#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xad s LYS 2 N 0.00 3.08 -0.28 2.12 2.20 -1.26 -0.71 119.74 124.89 1xad s LYS 2 Ca 0.00 -0.94 -0.04 0.00 -0.36 0.00 0.00 55.97 54.63 1xad s LYS 2 Cb 0.00 -3.94 0.02 0.00 -1.51 0.00 0.00 37.83 32.40 1xad s LYS 2 CO 0.00 -0.68 0.02 0.08 -0.36 0.00 0.00 175.35 174.40 1xad s VAL 3 N 1.69 3.39 -0.10 4.02 1.01 -0.50 0.43 120.40 130.34 1xad s VAL 3 Ca 0.05 -0.97 -0.30 0.00 0.00 0.00 0.00 61.98 60.77 1xad s VAL 3 Cb -0.19 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.39 1xad s VAL 3 CO 0.10 0.07 1.09 0.00 0.00 0.00 0.00 175.10 176.36 1xad s ALA 4 N 1.39 3.47 -0.23 5.51 0.00 -0.10 -3.07 121.76 128.72 1xad s ALA 4 Ca 0.00 0.46 -0.09 0.00 0.00 0.00 0.00 51.96 52.33 1xad s ALA 4 Cb -0.18 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 1xad s ALA 4 CO -0.01 -0.71 0.11 0.08 0.00 0.00 0.00 175.76 175.23 1xad s VAL 5 N 2.22 4.84 -0.72 0.00 1.01 -0.22 -1.41 120.40 126.11 1xad s VAL 5 Ca 0.51 -0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.51 1xad s VAL 5 Cb -0.21 -3.24 0.18 0.00 0.00 0.00 0.00 36.38 33.11 1xad s VAL 5 CO 0.19 0.36 0.53 -0.76 0.00 0.00 0.00 175.10 175.42 1xad s LEU 6 N 1.16 4.98 0.22 3.92 1.02 -0.51 -0.85 118.68 128.61 1xad s LEU 6 Ca 0.06 -3.65 0.22 0.00 0.02 0.00 0.00 54.13 50.77 1xad s LEU 6 Cb -0.14 -1.72 0.92 0.00 0.02 0.00 0.00 46.19 45.26 1xad s LEU 6 CO 0.04 -0.15 1.66 -0.81 0.02 0.00 0.00 176.35 177.11 1xad n PRO 7 N 2.31 0.16 0.00 1.29 -0.04 -1.26 -1.73 135.00 135.73 1xad n PRO 7 Ca 0.17 0.41 0.00 0.00 -0.04 0.00 0.00 63.50 64.04 1xad n PRO 7 Cb 0.35 -1.81 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 1xad n PRO 7 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xad n GLY 8 N -0.11 0.27 3.87 0.55 0.00 -1.26 -3.15 105.19 105.36 1xad n GLY 8 Ca 0.02 -0.87 -0.21 0.00 0.00 0.00 0.00 46.02 44.95 1xad n GLY 8 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xad s ASP 9 N -4.00 4.98 1.66 1.61 1.01 0.29 -4.49 116.67 117.74 1xad s ASP 9 Ca 0.00 -0.80 0.00 0.00 0.71 0.00 0.00 52.55 52.46 1xad s ASP 9 Cb 0.00 -0.51 0.00 0.00 1.01 0.00 0.00 42.92 43.42 1xad s ASP 9 CO 0.00 -0.67 0.00 0.61 0.21 0.00 0.00 175.17 175.32 1xad n GLY 10 N -1.54 3.32 0.02 0.21 0.00 -1.26 -1.12 105.19 104.81 1xad n GLY 10 Ca 0.03 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.16 1xad n GLY 10 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1xad n ILE 11 N 0.00 0.12 -0.28 -0.61 -5.35 0.59 -4.44 119.36 109.39 1xad n ILE 11 Ca 0.00 -0.07 -0.01 0.00 -0.27 0.00 0.00 62.75 62.40 1xad n ILE 11 Cb 0.00 -0.16 0.05 0.00 -1.74 0.00 0.00 39.64 37.79 1xad n ILE 11 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1xad h GLY 12 N 4.87 0.22 0.03 3.28 0.00 -1.28 -1.55 103.07 108.65 1xad h GLY 12 Ca 0.00 0.38 0.09 0.00 0.00 0.00 0.00 47.33 47.80 1xad h GLY 12 CO 0.00 -0.25 -0.16 -2.55 0.00 0.00 0.00 176.54 173.58 1xad h PRO 13 N -0.06 -0.07 0.52 4.80 0.11 -1.77 0.41 132.00 135.93 1xad h PRO 13 Ca 0.32 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.41 1xad h PRO 13 Cb 0.58 0.02 0.01 0.00 0.11 0.00 0.00 31.00 31.71 1xad h PRO 13 CO -0.81 -0.05 -0.25 0.93 -0.21 0.00 0.00 178.00 177.61 1xad h GLU 14 N -0.07 -0.67 0.00 1.05 5.08 -1.65 -1.15 114.58 117.17 1xad h GLU 14 Ca 0.21 0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 1xad h GLU 14 Cb 0.39 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1xad h GLU 14 CO -0.48 -0.38 -0.08 -0.39 -1.00 0.00 0.00 179.01 176.67 1xad h VAL 15 N -0.88 0.15 -0.05 3.13 -1.51 -1.30 -2.64 116.25 113.16 1xad h VAL 15 Ca -0.07 -1.11 -0.20 0.00 -1.23 0.00 0.00 66.70 64.09 1xad h VAL 15 Cb 0.60 1.98 -0.00 0.00 -2.13 0.00 0.00 31.29 31.74 1xad h VAL 15 CO 0.12 0.08 -0.80 0.74 -1.23 0.00 0.00 177.57 176.48 1xad h THR 16 N 0.00 1.40 -0.07 7.19 2.02 -0.81 -2.88 112.91 119.76 1xad h THR 16 Ca -0.00 -2.27 -0.08 0.00 0.77 0.00 0.00 66.41 64.83 1xad h THR 16 Cb 0.97 2.23 -0.01 0.00 -1.74 0.00 0.00 68.15 69.60 1xad h THR 16 CO 0.01 0.68 -0.32 -0.08 0.37 0.00 0.00 175.52 176.18 1xad h GLU 17 N 0.25 0.12 0.00 6.66 4.57 -0.97 -2.66 114.58 122.55 1xad h GLU 17 Ca -0.05 -0.04 -0.09 0.00 -1.18 0.00 0.00 59.36 58.00 1xad h GLU 17 Cb 1.40 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.97 1xad h GLU 17 CO 0.14 0.44 -0.44 0.00 -1.18 0.00 0.00 179.01 177.97 1xad h ALA 18 N 1.56 0.96 0.49 2.92 0.00 -1.27 -0.47 119.26 123.45 1xad h ALA 18 Ca 0.01 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1xad h ALA 18 Cb 0.63 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1xad h ALA 18 CO 0.05 0.55 -0.24 0.00 0.00 0.00 0.00 179.25 179.61 1xad h ALA 19 N 1.56 -0.66 -0.51 0.00 0.00 -1.33 -2.24 119.26 116.09 1xad h ALA 19 Ca -0.00 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 54.82 1xad h ALA 19 Cb 0.98 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.95 1xad h ALA 19 CO 0.06 -0.79 0.08 -0.07 0.00 0.00 0.00 179.25 178.52 1xad h LEU 20 N -0.82 -0.06 -0.70 0.00 3.38 -1.15 0.18 115.31 116.15 1xad h LEU 20 Ca -0.07 0.10 0.13 0.00 0.09 0.00 0.00 57.88 58.13 1xad h LEU 20 Cb 0.58 0.15 -0.09 0.00 0.09 0.00 0.00 40.66 41.38 1xad h LEU 20 CO 0.11 -0.00 0.24 0.11 0.09 0.00 0.00 178.44 178.98 1xad h LYS 21 N 0.20 0.37 -0.38 1.13 1.57 -0.90 0.40 116.57 118.96 