#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b8i s SER 5 N 0.00 5.03 0.28 0.00 1.04 -1.26 -4.86 113.70 113.92 3b8i s SER 5 Ca 0.00 0.99 0.00 0.00 0.48 0.00 0.00 55.95 57.42 3b8i s SER 5 Cb 0.00 -1.66 0.51 0.00 0.10 0.00 0.00 66.02 64.97 3b8i s SER 5 CO 0.00 -1.59 1.84 0.45 0.98 0.00 0.00 173.24 174.92 3b8i h HIS 6 N -0.83 1.14 -0.64 5.02 -0.00 -1.96 -1.05 115.15 116.83 3b8i h HIS 6 Ca -0.45 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 59.93 3b8i h HIS 6 Cb 1.29 -0.36 -0.03 0.00 -0.00 0.00 0.00 27.41 28.30 3b8i h HIS 6 CO 0.42 0.48 0.34 1.25 -0.00 0.00 0.00 177.93 180.43 3b8i h HIS 7 N 1.02 0.88 -0.31 2.45 -0.00 -1.93 -2.54 115.15 114.73 3b8i h HIS 7 Ca 0.48 -0.03 -0.08 0.00 -0.00 0.00 0.00 60.37 60.74 3b8i h HIS 7 Cb 0.41 -0.28 -0.02 0.00 -0.00 0.00 0.00 27.41 27.52 3b8i h HIS 7 CO -0.01 0.64 -0.16 0.93 -0.00 0.00 0.00 177.93 179.34 3b8i h GLU 8 N 0.87 0.54 -0.12 5.26 5.08 -1.62 -2.31 114.58 122.29 3b8i h GLU 8 Ca 0.22 -0.17 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 3b8i h GLU 8 Cb 0.05 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3b8i h GLU 8 CO -0.03 0.68 -0.33 -0.07 -1.00 0.00 0.00 179.01 178.26 3b8i h LEU 9 N 0.49 0.24 -0.44 1.33 3.38 -1.10 -1.52 115.31 117.69 3b8i h LEU 9 Ca 0.09 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3b8i h LEU 9 Cb 0.56 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 3b8i h LEU 9 CO 0.04 0.56 0.12 0.03 0.09 0.00 0.00 178.44 179.28 3b8i h ARG 10 N 0.21 0.69 -0.86 1.13 3.08 -1.02 -0.94 114.38 116.68 3b8i h ARG 10 Ca 0.03 -0.16 0.01 0.00 0.07 0.00 0.00 59.98 59.93 3b8i h ARG 10 Cb 0.68 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 3b8i h ARG 10 CO 0.05 0.68 0.56 0.00 -1.07 0.00 0.00 179.97 180.20 3b8i h ALA 11 N 0.98 1.09 -0.30 0.04 0.00 -1.15 0.07 119.26 120.00 3b8i h ALA 11 Ca 0.14 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.03 3b8i h ALA 11 Cb 0.29 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3b8i h ALA 11 CO -0.00 0.47 0.10 0.52 0.00 0.00 0.00 179.25 180.34 3b8i h MET 12 N 1.14 0.23 -0.31 0.00 2.86 -1.00 -1.39 114.93 116.46 3b8i h MET 12 Ca 0.32 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.92 3b8i h MET 12 Cb -0.10 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 3b8i h MET 12 CO -0.08 0.15 0.10 0.35 1.06 0.00 0.00 176.91 178.49 3b8i h PHE 13 N 0.24 0.49 -0.91 -0.22 3.57 -0.75 -0.94 116.94 118.42 3b8i h PHE 13 Ca 0.13 -0.05 0.11 0.00 3.53 0.00 0.00 57.97 61.69 3b8i h PHE 13 Cb 0.10 -0.14 -0.07 0.00 2.79 0.00 0.00 35.95 38.63 3b8i h PHE 13 CO -0.13 0.50 0.58 0.00 -2.23 0.00 0.00 178.31 177.04 3b8i h ARG 14 N 0.34 0.85 -0.10 1.11 2.47 -0.91 -0.67 114.38 117.47 3b8i h ARG 14 Ca 0.10 -0.05 -0.14 0.00 -1.26 0.00 0.00 59.98 58.62 3b8i h ARG 14 Cb 0.24 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 3b8i h ARG 14 CO -0.00 0.56 -0.57 0.00 0.56 0.00 0.00 179.97 180.51 3b8i h ALA 15 N 1.56 0.84 -0.58 0.04 0.00 -0.89 0.30 119.26 120.53 3b8i h ALA 15 Ca 0.43 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3b8i h ALA 15 Cb 0.46 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3b8i h ALA 15 CO -0.19 0.71 0.34 -0.07 0.00 0.00 0.00 179.25 180.04 3b8i h LEU 16 N 0.23 0.71 -1.29 0.00 3.38 -0.26 -2.84 115.31 115.23 3b8i h LEU 16 Ca -0.00 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 3b8i h LEU 16 Cb 1.08 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 3b8i h LEU 16 CO 0.09 0.58 -0.33 -0.07 0.09 0.00 0.00 178.44 178.79 3b8i h LEU 17 N 0.79 0.03 -0.80 1.67 3.38 -0.62 -2.70 115.31 117.06 3b8i h LEU 17 Ca 0.21 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3b8i h LEU 17 Cb 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3b8i h LEU 17 CO -0.04 0.36 0.00 0.44 0.09 0.00 0.00 178.44 179.30 3b8i h ASP 18 N 0.03 0.00 -2.87 -0.43 3.32 -0.80 -3.47 116.42 112.20 3b8i h ASP 18 Ca 0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 3b8i h ASP 18 Cb 0.61 0.00 0.15 0.00 0.22 0.00 0.00 39.33 40.31 3b8i h ASP 18 CO 0.04 0.00 0.07 -1.54 -1.72 0.00 0.00 179.24 176.09 3b8i n SER 19 N -2.98 -1.99 -0.76 6.45 3.41 -1.02 -4.99 113.62 111.75 3b8i n SER 19 Ca 0.02 -0.98 0.07 0.00 -0.26 0.00 0.00 58.87 57.73 3b8i n SER 19 Cb 0.39 -0.76 0.20 0.00 -0.26 0.00 0.00 64.21 63.78 3b8i n SER 19 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3b8i n SER 20 N -4.48 3.35 -4.68 4.04 3.41 -1.26 -5.02 113.62 108.98 3b8i n SER 20 Ca 0.11 -2.41 -0.25 0.00 -0.26 0.00 0.00 58.87 56.06 3b8i n SER 20 Cb 0.44 -0.36 -0.07 0.00 -0.26 0.00 0.00 64.21 63.96 3b8i n SER 20 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3b8i s ARG 21 N -1.74 2.44 0.04 4.33 0.52 -1.26 -4.78 118.95 118.50 3b8i s ARG 21 Ca 0.31 -1.19 0.03 0.00 -0.52 0.00 0.00 55.73 54.36 3b8i s ARG 21 Cb 0.21 -2.33 -0.04 0.00 0.52 0.00 0.00 34.95 33.32 3b8i s ARG 21 CO 0.13 0.42 0.00 0.00 0.02 0.00 0.00 175.30 175.88 3b8i s TYR 23 N -1.19 2.29 -0.24 0.00 2.02 0.00 -4.96 117.35 115.28 3b8i s TYR 23 Ca 0.22 -0.42 -0.14 0.00 -0.37 0.00 0.00 57.07 56.36 3b8i s TYR 23 Cb -0.12 -1.41 -0.04 0.00 -0.40 0.00 0.00 41.96 39.99 3b8i s TYR 23 CO 0.14 0.05 0.35 -1.01 -1.57 0.00 0.00 175.55 173.51 3b8i s HIS 24 N -0.72 3.30 0.59 2.71 3.76 -1.26 -0.31 115.29 123.37 3b8i s HIS 24 Ca 0.11 0.45 -0.19 0.00 -0.15 0.00 0.00 55.06 55.28 3b8i s HIS 24 Cb -0.10 -2.50 -0.04 0.00 1.11 0.00 0.00 32.58 31.05 3b8i s HIS 24 CO 0.01 -0.10 1.21 0.95 -0.85 0.00 0.00 174.74 175.95 3b8i s THR 25 N 1.63 2.64 0.09 1.30 -4.23 -0.77 -4.76 115.64 111.55 3b8i s THR 25 Ca 0.15 0.40 -0.21 0.00 -1.18 0.00 0.00 61.69 60.85 3b8i s THR 25 Cb -0.15 -3.16 -0.07 0.00 1.34 0.00 0.00 72.50 70.46 3b8i s THR 25 CO 0.08 -0.08 0.64 0.00 -0.54 0.00 0.00 174.62 174.72 3b8i s ALA 26 N -1.59 3.53 -0.26 3.99 0.00 -0.92 -4.78 121.76 121.73 3b8i s ALA 26 Ca 0.77 0.14 -0.29 0.00 0.00 0.00 0.00 51.96 52.59 3b8i s ALA 26 Cb -0.30 -2.76 -0.01 0.00 0.00 0.00 0.00 23.12 20.05 3b8i s ALA 26 CO 0.33 0.33 1.47 0.45 0.00 0.00 0.00 175.76 178.34 3b8i s SER 27 N -0.99 6.52 -0.19 0.00 0.15 -1.26 -0.92 113.70 117.00 3b8i s SER 27 Ca 0.32 1.43 0.01 0.00 0.70 0.00 0.00 55.95 58.40 3b8i s SER 27 Cb -0.21 -2.54 0.04 0.00 -1.71 0.00 0.00 66.02 61.61 3b8i s SER 27 CO 0.21 -1.17 -0.11 -0.69 1.20 0.00 0.00 173.24 172.67 3b8i s VAL 28 N 4.81 1.68 0.00 4.45 1.01 -0.16 -4.87 120.40 127.32 3b8i s VAL 28 Ca 0.64 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.64 3b8i s VAL 28 Cb -0.21 -1.72 0.00 0.00 0.00 0.00 0.00 36.38 34.45 3b8i s VAL 28 CO 0.26 0.22 0.01 2.22 0.00 0.00 0.00 175.10 177.82 3b8i n PHE 29 N 4.68 0.00 -3.86 5.22 1.16 -1.26 -3.12 117.46 120.28 3b8i n PHE 29 Ca -0.15 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.35 3b8i n PHE 29 Cb 0.47 0.00 -0.01 0.00 -1.61 0.00 0.00 39.48 38.33 3b8i n PHE 29 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 3b8i s ASP 30 N -0.36 -0.16 0.29 5.98 1.47 -1.26 -4.93 116.67 117.70 3b8i s ASP 30 Ca 0.00 -0.78 0.01 0.00 1.18 0.00 0.00 52.55 52.96 3b8i s ASP 30 Cb 0.00 0.75 0.52 0.00 -0.34 0.00 0.00 42.92 43.85 3b8i s ASP 30 CO 0.00 -1.41 1.88 1.55 0.68 0.00 0.00 175.17 177.87 3b8i h PRO 31 N 2.02 1.01 -0.56 2.11 0.13 -1.90 -2.14 132.00 132.68 3b8i h PRO 31 Ca -0.23 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 64.80 3b8i h PRO 31 Cb 1.25 -0.23 -0.02 0.00 0.13 0.00 0.00 31.00 32.13 3b8i h PRO 31 CO 0.28 0.67 0.19 0.52 -0.23 0.00 0.00 178.00 179.44 3b8i h MET 32 N 1.04 0.85 -0.01 0.86 2.86 -1.97 -2.00 114.93 116.56 3b8i h MET 32 Ca 0.43 -0.17 -0.10 0.00 -2.06 0.00 0.00 59.70 57.79 3b8i h MET 32 Cb 0.29 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3b8i h MET 32 CO -0.18 0.76 -0.48 0.66 1.06 0.00 0.00 176.91 178.72 3b8i h SER 33 N 0.77 0.04 -0.32 1.22 4.64 -1.91 -1.62 113.55 116.36 3b8i h SER 33 Ca 0.18 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.47 3b8i h SER 33 Cb 0.25 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 3b8i h SER 33 CO -0.01 0.52 0.13 0.00 -0.87 0.00 0.00 176.83 176.60 3b8i h ALA 34 N 1.48 0.42 -0.68 5.18 0.00 -1.16 -0.81 119.26 123.68 3b8i h ALA 34 Ca -0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 3b8i h ALA 34 Cb 0.87 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 3b8i h ALA 34 CO 0.06 0.02 0.32 0.00 0.00 0.00 0.00 179.25 179.65 3b8i h ARG 35 N 0.37 0.99 0.10 0.00 3.08 -1.17 -2.38 114.38 115.36 3b8i h ARG 35 Ca 0.11 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 3b8i h ARG 35 Cb 0.18 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.06 3b8i h ARG 35 CO -0.01 0.79 -0.05 0.82 -1.07 0.00 0.00 179.97 180.45 3b8i h ILE 36 N 0.95 0.99 -0.86 2.04 2.04 -1.29 -0.87 117.51 120.50 3b8i h ILE 36 Ca 0.23 -0.29 0.08 0.00 1.00 0.00 0.00 64.86 65.88 3b8i h ILE 36 Cb 0.13 1.18 -0.07 0.00 -0.74 0.00 0.00 36.82 37.32 3b8i h ILE 36 CO -0.03 0.07 0.53 0.00 0.00 0.00 0.00 178.15 178.72 3b8i h ALA 37 N 0.63 1.21 -0.08 1.87 0.00 -1.10 -1.45 119.26 120.34 3b8i h ALA 37 Ca -0.01 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3b8i h ALA 37 Cb 0.22 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3b8i h ALA 37 CO 0.02 0.23 -0.05 0.00 0.00 0.00 0.00 179.25 179.45 3b8i h ALA 38 N 1.43 0.12 -1.00 0.00 0.00 -1.39 -2.36 119.26 116.06 3b8i h ALA 38 Ca 0.39 -0.25 0.21 0.00 0.00 0.00 0.00 54.91 55.26 3b8i h ALA 38 Cb 0.25 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.91 3b8i h ALA 38 CO -0.20 -0.11 0.62 0.22 0.00 0.00 0.00 179.25 179.78 3b8i h ASP 39 N -0.20 0.68 0.15 0.00 3.58 -0.92 -0.87 116.42 118.84 3b8i h ASP 39 Ca 0.02 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.56 3b8i h ASP 39 Cb 0.51 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.53 3b8i h ASP 39 CO 0.01 0.22 -0.03 0.18 -2.88 0.00 0.00 179.24 176.74 3b8i