0.45 -1.46 0.00 0.00 175.22 174.54 3a8i s SER 317 N 1.30 6.58 0.23 6.13 0.15 -0.37 -4.93 113.70 122.79 3a8i s SER 317 Ca 0.40 0.35 0.01 0.00 0.70 0.00 0.00 55.95 57.41 3a8i s SER 317 Cb -0.15 -2.45 0.24 0.00 -1.71 0.00 0.00 66.02 61.96 3a8i s SER 317 CO 0.07 -0.93 1.59 -0.65 1.20 0.00 0.00 173.24 174.52 3a8i h PRO 318 N 8.74 0.45 -0.66 5.44 0.11 -1.95 0.59 132.00 144.72 3a8i h PRO 318 Ca -0.24 -0.25 0.03 0.00 0.11 0.00 0.00 66.00 65.65 3a8i h PRO 318 Cb 1.08 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 3a8i h PRO 318 CO 0.99 0.82 0.41 1.15 -0.21 0.00 0.00 178.00 181.17 3a8i h THR 319 N 0.36 1.10 0.00 -1.15 2.02 -1.95 -2.77 112.91 110.51 3a8i h THR 319 Ca 0.02 -0.28 -0.17 0.00 0.77 0.00 0.00 66.41 66.76 3a8i h THR 319 Cb 0.96 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 3a8i h THR 319 CO 0.08 0.15 -0.99 -0.07 0.37 0.00 0.00 175.52 175.07 3a8i h LEU 320 N 0.81 0.00 0.23 2.58 4.07 -1.95 -3.47 115.31 117.59 3a8i h LEU 320 Ca 0.26 0.00 -0.37 0.00 0.08 0.00 0.00 57.88 57.85 3a8i h LEU 320 Cb 0.00 0.00 0.08 0.00 1.08 0.00 0.00 40.66 41.83 3a8i h LEU 320 CO -0.10 0.69 -0.58 0.61 -1.08 0.00 0.00 178.44 177.98 3a8i n GLY 321 N 1.33 -0.42 3.21 0.83 0.00 0.20 -5.04 105.19 105.30 3a8i n GLY 321 Ca -0.03 0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 3a8i n GLY 321 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a8i s TYR 322 N -3.19 -0.09 0.23 1.61 2.02 -0.92 -4.99 117.35 112.03 3a8i s TYR 322 Ca 0.38 0.05 -0.31 0.00 -0.37 0.00 0.00 57.07 56.81 3a8i s TYR 322 Cb -0.17 0.05 -0.12 0.00 -0.40 0.00 0.00 41.96 41.33 3a8i s TYR 322 CO 0.47 -0.40 1.68 -1.12 -1.57 0.00 0.00 175.55 174.61 3a8i s SER 323 N -1.58 6.38 0.19 2.29 0.01 -1.12 -1.24 113.70 118.63 3a8i s SER 323 Ca -0.11 2.89 0.05 0.00 1.31 0.00 0.00 55.95 60.09 3a8i s SER 323 Cb -0.04 -2.61 -0.05 0.00 0.21 0.00 0.00 66.02 63.53 3a8i s SER 323 CO 0.01 -0.95 -0.08 0.27 0.41 0.00 0.00 173.24 172.90 3a8i s ILE 324 N 0.79 1.28 -0.13 1.44 -4.36 0.40 -0.89 121.20 119.74 3a8i s ILE 324 Ca 0.71 -2.09 -0.20 0.00 -0.26 0.00 0.00 60.65 58.81 3a8i s ILE 324 Cb -0.49 -2.04 0.05 0.00 1.25 0.00 0.00 42.46 41.23 3a8i s ILE 324 CO 0.37 -0.59 0.51 0.00 0.24 0.00 0.00 174.94 175.47 3a8i s ALA 325 N -3.26 -1.29 -0.08 2.27 0.00 -0.15 -1.61 121.76 117.64 3a8i s ALA 325 Ca 0.21 1.19 -0.10 0.00 0.00 0.00 0.00 51.96 53.27 3a8i s ALA 325 Cb 0.03 -0.47 -0.05 0.00 0.00 0.00 0.00 23.12 22.63 3a8i s ALA 325 CO 0.04 -0.28 0.24 -0.51 0.00 0.00 0.00 175.76 175.26 3a8i s LEU 326 N -0.39 4.42 -0.01 0.00 1.43 