1xad h LYS 21 Ca 0.26 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.98 1xad h LYS 21 Cb 0.36 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1xad h LYS 21 CO -0.36 0.24 0.10 0.28 -0.57 0.00 0.00 179.45 179.15 1xad h VAL 22 N 0.38 1.22 -0.19 0.50 2.07 -0.08 -2.85 116.25 117.30 1xad h VAL 22 Ca 0.38 -0.75 -0.09 0.00 0.82 0.00 0.00 66.70 67.06 1xad h VAL 22 Cb 0.56 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1xad h VAL 22 CO -0.40 0.26 -0.27 -0.07 0.02 0.00 0.00 177.57 177.11 1xad h LEU 23 N 0.47 0.36 -0.88 2.57 3.38 0.97 0.34 115.31 122.52 1xad h LEU 23 Ca 0.12 -0.12 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1xad h LEU 23 Cb 0.29 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1xad h LEU 23 CO -0.00 0.63 -0.50 0.03 0.09 0.00 0.00 178.44 178.69 1xad h ARG 24 N 0.32 0.14 -0.44 1.13 3.08 -0.34 -0.96 114.38 117.32 1xad h ARG 24 Ca 0.05 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1xad h ARG 24 Cb 0.65 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 1xad h ARG 24 CO 0.05 0.62 0.12 0.00 -1.07 0.00 0.00 179.97 179.68 1xad h ALA 25 N 1.37 0.58 -0.20 0.04 0.00 -0.70 0.70 119.26 121.05 1xad h ALA 25 Ca 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1xad h ALA 25 Cb 0.93 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1xad h ALA 25 CO 0.07 0.25 -0.02 -0.07 0.00 0.00 0.00 179.25 179.49 1xad h LEU 26 N 0.58 0.37 -0.55 0.00 3.38 -1.37 -0.92 115.31 116.81 1xad h LEU 26 Ca 0.14 -0.33 0.11 0.00 0.09 0.00 0.00 57.88 57.89 1xad h LEU 26 Cb 0.30 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 40.86 1xad h LEU 26 CO -0.00 0.61 -0.01 -0.78 0.09 0.00 0.00 178.44 178.35 1xad h ASP 27 N 0.12 -0.25 0.00 -0.43 3.58 -0.90 0.20 116.42 118.74 1xad h ASP 27 Ca 0.06 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.64 1xad h ASP 27 Cb 0.43 0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.72 1xad h ASP 27 CO 0.01 -0.09 0.00 -0.62 -2.88 0.00 0.00 179.24 175.66 1xad n GLU 28 N -5.26 0.00 -0.32 0.28 -0.58 0.22 0.03 120.64 115.00 1xad n GLU 28 Ca 0.07 0.24 0.29 0.00 -0.42 0.00 0.00 57.16 57.34 1xad n GLU 28 Cb 0.30 -1.20 0.51 0.00 -0.57 0.00 0.00 31.44 30.49 1xad n GLU 28 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xad n ALA 29 N -1.16 0.97 0.20 0.62 0.00 -0.37 -1.77 120.51 118.99 1xad n ALA 29 Ca 0.00 0.76 0.02 0.00 0.00 0.00 0.00 53.44 54.22 1xad n ALA 29 Cb 0.00 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 18.60 1xad n ALA 29 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1xad n GLU 30 N -4.56 4.06 -3.00 0.00 -0.58 0.63 -5.03 120.64 112.17 1xad n GLU 30 Ca 0.32 -0.20 -0.11 0.00 -0.42 0.00 0.00 57.16 56.74 1xad n GLU 30 Cb 1.16 -0.80 0.05 0.00 -0.57 0.00 0.00 31.44 31.28 1xad n GLU 30 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xad n GLY 31 N 0.88 -0.94 0.09 0.62 0.00 0.10 -4.90 105.19 101.05 1xad n GLY 31 Ca 0.01 0.46 0.13 0.00 0.00 0.00 0.00 46.02 46.62 1xad n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xad n LEU 32 N -2.77 0.64 -1.98 0.99 4.32 -1.13 -4.97 117.00 112.10 1xad n LEU 32 Ca -0.05 -0.05 -0.06 0.00 -0.02 0.00 0.00 56.01 55.82 1xad n LEU 32 Cb 0.59 -0.22 0.03 0.00 -1.62 0.00 0.00 43.42 42.20 1xad n LEU 32 CO 0.51 0.13 0.04 0.61 -1.22 0.00 0.00 177.39 177.46 1xad n GLY 33 N 1.42 0.13 3.68 -0.72 0.00 -1.26 -3.65 105.19 104.79 1xad n GLY 33 Ca 0.09 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 1xad n GLY 33 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xad s LEU 34 N -3.71 4.21 -0.16 0.99 1.98 -1.26 -0.52 118.68 120.21 1xad s LEU 34 Ca 0.04 1.54 0.02 0.00 -2.89 0.00 0.00 54.13 52.84 1xad s LEU 34 Cb -0.00 -3.55 0.01 0.00 0.66 0.00 0.00 46.19 43.31 1xad s LEU 34 CO 0.28 -0.55 -0.20 0.00 -1.89 0.00 0.00 176.35 173.99 1xad s ALA 35 N 2.46 2.31 0.21 5.97 0.00 0.11 -4.94 121.76 127.89 1xad s ALA 35 Ca 0.49 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 51.39 1xad s ALA 35 Cb -0.19 -1.09 -0.05 0.00 0.00 0.00 0.00 23.12 21.79 1xad s ALA 35 CO 0.15 -0.14 -0.12 1.52 0.00 0.00 0.00 175.76 177.18 1xad s TYR 36 N 0.97 1.67 -0.04 0.00 -0.85 -1.26 -1.41 117.35 116.44 1xad s TYR 36 Ca -0.03 -0.64 -0.02 0.00 -0.52 0.00 0.00 57.07 55.86 1xad s TYR 36 Cb -0.15 -0.83 0.03 0.00 0.38 0.00 0.00 41.96 41.39 1xad s TYR 36 CO -0.05 0.28 0.08 -2.00 -1.52 0.00 0.00 175.55 172.34 1xad s GLU 37 N -3.69 0.03 -0.04 -3.49 2.12 -1.17 -4.97 118.70 107.50 1xad s GLU 37 Ca 0.23 0.24 -0.20 0.00 0.36 0.00 0.00 54.97 55.59 1xad s GLU 37 Cb 0.01 -0.16 -0.05 0.00 0.26 0.00 0.00 34.13 34.19 1xad s GLU 37 CO 0.07 -0.13 0.58 0.08 -0.54 0.00 0.00 175.26 175.32 1xad s VAL 38 N 0.89 4.99 0.26 3.70 1.01 -1.26 -1.06 120.40 128.93 1xad s VAL 38 Ca -0.07 1.21 0.11 0.00 0.00 0.00 0.00 61.98 63.23 1xad s VAL 38 Cb -0.10 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 1xad s VAL 38 CO -0.03 0.38 -0.16 -0.36 0.00 0.00 0.00 175.10 174.92 1xad s PHE 39 N 0.12 2.39 0.07 5.22 0.40 -0.03 -4.93 117.98 121.21 1xad s PHE 39 Ca 0.31 -0.31 -0.25 0.00 -0.60 0.00 0.00 56.93 56.08 1xad s PHE 39 Cb -0.17 -1.07 -0.06 0.00 0.51 0.00 0.00 43.02 42.23 1xad s PHE 39 CO 0.16 0.66 0.75 -1.25 0.70 0.00 0.00 175.22 176.24 1xad s PRO 40 N -3.38 4.49 -0.18 0.24 0.04 -1.26 -4.48 135.00 130.46 1xad