n LEU 40 N -4.72 0.44 0.00 2.28 4.77 -0.56 -4.95 117.00 114.25 3b8i n LEU 40 Ca 0.23 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3b8i n LEU 40 Cb 0.65 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 3b8i n LEU 40 CO 0.23 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3b8i n GLY 41 N 1.14 0.76 3.73 -0.72 0.00 -0.33 -5.04 105.19 104.73 3b8i n GLY 41 Ca 0.19 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3b8i n GLY 41 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3b8i n PHE 42 N -2.48 2.71 -0.09 1.61 3.72 -0.91 -4.90 117.46 117.13 3b8i n PHE 42 Ca 0.00 0.31 -0.07 0.00 -0.05 0.00 0.00 57.45 57.64 3b8i n PHE 42 Cb 0.00 -2.56 0.11 0.00 -0.94 0.00 0.00 39.48 36.08 3b8i n PHE 42 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3b8i h GLU 43 N 4.50 0.76 -3.27 -1.08 3.07 -1.90 -3.44 114.58 113.22 3b8i h GLU 43 Ca -0.47 -0.29 -0.07 0.00 -0.50 0.00 0.00 59.36 58.04 3b8i h GLU 43 Cb 1.24 -0.05 -0.15 0.00 -0.84 0.00 0.00 28.75 28.95 3b8i h GLU 43 CO 0.77 0.89 -0.13 0.00 -1.40 0.00 0.00 179.01 179.15 3b8i s GLY 45 N -2.42 1.73 -0.09 0.00 0.00 -0.61 -2.17 107.32 103.76 3b8i s GLY 45 Ca -0.01 -1.85 -0.01 0.00 0.00 0.00 0.00 44.72 42.85 3b8i s GLY 45 CO -0.07 -1.77 -0.04 -1.50 0.00 0.00 0.00 173.10 169.72 3b8i s ILE 46 N -3.18 0.71 -0.49 0.90 1.10 -0.09 -0.37 121.20 119.78 3b8i s ILE 46 Ca 0.29 -0.11 -0.24 0.00 -0.51 0.00 0.00 60.65 60.09 3b8i s ILE 46 Cb 0.05 -0.79 0.03 0.00 0.15 0.00 0.00 42.46 41.90 3b8i s ILE 46 CO 0.11 0.31 0.85 -0.22 -2.11 0.00 0.00 174.94 173.88 3b8i s LEU 47 N 1.72 4.20 0.20 8.50 2.96 0.35 -0.99 118.68 135.62 3b8i s LEU 47 Ca 0.03 -0.19 -0.24 0.00 -0.22 0.00 0.00 54.13 53.51 3b8i s LEU 47 Cb -0.13 -2.94 -0.08 0.00 0.50 0.00 0.00 46.19 43.55 3b8i s LEU 47 CO -0.06 -1.04 0.78 -0.83 -1.32 0.00 0.00 176.35 173.88 3b8i s GLY 48 N 2.42 2.81 0.32 7.98 0.00 -1.26 -1.00 107.32 118.60 3b8i s GLY 48 Ca 0.31 0.32 0.00 0.00 0.00 0.00 0.00 44.72 45.35 3b8i s GLY 48 CO 0.22 0.77 1.96 -1.33 0.00 0.00 0.00 173.10 174.71 3b8i h GLY 49 N 3.89 0.95 1.15 0.20 0.00 -1.98 -1.76 103.07 105.52 3b8i h GLY 49 Ca -0.47 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 46.41 3b8i h GLY 49 CO 0.66 0.38 0.24 1.48 0.00 0.00 0.00 176.54 179.30 3b8i h SER 50 N 0.90 1.00 -0.29 0.19 4.64 -1.93 -2.32 113.55 115.74 3b8i h SER 50 Ca 0.24 -0.17 -0.18 0.00 -0.47 0.00 0.00 61.79 61.21 3b8i h SER 50 Cb -0.02 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 61.81 3b8i h SER 50 CO -0.04 0.91 -0.51 0.58 -0.87 0.00 0.00 176.83 176.91 3b8i h VAL 51 N 1.04 1.28 -0.68 0.95 2.07 -1.86 -2.17 116.25 116.89 3b8i h VAL 51 Ca 0.23 -1.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.05 3b8i h VAL 51 Cb 0.26 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 3b8i h VAL 51 CO -0.01 0.55 0.37 0.00 0.02 0.00 0.00 177.57 178.50 3b8i h ALA 52 N 0.68 1.38 -0.60 1.67 0.00 -1.31 -0.89 119.26 120.19 3b8i h ALA 52 Ca 0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3b8i h ALA 52 Cb 1.11 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 3b8i h ALA 52 CO 0.11 0.51 0.22 1.03 0.00 0.00 0.00 179.25 181.12 3b8i h SER 53 N 0.95 0.84 -0.36 0.00 0.87 -1.15 0.57 113.55 115.28 3b8i h SER 53 Ca 0.24 -0.19 -0.00 0.00 -1.23 0.00 0.00 61.79 60.61 3b8i h SER 53 Cb 0.02 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.74 3b8i h SER 53 CO -0.04 0.80 0.22 -0.07 -0.53 0.00 0.00 176.83 177.21 3b8i h LEU 54 N 0.84 0.43 -0.23 2.23 3.38 -0.99 -0.66 115.31 120.30 3b8i h LEU 54 Ca 0.20 -0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.96 3b8i h LEU 54 Cb 0.24 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3b8i h LEU 54 CO -0.01 0.34 -0.51 1.56 0.09 0.00 0.00 178.44 179.91 3b8i h GLN 55 N 0.47 0.75 0.17 1.13 4.20 -0.94 0.53 115.11 121.42 3b8i h GLN 55 Ca 0.13 -0.50 -0.27 0.00 0.06 0.00 0.00 58.65 58.06 3b8i h GLN 55 Cb -0.01 0.07 0.02 0.00 0.30 0.00 0.00 27.48 27.85 3b8i h GLN 55 CO -0.03 1.13 -1.30 0.28 -0.67 0.00 0.00 178.83 178.24 3b8i h VAL 56 N 0.48 1.22 0.00 -0.54 2.07 -0.94 -3.42 116.25 115.12 3b8i h VAL 56 Ca 0.00 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 64.99 3b8i h VAL 56 Cb 1.12 2.95 0.00 0.00 -1.52 0.00 0.00 31.29 33.84 3b8i h VAL 56 CO 0.11 0.76 -0.72 0.18 0.02 0.00 0.00 177.57 177.92 3b8i n LEU 57 N -3.89 0.01 -3.83 2.57 4.77 -0.31 -5.01 117.00 111.31 3b8i n LEU 57 Ca -0.20 -0.16 -0.24 0.00 -0.03 0.00 0.00 56.01 55.38 3b8i n LEU 57 Cb 0.95 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 42.05 3b8i n LEU 57 CO 0.49 0.00 -0.09 0.00 -1.33 0.00 0.00 177.39 176.47 3b8i n ALA 58 N -1.37 -1.88 -2.44 -1.18 0.00 0.18 -4.98 120.51 108.85 3b8i n ALA 58 Ca -0.00 -0.14 -0.22 0.00 0.00 0.00 0.00 53.44 53.08 3b8i n ALA 58 Cb 0.02 -2.23 -0.11 0.00 0.00 0.00 0.00 19.45 17.13 3b8i n ALA 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3b8i s ALA 59 N -3.69 2.16 1.11 0.00 0.00 -1.02 -4.07 121.76 116.26 3b8i s ALA 59 Ca 0.13 -1.58 -0.16 0.00 0.00 0.00 0.00 51.96 50.35 3b8i s ALA 59 Cb -0.07 -0.20 0.24 0.00 0.00 0.00 0.00 23.12 23.10 3b8i s ALA 59 CO 0.84 0.24 1.10 -2.14 0.00 0.00 0.00 175.76 175.81 3b8i s PRO 60 N -2.97 -0.51 -1.56 0.00 0.02 -1.26 -3.59 135.00 125.13 3b8i s PRO 60 Ca 0.19 0.20 -0.09 0.00 0.02 0.00 0.00 61.00 61.31 3b8i s PRO 60 Cb -0.05 -1.66 -0.04 0.00 0.02 0.00 0.00 34.50 32.77 3b8i s PRO 60 CO 0.08 -3.29 2.79 -3.47 -0.33 0.00 0.00 177.00 172.77 3b8i n ASP 61 N -4.51 8.21 -0.80 2.53 2.03 -1.26 -4.53 116.55 118.21 3b8i n ASP 61 Ca 0.09 -2.70 0.07 0.00 0.52 0.00 0.00 54.79 52.77 3b8i n ASP 61 Cb 0.58 -1.53 0.22 0.00 -0.72 0.00 0.00 41.12 39.67 3b8i n ASP 61 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3b8i n PHE 62 N 3.46 0.75 -3.29 -0.67 3.72 -1.26 -4.96 117.46 115.21 3b8i n PHE 62 Ca 0.73 -0.70 -0.17 0.00 -0.05 0.00 0.00 57.45 57.26 3b8i n PHE 62 Cb 0.25 -0.19 0.07 0.00 -0.94 0.00 0.00 39.48 38.67 3b8i n PHE 62 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3b8i n ALA 63 N -0.02 -1.41 -0.06 4.37 0.00 -1.26 -4.72 120.51 117.41 3b8i n ALA 63 Ca 0.17 0.12 -0.14 0.00 0.00 0.00 0.00 53.44 53.60 3b8i n ALA 63 Cb 0.69 -3.25 -0.14 0.00 0.00 0.00 0.00 19.45 16.75 3b8i n ALA 63 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3b8i n LEU 64 N -3.88 1.43 -4.76 0.00 4.77 -1.26 -4.91 117.00 108.40 3b8i n LEU 64 Ca -0.13 0.16 -0.39 0.00 -0.03 0.00 0.00 56.01 55.62 3b8i n LEU 64 Cb 0.60 -0.24 0.03 0.00 -2.33 0.00 0.00 43.42 41.49 3b8i n LEU 64 CO 0.52 0.62 1.03 -0.51 -1.33 0.00 0.00 177.39 177.72 3b8i s ILE 65 N -2.55 2.04 0.39 -0.08 2.07 -1.26 -5.02 121.20 116.79 3b8i s ILE 65 Ca -0.16 0.04 -0.05 0.00 -1.41 0.00 0.00 60.65 59.07 3b8i s ILE 65 Cb 0.07 -3.02 -0.04 0.00 0.13 0.00 0.00 42.46 39.60 3b8i s ILE 65 CO 0.77 0.00 0.67 0.42 -1.91 0.00 0.00 174.94 174.90 3b8i s THR 66 N -1.25 4.96 0.27 4.00 -4.23 -1.26 -4.94 115.64 113.18 3b8i s THR 66 Ca 0.67 0.09 -0.02 0.00 -1.18 0.00 0.00 61.69 61.26 3b8i s THR 66 Cb -0.42 -3.81 0.29 0.00 1.34 0.00 0.00 72.50 69.90 3b8i s THR 66 CO 0.52 -0.59 1.65 0.25 -0.54 0.00 0.00 174.62 175.91 3b8i h LEU 67 N 0.91 -0.09 -0.93 4.79 5.85 -1.95 -1.76 115.31 122.12 3b8i h LEU 67 Ca -0.48 0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.50 3b8i h LEU 67 Cb 1.20 0.27 -0.07 0.00 0.37 0.00 0.00 40.66 42.43 3b8i h LEU 67 CO 0.63 -0.13 0.59 0.28 -0.34 0.00 0.00 178.44 179.46 3b8i h SER 68 N 0.20 0.92 -0.17 1.25 0.02 -1.98 0.11 113.55 113.89 3b8i h SER 68 Ca 0.49 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.41 3b8i h SER 68 Cb 0.92 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.29 3b8i h SER 68 CO -0.63 0.57 -0.08 -0.33 -1.14 0.00 0.00 176.83 175.22 3b8i h GLU 69 N 1.04 0.34 -0.47 3.45 5.08 -1.73 -1.36 114.58 120.93 3b8i h GLU 69 Ca 0.42 -0.15 0.07 0.00 -1.00 0.00 0.00 59.36 58.70 3b8i h GLU 69 Cb 0.23 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.41 3b8i h GLU 69 CO -0.19 0.65 0.12 0.35 -1.00 0.00 0.00 179.01 178.94 3b8i h PHE 70 N 0.02 0.20 -0.44 4.33 3.57 -1.16 -2.20 116.94 121.27 3b8i h PHE 70 Ca 0.04 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 3b8i h PHE 70 Cb 0.55 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 3b8i h PHE 70 CO 0.06 0.04 0.10 0.28 -2.23 0.00 0.00 178.31 176.55 3b8i h VAL 71 N 0.27 1.20 -0.52 1.41 2.07 -0.79 -0.75 116.25 119.14 3b8i h VAL 71 Ca 0.23 -0.73 -0.05 0.00 0.82 0.00 0.00 66.70 66.97 3b8i h VAL 71 Cb 0.28 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 3b8i h VAL 71 CO -0.28 0.26 0.10 -0.08 0.02 0.00 0.00 177.57 177.60 3b8i h GLU 72 N 0.65 0.81 -0.50 1.57 4.57 -0.95 0.25 114.58 120.98 3b8i h GLU 72 Ca 0.15 -0.17 -0.12 0.00 -1.18 0.00 0.00 59.36 58.03 3b8i h GLU 72 Cb 0.26 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 3b8i h GLU 72 CO -0.00 0.75 -0.16 1.96 -1.18 0.00 0.00 179.01 180.38 3b8i h GLN 73 N 0.78 0.99 -0.52 1.92 1.08 -0.96 -2.23 115.11 116.17 3b8i h GLN 73 Ca 0.17 -0.40 -0.03 0.00 -1.45 0.00 0.00 58.65 56.95 3b8i h GLN 73 Cb 0.32 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 3b8i h GLN 73 CO 0.00 1.07 0.22 0.00 -0.95 0.00 0.00 178.83 179.18 3b8i h ALA 74 N 0.89 0.68 -0.27 3.87 0.00 -0.83 -2.94 119.26 120.66 3b8i h ALA 74 Ca 0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3b8i h ALA 74 Cb 0.73 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3b8i h ALA 74 CO 0.06 0.28 0.14 1.15 0.00 0.00 0.00 179.25 180.87 3b8i h THR 75 N 0.71 1.14 -0.55 0.00 2.02 -0.38 -0.77 112.91 115.06 3b8i h THR 75 Ca 0.18 -0.38 0.10 0.00 0.77 0.00 0.00 66.41 67.08 3b8i h THR 75 Cb 0.18 0.89 -0.08 0.00 -1.74 0.00 0.00 68.15 67.40 3b8i h THR 75 CO -0.02 0.14 0.12 0.03 0.37 0.00 0.00 175.52 176.16 3b8i h ARG 76 N 0.32 0.25 -0.53 6.66 3.08 -1.40 -1.75 114.38 121.00 3b8i h ARG 76 Ca 