0.41 0.83 118.68 125.36 3a8i s LEU 326 Ca -0.05 0.65 0.01 0.00 -1.03 0.00 0.00 54.13 53.70 3a8i s LEU 326 Cb -0.03 -2.26 0.01 0.00 0.03 0.00 0.00 46.19 43.93 3a8i s LEU 326 CO 0.03 0.37 -0.03 0.00 0.23 0.00 0.00 176.35 176.96 3a8i s ALA 327 N -1.00 0.33 -0.26 4.21 0.00 0.86 -0.60 121.76 125.29 3a8i s ALA 327 Ca 0.18 -0.07 -0.14 0.00 0.00 0.00 0.00 51.96 51.93 3a8i s ALA 327 Cb -0.14 -0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 3a8i s ALA 327 CO 0.07 0.03 0.33 0.50 0.00 0.00 0.00 175.76 176.70 3a8i s ARG 328 N 0.25 4.02 0.03 0.00 3.52 -0.25 -0.69 118.95 125.83 3a8i s ARG 328 Ca -0.02 -0.03 -0.00 0.00 -0.13 0.00 0.00 55.73 55.55 3a8i s ARG 328 Cb -0.05 -3.64 -0.02 0.00 -1.56 0.00 0.00 34.95 29.67 3a8i s ARG 328 CO -0.01 -0.22 -0.03 0.14 -0.81 0.00 0.00 175.30 174.37 3a8i s VAL 329 N 1.89 0.16 0.58 7.11 -7.23 -0.19 -0.74 120.40 121.97 3a8i s VAL 329 Ca 0.13 -1.11 -0.19 0.00 -1.81 0.00 0.00 61.98 59.01 3a8i s VAL 329 Cb -0.16 -0.55 -0.07 0.00 0.56 0.00 0.00 36.38 36.17 3a8i s VAL 329 CO 0.10 -0.60 0.77 -2.65 -0.31 0.00 0.00 175.10 172.41 3a8i n PRO 330 N 1.27 0.74 -1.44 4.82 -0.02 -1.26 -0.47 135.00 138.64 3a8i n PRO 330 Ca -0.22 0.29 -0.37 0.00 -2.02 0.00 0.00 63.50 61.18 3a8i n PRO 330 Cb 0.56 -1.95 0.06 0.00 -0.02 0.00 0.00 33.50 32.15 3a8i n PRO 330 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3a8i n GLU 331 N -0.52 0.56 -0.49 -0.52 1.02 -1.26 -4.02 120.64 115.41 3a8i n GLU 331 Ca 0.13 0.23 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 3a8i n GLU 331 Cb 0.47 -1.95 0.00 0.00 -0.02 0.00 0.00 31.44 29.94 3a8i n GLU 331 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3a8i n GLY 332 N 1.50 0.72 3.77 0.62 0.00 -1.26 -5.06 105.19 105.48 3a8i n GLY 332 Ca 0.12 -0.52 -0.38 0.00 0.00 0.00 0.00 46.02 45.24 3a8i n GLY 332 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3a8i s ILE 333 N -2.00 3.61 0.00 -0.61 2.07 -1.26 -4.46 121.20 118.55 3a8i s ILE 333 Ca 0.00 1.41 0.00 0.00 -1.41 0.00 0.00 60.65 60.65 3a8i s ILE 333 Cb 0.00 -3.81 0.00 0.00 0.13 0.00 0.00 42.46 38.78 3a8i s ILE 333 CO 0.00 0.18 0.00 0.61 -1.91 0.00 0.00 174.94 173.82 3a8i n GLY 334 N 0.76 1.29 0.16 1.50 0.00 -1.26 -5.01 105.19 102.62 3a8i n GLY 334 Ca 0.02 -1.27 0.11 0.00 0.00 0.00 0.00 46.02 44.88 3a8i n GLY 334 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3a8i n GLU 335 N 0.00 0.39 -4.31 1.61 1.02 -1.26 -4.75 120.64 113.34 3a8i n GLU 335 Ca 0.00 -0.31 -0.16 0.00 -0.02 0.00 0.00 57.16 56.66 3a8i n GLU 335 Cb 0.00 -1.49 -0.10 0.00 -0.02 0.00 0.00 