s PRO 40 Ca 0.29 1.06 -0.11 0.00 0.04 0.00 0.00 61.00 62.28 1xad s PRO 40 Cb -0.06 -3.34 0.06 0.00 0.04 0.00 0.00 34.50 31.21 1xad s PRO 40 CO 0.15 0.36 0.45 0.12 0.04 0.00 0.00 177.00 178.12 1xad s PHE 41 N -0.33 -0.65 0.00 0.56 5.36 -1.26 -4.56 117.98 117.10 1xad s PHE 41 Ca 0.37 1.39 0.00 0.00 -0.96 0.00 0.00 56.93 57.73 1xad s PHE 41 Cb -0.21 0.30 0.00 0.00 -0.34 0.00 0.00 43.02 42.77 1xad s PHE 41 CO 0.23 -0.36 0.00 0.41 -1.46 0.00 0.00 175.22 174.05 1xad n GLY 42 N 4.13 0.01 0.38 13.12 0.00 0.01 -4.14 105.19 118.71 1xad n GLY 42 Ca -0.22 -1.82 0.20 0.00 0.00 0.00 0.00 46.02 44.19 1xad n GLY 42 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xad h GLY 43 N 0.00 0.00 1.52 -0.02 0.00 -1.90 0.25 103.07 102.92 1xad h GLY 43 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 1xad h GLY 43 CO 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 176.54 175.90 1xad h ALA 44 N 1.71 0.65 0.00 3.60 0.00 -1.89 -2.23 119.26 121.10 1xad h ALA 44 Ca 0.25 -0.56 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1xad h ALA 44 Cb 1.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1xad h ALA 44 CO -0.00 0.72 -0.56 0.00 0.00 0.00 0.00 179.25 179.41 1xad h ALA 45 N 0.95 0.75 0.13 0.00 0.00 -0.82 0.80 119.26 121.07 1xad h ALA 45 Ca -0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1xad h ALA 45 Cb 1.19 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1xad h ALA 45 CO 0.11 0.25 -0.06 0.82 0.00 0.00 0.00 179.25 180.37 1xad h ILE 46 N 0.00 1.02 0.02 0.00 2.04 -0.88 0.70 117.51 120.41 1xad h ILE 46 Ca -0.02 -0.63 -0.00 0.00 1.00 0.00 0.00 64.86 65.21 1xad h ILE 46 Cb 1.16 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 38.64 1xad h ILE 46 CO 0.02 0.15 -0.01 0.44 0.00 0.00 0.00 178.15 178.75 1xad h ASP 47 N -0.47 -0.02 0.05 1.72 3.32 -1.36 0.32 116.42 119.99 1xad h ASP 47 Ca -0.02 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1xad h ASP 47 Cb 0.37 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1xad h ASP 47 CO 0.03 -0.00 -0.02 0.00 -1.72 0.00 0.00 179.24 177.52 1xad h ALA 48 N 0.95 -0.50 -0.02 3.45 0.00 -0.81 -3.38 119.26 118.95 1xad h ALA 48 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xad h ALA 48 Cb 0.03 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1xad h ALA 48 CO 0.00 -0.49 -0.00 1.19 0.00 0.00 0.00 179.25 179.95 1xad n PHE 49 N -2.32 0.00 -1.82 0.00 3.72 0.23 -4.94 117.46 112.34 1xad n PHE 49 Ca -0.01 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.34 1xad n PHE 49 Cb 0.03 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.56 1xad n PHE 49 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xad n GLY 50 N 1.24 0.34 3.63 1.37 0.00 0.11 -4.95 105.19 106.94 1xad n GLY 50 Ca 0.17 -0.74 -0.03 0.00 0.00 0.00 0.00 46.02 45.43 1xad n GLY 50 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1xad s GLU 51 N -3.72 0.12 0.05 1.61 -1.05 -1.15 -4.95 118.70 109.60 1xad s GLU 51 Ca 0.00 -0.01 0.26 0.00 -0.15 0.00 0.00 54.97 55.08 1xad s GLU 51 Cb 0.00 0.05 1.07 0.00 -0.44 0.00 0.00 34.13 34.81 1xad s GLU 51 CO 0.00 -0.04 1.83 -0.35 0.95 0.00 0.00 175.26 177.65 1xad n PRO 52 N 0.28 0.06 -3.23 -4.83 -0.04 -1.26 -3.43 135.00 122.55 1xad n PRO 52 Ca 0.01 0.09 -0.21 0.00 -0.04 0.00 0.00 63.50 63.35 1xad n PRO 52 Cb 0.58 -1.57 -0.07 0.00 -0.04 0.00 0.00 33.50 32.39 1xad n PRO 52 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1xad s PHE 53 N -3.03 0.39 0.57 0.54 5.36 -1.26 -0.81 117.98 119.74 1xad s PHE 53 Ca 0.12 -1.87 -0.16 0.00 -0.96 0.00 0.00 56.93 54.05 1xad s PHE 53 Cb 0.16 -0.59 -0.05 0.00 -0.34 0.00 0.00 43.02 42.20 1xad s PHE 53 CO 0.51 -0.95 1.04 -1.25 -1.46 0.00 0.00 175.22 173.11 1xad s PRO 54 N 0.27 3.49 0.56 10.12 0.04 -1.26 -4.70 135.00 143.52 1xad s PRO 54 Ca 0.32 1.16 0.24 0.00 0.04 0.00 0.00 61.00 62.77 1xad s PRO 54 Cb 0.03 -2.06 1.53 0.00 0.04 0.00 0.00 34.50 34.04 1xad s PRO 54 CO -0.16 -0.67 2.15 1.49 0.04 0.00 0.00 177.00 179.85 1xad h GLU 55 N 0.62 0.00 -0.71 4.56 4.57 -1.98 0.26 114.58 121.91 1xad h GLU 55 Ca -0.47 0.00 0.15 0.00 -1.18 0.00 0.00 59.36 57.86 1xad h GLU 55 Cb 1.21 0.00 -0.10 0.00 -0.16 0.00 0.00 28.75 29.70 1xad h GLU 55 CO 0.58 0.00 0.17 -1.35 -1.18 0.00 0.00 179.01 177.24 1xad h PRO 56 N 0.00 0.27 -0.12 0.92 0.10 -1.98 -1.26 132.00 129.93 1xad h PRO 56 Ca 0.05 -0.02 -0.10 0.00 0.10 0.00 0.00 66.00 66.03 1xad h PRO 56 Cb 0.26 -0.06 0.00 0.00 0.10 0.00 0.00 31.00 31.30 1xad h PRO 56 CO -0.00 0.18 -0.33 1.15 0.10 0.00 0.00 178.00 179.10 1xad h THR 57 N 0.28 1.38 -0.69 -1.15 2.02 -0.85 -0.12 112.91 113.77 1xad h THR 57 Ca 0.39 -1.63 0.13 0.00 0.77 0.00 0.00 66.41 66.08 1xad h THR 57 Cb 0.65 2.10 -0.13 0.00 -1.74 0.00 0.00 68.15 69.03 1xad h THR 57 CO -0.48 0.48 -0.24 0.03 0.37 0.00 0.00 175.52 175.68 1xad h ARG 58 N 0.03 -0.05 -0.32 6.66 -0.00 -0.61 0.87 114.38 120.96 1xad h ARG 58 Ca -0.01 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.47 1xad h ARG 58 Cb 0.94 0.01 -0.02 0.00 0.00 0.00 0.00 29.97 30.91 1xad h ARG 58 CO 0.07 -0.03 0.18 -0.22 0.00 0.00 0.00 179.97 179.97 1xad h LYS 59 N -0.05 0.45 -0.24 0.04 3.64 -1.09 -1.85 116.57 117.46 1xad h LYS 59 Ca 0.31 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.67 1xad h LYS 59 Cb 0.54 