0.09 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 3b8i h ARG 76 Cb 0.09 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 3b8i h ARG 76 CO -0.01 0.16 0.18 0.82 -1.07 0.00 0.00 179.97 180.05 3b8i h ILE 77 N 0.25 1.23 0.00 2.04 2.04 -1.33 -3.13 117.51 118.62 3b8i h ILE 77 Ca 0.28 -0.76 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 3b8i h ILE 77 Cb 0.40 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 3b8i h ILE 77 CO -0.37 0.28 -0.04 1.23 0.00 0.00 0.00 178.15 179.25 3b8i h GLY 78 N 0.72 0.00 2.00 5.37 0.00 -0.27 -1.63 103.07 109.26 3b8i h GLY 78 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.47 3b8i h GLY 78 CO -0.01 0.00 -0.17 3.21 0.00 0.00 0.00 176.54 179.58 3b8i h ARG 79 N 0.00 0.00 0.00 4.80 3.08 -1.36 -3.35 114.38 117.55 3b8i h ARG 79 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3b8i h ARG 79 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3b8i h ARG 79 CO 0.01 0.17 -0.81 1.33 -1.07 0.00 0.00 179.97 179.60 3b8i n VAL 80 N -3.68 0.00 -1.99 2.04 0.24 -0.75 -5.08 118.33 109.12 3b8i n VAL 80 Ca -0.02 -0.15 -0.42 0.00 -2.04 0.00 0.00 64.34 61.72 3b8i n VAL 80 Cb 0.29 0.61 -0.03 0.00 -1.47 0.00 0.00 33.84 33.24 3b8i n VAL 80 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3b8i s ALA 81 N -1.85 3.68 -0.30 2.33 0.00 -0.69 -4.88 121.76 120.05 3b8i s ALA 81 Ca -0.00 1.34 0.03 0.00 0.00 0.00 0.00 51.96 53.33 3b8i s ALA 81 Cb 0.01 -3.58 0.08 0.00 0.00 0.00 0.00 23.12 19.63 3b8i s ALA 81 CO 0.06 -0.76 1.01 0.54 0.00 0.00 0.00 175.76 176.62 3b8i n ARG 82 N 3.00 2.50 -4.21 0.00 1.74 -1.26 -4.89 116.66 113.52 3b8i n ARG 82 Ca 0.10 -1.54 -0.19 0.00 -0.77 0.00 0.00 57.85 55.45 3b8i n ARG 82 Cb 0.40 -1.08 -0.12 0.00 -1.02 0.00 0.00 32.46 30.64 3b8i n ARG 82 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 3b8i s LEU 83 N -0.90 2.25 0.23 0.55 2.34 -1.26 -4.98 118.68 116.91 3b8i s LEU 83 Ca 0.07 -0.58 -0.30 0.00 0.06 0.00 0.00 54.13 53.37 3b8i s LEU 83 Cb 0.04 -0.54 -0.10 0.00 -0.56 0.00 0.00 46.19 45.02 3b8i s LEU 83 CO 0.05 -0.05 1.48 -2.16 -1.06 0.00 0.00 176.35 174.61 3b8i s PRO 84 N -1.60 4.25 -0.10 1.48 0.04 -1.26 -4.85 135.00 132.97 3b8i s PRO 84 Ca -0.01 2.32 0.01 0.00 0.04 0.00 0.00 61.00 63.36 3b8i s PRO 84 Cb -0.09 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.31 3b8i s PRO 84 CO 0.02 -0.48 -0.13 0.08 0.04 0.00 0.00 177.00 176.54 3b8i s VAL 85 N 0.30 3.14 -0.11 -0.36 1.01 -1.26 -1.57 120.40 121.55 3b8i s VAL 85 Ca 0.62 -0.66 -0.14 0.00 0.00 0.00 0.00 61.98 61.81 3b8i s VAL 85 Cb -0.42 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.62 3b8i s VAL 85 CO 0.40 0.55 0.32 -0.63 0.00 0.00 0.00 175.10 175.75 3b8i s ILE 86 N -0.13 5.25 -0.27 2.22 1.01 0.50 -0.75 121.20 129.03 3b8i s ILE 86 Ca -0.01 0.62 -0.11 0.00 0.00 0.00 0.00 60.65 61.15 3b8i s ILE 86 Cb -0.14 -3.64 -0.05 0.00 0.01 0.00 0.00 42.46 38.65 3b8i s ILE 86 CO 0.03 0.46 0.17 0.00 0.00 0.00 0.00 174.94 175.60 3b8i s ALA 87 N -0.09 3.50 -0.68 9.38 0.00 -0.26 -0.49 121.76 133.12 3b8i s ALA 87 Ca 0.19 -1.06 -0.26 0.00 0.00 0.00 0.00 51.96 50.82 3b8i s ALA 87 Cb -0.14 -2.41 -0.01 0.00 0.00 0.00 0.00 23.12 20.55 3b8i s ALA 87 CO 0.07 -0.49 1.77 0.34 0.00 0.00 0.00 175.76 177.45 3b8i s ASP 88 N 1.63 5.42 -0.08 0.00 2.15 -0.17 -1.00 116.67 124.63 3b8i s ASP 88 Ca 0.07 0.04 0.08 0.00 0.43 0.00 0.00 52.55 53.17 3b8i s ASP 88 Cb -0.16 -2.54 0.37 0.00 -0.30 0.00 0.00 42.92 40.30 3b8i s ASP 88 CO 0.09 -2.32 1.17 0.00 -0.17 0.00 0.00 175.17 173.94 3b8i n ALA 89 N 12.30 2.93 -0.61 3.66 0.00 -0.89 -3.92 120.51 133.97 3b8i n ALA 89 Ca 0.21 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.81 3b8i n ALA 89 Cb 0.51 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.93 3b8i n ALA 89 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3b8i n ASP 90 N 0.39 0.00 -0.61 0.00 8.00 -1.25 -1.26 116.55 121.81 3b8i n ASP 90 Ca 0.13 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.72 3b8i n ASP 90 Cb 0.58 0.00 0.31 0.00 -0.02 0.00 0.00 41.12 41.99 3b8i n ASP 90 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3b8i n HIS 91 N 14.00 0.30 -0.85 1.24 1.44 -1.26 -0.64 115.22 129.45 3b8i n HIS 91 Ca 0.00 -0.15 0.00 0.00 -2.01 0.00 0.00 57.72 55.56 3b8i n HIS 91 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 3b8i n HIS 91 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3b8i n GLY 92 N 1.14 0.51 2.26 -1.39 0.00 -0.39 -4.30 105.19 103.02 3b8i n GLY 92 Ca 0.15 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.49 3b8i n GLY 92 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3b8i n TYR 93 N -2.85 -0.66 0.00 1.61 4.01 -1.26 -2.93 117.16 115.08 3b8i n TYR 93 Ca 0.00 0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 3b8i n TYR 93 Cb 0.00 -2.70 0.00 0.00 -0.31 0.00 0.00 39.34 36.33 3b8i n TYR 93 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3b8i n GLY 94 N -1.05 0.17 0.62 2.72 0.00 -1.26 -4.86 105.19 101.53 3b8i n GLY 94 Ca -0.12 -1.07 -0.04 0.00 0.00 0.00 0.00 46.02 44.79 3b8i n GLY 94 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3b8i n ASN 95 N 0.00 0.17 -0.16 1.61 0.23 -1.26 -4.69 115.26 111.16 3b8i n ASN 95 Ca 0.00 -1.16 0.24 0.00 -0.53 0.00 0.00 54.58 53.13 3b8i n ASN 95 Cb 0.00 -0.12 0.66 0.00 -2.08 0.00 0.00 39.78 38.24 3b8i n ASN 95 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3b8i h ALA 96 N -0.81 2.61 -0.11 -2.53 0.00 -1.92 -0.09 119.26 116.40 3b8i h ALA 96 Ca -0.06 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.65 3b8i h ALA 96 Cb 0.19 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3b8i h ALA 96 CO 0.06 -0.85 -0.70 -0.07 0.00 0.00 0.00 179.25 177.69 3b8i h LEU 97 N 0.11 0.57 -0.65 0.00 4.07 -1.96 -2.88 115.31 114.57 3b8i h LEU 97 Ca 0.40 -0.36 -0.15 0.00 0.08 0.00 0.00 57.88 57.85 3b8i h LEU 97 Cb 1.42 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 42.97 3b8i h LEU 97 CO -0.05 1.10 -0.65 0.78 -1.08 0.00 0.00 178.44 178.54 3b8i h ASN 98 N 0.34 0.15 -0.89 -0.43 4.21 -1.45 -3.00 115.58 114.51 3b8i h ASN 98 Ca -0.03 -0.09 0.06 0.00 1.21 0.00 0.00 56.30 57.46 3b8i h ASN 98 Cb 1.27 -0.04 -0.06 0.00 -1.12 0.00 0.00 38.32 38.37 3b8i h ASN 98 CO 0.13 0.75 0.58 0.58 -1.29 0.00 0.00 177.43 178.17 3b8i h VAL 99 N 0.09 1.06 -0.33 2.81 2.07 -0.95 0.04 116.25 121.03 3b8i h VAL 99 Ca -0.01 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 3b8i h VAL 99 Cb 1.16 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 3b8i h VAL 99 CO 0.09 0.18 0.12 0.24 0.02 0.00 0.00 177.57 178.22 3b8i h MET 100 N 1.00 0.51 -0.38 1.57 2.86 -1.37 -0.14 114.93 118.99 3b8i h MET 100 Ca 0.38 -0.10 0.03 0.00 -2.06 0.00 0.00 59.70 57.95 3b8i h MET 100 Cb 0.20 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.75 3b8i h MET 100 CO -0.14 0.53 0.18 0.00 1.06 0.00 0.00 176.91 178.54 3b8i h ARG 101 N 0.39 0.36 -0.82 1.72 3.08 -1.38 -1.36 114.38 116.38 3b8i h ARG 101 Ca 0.11 -0.02 0.14 0.00 0.07 0.00 0.00 59.98 60.28 3b8i h ARG 101 Cb 0.22 -0.08 -0.09 0.00 0.08 0.00 0.00 29.97 30.09 3b8i h ARG 101 CO -0.01 0.24 0.40 1.15 -1.07 0.00 0.00 179.97 180.68 3b8i h THR 102 N 0.37 0.72 -0.21 2.04 2.02 -0.18 0.22 112.91 117.90 3b8i h THR 102 Ca 0.16 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 3b8i h THR 102 Cb 0.08 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.57 3b8i h THR 102 CO -0.12 0.10 -0.04 0.58 0.37 0.00 0.00 175.52 176.42 3b8i h VAL 103 N 0.57 1.28 -0.34 3.16 2.07 -0.89 -2.04 116.25 120.07 3b8i h VAL 103 Ca 0.44 -1.00 0.02 0.00 0.82 0.00 0.00 66.70 66.98 3b8i h VAL 103 Cb 0.63 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 3b8i h VAL 103 CO -0.37 0.31 0.19 0.58 0.02 0.00 0.00 177.57 178.29 3b8i h VAL 104 N 0.12 1.01 -0.07 2.57 2.07 -0.31 -0.77 116.25 120.88 3b8i h VAL 104 Ca 0.05 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 3b8i h VAL 104 Cb 0.48 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3b8i h VAL 104 CO 0.02 0.07 0.04 -0.33 0.02 0.00 0.00 177.57 177.39 3b8i h GLU 105 N 0.38 0.10 -0.27 1.57 4.39 -1.00 -2.18 114.58 117.57 3b8i h GLU 105 Ca 0.14 -0.01 -0.18 0.00 0.34 0.00 0.00 59.36 59.65 3b8i h GLU 105 Cb 0.03 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 3b8i h GLU 105 CO -0.08 0.15 -0.52 -0.07 -1.16 0.00 0.00 179.01 177.33 3b8i h LEU 106 N 0.02 0.93 -0.11 1.33 3.38 -1.26 0.22 115.31 119.82 3b8i h LEU 106 Ca 0.03 -0.54 0.04 0.00 0.09 0.00 0.00 57.88 57.50 3b8i h LEU 106 Cb 0.08 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 3b8i h LEU 106 CO -0.00 1.29 -0.13 -0.08 0.09 0.00 0.00 178.44 179.61 3b8i h GLU 107 N 0.61 -0.16 -0.90 1.13 4.81 -1.18 -2.36 114.58 116.52 3b8i h GLU 107 Ca 0.01 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3b8i h GLU 107 Cb 1.13 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.50 3b8i h GLU 107 CO 0.12 -0.11 0.57 -0.09 -0.73 0.00 0.00 179.01 178.77 3b8i h ARG 108 N -0.17 1.20 -0.80 1.92 2.43 -1.21 -1.69 114.38 116.07 3b8i h ARG 108 Ca 0.09 -0.09 0.18 0.00 -0.81 0.00 0.00 59.98 59.35 3b8i h ARG 108 Cb 0.29 -0.26 -0.05 0.00 -0.42 0.00 0.00 29.97 29.53 3b8i h ARG 108 CO -0.21 0.82 0.54 0.00 -1.51 0.00 0.00 179.97 179.61 3b8i h ALA 109 N 1.31 2.28 0.00 2.80 0.00 -0.77 -3.46 119.26 121.42 3b8i h ALA 109 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3b8i h ALA 109 Cb -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3b8i h ALA 109 CO -0.07 -0.51 0.00 0.41 0.00 0.00 0.00 179.25 179.08 3b8i n GLY 110 N -1.56 1.46 3.76 0.00 0.00 -0.63 -4.37 105.19 103.84 3b8i n GLY 110 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3b8i n GLY 110 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3b8i s ILE 111 N -2.00 2.52 -0.09 -0.61 1.10 -1.05 -4.78 121.20 116.28 3b8i s ILE 111 Ca 0.00 0.38 0.15 0.00 -0.51 0.00 0.00 60.65 60.67 3b8i s ILE 111 Cb 0.00 -3.19 -0.15 0.00 0.15 0.00 0.00 42.46 39.28 3b8i s ILE 111 CO 0.00 -0.02 0.87 0.00 -2.11 0.00 0.00 174.94 173.69 3b8i h ALA 112 N 1.57 0.67 -2.60 1.50 0.00 -1.29 -3.45 119.26 115.66 3b8i h ALA 112 Ca -0.50 -0.97 -0.05 0.00 0.00 0.00 0.00 54.91 53.38 3b8i h ALA 112 Cb 1.28 0.27 -0.15 0.00 0.00 0.00 0.00 17.79 19.19 3b8i h ALA 112 CO 0.58 1.08 0.06 0.00 0.00 0.00 0.00 179.25 180.97 3b8i s ALA 113 N -2.83 -1.33 0.05 0.00 0.00 -1.20 -2.32 121.76 114.13 3b8i s ALA 113 Ca -0.02 0.52 0.01 0.00 0.00 0.00 0.00 51.96 52.46 3b8i s ALA 113 Cb 0.08 0.50 -0.03 0.00 0.00 0.00 0.00 23.12 23.67 3b8i s ALA 113 CO 0.81 -0.56 -0.06 -0.48 0.00 0.00 0.00 175.76 175.47 3b8i s LEU 114 N -2.19 2.36 -0.07 0.00 0.05 -0.32 -1.10 118.68 117.40 3b8i s LEU 114 Ca -0.03 -0.73 0.01 0.00 0.05 0.00 0.00 54.13 53.43 3b8i s LEU 114 Cb -0.00 -0.03 -0.03 0.00 -2.05 0.00 0.00 46.19 44.08 3b8i s LEU 114 CO -0.05 -0.35 -0.07 0.42 -0.55 0.00 0.00 176.35 175.75 3b8i s THR 115 N -2.37 3.67 -0.17 5.48 -4.23 -0.17 -1.04 115.64 116.81 3b8i s THR 115 Ca -0.03 -0.49 0.01 0.00 -1.18 0.00 0.00 61.69 60.00 3b8i s THR 115 Cb -0.03 -2.50 0.03 0.00 1.34 0.00 0.00 72.50 71.34 3b8i s THR 115 CO -0.03 0.60 -0.14 -0.63 -0.54 0.00 0.00 174.62 173.88 3b8i s ILE 116 N -0.81 1.71 0.26 2.99 -1.09 -0.48 -2.10 121.20 121.67 3b8i s ILE 116 Ca 0.12 -0.83 0.03 0.00 -2.23 0.00 0.00 60.65 57.75 3b8i s ILE 116 Cb -0.11 -1.64 -0.03 0.00 -1.58 0.00 0.00 42.46 39.09 3b8i s ILE 116 CO 0.01 0.38 0.40 -1.83 -1.23 0.00 0.00 174.94 172.67 3b8i s GLU 117 N 1.41 3.46 -0.13 2.79 -1.05 0.19 -0.71 118.70 124.66 3b8i s GLU 117 Ca 0.03 -0.61 0.16 0.00 -0.15 0.00 0.00 54.97 54.40 3b8i s GLU 117 Cb -0.14 -2.84 0.68 0.00 -0.44 0.00 0.00 34.13 31.40 3b8i s GLU 117 CO -0.10 0.37 1.57 -0.40 0.95 0.00 0.00 175.26 177.65 3b8i n ASP 118 N -1.37 4.61 -4.75 0.83 5.68 -1.00 -4.35 116.55 116.20 3b8i n ASP 118 Ca -0.07 -2.51 -0.41 0.00 -0.50 0.00 0.00 54.79 51.29 3b8i n ASP 118 Cb 0.56 -0.58 -0.02 0.00 -1.14 0.00 0.00 41.12 39.94 3b8i n ASP 118 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3b8i s THR 119 N -2.01 2.23 -0.55 2.12 2.01 -1.26 -0.33 115.64 117.85 3b8i s THR 119 Ca 0.47 0.20 -0.28 0.00 0.31 0.00 0.00 61.69 62.39 3b8i s THR 119 Cb 0.32 -3.13 0.03 0.00 0.01 0.00 0.00 72.50 69.73 3b8i s THR 119 CO 0.21 0.03 1.23 -0.22 -0.69 0.00 0.00 174.62 175.18 3b8i s LEU 120 N -0.75 3.48 0.06 4.42 0.20 0.40 -4.67 118.68 121.81 3b8i s LEU 120 Ca 0.60 0.25 0.05 0.00 0.69 0.00 0.00 54.13 55.72 3b8i s LEU 120 Cb -0.46 -3.25 -0.03 0.00 -0.43 0.00 0.00 46.19 42.03 3b8i s LEU 120 CO 0.49 -1.47 -0.14 -0.76 -0.29 0.00 0.00 176.35 174.18 3b8i s LEU 121 N 5.05 2.23 1.06 -0.68 1.43 -1.26 -4.44 118.68 122.07 3b8i s LEU 121 Ca 0.46 -0.55 -0.17 0.00 -1.03 0.00 0.00 54.13 52.84 3b8i s LEU 121 Cb -0.08 -0.57 0.24 0.00 0.03 0.00 0.00 46.19 45.81 3b8i s LEU 121 CO 0.27 -0.02 1.24 -2.16 0.23 0.00 0.00 176.35 175.91 3b8i s PRO 122 N -1.48 -0.14 0.29 1.29 0.04 -1.26 -4.87 135.00 128.87 3b8i s PRO 122 Ca -0.00 -0.28 -0.27 0.00 0.04 0.00 0.00 61.00 60.48 3b8i s PRO 122 Cb -0.09 -1.74 -0.14 0.00 0.04 0.00 0.00 34.50 32.57 3b8i s PRO 122 CO 0.02 -2.96 0.89 0.00 0.04 0.00 0.00 177.00 174.99 3b8i n ALA 123 N -4.18 -0.73 -2.76 8.56 0.00 -1.26 -4.96 120.51 115.19 3b8i n ALA 123 Ca 0.15 0.37 -0.33 0.00 0.00 0.00 0.00 53.44 53.62 3b8i n ALA 123 Cb 0.59 -1.94 -0.05 0.00 0.00 0.00 0.00 19.45 18.06 3b8i n ALA 123 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3b8i s GLN 124 N -1.50 3.58 0.26 0.00 -0.21 -1.26 -5.04 119.66 115.49 3b8i s GLN 124 Ca 0.60 -0.12 -0.30 0.00 0.02 0.00 0.00 55.36 55.56 3b8i s GLN 124 Cb -0.72 -3.02 -0.14 0.00 1.00 0.00 0.00 33.01 30.14 3b8i s GLN 124 CO 0.59 0.60 1.28 0.34 -2.12 0.00 0.00 175.29 175.97 3b8i n PHE 125 N 0.76 1.90 -0.74 0.91 7.35 -1.26 -2.37 117.46 124.00 3b8i n PHE 125 Ca -0.08 0.54 0.00 0.00 -0.76 0.00 0.00 57.45 57.15 3b8i n PHE 125 Cb 0.52 -2.39 0.00 0.00 0.35 0.00 0.00 39.48 37.97 3b8i n PHE 125 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3b8i n GLY 126 N 1.68 0.37 3.25 7.13 0.00 -0.14 -4.95 105.19 112.53 3b8i n GLY 126 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 3b8i n GLY 126 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3b8i s ARG 127 N -0.69 2.55 0.43 1.61 0.52 -1.00 -4.96 118.95 117.42 3b8i s ARG 127 Ca 0.00 -1.27 0.24 0.00 -0.52 0.00 0.00 55.73 54.18 3b8i s ARG 127 Cb 0.00 -3.46 0.73 0.00 0.52 0.00 0.00 34.95 32.74 3b8i s ARG 127 CO 0.00 -0.72 1.74 1.57 0.02 0.00 0.00 175.30 177.92 3b8i h LYS 128 N 8.19 0.00 -7.25 3.54 5.09 -1.92 -3.41 116.57 120.81 3b8i h LYS 128 Ca -0.22 0.00 -0.49 0.00 0.09 0.00 0.00 60.65 60.03 3b8i h LYS 128 Cb 1.08 0.00 0.04 0.00 0.10 0.00 0.00 32.23 33.45 3b8i h LYS 128 CO 0.61 0.19 0.39 -1.54 -2.09 0.00 0.00 179.45 177.01 3b8i s SER 129 N -6.15 6.24 -0.16 7.07 1.04 -1.26 -5.07 113.70 115.41 3b8i s SER 129 Ca 0.03 1.58 -0.16 0.00 0.48 0.00 0.00 55.95 57.87 3b8i s SER 129 Cb 0.08 -2.50 -0.04 0.00 0.10 0.00 0.00 66.02 63.66 3b8i s SER 129 CO 0.65 -0.85 0.40 0.28 0.98 0.00 0.00 173.24 174.69 3b8i s THR 130 N -2.78 5.23 0.26 2.02 -1.32 -1.26 -4.85 115.64 112.94 3b8i s THR 130 Ca 0.59 0.76 0.11 0.00 -1.21 0.00 0.00 61.69 61.93 3b8i s THR 130 Cb -0.12 -3.73 -0.05 0.00 -1.51 0.00 0.00 72.50 67.09 3b8i s THR 130 CO 0.41 0.32 -0.18 -1.81 -2.21 0.00 0.00 174.62 171.14 3b8i s ASP 131 N 0.70 3.29 0.11 8.08 1.01 -1.26 -5.04 116.67 123.55 3b8i s ASP 131 Ca 0.21 -1.03 0.04 0.00 0.71 0.00 0.00 52.55 52.48 3b8i s ASP 131 Cb -0.14 -0.25 -0.04 0.00 1.01 0.00 0.00 42.92 43.50 3b8i s ASP 131 CO 0.07 -0.02 0.10 -0.76 0.21 0.00 0.00 175.17 174.78 3b8i s LEU 132 N -3.45 3.82 0.75 1.23 1.43 -1.26 -0.46 118.68 120.75 3b8i s LEU 132 Ca 0.28 -0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 53.23 3b8i s LEU 132 Cb -0.04 -2.48 0.05 0.00 0.03 0.00 0.00 46.19 43.75 3b8i s LEU 132 CO 0.13 0.14 1.09 0.27 0.23 0.00 0.00 176.35 178.20 3b8i s ILE 133 N -1.51 3.47 0.72 -0.59 -4.36 0.55 -4.69 121.20 114.79 3b8i s ILE 133 Ca 0.30 0.48 -0.15 0.00 -0.26 0.00 0.00 60.65 61.02 3b8i s ILE 133 Cb -0.11 -3.02 0.03 0.00 1.25 0.00 0.00 42.46 40.61 3b8i s ILE 133 CO 0.23 -0.62 1.20 0.00 0.24 0.00 0.00 174.94 175.99 3b8i h VAL 135 N -0.20 1.13 -0.61 0.00 3.04 -1.98 -1.70 116.25 115.92 3b8i h VAL 135 Ca -0.48 -0.35 0.08 0.00 -1.01 0.00 0.00 66.70 64.94 3b8i h VAL 135 Cb 1.29 0.00 -0.07 0.00 -2.01 0.00 0.00 31.29 30.51 3b8i h VAL 135 CO 0.50 0.19 0.26 -0.33 -1.01 0.00 0.00 177.57 177.18 3b8i h GLU 136 N 1.03 0.46 -0.43 4.17 3.07 -1.99 0.11 114.58 121.00 3b8i h GLU 136 Ca 0.33 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 59.13 3b8i h GLU 136 Cb 0.01 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 27.80 3b8i h GLU 136 CO -0.11 0.31 0.12 1.49 -1.40 0.00 0.00 179.01 179.41 3b8i h GLU 137 N 0.48 0.68 -0.74 2.33 4.81 -1.76 -1.94 114.58 118.44 3b8i h GLU 137 Ca 0.30 -0.15 0.09 0.00 -0.13 0.00 0.00 59.36 59.46 3b8i h GLU 137 Cb 0.32 -0.09 -0.07 0.00 0.63 0.00 0.00 28.75 29.53 3b8i h GLU 137 CO -0.26 0.68 0.39 0.78 -0.73 0.00 0.00 179.01 179.86 3b8i h GLY 138 N 0.56 1.12 0.84 1.92 0.00 -0.76 -1.13 103.07 105.61 3b8i h GLY 138 Ca 0.14 -0.25 0.04 0.00 0.00 0.00 0.00 47.33 47.26 3b8i h GLY 138 CO -0.00 0.09 0.47 -2.08 0.00 0.00 0.00 176.54 175.01 3b8i h VAL 139 N 0.66 1.08 -0.61 4.60 2.07 -0.66 -1.61 116.25 121.79 3b8i h VAL 139 Ca 0.36 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.49 3b8i h VAL 139 Cb 0.35 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 3b8i h VAL 139 CO -0.25 0.16 0.07 1.23 0.02 0.00 0.00 177.57 178.80 3b8i h GLY 140 N 0.90 1.08 0.97 2.17 0.00 -0.87 -0.94 103.07 106.37 3b8i h GLY 140 Ca 0.31 -0.71 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 3b8i h GLY 140 CO -0.12 0.66 0.23 0.50 0.00 0.00 0.00 176.54 177.81 3b8i h LYS 141 N 0.93 0.59 0.01 4.80 1.57 -0.96 0.35 116.57 123.86 3b8i h LYS 141 Ca 0.18 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3b8i h LYS 141 Cb 0.44 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3b8i h LYS 141 CO 0.01 0.47 -0.00 0.82 -0.57 0.00 0.00 179.45 180.18 3b8i h ILE 142 N 0.55 1.20 -0.82 1.86 1.08 -1.07 -0.47 117.51 119.83 3b8i h ILE 142 Ca 0.15 -0.61 0.09 0.00 -0.39 0.00 0.00 64.86 64.10 3b8i h ILE 142 Cb 0.05 1.61 -0.07 0.00 -3.07 0.00 0.00 36.82 35.34 3b8i h ILE 142 CO -0.02 0.16 0.47 0.03 -0.69 0.00 0.00 178.15 178.09 3b8i h ARG 143 N -0.27 0.76 -0.33 2.37 3.08 -1.19 -1.47 114.38 117.33 3b8i h ARG 143 Ca -0.00 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.05 3b8i h ARG 143 Cb 0.27 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 3b8i h ARG 143 CO 0.00 0.50 0.05 0.00 -1.07 0.00 0.00 179.97 179.46 3b8i h ALA 144 N 1.45 0.34 -0.86 0.04 0.00 -0.83 -1.84 119.26 117.56 3b8i h ALA 144 Ca 0.39 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.39 3b8i h ALA 144 Cb 0.36 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 3b8i h ALA 144 CO -0.24 -0.35 0.56 0.00 0.00 0.00 0.00 179.25 179.22 3b8i h ALA 145 N 1.25 1.10 -0.07 0.00 0.00 -0.73 -1.99 119.26 118.82 3b8i h ALA 145 Ca 0.15 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 3b8i h ALA 145 Cb 0.18 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3b8i h ALA 145 CO -0.21 0.46 -0.31 -0.07 0.00 0.00 0.00 179.25 179.12 3b8i h LEU 146 N 1.14 0.12 -0.24 0.00 3.38 -1.08 -2.64 115.31 116.00 3b8i h LEU 146 Ca 0.32 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 58.14 3b8i h LEU 146 Cb -0.09 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 3b8i h LEU 146 CO -0.08 0.43 -0.30 -0.08 0.09 0.00 0.00 178.44 178.51 3b8i h GLU 147 N 0.11 0.62 0.00 1.13 4.57 -0.97 -3.23 114.58 116.80 3b8i h GLU 