31.44 29.82 3a8i n GLU 335 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3a8i s THR 336 N -2.83 1.01 0.15 2.62 -4.23 -1.26 -0.92 115.64 110.17 3a8i s THR 336 Ca 0.12 -2.03 -0.18 0.00 -1.18 0.00 0.00 61.69 58.41 3a8i s THR 336 Cb 0.17 -2.25 0.06 0.00 1.34 0.00 0.00 72.50 71.82 3a8i s THR 336 CO 0.76 -0.40 0.88 0.00 -0.54 0.00 0.00 174.62 175.32 3a8i n ALA 337 N -0.37 -2.30 -2.71 3.99 0.00 -0.93 -4.83 120.51 113.36 3a8i n ALA 337 Ca -0.06 -0.86 -0.18 0.00 0.00 0.00 0.00 53.44 52.35 3a8i n ALA 337 Cb 0.63 0.47 -0.14 0.00 0.00 0.00 0.00 19.45 20.41 3a8i n ALA 337 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3a8i s ILE 338 N -2.14 0.70 -0.03 0.00 1.01 -0.47 -0.91 121.20 119.37 3a8i s ILE 338 Ca 0.20 -0.53 0.07 0.00 0.00 0.00 0.00 60.65 60.39 3a8i s ILE 338 Cb -0.02 -0.62 -0.02 0.00 0.01 0.00 0.00 42.46 41.81 3a8i s ILE 338 CO 0.04 0.09 -0.25 0.68 0.00 0.00 0.00 174.94 175.50 3a8i s VAL 339 N -0.43 1.98 -0.42 2.92 -7.23 0.11 -1.37 120.40 115.97 3a8i s VAL 339 Ca 0.01 -1.06 -0.23 0.00 -1.81 0.00 0.00 61.98 58.89 3a8i s VAL 339 Cb -0.05 -1.65 0.02 0.00 0.56 0.00 0.00 36.38 35.26 3a8i s VAL 339 CO 0.00 0.56 0.77 -1.58 -0.31 0.00 0.00 175.10 174.54 3a8i s GLN 340 N -0.48 3.53 -0.56 4.82 0.74 -1.08 -1.13 119.66 125.51 3a8i s GLN 340 Ca 0.06 0.04 -0.02 0.00 0.05 0.00 0.00 55.36 55.49 3a8i s GLN 340 Cb -0.11 -3.89 0.14 0.00 1.10 0.00 0.00 33.01 30.26 3a8i s GLN 340 CO 0.00 -1.01 0.36 0.42 -0.55 0.00 0.00 175.29 174.52 3a8i s ILE 341 N 3.19 3.53 0.00 -2.34 1.01 -0.80 -4.35 121.20 121.44 3a8i s ILE 341 Ca 0.30 -2.72 0.00 0.00 0.00 0.00 0.00 60.65 58.23 3a8i s ILE 341 Cb -0.13 -3.34 0.00 0.00 0.01 0.00 0.00 42.46 39.00 3a8i s ILE 341 CO 0.20 -0.82 0.00 -1.14 0.00 0.00 0.00 174.94 173.18 3a8i n ARG 342 N 3.79 0.00 0.18 2.79 3.00 -1.26 -2.48 116.66 122.68 3a8i n ARG 342 Ca 0.05 0.00 0.13 0.00 -0.00 0.00 0.00 57.85 58.03 3a8i n ARG 342 Cb 0.39 0.00 0.39 0.00 0.00 0.00 0.00 32.46 33.24 3a8i n ARG 342 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.63 176.66 3a8i h ASN 343 N 0.00 0.00 -3.24 6.15 -0.00 -2.00 -3.46 115.58 113.02 3a8i h ASN 343 Ca 0.00 0.00 -0.67 0.00 -0.00 0.00 0.00 56.30 55.63 3a8i h ASN 343 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 38.32 38.19 3a8i h ASN 343 CO 0.00 0.00 -0.61 -0.13 -0.00 0.00 0.00 177.43 176.69 3a8i s ARG 344 N -3.28 2.98 -1.02 6.67 0.52 -1.03 -5.05 118.95 118.73 3a8i s ARG 344 Ca 0.07 -0.45 -0.18 0.00 -0.52 0.00 0.00 55.73 54.64 3a8i s ARG 344 Cb 0.09 -2.80 0.13 0.00 0.52 0.00 0.00 34.95 32.88 3a8i