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 1xad h LYS 59 CO -0.74 0.37 0.06 0.78 -2.27 0.00 0.00 179.45 177.65 1xad h GLY 60 N 0.40 0.28 2.00 5.01 0.00 0.11 -1.08 103.07 109.79 1xad h GLY 60 Ca 0.11 -0.03 -0.13 0.00 0.00 0.00 0.00 47.33 47.28 1xad h GLY 60 CO -0.02 0.01 -0.61 -0.39 0.00 0.00 0.00 176.54 175.53 1xad h VAL 61 N 0.16 1.39 -0.01 4.60 -1.51 -1.24 -1.64 116.25 117.99 1xad h VAL 61 Ca 0.11 -2.13 -0.02 0.00 -1.23 0.00 0.00 66.70 63.43 1xad h VAL 61 Cb 0.09 2.17 -0.00 0.00 -2.13 0.00 0.00 31.29 31.41 1xad h VAL 61 CO -0.13 0.60 -0.08 -0.08 -1.23 0.00 0.00 177.57 176.65 1xad h GLU 62 N 0.00 0.02 0.00 5.19 4.57 -0.35 -3.27 114.58 120.74 1xad h GLU 62 Ca -0.01 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1xad h GLU 62 Cb 1.12 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.70 1xad h GLU 62 CO 0.08 0.10 -1.13 0.39 -1.18 0.00 0.00 179.01 177.28 1xad n GLU 63 N -4.43 1.54 -1.52 1.92 1.02 -0.76 -4.91 120.64 113.50 1xad n GLU 63 Ca -0.03 -0.06 -0.29 0.00 -0.02 0.00 0.00 57.16 56.76 1xad n GLU 63 Cb 0.17 -1.20 0.15 0.00 -0.02 0.00 0.00 31.44 30.54 1xad n GLU 63 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xad s ALA 64 N -2.56 1.67 -1.45 0.62 0.00 -0.64 -4.99 121.76 114.41 1xad s ALA 64 Ca -0.00 -0.65 0.23 0.00 0.00 0.00 0.00 51.96 51.54 1xad s ALA 64 Cb 0.09 -2.99 0.10 0.00 0.00 0.00 0.00 23.12 20.32 1xad s ALA 64 CO 0.52 -2.47 1.14 0.39 0.00 0.00 0.00 175.76 175.34 1xad n GLU 65 N -3.89 0.51 -3.51 0.00 1.02 0.17 -4.86 120.64 110.07 1xad n GLU 65 Ca 0.08 -0.40 -0.18 0.00 -0.02 0.00 0.00 57.16 56.65 1xad n GLU 65 Cb 0.59 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.46 1xad n GLU 65 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xad s ALA 66 N -2.76 -1.76 -0.11 0.62 0.00 -1.05 -4.52 121.76 112.17 1xad s ALA 66 Ca 0.14 1.27 -0.03 0.00 0.00 0.00 0.00 51.96 53.34 1xad s ALA 66 Cb 0.17 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.32 1xad s ALA 66 CO 0.70 -0.40 0.01 0.08 0.00 0.00 0.00 175.76 176.15 1xad s VAL 67 N -1.36 4.37 -0.31 0.00 1.01 -0.73 -0.92 120.40 122.46 1xad s VAL 67 Ca -0.10 -0.21 -0.06 0.00 0.00 0.00 0.00 61.98 61.61 1xad s VAL 67 Cb -0.00 -2.88 0.03 0.00 0.00 0.00 0.00 36.38 33.53 1xad s VAL 67 CO 0.08 0.56 0.08 -0.22 0.00 0.00 0.00 175.10 175.61 1xad s LEU 68 N -0.48 4.04 -0.01 3.92 0.20 -0.50 -2.76 118.68 123.09 1xad s LEU 68 Ca 0.09 -0.97 0.02 0.00 0.69 0.00 0.00 54.13 53.95 1xad s LEU 68 Cb -0.12 -1.85 -0.03 0.00 -0.43 0.00 0.00 46.19 43.76 1xad s LEU 68 CO 0.02 -0.26 -0.02 -0.22 -0.29 0.00 0.00 176.35 175.58 1xad s LEU 69 N 1.42 3.40 0.00 -0.68 2.96 -0.59 -1.43 118.68 123.76 1xad s LEU 69 Ca -0.00 -0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.87 1xad s LEU 69 Cb -0.18 -1.93 0.00 0.00 0.50 0.00 0.00 46.19 44.58 1xad s LEU 69 CO 0.02 0.29 0.00 0.61 -1.32 0.00 0.00 176.35 175.95 1xad n GLY 70 N 1.53 1.35 3.02 7.98 0.00 -0.70 -4.25 105.19 114.12 1xad n GLY 70 Ca -0.15 -0.87 -0.21 0.00 0.00 0.00 0.00 46.02 44.79 1xad n GLY 70 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xad s SER 71 N -0.88 1.40 0.43 1.61 0.01 -1.19 -4.71 113.70 110.37 1xad s SER 71 Ca 0.00 -0.22 0.08 0.00 1.31 0.00 0.00 55.95 57.12 1xad s SER 71 Cb 0.00 -0.39 -0.02 0.00 0.21 0.00 0.00 66.02 65.83 1xad s SER 71 CO 0.00 0.08 0.38 0.68 0.41 0.00 0.00 173.24 174.79 1xad s VAL 72 N 0.19 2.56 0.00 3.43 -7.23 -1.26 0.10 120.40 118.19 1xad s VAL 72 Ca -0.04 -1.36 0.00 0.00 -1.81 0.00 0.00 61.98 58.77 1xad s VAL 72 Cb -0.09 -2.92 0.00 0.00 0.56 0.00 0.00 36.38 33.93 1xad s VAL 72 CO 0.01 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.41 1xad n GLY 73 N -1.57 3.72 3.54 2.32 0.00 -1.26 -4.08 105.19 107.86 1xad n GLY 73 Ca 0.03 -1.44 -0.14 0.00 0.00 0.00 0.00 46.02 44.48 1xad n GLY 73 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xad s GLY 74 N 0.00 -0.42 0.38 -0.02 0.00 -1.26 -4.72 107.32 101.28 1xad s GLY 74 Ca 0.00 1.62 0.06 0.00 0.00 0.00 0.00 44.72 46.40 1xad s GLY 74 CO 0.00 0.93 2.00 -2.55 0.00 0.00 0.00 173.10 173.48 1xad h PRO 75 N 2.70 0.57 -1.36 2.90 0.11 -2.03 -2.94 132.00 131.95 1xad h PRO 75 Ca -0.23 -0.06 0.40 0.00 0.11 0.00 0.00 66.00 66.23 1xad h PRO 75 Cb 1.16 -0.12 -0.09 0.00 0.11 0.00 0.00 31.00 32.07 1xad h PRO 75 CO 0.35 0.44 0.93 -0.22 -0.21 0.00 0.00 178.00 179.29 1xad h LYS 76 N 0.58 0.10 0.00 1.05 3.64 -2.03 -0.39 116.57 119.52 1xad h LYS 76 Ca 0.15 -0.01 -0.34 0.00 -1.27 0.00 0.00 60.65 59.19 1xad h LYS 76 Cb 0.05 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 31.79 1xad h LYS 76 CO -0.02 0.07 -2.08 0.91 -2.27 0.00 0.00 179.45 176.06 1xad n TRP 77 N -4.38 0.49 -0.33 1.91 8.01 -1.11 -4.51 117.44 117.51 1xad n TRP 77 Ca 0.33 0.17 0.11 0.00 -1.31 0.00 0.00 57.50 56.80 1xad n TRP 77 Cb 1.39 -1.09 0.23 0.00 -2.01 0.00 0.00 31.31 29.84 1xad n TRP 77 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.69 176.24 1xad h ASP 78 N 0.00 -0.56 -0.50 -0.99 3.32 -1.18 0.60 116.42 117.11 1xad h ASP 78 Ca -0.43 0.27 0.04 0.00 0.02 0.00 0.00 57.03 56.93 1xad h ASP 78 Cb 2.13 0.50 -0.04 0.00 0.22 0.00 0.00 39.33 42.13 1xad h ASP 78 CO 0.05 -0.32 0.26 0.06 -1.72 0.00 0.00 179.24 177.57 1xad h GLN 79 N 0.02 0.49 -7.43 3.56 3.07 -1.79 -3.43 115.11 109.61 1xad h GLN 79 Ca 0.54 -0.03 -0.45 0.00 