147 Ca 0.02 -0.35 -0.00 0.00 -1.18 0.00 0.00 59.36 57.85 3b8i h GLU 147 Cb 0.61 0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.22 3b8i h GLU 147 CO 0.04 0.95 -0.01 0.00 -1.18 0.00 0.00 179.01 178.82 3b8i h ALA 148 N 0.65 1.00 -2.80 2.92 0.00 -1.19 -3.44 119.26 116.40 3b8i h ALA 148 Ca 0.03 -0.01 -0.54 0.00 0.00 0.00 0.00 54.91 54.39 3b8i h ALA 148 Cb 0.87 -0.00 0.10 0.00 0.00 0.00 0.00 17.79 18.75 3b8i h ALA 148 CO 0.07 0.01 0.80 -2.13 0.00 0.00 0.00 179.25 178.00 3b8i n ARG 149 N -3.10 2.62 -0.04 0.00 0.63 -1.01 -4.65 116.66 111.11 3b8i n ARG 149 Ca 0.01 0.93 -0.05 0.00 -0.92 0.00 0.00 57.85 57.82 3b8i n ARG 149 Cb 0.32 -2.67 -0.02 0.00 0.45 0.00 0.00 32.46 30.55 3b8i n ARG 149 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3b8i n VAL 150 N 1.35 0.95 -1.88 5.15 0.31 -1.26 -4.90 118.33 118.05 3b8i n VAL 150 Ca 0.06 0.27 -0.43 0.00 -0.01 0.00 0.00 64.34 64.22 3b8i n VAL 150 Cb 0.37 -1.95 -0.03 0.00 -0.91 0.00 0.00 33.84 31.32 3b8i n VAL 150 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3b8i s ASP 151 N -5.31 5.90 0.38 4.52 2.15 -1.26 -4.88 116.67 118.18 3b8i s ASP 151 Ca -0.16 1.64 0.28 0.00 0.43 0.00 0.00 52.55 54.74 3b8i s ASP 151 Cb 0.02 -2.52 1.12 0.00 -0.30 0.00 0.00 42.92 41.24 3b8i s ASP 151 CO 0.24 -1.64 1.83 1.55 -0.17 0.00 0.00 175.17 176.97 3b8i h PRO 152 N 12.92 0.00 0.00 4.34 0.13 -2.01 -1.35 132.00 146.03 3b8i h PRO 152 Ca -0.37 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.73 3b8i h PRO 152 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 3b8i h PRO 152 CO 1.00 0.00 -0.15 0.00 -0.23 0.00 0.00 178.00 178.62 3b8i h ALA 153 N 2.16 1.22 -2.57 -0.56 0.00 -1.96 -3.44 119.26 114.11 3b8i h ALA 153 Ca 0.00 -0.14 -0.56 0.00 0.00 0.00 0.00 54.91 54.21 3b8i h ALA 153 Cb 0.45 -0.02 0.09 0.00 0.00 0.00 0.00 17.79 18.31 3b8i h ALA 153 CO 0.00 0.19 0.72 -0.11 0.00 0.00 0.00 179.25 180.05 3b8i n LEU 154 N -3.58 3.77 -4.75 0.00 7.94 -0.51 -4.73 117.00 115.13 3b8i n LEU 154 Ca -0.01 1.16 -0.35 0.00 -1.11 0.00 0.00 56.01 55.69 3b8i n LEU 154 Cb 0.29 -1.51 -0.08 0.00 0.53 0.00 0.00 43.42 42.65 3b8i n LEU 154 CO 0.31 -0.19 -0.16 -0.89 -1.11 0.00 0.00 177.39 175.35 3b8i s THR 155 N -0.22 5.41 -0.26 1.96 2.01 -0.98 -5.01 115.64 118.55 3b8i s THR 155 Ca 0.64 0.24 -0.04 0.00 0.31 0.00 0.00 61.69 62.84 3b8i s THR 155 Cb -0.57 -3.48 0.01 0.00 0.01 0.00 0.00 72.50 68.48 3b8i s THR 155 CO 0.51 0.46 -0.01 -0.63 -0.69 0.00 0.00 174.62 174.27 3b8i s ILE 156 N 0.15 3.36 -0.17 1.82 -1.09 -1.26 -1.18 121.20 122.83 3b8i s ILE 156 Ca 0.10 -0.81 -0.03 0.00 -2.23 0.00 0.00 60.65 57.67 3b8i s ILE 156 Cb -0.11 -2.69 -0.02 0.00 -1.58 0.00 0.00 42.46 38.06 3b8i s ILE 156 CO -0.00 0.19 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.21 3b8i s ILE 157 N 1.41 3.59 -0.14 2.92 1.01 -0.20 -0.34 121.20 129.45 3b8i s ILE 157 Ca 0.02 -0.45 -0.22 0.00 0.00 0.00 0.00 60.65 60.00 3b8i s ILE 157 Cb -0.16 -2.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.69 3b8i s ILE 157 CO -0.02 0.47 0.65 0.00 0.00 0.00 0.00 174.94 176.04 3b8i s ALA 158 N 0.71 3.46 -0.08 9.38 0.00 -0.84 -1.39 121.76 133.01 3b8i s ALA 158 Ca -0.03 -0.09 0.01 0.00 0.00 0.00 0.00 51.96 51.85 3b8i s ALA 158 Cb -0.15 -2.94 -0.03 0.00 0.00 0.00 0.00 23.12 20.01 3b8i s ALA 158 CO 0.02 -0.32 -0.09 0.50 0.00 0.00 0.00 175.76 175.86 3b8i s ARG 159 N 1.35 2.82 0.26 0.00 3.52 0.12 -0.17 118.95 126.85 3b8i s ARG 159 Ca 0.32 -0.60 0.02 0.00 -0.13 0.00 0.00 55.73 55.34 3b8i s ARG 159 Cb -0.16 -2.56 -0.04 0.00 -1.56 0.00 0.00 34.95 30.63 3b8i s ARG 159 CO 0.13 0.57 0.16 -0.08 -0.81 0.00 0.00 175.30 175.28 3b8i s THR 160 N -0.57 0.16 -0.31 4.11 -1.32 -0.10 -2.39 115.64 115.23 3b8i s THR 160 Ca 0.08 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.57 3b8i s THR 160 Cb -0.12 -2.52 0.07 0.00 -1.51 0.00 0.00 72.50 68.42 3b8i s THR 160 CO 0.02 0.00 -0.00 0.21 -2.21 0.00 0.00 174.62 172.64 3b8i s ASN 161 N -3.29 4.79 0.00 8.08 3.84 -1.26 -2.29 114.94 124.81 3b8i s ASN 161 Ca 0.38 -1.51 0.30 0.00 0.21 0.00 0.00 52.86 52.24 3b8i s ASN 161 Cb 0.06 -1.67 1.44 0.00 -0.55 0.00 0.00 41.25 40.53 3b8i s ASN 161 CO 0.17 -0.29 1.99 0.00 -2.79 0.00 0.00 177.10 176.18 3b8i n ALA 162 N 4.52 2.65 0.10 1.71 0.00 0.31 -3.52 120.51 126.27 3b8i n ALA 162 Ca -0.10 -0.22 -0.21 0.00 0.00 0.00 0.00 53.44 52.92 3b8i n ALA 162 Cb 0.43 -1.41 -0.15 0.00 0.00 0.00 0.00 19.45 18.31 3b8i n ALA 162 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3b8i h GLU 163 N 0.33 0.38 0.00 0.00 4.81 -1.68 -3.38 114.58 115.04 3b8i h GLU 163 Ca 0.00 -0.65 0.00 0.00 -0.13 0.00 0.00 59.36 58.58 3b8i h GLU 163 Cb 0.28 0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.90 3b8i h GLU 163 CO 0.00 1.28 0.00 -0.07 -0.73 0.00 0.00 179.01 179.49 3b8i h LEU 164 N 0.10 0.00 -8.31 1.64 3.38 -1.93 -3.47 115.31 106.74 3b8i h LEU 164 Ca -0.26 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.49 3b8i h LEU 164 Cb 2.08 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 42.66 3b8i h LEU 164 CO 0.21 0.00 -0.71 0.27 0.09 0.00 0.00 178.44 178.30 3b8i s ILE 165 N -3.39 0.56 0.67 1.22 -4.36 -1.26 -5.11 121.20 109.53 3b8i s ILE 165 Ca 0.05 -1.60 -0.13 0.00 -0.26 0.00 0.00 60.65 58.70 3b8i s ILE 165 Cb 0.07 -1.25 0.00 0.00 1.25 0.00 0.00 42.46 42.54 3b8i s ILE 165 CO 0.60 -0.72 1.08 -1.81 0.24 0.00 0.00 174.94 174.34 3b8i s ASP 166 N -2.49 5.18 0.50 4.36 1.01 -1.26 -4.77 116.67 119.20 3b8i s ASP 166 Ca 0.03 1.85 0.20 0.00 0.71 0.00 0.00 52.55 55.34 3b8i s ASP 166 Cb 0.00 -2.53 1.26 0.00 1.01 0.00 0.00 42.92 42.66 3b8i s ASP 166 CO -0.04 -1.58 2.02 1.62 0.21 0.00 0.00 175.17 177.41 3b8i h VAL 167 N -0.25 0.84 -0.39 -1.27 3.04 -2.00 -1.78 116.25 114.44 3b8i h VAL 167 Ca -0.46 -0.04 -0.03 0.00 -1.01 0.00 0.00 66.70 65.17 3b8i h VAL 167 Cb 1.23 0.71 -0.02 0.00 -2.01 0.00 0.00 31.29 31.20 3b8i h VAL 167 CO 0.55 0.02 0.15 -2.24 -1.01 0.00 0.00 177.57 175.04 3b8i h ASP 168 N 0.12 0.55 -0.62 3.17 -0.00 -1.99 -0.72 116.42 116.94 3b8i h ASP 168 Ca 0.20 -0.18 -0.08 0.00 -0.00 0.00 0.00 57.03 56.98 3b8i h ASP 168 Cb 0.65 -0.14 -0.02 0.00 -0.00 0.00 0.00 39.33 39.81 3b8i h ASP 168 CO -0.02 0.58 0.09 0.00 -0.00 0.00 0.00 179.24 179.89 3b8i h ALA 169 N 0.99 0.83 -0.05 4.15 0.00 -1.71 0.26 119.26 123.73 3b8i h ALA 169 Ca 0.13 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.80 3b8i h ALA 169 Cb 0.21 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3b8i h ALA 169 CO -0.01 0.59 -0.08 0.28 0.00 0.00 0.00 179.25 180.03 3b8i h VAL 170 N 0.95 0.77 -0.30 0.00 2.07 -1.25 -0.94 116.25 117.54 3b8i h VAL 170 Ca 0.19 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.74 3b8i h VAL 170 Cb 0.44 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 3b8i h VAL 170 CO 0.01 0.00 0.12 0.40 0.02 0.00 0.00 177.57 178.12 3b8i h ILE 171 N -0.12 0.94 -0.61 4.57 2.04 -1.03 -0.33 117.51 122.97 3b8i h ILE 171 Ca 0.05 -0.09 0.07 0.00 1.00 0.00 0.00 64.86 65.90 3b8i h ILE 171 Cb 0.19 0.66 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 3b8i h ILE 171 CO -0.12 0.05 0.29 -0.61 0.00 0.00 0.00 178.15 177.75 3b8i h GLN 172 N 0.25 0.50 -0.07 2.37 4.15 -0.76 -1.48 115.11 120.08 3b8i h GLN 172 Ca 0.13 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.50 3b8i h GLN 172 Cb 0.08 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 27.66 3b8i h GLN 172 CO -0.12 0.33 -0.04 0.00 -1.93 0.00 0.00 178.83 177.07 3b8i h ARG 173 N 0.52 0.16 -0.62 1.69 3.08 -0.92 -2.08 114.38 116.20 3b8i h ARG 173 Ca 0.29 -0.07 -0.10 0.00 0.07 0.00 0.00 59.98 60.18 3b8i h ARG 173 Cb 0.28 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 3b8i h ARG 173 CO -0.24 0.53 0.02 1.79 -1.07 0.00 0.00 179.97 181.00 3b8i h THR 174 N -0.22 1.27 -0.77 2.04 1.35 -0.99 -1.67 112.91 113.92 3b8i h THR 174 Ca 0.02 -1.14 0.04 0.00 -0.55 0.00 0.00 66.41 64.77 3b8i h THR 174 Cb 0.48 0.77 -0.05 0.00 -1.73 0.00 0.00 68.15 67.62 3b8i h THR 174 CO 0.01 0.42 0.48 -0.07 -0.25 0.00 0.00 175.52 176.11 3b8i h LEU 175 N 1.00 0.78 -0.71 3.87 3.38 -1.28 -0.45 115.31 121.89 3b8i h LEU 175 Ca 0.18 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.08 3b8i h LEU 175 Cb 0.55 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 3b8i h LEU 175 CO 0.03 0.52 0.13 0.00 0.09 0.00 0.00 178.44 179.21 3b8i h ALA 176 N 1.34 0.93 -0.13 1.53 0.00 -1.01 0.14 119.26 122.06 3b8i h ALA 176 Ca 0.32 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 3b8i h ALA 176 Cb 0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3b8i h ALA 176 CO -0.13 0.67 -0.56 1.88 0.00 0.00 0.00 179.25 181.11 3b8i h TYR 177 N 1.05 0.49 0.09 0.00 0.05 -1.11 -0.70 116.97 116.84 3b8i h TYR 177 Ca 0.21 -0.18 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 3b8i h TYR 177 Cb 0.42 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.07 3b8i h TYR 177 CO 0.03 0.86 -0.04 0.37 -1.05 0.00 0.00 178.16 178.33 3b8i h GLN 178 N 0.30 -0.12 -0.30 4.88 4.15 -0.84 -1.89 115.11 121.29 3b8i h GLN 178 Ca 0.00 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.52 3b8i h GLN 178 Cb 1.08 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.78 3b8i h GLN 178 CO 0.10 0.19 0.27 1.49 -1.93 0.00 0.00 178.83 178.95 3b8i h GLU 179 N -0.43 0.00 0.00 1.69 4.81 -0.58 -0.67 114.58 119.40 3b8i h GLU 179 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3b8i h GLU 179 Cb 0.36 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.74 3b8i h GLU 179 CO 0.02 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.30 3b8i n ALA 180 N -2.45 2.06 -0.15 2.92 0.00 -0.28 -4.89 120.51 117.72 3b8i n ALA 180 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3b8i n ALA 180 Cb 0.43 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.46 3b8i n ALA 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b8i