s ARG 344 CO 0.58 0.68 1.26 -1.21 0.02 0.00 0.00 175.30 176.63 3a8i s GLU 345 N -1.22 3.73 -0.30 3.54 8.01 -1.26 -1.90 118.70 129.31 3a8i s GLU 345 Ca 0.17 -1.91 -0.28 0.00 0.01 0.00 0.00 54.97 52.96 3a8i s GLU 345 Cb -0.12 -5.03 0.01 0.00 -4.31 0.00 0.00 34.13 24.69 3a8i s GLU 345 CO 0.06 -1.84 1.02 -1.64 0.01 0.00 0.00 175.26 172.88 3a8i s MET 346 N 2.72 4.09 0.31 1.61 -1.94 -0.29 -4.82 119.30 120.99 3a8i s MET 346 Ca 0.37 1.06 -0.29 0.00 -1.71 0.00 0.00 55.69 55.12 3a8i s MET 346 Cb -0.03 -3.71 -0.10 0.00 2.01 0.00 0.00 34.83 32.99 3a8i s MET 346 CO -0.06 -0.80 1.30 -1.25 -0.01 0.00 0.00 175.02 174.19 3a8i s PRO 347 N 3.43 4.38 0.04 2.03 0.04 -1.26 0.06 135.00 143.72 3a8i s PRO 347 Ca 0.43 2.18 -0.01 0.00 0.04 0.00 0.00 61.00 63.64 3a8i s PRO 347 Cb -0.13 -3.09 -0.03 0.00 0.04 0.00 0.00 34.50 31.28 3a8i s PRO 347 CO 0.13 -0.17 -0.03 0.14 0.04 0.00 0.00 177.00 177.11 3a8i s VAL 348 N -1.00 0.22 0.11 -0.36 -7.23 -0.09 -4.76 120.40 107.28 3a8i s VAL 348 Ca 0.50 -1.53 -0.17 0.00 -1.81 0.00 0.00 61.98 58.96 3a8i s VAL 348 Cb -0.39 -1.13 -0.07 0.00 0.56 0.00 0.00 36.38 35.35 3a8i s VAL 348 CO 0.50 -0.83 0.57 -0.75 -0.31 0.00 0.00 175.10 174.28 3a8i s LYS 349 N -3.13 4.12 -0.20 4.82 2.47 -0.63 -2.20 119.74 124.98 3a8i s LYS 349 Ca -0.00 0.65 -0.06 0.00 -1.56 0.00 0.00 55.97 55.00 3a8i s LYS 349 Cb 0.02 -3.10 -0.03 0.00 -1.46 0.00 0.00 37.83 33.26 3a8i s LYS 349 CO -0.07 0.57 0.02 0.08 0.16 0.00 0.00 175.35 176.10 3a8i s VAL 350 N -1.26 4.09 0.29 4.02 1.01 -0.10 -1.37 120.40 127.07 3a8i s VAL 350 Ca 0.33 -0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.07 3a8i s VAL 350 Cb -0.18 -2.86 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 3a8i s VAL 350 CO 0.19 0.42 0.09 0.35 0.00 0.00 0.00 175.10 176.15 3a8i n THR 351 N 4.23 0.00 -1.73 3.92 -2.24 0.40 -4.70 114.28 114.16 3a8i n THR 351 Ca -0.17 -1.63 -0.38 0.00 -2.27 0.00 0.00 64.05 59.61 3a8i n THR 351 Cb 0.52 0.55 0.06 0.00 -2.10 0.00 0.00 70.33 69.36 3a8i n THR 351 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3a8i n LYS 352 N -0.65 1.41 -0.92 -0.78 5.02 -1.26 -1.16 118.16 119.82 3a8i n LYS 352 Ca -0.05 0.53 -0.13 0.00 -2.02 0.00 0.00 58.31 56.64 3a8i n LYS 352 Cb 0.42 -2.54 -0.14 0.00 -0.02 0.00 0.00 35.03 32.75 3a8i n LYS 352 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3a8i n PRO 353 N -1.41 1.95 -3.64 1.97 -0.04 -1.26 -3.37 135.00 129.21 3a8i n PRO 353 Ca 0.13 -1.02 -0.09 0.00 -0.04 0.00 0.00 63.50 62.48 3a8i n PRO 353 Cb 0.46 -2.03 -0.07 0.00 -0.04 0.00 0.00 33.50 