0.09 0.00 0.00 58.65 58.80 1xad h GLN 79 Cb 1.04 -0.11 0.15 0.00 0.08 0.00 0.00 27.48 28.63 1xad h GLN 79 CO -0.91 0.33 0.24 0.54 0.09 0.00 0.00 178.83 179.12 1xad s ASN 80 N -5.50 2.93 0.00 0.06 4.22 0.21 -4.98 114.94 111.88 1xad s ASN 80 Ca -0.13 1.05 0.00 0.00 -2.14 0.00 0.00 52.86 51.64 1xad s ASN 80 Cb 0.13 -1.65 0.00 0.00 1.28 0.00 0.00 41.25 41.01 1xad s ASN 80 CO 0.73 -2.92 0.00 -0.81 -2.04 0.00 0.00 177.10 172.06 1xad n PRO 81 N -4.02 0.00 0.00 3.55 -0.04 -1.26 -4.82 135.00 128.41 1xad n PRO 81 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1xad n PRO 81 Cb 0.58 -0.08 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 1xad n PRO 81 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1xad n ARG 82 N 0.00 0.00 0.00 0.54 1.74 -1.26 -4.80 116.66 112.88 1xad n ARG 82 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1xad n ARG 82 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1xad n ARG 82 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1xad n GLU 83 N -2.19 0.68 -1.88 5.56 4.71 -1.26 -1.92 120.64 124.34 1xad n GLU 83 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1xad n GLU 83 Cb 0.00 -1.22 0.06 0.00 -1.01 0.00 0.00 31.44 29.27 1xad n GLU 83 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1xad n LEU 84 N 0.50 1.85 -4.18 -4.62 7.99 -1.26 -4.70 117.00 112.57 1xad n LEU 84 Ca 0.00 -2.90 -0.16 0.00 -0.01 0.00 0.00 56.01 52.94 1xad n LEU 84 Cb 0.29 0.05 -0.11 0.00 -0.11 0.00 0.00 43.42 43.54 1xad n LEU 84 CO 0.00 0.97 -0.44 -0.60 -1.51 0.00 0.00 177.39 175.82 1xad s ARG 85 N -2.10 0.85 0.25 3.23 3.52 -0.81 -4.67 118.95 119.23 1xad s ARG 85 Ca 0.34 -1.08 -0.05 0.00 -0.13 0.00 0.00 55.73 54.82 1xad s ARG 85 Cb 0.37 -0.69 0.33 0.00 -1.56 0.00 0.00 34.95 33.40 1xad s ARG 85 CO -0.09 0.13 1.89 -1.35 -0.81 0.00 0.00 175.30 175.07 1xad h PRO 86 N 3.86 1.13 0.00 5.12 0.11 -1.90 -2.27 132.00 138.06 1xad h PRO 86 Ca -0.39 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 1xad h PRO 86 Cb 1.19 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1xad h PRO 86 CO 0.47 0.75 -0.31 0.93 -0.21 0.00 0.00 178.00 179.63 1xad h GLU 87 N 1.17 0.00 -0.86 1.05 3.07 -1.94 -2.38 114.58 114.69 1xad h GLU 87 Ca 0.39 0.00 0.12 0.00 -0.50 0.00 0.00 59.36 59.37 1xad h GLU 87 Cb 0.06 0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 27.89 1xad h GLU 87 CO -0.14 0.31 0.48 -0.22 -1.40 0.00 0.00 179.01 178.04 1xad h LYS 88 N 0.00 0.72 -0.12 2.33 3.11 -1.71 0.29 116.57 121.20 1xad h LYS 88 Ca -0.00 -0.04 0.02 0.00 -2.81 0.00 0.00 60.65 57.81 1xad h LYS 88 Cb 0.58 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 31.65 1xad h LYS 88 CO 0.04 0.48 0.08 0.78 -2.81 0.00 0.00 179.45 178.02 1xad h GLY 89 N 0.74 0.10 2.00 5.01 0.00 -1.58 -0.43 103.07 108.90 1xad h GLY 89 Ca 0.44 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.72 1xad h GLY 89 CO -0.30 0.03 -0.10 1.41 0.00 0.00 0.00 176.54 177.58 1xad h LEU 90 N 0.09 0.00 0.02 3.11 3.38 -0.49 0.11 115.31 121.53 1xad h LEU 90 Ca 0.05 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.67 1xad h LEU 90 Cb 0.09 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 1xad h LEU 90 CO -0.01 0.10 -2.16 0.18 0.09 0.00 0.00 178.44 176.65 1xad n LEU 91 N -3.65 1.26 -0.20 1.67 4.77 -0.32 -3.26 117.00 117.27 1xad n LEU 91 Ca -0.02 0.12 -0.07 0.00 -0.03 0.00 0.00 56.01 56.01 1xad n LEU 91 Cb 0.22 -0.13 0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1xad n LEU 91 CO 0.30 0.61 1.06 0.28 -1.33 0.00 0.00 177.39 178.31 1xad h SER 92 N 0.01 0.70 0.33 -1.43 0.02 -0.31 0.25 113.55 113.12 1xad h SER 92 Ca -0.46 -0.08 -0.09 0.00 -0.84 0.00 0.00 61.79 60.31 1xad h SER 92 Cb 2.08 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 64.43 1xad h SER 92 CO 0.03 0.57 -0.41 -0.29 -1.14 0.00 0.00 176.83 175.59 1xad h ILE 93 N 0.77 1.30 -0.56 3.27 2.10 -1.17 -1.44 117.51 121.78 1xad h ILE 93 Ca 0.20 -1.46 -0.09 0.00 1.08 0.00 0.00 64.86 64.59 1xad h ILE 93 Cb 0.02 1.72 -0.02 0.00 -1.09 0.00 0.00 36.82 37.45 1xad h ILE 93 CO -0.04 0.42 -0.02 -0.09 -1.08 0.00 0.00 178.15 177.35 1xad h ARG 94 N 0.09 0.99 -0.13 2.19 2.43 -1.39 -2.54 114.38 116.02 1xad h ARG 94 Ca 0.01 -0.33 -0.03 0.00 -0.81 0.00 0.00 59.98 58.82 1xad h ARG 94 Cb 0.76 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.22 1xad h ARG 94 CO 0.06 1.00 -0.02 -0.22 -1.51 0.00 0.00 179.97 179.28 1xad h LYS 95 N 0.88 0.24 -0.14 0.20 1.63 -0.56 -2.90 116.57 115.91 1xad h LYS 95 Ca 0.16 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 1xad h LYS 95 Cb 0.57 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.17 1xad h LYS 95 CO 0.03 0.52 0.09 0.37 -3.45 0.00 0.00 179.45 177.01 1xad h GLN 96 N -0.05 0.19 -0.42 1.90 4.15 -1.25 -1.69 115.11 117.94 1xad h GLN 96 Ca 0.03 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1xad h GLN 96 Cb 0.42 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.07 1xad h GLN 96 CO 0.01 0.15 0.00 1.28 -1.93 0.00 0.00 178.83 178.34 1xad n LEU 97 N -4.97 1.32 -4.06 -2.39 4.32 -0.96 -4.90 117.00 105.36 1xad n LEU 97 Ca -0.04 -0.66 -0.45 0.00 -0.02 0.00 0.00 56.01 54.83 1xad n LEU 97 Cb 0.04 -0.26 0.02 0.00 -1.62 0.00 0.00 43.42 41.60 1xad n LEU 97 CO 0.34 0.27 -0.17 0.47 -1.22 0.00 0.00 177.39 177.07 1xad n ASP 