n GLY 181 N 0.85 0.92 3.68 0.00 0.00 -0.26 -4.64 105.19 105.74 3b8i n GLY 181 Ca 0.05 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 3b8i n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b8i n ALA 182 N -1.55 1.09 0.33 4.61 0.00 -0.73 -4.89 120.51 119.37 3b8i n ALA 182 Ca 0.00 0.37 0.14 0.00 0.00 0.00 0.00 53.44 53.96 3b8i n ALA 182 Cb 0.00 -2.23 0.48 0.00 0.00 0.00 0.00 19.45 17.70 3b8i n ALA 182 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3b8i h ASP 183 N 2.79 0.00 -5.14 0.00 3.32 -1.03 -3.46 116.42 112.90 3b8i h ASP 183 Ca -0.45 0.00 0.17 0.00 0.02 0.00 0.00 57.03 56.77 3b8i h ASP 183 Cb 1.29 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.73 3b8i h ASP 183 CO 0.65 0.00 0.52 -0.83 -1.72 0.00 0.00 179.24 177.86 3b8i s GLY 184 N -3.99 -0.32 -0.11 2.75 0.00 -1.21 -3.95 107.32 100.49 3b8i s GLY 184 Ca 0.04 0.46 0.03 0.00 0.00 0.00 0.00 44.72 45.24 3b8i s GLY 184 CO 0.55 0.12 -0.18 -0.42 0.00 0.00 0.00 173.10 173.17 3b8i s ILE 185 N -3.15 1.71 -0.15 0.90 -1.09 -0.32 -1.98 121.20 117.13 3b8i s ILE 185 Ca 0.10 -0.79 -0.08 0.00 -2.23 0.00 0.00 60.65 57.65 3b8i s ILE 185 Cb -0.01 -1.52 -0.04 0.00 -1.58 0.00 0.00 42.46 39.31 3b8i s ILE 185 CO -0.02 0.48 0.14 0.00 -1.23 0.00 0.00 174.94 174.32 3b8i s LEU 187 N -0.55 1.46 0.14 0.00 1.43 0.18 -0.93 118.68 120.41 3b8i s LEU 187 Ca 0.13 -0.36 0.04 0.00 -1.03 0.00 0.00 54.13 52.91 3b8i s LEU 187 Cb -0.12 -0.94 -0.04 0.00 0.03 0.00 0.00 46.19 45.12 3b8i s LEU 187 CO 0.02 -0.06 0.14 0.54 0.23 0.00 0.00 176.35 177.22 3b8i s VAL 188 N 1.34 4.60 0.00 -1.59 0.11 -0.97 -1.18 120.40 122.71 3b8i s VAL 188 Ca -0.01 -0.94 0.00 0.00 -2.93 0.00 0.00 61.98 58.10 3b8i s VAL 188 Cb -0.14 -3.31 0.00 0.00 -1.53 0.00 0.00 36.38 31.40 3b8i s VAL 188 CO -0.05 -0.04 0.00 0.61 -3.33 0.00 0.00 175.10 172.29 3b8i n GLY 189 N -0.12 0.43 3.67 6.54 0.00 -1.26 -0.53 105.19 113.92 3b8i n GLY 189 Ca -0.08 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.76 3b8i n GLY 189 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b8i s VAL 190 N -2.00 4.50 -0.05 1.61 1.01 -1.26 -3.51 120.40 120.69 3b8i s VAL 190 Ca 0.00 1.80 -0.26 0.00 0.00 0.00 0.00 61.98 63.52 3b8i s VAL 190 Cb 0.00 -4.16 -0.22 0.00 0.00 0.00 0.00 36.38 32.00 3b8i s VAL 190 CO 0.00 -0.09 1.11 0.03 0.00 0.00 0.00 175.10 176.15 3b8i h ARG 191 N 7.59 0.07 0.00 2.72 3.08 -1.95 -3.49 114.38 122.39 3b8i h ARG 191 Ca -0.27 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.72 3b8i h ARG 191 Cb 1.11 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.17 3b8i h ARG 191 CO 0.93 0.72 0.00 -0.40 -1.07 0.00 0.00 179.97 180.15 3b8i n ASP 192 N -4.69 0.00 0.04 7.04 5.68 -1.26 -4.75 116.55 118.60 3b8i n ASP 192 Ca -0.09 -0.59 -0.05 0.00 -0.50 0.00 0.00 54.79 53.56 3b8i n ASP 192 Cb 0.37 0.00 0.16 0.00 -1.14 0.00 0.00 41.12 40.51 3b8i n ASP 192 CO 0.00 0.00 0.00 -0.26 -1.33 0.00 0.00 177.20 175.61 3b8i h PHE 193 N 0.59 0.49 -0.75 2.11 0.04 -1.96 -1.56 116.94 115.91 3b8i h PHE 193 Ca 0.00 -0.14 -0.06 0.00 2.80 0.00 0.00 57.97 60.57 3b8i h PHE 193 Cb 0.00 -0.11 -0.03 0.00 2.20 0.00 0.00 35.95 38.01 3b8i h PHE 193 CO 0.00 0.76 0.23 0.00 -0.60 0.00 0.00 178.31 178.70 3b8i h ALA 194 N 1.22 1.00 0.48 2.45 0.00 -1.97 0.79 119.26 123.24 3b8i h ALA 194 Ca 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3b8i h ALA 194 Cb 0.87 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3b8i h ALA 194 CO 0.07 0.67 -0.23 1.25 0.00 0.00 0.00 179.25 181.01 3b8i h HIS 195 N 1.11 -0.60 -0.86 0.00 -0.00 -1.93 -2.81 115.15 110.07 3b8i h HIS 195 Ca 0.24 -0.01 0.20 0.00 -0.00 0.00 0.00 60.37 60.80 3b8i h HIS 195 Cb 0.31 0.20 -0.12 0.00 -0.00 0.00 0.00 27.41 27.80 3b8i h HIS 195 CO 0.03 -0.33 0.34 1.25 -0.00 0.00 0.00 177.93 179.22 3b8i h LEU 196 N -0.74 0.26 -0.21 0.26 5.85 -1.12 -2.74 115.31 116.86 3b8i h LEU 196 Ca -0.07 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3b8i h LEU 196 Cb 0.54 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 3b8i h LEU 196 CO 0.11 0.00 0.10 -0.33 -0.34 0.00 0.00 178.44 177.98 3b8i h GLU 197 N 0.38 0.31 -0.92 1.25 5.08 -0.74 0.66 114.58 120.59 3b8i h GLU 197 Ca 0.52 -0.05 0.16 0.00 -1.00 0.00 0.00 59.36 59.00 3b8i h GLU 197 Cb 0.96 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 30.07 3b8i h GLU 197 CO -0.52 0.34 0.59 0.00 -1.00 0.00 0.00 179.01 178.42 3b8i h ALA 198 N 0.96 1.88 0.16 3.43 0.00 -1.23 -1.82 119.26 122.63 3b8i h ALA 198 Ca 0.07 0.03 -0.33 0.00 0.00 0.00 0.00 54.91 54.68 3b8i h ALA 198 Cb 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3b8i h ALA 198 CO -0.01 -0.15 -1.66 0.82 0.00 0.00 0.00 179.25 178.25 3b8i h ILE 199 N 0.65 1.03 0.00 0.00 2.04 -1.04 -3.32 117.51 116.87 3b8i h ILE 199 Ca 0.48 -2.64 0.00 0.00 1.00 0.00 0.00 64.86 63.70 3b8i h ILE 199 Cb 0.85 2.76 0.00 0.00 -0.74 0.00 0.00 36.82 39.69 3b8i h ILE 199 CO -0.23 0.83 0.00 0.00 0.00 0.00 0.00 178.15 178.75 3b8i h ALA 200 N 0.29 1.00 -0.52 1.87 0.00 0.64 -3.36 119.26 119.19 3b8i h ALA 200 Ca -0.30 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.68 3b8i h ALA 200 Cb 2.07 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.80 3b8i h ALA 200 CO 0.17 0.00 0.19 1.49 0.00 0.00 0.00 179.25 181.10 3b8i h GLU 201 N 0.00 0.36 -0.65 0.00 4.57 -1.45 -2.45 114.58 114.95 3b8i h GLU 201 Ca 0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3b8i h GLU 201 Cb 0.65 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 3b8i h GLU 201 CO 0.00 0.24 0.00 0.72 -1.18 0.00 0.00 179.01 178.79 3b8i n HIS 202 N -5.00 1.10 -3.93 0.92 8.25 -1.26 -4.96 115.22 110.34 3b8i n HIS 202 Ca 0.06 -0.55 -0.37 0.00 -0.26 0.00 0.00 57.72 56.60 3b8i n HIS 202 Cb 0.21 -0.09 -0.06 0.00 1.12 0.00 0.00 29.99 31.16 3b8i n HIS 202 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3b8i s LEU 203 N -1.33 4.30 -0.00 2.41 1.02 -0.92 -4.97 118.68 119.18 3b8i s LEU 203 Ca 0.47 0.43 0.01 0.00 0.02 0.00 0.00 54.13 55.06 3b8i s LEU 203 Cb 0.27 -2.06 0.01 0.00 0.02 0.00 0.00 46.19 44.43 3b8i s LEU 203 CO 0.28 0.40 0.92 0.00 0.02 0.00 0.00 176.35 177.97 3b8i n HIS 204 N 1.96 0.00 -4.29 0.29 1.44 -1.26 -5.00 115.22 108.36 3b8i n HIS 204 Ca -0.20 -0.03 -0.26 0.00 -2.01 0.00 0.00 57.72 55.21 3b8i n HIS 204 Cb 0.55 -0.04 -0.09 0.00 0.12 0.00 0.00 29.99 30.52 3b8i n HIS 204 CO 0.00 0.00 0.00 0.96 -2.81 0.00 0.00 176.34 174.49 3b8i s ILE 205 N -0.10 3.19 0.26 0.61 -4.36 -1.26 -5.09 121.20 114.45 3b8i s ILE 205 Ca 0.01 -1.69 -0.30 0.00 -0.26 0.00 0.00 60.65 58.42 3b8i s ILE 205 Cb 0.01 -2.59 -0.14 0.00 1.25 0.00 0.00 42.46 40.99 3b8i s ILE 205 CO 0.00 -0.13 1.15 -2.65 0.24 0.00 0.00 174.94 173.55 3b8i n PRO 206 N -0.02 1.52 -3.99 0.37 -0.02 -1.25 -4.62 135.00 126.99 3b8i n PRO 206 Ca -0.10 0.54 -0.34 0.00 -2.02 0.00 0.00 63.50 61.57 3b8i n PRO 206 Cb 0.56 -2.01 -0.06 0.00 -0.02 0.00 0.00 33.50 31.96 3b8i n PRO 206 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3b8i s LEU 207 N 0.25 4.18 -0.07 2.45 1.43 -0.47 -1.17 118.68 125.29 3b8i s LEU 207 Ca 0.63 0.31 0.05 0.00 -1.03 0.00 0.00 54.13 54.09 3b8i s LEU 207 Cb -0.71 -2.33 -0.01 0.00 0.03 0.00 0.00 46.19 43.18 3b8i s LEU 207 CO 0.57 0.31 -0.24 -0.32 0.23 0.00 0.00 176.35 176.89 3b8i s MET 208 N -1.58 2.73 -0.11 1.70 -2.45 0.61 -0.46 119.30 119.74 3b8i s MET 208 Ca 0.22 -0.89 0.03 0.00 -1.25 0.00 0.00 55.69 53.80 3b8i s MET 208 Cb -0.12 -2.22 0.01 0.00 1.25 0.00 0.00 34.83 33.74 3b8i s MET 208 CO 0.13 0.32 -0.21 -0.51 1.05 0.00 0.00 175.02 175.79 3b8i s LEU 209 N -0.00 1.99 -0.59 4.11 1.02 0.03 -0.64 118.68 124.59 3b8i s LEU 209 Ca -0.08 -0.52 -0.13 0.00 0.02 0.00 0.00 54.13 53.41 3b8i s LEU 209 Cb -0.15 -1.30 0.15 0.00 0.02 0.00 0.00 46.19 44.90 3b8i s LEU 209 CO 0.05 0.11 0.52 -0.69 0.02 0.00 0.00 176.35 176.36 3b8i s VAL 210 N 0.58 5.00 -0.10 -1.59 1.01 -0.32 -0.02 120.40 124.95 3b8i s VAL 210 Ca -0.14 -1.84 0.20 0.00 0.00 0.00 0.00 61.98 60.20 3b8i s VAL 210 Cb -0.17 -4.20 -0.29 0.00 0.00 0.00 0.00 36.38 31.73 3b8i s VAL 210 CO 0.04 -0.88 0.36 0.35 0.00 0.00 0.00 175.10 174.97 3b8i n THR 211 N 4.82 0.61 -3.91 3.92 -2.24 -0.54 -4.10 114.28 112.84 3b8i n THR 211 Ca -0.06 -0.65 -0.33 0.00 -2.27 0.00 0.00 64.05 60.75 3b8i n THR 211 Cb 0.42 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 3b8i n THR 211 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3b8i n TYR 212 N -2.49 -1.66 -1.14 4.78 4.01 -1.22 -1.89 117.16 117.56 3b8i n TYR 212 Ca -0.15 0.48 -0.05 0.00 -0.16 0.00 0.00 57.90 58.02 3b8i n TYR 212 Cb 0.81 -3.35 -0.02 0.00 -0.31 0.00 0.00 39.34 36.47 3b8i n TYR 212 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3b8i n GLY 213 N -1.95 0.63 3.45 2.72 0.00 -1.16 -4.91 105.19 103.97 3b8i n GLY 213 Ca -0.19 -0.16 -0.58 0.00 0.00 0.00 0.00 46.02 45.09 3b8i n GLY 213 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3b8i n ASN 214 N -0.40 1.51 0.26 1.61 2.85 -0.79 -4.82 115.26 115.48 3b8i n ASN 214 Ca -0.05 0.73 0.16 0.00 -0.11 0.00 0.00 54.58 55.31 3b8i n ASN 214 Cb 0.35 -1.05 0.60 0.00 1.24 0.00 0.00 39.78 40.92 3b8i n ASN 214 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3b8i h PRO 215 N 9.26 0.00 -0.54 1.20 0.11 -1.91 -2.90 132.00 137.21 3b8i h PRO 215 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3b8i h PRO 215 Cb 1.