31.82 3a8i n PRO 353 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3a8i s VAL 354 N 1.38 0.00 -0.05 0.52 0.11 -1.26 -4.19 120.40 116.91 3a8i s VAL 354 Ca 0.60 0.00 0.06 0.00 -2.93 0.00 0.00 61.98 59.71 3a8i s VAL 354 Cb 0.27 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 34.03 3a8i s VAL 354 CO -0.01 0.00 0.07 0.49 -3.33 0.00 0.00 175.10 172.32 3a8i n PHE 355 N 3.14 0.00 -4.24 1.54 3.01 0.12 -4.85 117.46 116.18 3a8i n PHE 355 Ca -0.16 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.17 3a8i n PHE 355 Cb 0.57 -0.27 -0.10 0.00 -0.01 0.00 0.00 39.48 39.66 3a8i n PHE 355 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3a8i s VAL 356 N -2.27 0.21 0.05 -4.37 1.01 -0.79 -1.75 120.40 112.49 3a8i s VAL 356 Ca -0.03 -2.00 -0.11 0.00 0.00 0.00 0.00 61.98 59.84 3a8i s VAL 356 Cb 0.03 -2.52 0.04 0.00 0.00 0.00 0.00 36.38 33.92 3a8i s VAL 356 CO 0.28 -0.03 0.53 0.54 0.00 0.00 0.00 175.10 176.42 3a8i n ARG 357 N -0.33 0.21 0.00 2.72 1.74 0.16 -4.65 116.66 116.52 3a8i n ARG 357 Ca 0.01 -0.56 0.00 0.00 -0.77 0.00 0.00 57.85 56.53 3a8i n ARG 357 Cb 0.66 0.80 0.00 0.00 -1.02 0.00 0.00 32.46 32.90 3a8i n ARG 357 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3a8i n ASN 358 N -0.78 0.00 0.00 0.55 4.13 -1.23 0.54 115.26 118.46 3a8i n ASN 358 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 3a8i n ASN 358 Cb 0.27 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.51 3a8i n ASN 358 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3a8i n GLY 359 N 0.00 0.24 3.78 7.41 0.00 -1.26 -4.86 105.19 110.51 3a8i n GLY 359 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 3a8i n GLY 359 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a8i s LYS 360 N 0.00 2.25 0.20 1.61 -2.85 0.19 -5.03 119.74 116.11 3a8i s LYS 360 Ca 0.00 -1.93 -0.12 0.00 -1.00 0.00 0.00 55.97 52.92 3a8i s LYS 360 Cb 0.00 -1.98 -0.07 0.00 -2.06 0.00 0.00 37.83 33.72 3a8i s LYS 360 CO 0.00 -0.26 0.57 0.00 0.10 0.00 0.00 175.35 175.77 3a8i s ALA 361 N -2.66 3.54 -1.27 0.59 0.00 -1.26 -0.66 121.76 120.04 3a8i s ALA 361 Ca 0.36 -0.17 -0.13 0.00 0.00 0.00 0.00 51.96 52.02 3a8i s ALA 361 Cb 0.02 -2.51 0.14 0.00 0.00 0.00 0.00 23.12 20.77 3a8i s ALA 361 CO 0.20 0.46 1.71 0.28 0.00 0.00 0.00 175.76 178.41 3a8i n VAL 362 N 0.27 4.16 0.77 0.00 0.31 -0.72 -4.94 118.33 118.19 3a8i n VAL 362 Ca -0.02 -4.36 0.09 0.00 -0.01 0.00 0.00 64.34 60.04 3a8i n VAL 362 Cb 0.52 -2.43 0.08 0.00 -0.91 0.00 0.00 33.84 31.10 3a8i n VAL 362 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51