98 N 0.05 -3.97 -4.74 -1.43 8.00 -0.64 0.23 116.55 114.06 1xad n ASP 98 Ca 0.06 -1.28 -0.37 0.00 0.71 0.00 0.00 54.79 53.91 1xad n ASP 98 Cb 0.26 -1.80 -0.06 0.00 -0.02 0.00 0.00 41.12 39.49 1xad n ASP 98 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xad s LEU 99 N -7.40 4.29 -0.01 0.64 1.43 -1.13 -1.38 118.68 115.12 1xad s LEU 99 Ca 0.47 0.73 0.01 0.00 -1.03 0.00 0.00 54.13 54.31 1xad s LEU 99 Cb -0.25 -2.57 0.02 0.00 0.03 0.00 0.00 46.19 43.42 1xad s LEU 99 CO 0.97 0.08 0.79 2.22 0.23 0.00 0.00 176.35 180.63 1xad n PHE 100 N 3.40 0.00 -3.76 0.29 1.16 0.20 -4.78 117.46 113.97 1xad n PHE 100 Ca -0.10 -0.09 -0.13 0.00 -1.87 0.00 0.00 57.45 55.26 1xad n PHE 100 Cb 0.52 -0.03 -0.10 0.00 -1.61 0.00 0.00 39.48 38.25 1xad n PHE 100 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1xad s ALA 101 N -0.24 -0.84 -0.12 1.98 0.00 -1.20 -1.47 121.76 119.87 1xad s ALA 101 Ca 0.02 0.81 0.01 0.00 0.00 0.00 0.00 51.96 52.79 1xad s ALA 101 Cb 0.02 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.75 1xad s ALA 101 CO 0.00 -0.19 -0.13 1.21 0.00 0.00 0.00 175.76 176.65 1xad s ASN 102 N -0.20 2.45 -0.18 0.00 3.04 0.32 -2.45 114.94 117.92 1xad s ASN 102 Ca -0.03 -0.42 -0.12 0.00 0.04 0.00 0.00 52.86 52.33 1xad s ASN 102 Cb -0.03 -1.06 -0.05 0.00 -1.54 0.00 0.00 41.25 38.57 1xad s ASN 102 CO 0.01 -0.04 0.21 -0.76 -3.04 0.00 0.00 177.10 173.48 1xad s LEU 103 N 1.34 4.24 -0.23 3.21 1.02 -0.05 -1.64 118.68 126.57 1xad s LEU 103 Ca 0.00 0.37 -0.02 0.00 0.02 0.00 0.00 54.13 54.51 1xad s LEU 103 Cb -0.14 -2.22 0.07 0.00 0.02 0.00 0.00 46.19 43.93 1xad s LEU 103 CO -0.07 0.16 0.05 -0.13 0.02 0.00 0.00 176.35 176.38 1xad s ARG 104 N 0.32 0.73 0.07 1.70 1.81 -0.78 -2.24 118.95 120.57 1xad s ARG 104 Ca 0.12 -0.63 -0.20 0.00 -1.72 0.00 0.00 55.73 53.30 1xad s ARG 104 Cb -0.12 -2.08 -0.07 0.00 -0.45 0.00 0.00 34.95 32.23 1xad s ARG 104 CO 0.01 -0.74 0.61 -1.25 -0.68 0.00 0.00 175.30 173.25 1xad s PRO 105 N 1.77 4.28 -0.07 3.54 0.04 -1.26 -0.58 135.00 142.72 1xad s PRO 105 Ca 0.02 0.80 0.04 0.00 0.04 0.00 0.00 61.00 61.90 1xad s PRO 105 Cb -0.17 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1xad s PRO 105 CO -0.13 0.58 -0.18 0.08 0.04 0.00 0.00 177.00 177.38 1xad s VAL 106 N -0.95 1.59 0.01 -0.36 1.01 -0.57 -4.60 120.40 116.53 1xad s VAL 106 Ca 0.30 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1xad s VAL 106 Cb -0.20 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 1xad s VAL 106 CO 0.20 0.46 -0.05 -0.75 0.00 0.00 0.00 175.10 174.95 1xad s LYS 107 N 0.34 0.38 -0.20 2.72 2.20 -1.26 -1.50 119.74 122.42 1xad s LYS 107 Ca -0.13 -0.32 0.02 0.00 -0.36 0.00 0.00 55.97 55.18 1xad s LYS 107 Cb -0.15 -0.30 0.03 0.00 -1.51 0.00 0.00 37.83 35.91 1xad s LYS 107 CO 0.05 0.07 -0.16 0.08 -0.36 0.00 0.00 175.35 175.03 1xad s VAL 108 N -0.48 2.04 -0.38 4.02 1.01 -1.16 -4.68 120.40 120.76 1xad s VAL 108 Ca -0.02 -1.14 -0.29 0.00 0.00 0.00 0.00 61.98 60.52 1xad s VAL 108 Cb -0.04 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 34.39 1xad s VAL 108 CO -0.00 0.33 1.24 -0.36 0.00 0.00 0.00 175.10 176.31 1xad s PHE 109 N 1.25 2.74 0.19 5.22 0.08 -1.26 -4.59 117.98 121.61 1xad s PHE 109 Ca 0.00 0.84 0.05 0.00 0.12 0.00 0.00 56.93 57.95 1xad s PHE 109 Cb -0.15 -4.11 0.55 0.00 -0.57 0.00 0.00 43.02 38.74 1xad s PHE 109 CO -0.10 -1.47 0.89 0.39 -0.10 0.00 0.00 175.22 174.82 1xad n GLU 110 N 7.55 -0.04 0.11 0.44 4.71 -1.26 0.66 120.64 132.81 1xad n GLU 110 Ca 0.14 0.82 -0.00 0.00 -0.01 0.00 0.00 57.16 58.11 1xad n GLU 110 Cb 0.48 -1.37 0.29 0.00 -1.01 0.00 0.00 31.44 29.83 1xad n GLU 110 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 1xad h SER 111 N 0.00 0.21 -0.63 1.62 0.02 -1.93 -0.68 113.55 112.16 1xad h SER 111 Ca 0.39 -0.07 -0.18 0.00 -0.84 0.00 0.00 61.79 61.09 1xad h SER 111 Cb 0.91 -0.06 -0.11 0.00 0.14 0.00 0.00 62.40 63.29 1xad h SER 111 CO -0.50 0.53 0.23 0.18 -1.14 0.00 0.00 176.83 176.13 1xad n LEU 112 N -4.11 5.50 -0.06 5.07 4.77 0.21 -4.55 117.00 123.83 1xad n LEU 112 Ca -0.01 -2.85 -0.08 0.00 -0.03 0.00 0.00 56.01 53.03 1xad n LEU 112 Cb 0.41 -0.71 -0.02 0.00 -2.33 0.00 0.00 43.42 40.76 1xad n LEU 112 CO 0.40 0.73 0.67 0.28 -1.33 0.00 0.00 177.39 178.14 1xad h SER 113 N 2.36 -0.90 0.00 -1.43 0.02 -1.00 -1.36 113.55 111.24 1xad h SER 113 Ca 0.22 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1xad h SER 113 Cb 2.10 0.41 0.00 0.00 0.14 0.00 0.00 62.40 65.05 1xad h SER 113 CO 0.63 -0.31 0.00 0.47 -1.14 0.00 0.00 176.83 176.48 1xad n ASP 114 N -5.40 0.00 0.03 3.07 8.00 -1.26 -1.34 116.55 119.65 1xad n ASP 114 Ca -0.01 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.60 1xad n ASP 114 Cb 0.31 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.33 1xad n ASP 114 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xad n ALA 115 N -0.95 2.96 -1.28 2.24 0.00 -0.51 -4.94 120.51 118.03 1xad n ALA 115 Ca 0.00 -0.42 -0.33 0.00 0.00 0.00 0.00 53.44 52.69 1xad n ALA 115 Cb 0.00 -0.89 0.09 0.00 0.00 0.00 0.00 19.45 18.65 1xad n ALA 115 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xad s SER 116 N -4.54 4.26 0.39 0.00 0.15 -0.45 -3.81 113.70 109.69 1xad s SER 116 Ca -0.03 2.18 0.21 0.00 0.70 0.00 0.00 55.95 59.01 1xad s SER 116 Cb 0.13 -2.57 0.33 0.00 -1.71 0.00 0.00 66.02 62.20 1xad s SER 116 CO 0.85 -2.21 1.59 -0.65 1.20 0.00 0.00 173.24 174.02 1xad h PRO 117 N -0.55 0.00 -6.90 5.44 0.11 -1.80 -3.46 132.00 124.83 1xad h PRO 117 Ca -0.46 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.16 1xad h PRO 117 Cb 1.27 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.41 1xad h PRO 117 CO 0.50 0.17 0.10 -0.51 -0.21 0.00 0.00 178.00 178.05 1xad s LEU 118 N -6.32 3.67 0.56 2.35 1.43 -1.26 -5.05 118.68 114.06 1xad s LEU 118 Ca 0.05 0.94 -0.20 0.00 -1.03 0.00 0.00 54.13 53.90 1xad s LEU 118 Cb 0.06 -3.88 -0.05 0.00 0.03 0.00 0.00 46.19 42.35 1xad s LEU 118 CO 0.69 -0.54 1.22 -0.54 0.23 0.00 0.00 176.35 177.41 1xad s LYS 119 N -4.58 3.16 0.12 1.70 1.02 -1.26 -4.87 119.74 115.02 1xad s LYS 119 Ca 0.48 1.88 -0.22 0.00 0.02 0.00 0.00 55.97 58.12 1xad s LYS 119 Cb -0.10 -2.08 -0.05 0.00 -0.52 0.00 0.00 37.83 35.08 1xad s LYS 119 CO 0.43 -1.07 1.38 1.17 -0.92 0.00 0.00 175.35 176.34 1xad n LYS 120 N -1.27 -0.32 0.01 1.68 4.81 -1.26 -0.82 118.16 120.99 1xad n LYS 120 Ca 0.12 1.35 0.21 0.00 -0.87 0.00 0.00 58.31 59.12 1xad n LYS 120 Cb 0.49 -2.00 0.56 0.00 0.02 0.00 0.00 35.03 34.10 1xad n LYS 120 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 1xad h GLU 121 N 0.00 0.00 0.00 1.64 4.11 -1.97 -0.20 114.58 118.16 1xad h GLU 121 Ca 0.12 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.40 1xad h GLU 121 Cb 0.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1xad h GLU 121 CO -0.68 0.00 -0.98 1.88 0.07 0.00 0.00 179.01 179.31 1xad h TYR 122 N 0.00 0.00 0.00 2.06 -1.99 -1.33 -3.36 116.97 112.36 1xad h TYR 122 Ca 0.28 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 60.84 1xad h TYR 122 Cb 1.87 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 40.57 1xad h TYR 122 CO 0.00 0.59 -1.55 0.44 -0.00 0.00 0.00 178.16 177.65 1xad n ILE 123 N -3.08 1.09 -1.59 -2.88 -5.35 -0.14 -4.34 119.36 103.06 1xad n ILE 123 Ca -0.04 -0.69 -0.60 0.00 -0.27 0.00 0.00 62.75 61.15 1xad n ILE 123 Cb 0.81 -0.64 -0.08 0.00 -1.74 0.00 0.00 39.64 37.99 1xad n ILE 123 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1xad n ASP 124 N -2.81 0.71 -0.34 7.28 8.00 -0.86 -1.70 116.55 126.83 1xad n ASP 124 Ca -0.11 1.16 -0.04 0.00 0.71 0.00 0.00 54.79 56.50 1xad n ASP 124 Cb 0.84 -0.96 -0.02 0.00 -0.02 0.00 0.00 41.12 40.96 1xad n ASP 124 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1xad n ASN 125 N 2.57 -4.28 -4.71 -2.24 5.03 -1.26 -4.72 115.26 105.65 1xad n ASN 125 Ca 0.23 0.11 -0.42 0.00 0.87 0.00 0.00 54.58 55.37 1xad n ASN 125 Cb 0.06 -2.16 -0.03 0.00 -1.02 0.00 0.00 39.78 36.63 1xad n ASN 125 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1xad s VAL 126 N -1.91 2.54 -0.29 2.41 1.01 -0.69 -4.75 120.40 118.72 1xad s VAL 126 Ca 0.00 0.30 0.04 0.00 0.00 0.00 0.00 61.98 62.32 1xad s VAL 126 Cb 0.00 -3.19 0.20 0.00 0.00 0.00 0.00 36.38 33.39 1xad s VAL 126 CO 0.00 0.02 0.65 -0.62 0.00 0.00 0.00 175.10 175.14 1xad s ASP 127 N 1.58 -1.48 0.13 3.32 2.15 -1.25 -3.01 116.67 118.11 1xad s ASP 127 Ca 0.73 0.18 -0.09 0.00 0.43 0.00 0.00 52.55 53.80 1xad s ASP 127 Cb -0.45 1.94 -0.00 0.00 -0.30 0.00 0.00 42.92 44.11 1xad s ASP 127 CO 0.32 -0.27 0.25 0.72 -0.17 0.00 0.00 175.17 176.02 1xad s PHE 128 N 2.85 0.29 -0.17 -5.34 -0.12 -0.56 -4.59 117.98 110.34 1xad s PHE 128 Ca 0.12 -0.67 -0.01 0.00 -0.05 0.00 0.00 56.93 56.32 1xad s PHE 128 Cb -0.09 -0.05 0.04 0.00 -0.63 0.00 0.00 43.02 42.29 1xad s PHE 128 CO -0.26 -0.65 -0.05 0.08 -0.05 0.00 0.00 175.22 174.29 1xad s VAL 129 N -3.92 1.10 -0.13 -2.49 1.01 0.55 -1.51 120.40 115.00 1xad s VAL 129 Ca 0.12 -0.63 -0.20 0.00 0.00 0.00 0.00 61.98 61.28 1xad s VAL 129 Cb 0.04 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 1xad s VAL 129 CO -0.05 0.12 0.55 -0.63 0.00 0.00 0.00 175.10 175.09 1xad s ILE 130 N 1.64 5.13 -0.24 2.22 1.01 0.25 -1.08 121.20 130.13 1xad s ILE 130 Ca 0.01 1.08 -0.02 0.00 0.00 0.00 0.00 60.65 61.72 1xad s ILE 130 Cb -0.15 -3.88 0.02 0.00 0.01 0.00 0.00 42.46 38.46 1xad s ILE 130 CO -0.08 0.26 -0.07 0.68 0.00 0.00 0.00 174.94 175.73 1xad s VAL 131 N 0.97 2.83 -0.18 2.92 -7.23 0.21 -1.86 120.40 118.06 1xad s VAL 131 Ca 0.28 -0.96 -0.07 0.00 -1.81 0.00 0.00 61.98 59.42 1xad s VAL 131 Cb -0.16 -2.40 -0.04 0.00 0.56 0.00 0.00 36.38 34.34 1xad s VAL 131 CO 0.12 0.26 0.05 -0.60 -0.31 0.00 0.00 175.10 174.61 1xad s ARG 132 N 1.33 3.92 0.50 4.82 3.52 -0.65 -1.74 118.95 130.66 1xad s ARG 132 Ca 0.01 -0.37 -0.23 0.00 -0.13 0.00 0.00 55.73 55.01 1xad s ARG 132 Cb -0.16 -3.18 -0.07 0.00 -1.56 0.00 0.00 34.95 29.98 1xad s ARG 132 CO -0.05 0.25 1.38 -1.91 -0.81 0.00 0.00 175.30 174.16 1xad n GLU 133 N 3.59 1.92 -0.01 5.12 0.00 -0.65 -0.52 120.64 130.09 1xad n GLU 133 Ca -0.17 0.70 0.03 0.00 0.00 0.00 0.00 57.16 57.72 1xad n GLU 133 Cb 0.52 -2.58 -0.06 0.00 0.00 0.00 0.00 31.44 29.32 1xad n GLU 133 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1xad n LEU 134 N -0.61 0.00 -0.06 4.31 4.77 -0.54 -3.83 117.00 121.04 1xad n LEU 134 Ca 0.08 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.07 1xad n LEU 134 Cb 0.43 0.02 0.01 0.00 -2.33 0.00 0.00 43.42 41.55 1xad n LEU 134 CO 0.56 0.02 0.29 0.35 -1.33 0.00 0.00 177.39 177.29 1xad n THR 