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.48 3b8i h PRO 215 CO 1.03 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.86 3b8i n GLN 216 N -3.00 2.22 -2.70 1.05 6.02 -1.26 -4.35 117.38 115.35 3b8i n GLN 216 Ca 0.01 -1.31 -0.14 0.00 -0.01 0.00 0.00 57.00 55.55 3b8i n GLN 216 Cb 0.33 -1.52 0.02 0.00 1.02 0.00 0.00 30.24 30.08 3b8i n GLN 216 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3b8i n LEU 217 N 0.40 2.08 -0.28 1.08 4.77 -1.09 -4.09 117.00 119.87 3b8i n LEU 217 Ca 0.12 -4.21 0.03 0.00 -0.03 0.00 0.00 56.01 51.92 3b8i n LEU 217 Cb 0.46 0.27 0.05 0.00 -2.33 0.00 0.00 43.42 41.86 3b8i n LEU 217 CO 0.11 1.80 0.43 0.54 -1.33 0.00 0.00 177.39 178.94 3b8i n ARG 218 N -0.11 1.01 -3.09 3.23 5.12 -1.26 -4.87 116.66 116.70 3b8i n ARG 218 Ca 0.17 -1.21 -0.45 0.00 -1.93 0.00 0.00 57.85 54.43 3b8i n ARG 218 Cb 0.76 -1.12 -0.04 0.00 -1.16 0.00 0.00 32.46 30.90 3b8i n ARG 218 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 3b8i s ASP 219 N -0.69 6.33 0.37 0.55 -1.08 -1.26 -4.93 116.67 115.97 3b8i s ASP 219 Ca 0.09 -1.67 0.09 0.00 -0.52 0.00 0.00 52.55 50.54 3b8i s ASP 219 Cb 0.05 -2.32 0.71 0.00 -1.46 0.00 0.00 42.92 39.91 3b8i s ASP 219 CO 0.08 -1.06 1.87 0.44 0.52 0.00 0.00 175.17 177.02 3b8i h ASP 220 N 8.98 0.24 -0.38 -0.34 3.32 -1.99 -1.75 116.42 124.51 3b8i h ASP 220 Ca -0.17 -0.06 -0.14 0.00 0.02 0.00 0.00 57.03 56.68 3b8i h ASP 220 Cb 1.07 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 3b8i h ASP 220 CO 1.06 0.44 -0.31 0.00 -1.72 0.00 0.00 179.24 178.71 3b8i h ALA 221 N 1.59 0.68 -0.45 3.45 0.00 -1.99 -0.78 119.26 121.75 3b8i h ALA 221 Ca 0.04 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 3b8i h ALA 221 Cb 0.45 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3b8i h ALA 221 CO 0.03 0.67 -0.17 -0.09 0.00 0.00 0.00 179.25 179.69 3b8i h ARG 222 N 0.76 0.92 0.08 0.00 2.43 -1.93 -2.28 114.38 114.35 3b8i h ARG 222 Ca 0.08 -0.38 0.02 0.00 -0.81 0.00 0.00 59.98 58.90 3b8i h ARG 222 Cb 0.88 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.35 3b8i h ARG 222 CO 0.08 1.04 -0.35 -0.07 -1.51 0.00 0.00 179.97 179.16 3b8i h LEU 223 N 0.75 -1.02 -0.82 3.80 3.38 -1.02 -1.78 115.31 118.61 3b8i h LEU 223 Ca 0.11 0.12 0.13 0.00 0.09 0.00 0.00 57.88 58.33 3b8i h LEU 223 Cb 0.73 0.39 -0.09 0.00 0.09 0.00 0.00 40.66 41.79 3b8i h LEU 223 CO 0.06 -0.42 0.42 0.00 0.09 0.00 0.00 178.44 178.59 3b8i h ALA 224 N 0.08 1.21 -0.27 1.53 0.00 -1.15 -0.91 119.26 119.76 3b8i h ALA 224 Ca 0.04 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3b8i h ALA 224 Cb 0.60 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3b8i h ALA 224 CO -0.23 -0.06 0.11 0.00 0.00 0.00 0.00 179.25 179.07 3b8i h ARG 225 N 0.63 0.38 -0.08 0.00 3.08 -1.05 -0.91 114.38 116.43 3b8i h ARG 225 Ca 0.44 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.45 3b8i h ARG 225 Cb 0.57 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.55 3b8i h ARG 225 CO -0.34 0.32 0.00 1.28 -1.07 0.00 0.00 179.97 180.16 3b8i n LEU 226 N -4.43 0.88 0.00 3.04 4.77 -0.43 -4.90 117.00 115.94 3b8i n LEU 226 Ca 0.01 -0.36 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 3b8i n LEU 226 Cb 0.13 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3b8i n LEU 226 CO 0.36 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 3b8i n GLY 227 N 0.98 0.25 3.72 -0.72 0.00 -0.35 -4.86 105.19 104.21 3b8i n GLY 227 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3b8i n GLY 227 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b8i s VAL 228 N -2.00 2.83 0.00 1.61 1.01 -0.70 -1.36 120.40 121.79 3b8i s VAL 228 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 61.98 62.58 3b8i s VAL 228 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.99 3b8i s VAL 228 CO 0.00 0.05 0.00 0.54 0.00 0.00 0.00 175.10 175.69 3b8i n ARG 229 N 3.84 1.24 -3.83 2.72 5.12 0.39 -3.81 116.66 122.33 3b8i n ARG 229 Ca 0.13 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 55.86 3b8i n ARG 229 Cb 0.40 -0.90 -0.17 0.00 -1.16 0.00 0.00 32.46 30.63 3b8i n ARG 229 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3b8i s VAL 230 N -1.74 0.14 -0.13 1.55 1.01 -1.06 -0.82 120.40 119.36 3b8i s VAL 230 Ca 0.00 0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.18 3b8i s VAL 230 Cb 0.00 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 36.11 3b8i s VAL 230 CO 0.00 0.17 -0.19 -0.69 0.00 0.00 0.00 175.10 174.40 3b8i s VAL 231 N 1.48 1.79 -0.36 2.92 1.01 0.58 -0.79 120.40 127.03 3b8i s VAL 231 Ca -0.03 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 3b8i s VAL 231 Cb -0.13 -1.61 0.06 0.00 0.00 0.00 0.00 36.38 34.70 3b8i s VAL 231 CO -0.03 0.50 0.15 -0.69 0.00 0.00 0.00 175.10 175.03 3b8i s VAL 232 N 0.94 3.81 -0.23 2.92 1.01 0.97 -1.84 120.40 127.98 3b8i s VAL 232 Ca -0.06 -1.29 0.18 0.00 0.00 0.00 0.00 61.98 60.81 3b8i s VAL 232 Cb -0.15 -3.24 0.11 0.00 0.00 0.00 0.00 36.38 33.09 3b8i s VAL 232 CO -0.03 -0.30 1.38 0.78 0.00 0.00 0.00 175.10 176.94 3b8i h ASN 233 N 8.24 0.00 0.00 3.32 -0.26 -1.86 -1.44 115.58 123.58 3b8i h ASN 233 Ca -0.22 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.52 3b8i h ASN 233 Cb 1.08 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.34 3b8i h ASN 233 CO 0.64 0.34 0.00 0.61 -1.06 0.00 0.00 177.43 177.97 3b8i n GLY 234 N 1.21 0.84 1.29 2.83 0.00 -1.26 -3.01 105.19 107.09 3b8i n GLY 234 Ca 0.01 -1.99 -0.03 0.00 0.00 0.00 0.00 46.02 44.01 3b8i n GLY 234 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3b8i n HIS 235 N 6.32 0.82 -0.32 1.61 8.25 -1.26 -4.62 115.22 126.02 3b8i n HIS 235 Ca 0.00 -1.58 0.17 0.00 -0.26 0.00 0.00 57.72 56.04 3b8i n HIS 235 Cb 0.00 -0.26 0.34 0.00 1.12 0.00 0.00 29.99 31.19 3b8i n HIS 235 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3b8i h ALA 236 N 1.44 1.36 -0.00 -1.41 0.00 -2.00 -0.89 119.26 117.77 3b8i h ALA 236 Ca 0.05 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3b8i h ALA 236 Cb 1.30 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 19.55 3b8i h ALA 236 CO 0.23 -0.60 0.00 0.00 0.00 0.00 0.00 179.25 178.88 3b8i h ALA 237 N 1.91 1.57 0.17 0.00 0.00 -1.95 0.16 119.26 121.13 3b8i h ALA 237 Ca 0.62 -0.00 -0.35 0.00 0.00 0.00 0.00 54.91 55.18 3b8i h ALA 237 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3b8i h ALA 237 CO -0.80 -0.00 -1.78 -0.92 0.00 0.00 0.00 179.25 175.74 3b8i h TYR 238 N 0.00 0.67 -0.40 0.00 3.20 -1.53 -3.18 116.97 115.72 3b8i h TYR 238 Ca 0.00 -0.49 -0.04 0.00 3.14 0.00 0.00 58.73 61.34 3b8i h TYR 238 Cb 0.00 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 3b8i h TYR 238 CO 0.00 1.68 0.07 0.74 -1.64 0.00 0.00 178.16 179.01 3b8i h PHE 239 N 0.10 0.62 -0.54 -3.82 0.04 -1.21 -2.27 116.94 109.86 3b8i h PHE 239 Ca -0.35 -0.05 0.04 0.00 2.80 0.00 0.00 57.97 60.41 3b8i h PHE 239 Cb 2.09 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 40.01 3b8i h PHE 239 CO 0.10 0.55 0.30 0.00 -0.60 0.00 0.00 178.31 178.66 3b8i h ALA 240 N 1.50 0.70 -0.11 2.45 0.00 -0.80 -0.97 119.26 122.03 3b8i h ALA 240 Ca 0.13 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.09 3b8i h ALA 240 Cb 0.26 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 3b8i h ALA 240 CO 0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 179.25 179.09 3b8i h ALA 241 N 1.27 -0.06 -0.57 0.00 0.00 -1.40 -1.88 119.26 116.62 3b8i h ALA 241 Ca 0.23 0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.28 3b8i h ALA 241 Cb 0.10 0.28 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 3b8i h ALA 241 CO -0.14 -0.59 0.19 0.82 0.00 0.00 0.00 179.25 179.52 3b8i h ILE 242 N -0.17 0.75 -0.27 0.00 1.08 -1.18 -1.94 117.51 115.78 3b8i h ILE 242 Ca 0.09 -0.12 -0.06 0.00 -0.39 0.00 0.00 64.86 64.37 3b8i h ILE 242 Cb 0.30 0.37 -0.02 0.00 -3.07 0.00 0.00 36.82 34.40 3b8i h ILE 242 CO -0.22 0.06 -0.11 0.50 -0.69 0.00 0.00 178.15 177.70 3b8i h LYS 243 N 0.35 0.45 -0.11 2.37 1.63 -0.80 -1.41 116.57 119.05 3b8i h LYS 243 Ca 0.29 -0.12 -0.12 0.00 -0.85 0.00 0.00 60.65 59.85 3b8i h LYS 243 Cb 0.37 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.95 3b8i h LYS 243 CO -0.32 0.57 -0.40 0.00 -3.45 0.00 0.00 179.45 175.85 3b8i h ALA 244 N 1.47 0.20 -0.47 5.00 0.00 -0.99 -0.53 119.26 123.93 3b8i h ALA 244 Ca 0.08 -0.47 0.09 0.00 0.00 0.00 0.00 54.91 54.62 3b8i h ALA 244 Cb 0.45 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.15 3b8i h ALA 244 CO 0.03 0.31 0.02 1.15 0.00 0.00 0.00 179.25 180.75 3b8i h THR 245 N 0.05 0.65 -0.17 0.00 2.02 -1.28 -0.80 112.91 113.38 3b8i h THR 245 Ca -0.02 -0.05 0.02 0.00 0.77 0.00 0.00 66.41 67.13 3b8i h THR 245 Cb 1.04 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 3b8i h THR 245 CO 0.09 0.02 0.06 0.22 0.37 0.00 0.00 175.52 176.28 3b8i h TYR 246 N 0.14 0.10 -0.38 3.16 3.20 -0.93 -1.97 116.97 120.29 3b8i h TYR 246 Ca 0.24 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.11 3b8i h TYR 246 Cb 0.35 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 3b8i h TYR 246 CO -0.29 0.05 0.23 -0.44 -1.64 0.00 0.00 178.16 176.07 3b8i h ASP 247 N 0.14 0.46 -0.22 -2.11 3.32 -0.96 0.19 116.42 117.23 3b8i h ASP 247 Ca 0.07 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3b8i h ASP 247 Cb 0.04 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 3b8i h ASP 247 CO -0.08 0.38 0.10 0.00 -1.72 0.00 0.00 179.24 177.92 3b8i h LEU 249 N 0.23 0.88 -0.91 0.00 3.38 -1.05 -0.68 115.31 117.15 3b8i h LEU 249 Ca 0.08 -0.42 0.02 0.00 0.09 0.00 0.00 57.88 57.65 3b8i h LEU 249 Cb 0.13 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 3b8i h LEU 249 CO -0.01 1.11 0.60 -0.09 0.09 0.00 0.00 178.44 180.14 3b8i h ARG 250 N 0.65 1.16 -0.14 1.13 1.12 -0.56 -0.79 114.38 116.96 3b8i h ARG 250 Ca 0.08 -0.07 -0.04 0.00 -1.11 0.00 0.00 59.98 58.84 3b8i h ARG 250 Cb 0.79 -0.26 -0.00 0.00 -0.01 0.00 0.00 29.97 30.49 3b8i h ARG 250 CO 0.07 0.77 -0.08 0.93 -3.11 0.00 0.00 179.97 178.54 3b8i h GLU 251 N 1.20 0.30 -1.00 0.20 5.08 -0.97 -1.88 114.58 117.50 3b8i h GLU 251 Ca 0.35 -0.14 0.12 0.00 -1.00 0.00 0.00 59.36 58.69 3b8i h GLU 251 Cb -0.08 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.08 3b8i h GLU 251 CO -0.09 0.64 0.62 0.93 -1.00 0.00 0.00 179.01 180.12 3b8i h GLU 252 N -0.06 0.95 0.00 2.33 5.08 -0.79 -2.68 114.58 119.42 3b8i h GLU 252 Ca 0.03 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.21 3b8i h GLU 252 Cb 0.56 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3b8i h GLU 252 CO 0.02 0.63 -0.56 -0.09 -1.00 0.00 0.00 179.01 178.01 3b8i h ARG 253 N 0.98 0.00 0.00 2.33 9.65 -1.06 -3.48 114.38 122.80 3b8i h ARG 253 Ca 0.50 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.38 3b8i h ARG 253 Cb 0.50 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.08 3b8i h ARG 253 CO -0.27 0.56 0.00 0.41 2.80 0.00 0.00 179.97 183.47 3b8i n GLY 254 N 0.75 0.81 3.72 2.80 0.00 -0.85 -5.09 105.19 107.33 3b8i n GLY 254 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3b8i n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b8i s ALA 255 N -2.10 1.64 0.52 4.61 0.00 -0.77 -5.03 121.76 120.63 3b8i s ALA 255 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 51.96 51.76 3b8i s ALA 255 Cb 0.00 -3.21 -0.07 0.00 0.00 0.00 0.00 23.12 19.84 3b8i s ALA 255 CO 0.00 -2.28 1.09 0.54 0.00 0.00 0.00 175.76 175.11 3b8i s VAL 256 N -2.92 3.43 0.48 0.00 0.11 -1.26 -4.74 120.40 115.51 3b8i s VAL 256 Ca 0.63 0.90 -0.24 0.00 -2.93 0.00 0.00 61.98 60.34 3b8i s VAL 256 Cb -0.18 -3.37 -0.07 0.00 -1.53 0.00 0.00 36.38 31.23 3b8i s VAL 256 CO 0.57 -0.19 1.40 0.00 -3.33 0.00 0.00 175.10 173.55 3b8i s ALA 257 N -1.85 3.09 0.39 1.54 0.00 -1.26 -4.99 121.76 118.67 3b8i s ALA 257 Ca 0.70 1.40 -0.24 0.00 0.00 0.00 0.00 51.96 53.83 3b8i s ALA 257 Cb -0.21 -3.58 -0.09 0.00 0.00 0.00 0.00 23.12 19.24 3b8i s ALA 257 CO 0.24 -1.23 1.02 0.45 0.00 0.00 0.00 175.76 176.24 3b8i s SER 258 N -0.68 6.88 0.00 0.00 0.15 -1.26 -4.95 113.70 113.83 3b8i s SER 258 Ca 0.64 1.97 0.26 0.00 0.70 0.00 0.00 55.95 59.53 3b8i s SER 258 Cb -0.42 -2.58 0.66 0.00 -1.71 0.00 0.00 66.02 61.97 3b8i s SER 258 CO 0.53 -0.40 1.52 0.47 1.20 0.00 0.00 173.24 176.55 3b8i n ASP 259 N -0.01 1.89 -4.76 5.45 8.00 -1.26 -4.97 116.55 120.90 3b8i n ASP 259 Ca 0.05 -1.54 -0.40 0.00 0.71 0.00 0.00 54.79 53.60 3b8i n ASP 259 Cb 0.50 0.07 -0.04 0.00 -0.02 0.00 0.00 41.12 41.63 3b8i n ASP 259 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3b8i s LEU 260 N -2.12 4.52 0.88 0.64 1.43 -1.26 -5.03 118.68 117.74 3b8i s LEU 260 Ca 0.31 2.30 -0.10 0.00 -1.03 0.00 0.00 54.13 55.61 3b8i s LEU 260 Cb 0.20 -3.66 0.13 0.00 0.03 0.00 0.00 46.19 42.89 3b8i s LEU 260 CO 0.38 -0.21 1.14 0.42 0.23 0.00 0.00 176.35 178.31 3b8i s THR 261 N -1.19 2.27 0.28 5.49 -4.23 -1.26 -4.76 115.64 112.25 3b8i s THR 261 Ca 0.46 0.09 0.02 0.00 -1.18 0.00 0.00 61.69 61.08 3b8i s THR 261 Cb -0.32 -2.21 0.27 0.00 1.34 0.00 0.00 72.50 71.58 3b8i s THR 261 CO 0.42 -0.11 1.78 0.00 -0.54 0.00 0.00 174.62 176.16 3b8i h ALA 262 N -1.68 1.49 -0.01 3.99 0.00 -1.96 0.13 119.26 121.22 3b8i h ALA 262 Ca -0.43 0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 3b8i h ALA 262 Cb 1.26 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 3b8i h ALA 262 CO 0.43 -0.02 -0.62 0.66 0.00 0.00 0.00 179.25 179.71 3b8i h SER 263 N 0.75 0.03 -0.18 0.00 4.64 -1.92 -1.90 113.55 114.97 3b8i h SER 263 Ca 0.52 -0.02 -0.19 0.00 -0.47 0.00 0.00 61.79 61.63 3b8i h SER 263 Cb 0.73 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.82 3b8i h SER 263 CO -0.35 0.65 -0.62 -0.33 -0.87 0.00 0.00 176.83 175.30 3b8i h GLU 264 N 0.02 0.74 -0.06 4.77 5.08 -1.74 -1.60 114.58 121.79 3b8i h GLU 264 Ca -0.01 -0.55 -0.00 0.00 -1.00 0.00 0.00 59.36 57.80 3b8i h GLU 264 Cb 1.10 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 3b8i h GLU 264 CO 0.08 1.17 0.03 1.25 -1.00 0.00 0.00 179.01 180.54 3b8i h LEU 265 N 0.45 0.08 -0.14 1.33 5.85 -0.80 -1.44 115.31 120.64 3b8i h LEU 265 Ca -0.03 -0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.60 3b8i h LEU 265 Cb 1.25 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 42.20 3b8i h LEU 265 CO 0.13 0.20 -0.24 0.28 -0.34 0.00 0.00 178.44 178.47 3b8i h SER 266 N -0.05 -0.75 -0.62 1.25 0.02 -1.35 -2.28 113.55 109.78 3b8i h SER 266 Ca 0.02 0.12 0.10 0.00 -0.84 0.00 0.00 61.79 61.19 3b8i h SER 266 Cb 0.14 0.34 -0.07 0.00 0.14 0.00 0.00 62.40 62.95 3b8i h SER 266 CO -0.00 -0.29 0.23 0.50 -1.14 0.00 0.00 176.83 176.13 3b8i h LYS 267 N -0.30 0.40 -0.76 3.45 3.64 -1.20 -2.76 116.57 119.03 3b8i h LYS 267 Ca 0.10 -0.02 0.15 0.00 -1.27 0.00 0.00 60.65 59.61 3b8i h LYS 267 Cb 0.46 -0.09 -0.10 0.00 -0.41 0.00 0.00 32.23 32.09 3b8i h LYS 267 CO -0.31 0.26 0.28 -0.22 -2.27 0.00 0.00 179.45 177.18 3b8i h LYS 268 N 0.41 0.38 -0.09 1.90 3.64 -0.67 -1.85 116.57 120.29 3b8i h LYS 268 Ca 0.31 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 3b8i h LYS 268 Cb 0.39 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 3b8i h LYS 268 CO -0.31 0.25 0.00 0.66 -2.27 0.00 0.00 179.45 177.78 3b8i n TYR 269 N -5.05 0.11 1.33 1.91 4.01 -1.04 -2.04 117.16 116.39 3b8i n TYR 269 Ca 0.15 -0.06 0.14 0.00 -0.16 0.00 0.00 57.90 57.97 3b8i n TYR 269 Cb 0.45 0.00 0.50 0.00 -0.31 0.00 0.00 39.34 39.98 3b8i n TYR 269 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3b8i n THR 270 N -0.28 0.00 -3.63 -0.72 -2.24 -0.70 -4.78 114.28 101.94 3b8i n THR 270 Ca 0.12 -0.10 -0.27 0.00 -2.27 0.00 0.00 64.05 61.53 3b8i n THR 270 Cb 0.16 0.16 0.04 0.00 -2.10 0.00 0.00 70.33 68.59 3b8i n THR 270 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3b8i n PHE 271 N -0.77 -1.99 0.21 4.78 0.99 -0.86 -4.47 117.46 115.35 3b8i n PHE 271 Ca 0.13 0.60 0.06 0.00 -0.00 0.00 0.00 57.45 58.24 3b8i n PHE 271 Cb 0.31 -3.72 0.47 0.00 -1.00 0.00 0.00 39.48 35.55 3b8i n PHE 271 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 3b8i h PRO 272 N -1.75 0.00 -0.21 -1.08 0.13 -1.77 -2.46 132.00 124.86 3b8i h PRO 272 Ca -0.65 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.37 3b8i h PRO 272 Cb 1.35 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.47 3b8i h PRO 272 CO 0.50 0.28 -0.35 0.93 -0.23 0.00 0.00 178.00 179.12 3b8i h GLU 273 N 0.00 0.45 -0.35 0.86 3.07 -1.94 -1.15 114.58 115.52 3b8i h GLU 273 Ca -0.00 -0.21 -0.05 0.00 -0.50 0.00 0.00 59.36 58.61 3b8i h GLU 273 Cb 0.58 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.46 3b8i h GLU 273 CO 0.04 0.75 0.04 1.49 -1.40 0.00 0.00 179.01 179.93 3b8i h GLU 274 N 0.38 0.60 -0.31 2.33 4.81 -1.81 -0.67 114.58 119.92 3b8i h GLU 274 Ca 0.04 -0.17 -0.07 0.00 -0.13 0.00 0.00 59.36 59.03 3b8i h GLU 274 Cb 0.80 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.10 3b8i h GLU 274 CO 0.06 0.68 -0.11 1.88 -0.73 0.00 0.00 179.01 180.79 3b8i h TYR 275 N 0.42 0.56 -0.29 0.92 0.05 -1.44 -1.29 116.97 115.89 3b8i h TYR 275 Ca 0.11 -0.08 -0.18 0.00 0.05 0.00 0.00 58.73 58.62 3b8i h TYR 275 Cb 0.39 -0.15 -0.00 0.00 1.01 0.00 0.00 36.73 37.97 3b8i h TYR 275 CO 0.03 0.62 -0.52 0.37 -1.05 0.00 0.00 178.16 177.61 3b8i h GLN 276 N 0.48 0.85 -0.71 4.88 5.75 -1.08 -1.78 115.11 123.50 3b8i h GLN 276 Ca 0.09 -0.52 -0.03 0.00 -0.15 0.00 0.00 58.65 58.04 3b8i h GLN 276 Cb 0.49 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.06 3b8i h GLN 276 CO 0.03 1.16 0.32 0.00 -2.65 0.00 0.00 178.83 177.69 3b8i h ALA 277 N 0.74 1.23 -0.12 3.38 0.00 -0.86 -0.62 119.26 123.01 3b8i h ALA 277 Ca 0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3b8i h ALA 277 Cb 1.12 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3b8i h ALA 277 CO 0.12 0.58 0.04 -1.49 0.00 0.00 0.00 179.25 178.50 3b8i h TRP 278 N 1.01 0.19 -0.98 0.00 6.55 -1.01 -0.71 115.95 120.99 3b8i h TRP 278 Ca 0.24 -0.02 0.09 0.00 0.95 0.00 0.00 58.89 60.16 3b8i h TRP 278 Cb 0.13 -0.06 -0.07 0.00 -0.86 0.00 0.00 29.16 28.30 3b8i h TRP 278 CO 0.01 0.29 0.63 0.00 -1.05 0.00 0.00 178.44 178.33 3b8i h ALA 279 N 0.88 1.49 -0.26 1.49 0.00 -1.12 0.33 119.26 122.07 3b8i h ALA 279 Ca 0.04 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3b8i h ALA 279 Cb 0.19 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3b8i h ALA 279 CO -0.00 0.32 0.01 0.00 0.00 0.00 0.00 179.25 179.58 3b8i h ARG 280 N 1.06 0.45 -0.12 0.00 3.08 -0.79 -1.19 114.38 116.87 3b8i h ARG 280 Ca 0.45 -0.14 -0.22 0.00 0.07 0.00 0.00 59.98 60.15 3b8i h ARG 280 Cb 0.33 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.34 3b8i h ARG 280 CO -0.21 0.61 -0.80 0.22 -1.07 0.00 0.00 179.97 178.72 3b8i h ASP 281 N 0.24 0.81 -0.00 7.04 1.82 -0.34 -3.34 116.42 122.65 3b8i h ASP 281 Ca 0.08 -0.55 0.00 0.00 -0.39 0.00 0.00 57.03 56.17 3b8i h ASP 281 Cb 0.39 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 40.16 3b8i h ASP 281 CO 0.01 1.33 -0.35 -1.22 -1.61 0.00 0.00 179.24 177.40 3b8i n TYR 282 N -3.90 0.00 -0.88 0.28 4.01 0.11 -4.71 117.16 112.07 3b8i n TYR 282 Ca -0.07 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.70 3b8i n TYR 282 Cb 0.75 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.83 3b8i n TYR 282 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3b8i n MET 283 N -1.03 1.36 -4.74 -0.72 2.81 -0.45 -5.01 117.12 109.34 3b8i n MET 283 Ca 0.02 -1.56 -0.24 0.00 -1.81 0.00 0.00 57.70 54.10 3b8i n MET 283 Cb 0.14 -0.97 -0.16 0.00 -0.71 0.00 0.00 33.22 31.52 3b8i n MET 283 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 3b8i s GLU 284 N -1.22 1.50 0.11 0.03 2.02 -1.21 -0.97 118.70 118.96 3b8i s GLU 284 Ca 0.10 -0.55 -0.34 0.00 0.02 0.00 0.00 54.97 54.20 3b8i s GLU 284 Cb 0.09 -1.35 -0.18 0.00 0.10 0.00 0.00 34.13 32.79 3b8i s GLU 284 CO 0.01 0.25 0.91 0.28 0.02 0.00 0.00 175.26 176.73 3b8i n VAL 285 N 3.04 0.92 1.69 2.63 0.31 -1.26 -4.93 118.33 120.73 3b8i n VAL 285 Ca -0.17 -0.23 0.15 0.00 -0.01 0.00 0.00 64.34 64.08 3b8i n VAL 285 Cb 0.54 -0.23 0.69 0.00 -0.91 0.00 0.00 33.84 33.92 3b8i n VAL 285 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80