135 N -1.84 0.09 -4.28 -5.08 -2.24 -1.26 -5.00 114.28 94.67 1xad n THR 135 Ca -0.03 -0.54 -0.12 0.00 -2.27 0.00 0.00 64.05 61.09 1xad n THR 135 Cb 0.27 0.98 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 1xad n THR 135 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xad n GLY 136 N 0.03 3.95 7.00 3.38 0.00 -1.26 -4.84 105.19 113.46 1xad n GLY 136 Ca 0.01 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.76 1xad n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xad n GLY 137 N 2.72 -0.90 0.44 -0.02 0.00 -1.22 -4.44 105.19 101.77 1xad n GLY 137 Ca -0.08 -1.18 0.26 0.00 0.00 0.00 0.00 46.02 45.01 1xad n GLY 137 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1xad h ILE 138 N 0.00 0.51 0.00 -0.61 2.10 -1.85 0.47 117.51 118.13 1xad h ILE 138 Ca 0.00 0.00 -0.07 0.00 1.08 0.00 0.00 64.86 65.87 1xad h ILE 138 Cb 0.00 0.58 -0.01 0.00 -1.09 0.00 0.00 36.82 36.30 1xad h ILE 138 CO 0.00 0.00 -0.32 1.88 -1.08 0.00 0.00 178.15 178.63 1xad h TYR 139 N 0.00 0.00 0.00 2.19 0.05 -1.87 -3.36 116.97 113.99 1xad h TYR 139 Ca 0.35 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 59.09 1xad h TYR 139 Cb 1.51 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.24 1xad h TYR 139 CO 0.00 0.32 -1.23 1.19 -1.05 0.00 0.00 178.16 177.40 1xad n PHE 140 N -3.54 0.00 -1.31 4.88 3.72 0.42 -5.06 117.46 116.57 1xad n PHE 140 Ca -0.00 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.04 1xad n PHE 140 Cb 0.47 -0.15 0.09 0.00 -0.94 0.00 0.00 39.48 38.95 1xad n PHE 140 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xad n GLY 141 N 2.58 -0.58 3.13 1.37 0.00 0.14 -4.99 105.19 106.85 1xad n GLY 141 Ca -0.04 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.50 1xad n GLY 141 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xad s GLU 142 N -3.33 0.53 0.67 1.61 2.12 -1.26 -4.34 118.70 114.70 1xad s GLU 142 Ca 0.72 -0.37 -0.12 0.00 0.36 0.00 0.00 54.97 55.56 1xad s GLU 142 Cb -0.34 0.22 -0.00 0.00 0.26 0.00 0.00 34.13 34.27 1xad s GLU 142 CO 0.52 -0.13 1.06 -2.14 -0.54 0.00 0.00 175.26 174.03 1xad s PRO 143 N -1.40 3.01 0.13 4.30 0.02 -1.26 -4.81 135.00 134.99 1xad s PRO 143 Ca -0.14 1.02 -0.04 0.00 0.02 0.00 0.00 61.00 61.85 1xad s PRO 143 Cb -0.07 -2.00 -0.03 0.00 0.02 0.00 0.00 34.50 32.43 1xad s PRO 143 CO 0.02 -1.05 0.14 -0.98 -0.33 0.00 0.00 177.00 174.80 1xad s ARG 144 N -4.82 0.98 0.00 5.54 1.70 -1.26 -2.87 118.95 118.23 1xad s ARG 144 Ca 0.59 -1.30 0.00 0.00 -0.47 0.00 0.00 55.73 54.55 1xad s ARG 144 Cb -0.14 0.29 0.00 0.00 -0.57 0.00 0.00 34.95 34.53 1xad s ARG 144 CO 0.51 -0.31 0.00 0.41 -1.08 0.00 0.00 175.30 174.83 1xad n GLY 145 N -0.12 -1.29 3.61 3.88 0.00 -1.08 -4.90 105.19 105.29 1xad n GLY 145 Ca -0.07 -1.01 -0.07 0.00 0.00 0.00 0.00 46.02 44.87 1xad n GLY 145 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xad s MET 146 N -1.67 0.68 0.34 1.61 0.00 -1.26 -2.27 119.30 116.73 1xad s MET 146 Ca 0.00 1.20 0.03 0.00 0.00 0.00 0.00 55.69 56.92 1xad s MET 146 Cb 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 34.83 34.96 1xad s MET 146 CO 0.00 -0.15 0.10 -1.13 0.00 0.00 0.00 175.02 173.84 1xad n SER 147 N 4.34 1.50 0.15 1.11 3.41 0.20 -4.97 113.62 119.37 1xad n SER 147 Ca -0.20 -2.74 0.02 0.00 -0.26 0.00 0.00 58.87 55.69 1xad n SER 147 Cb 0.59 0.73 0.19 0.00 -0.26 0.00 0.00 64.21 65.46 1xad n SER 147 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1xad h GLU 148 N 0.00 0.00 0.11 4.33 4.22 -2.06 -3.30 114.58 117.88 1xad h GLU 148 Ca -0.27 0.00 -0.25 0.00 0.08 0.00 0.00 59.36 58.92 1xad h GLU 148 Cb 0.98 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.25 1xad h GLU 148 CO 0.43 0.53 -1.04 0.00 -2.18 0.00 0.00 179.01 176.75 1xad h ALA 149 N 1.47 -0.02 -3.48 2.92 0.00 -2.05 -3.49 119.26 114.60 1xad h ALA 149 Ca -0.01 -0.72 -0.16 0.00 0.00 0.00 0.00 54.91 54.03 1xad h ALA 149 Cb 1.14 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 1xad h ALA 149 CO 0.07 0.55 0.05 -0.85 0.00 0.00 0.00 179.25 179.06 1xad n GLU 150 N -3.95 0.86 -3.81 0.00 0.28 -1.24 -5.18 120.64 107.59 1xad n GLU 150 Ca -0.13 -2.40 -0.12 0.00 -0.16 0.00 0.00 57.16 54.35 1xad n GLU 150 Cb 0.89 2.59 -0.10 0.00 1.43 0.00 0.00 31.44 36.25 1xad n GLU 150 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1xad s ALA 151 N -2.39 -0.56 0.15 -1.84 0.00 -1.26 0.61 121.76 116.47 1xad s ALA 151 Ca 0.22 0.25 -0.01 0.00 0.00 0.00 0.00 51.96 52.42 1xad s ALA 151 Cb -0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 1xad s ALA 151 CO 0.16 -0.20 0.08 1.67 0.00 0.00 0.00 175.76 177.46 1xad s TRP 152 N -0.94 0.97 -0.29 0.00 -0.00 -0.96 -4.96 118.94 112.75 1xad s TRP 152 Ca -0.10 -1.27 -0.16 0.00 -0.00 0.00 0.00 56.10 54.57 1xad s TRP 152 Cb -0.05 -0.52 0.17 0.00 -0.00 0.00 0.00 33.47 33.07 1xad s TRP 152 CO 0.02 -0.54 1.08 -0.80 -0.00 0.00 0.00 176.95 176.71 1xad s ASN 153 N -3.09 -0.35 -0.16 -2.66 -0.87 -1.26 -2.63 114.94 103.91 1xad s ASN 153 Ca 0.29 0.56 -0.05 0.00 -1.57 0.00 0.00 52.86 52.09 1xad s ASN 153 Cb 0.07 1.17 -0.03 0.00 -0.02 0.00 0.00 41.25 42.44 1xad s ASN 153 CO 0.05 -0.09 -0.01 -0.89 -2.57 0.00 0.00 177.10 173.60 1xad s THR 154 N 1.32 4.17 -0.14 1.60 2.01 -1.14 -5.02 115.64 118.44 1xad s THR 154 Ca -0.08 -0.26 -0.23 0.00 0.31 0.00 0.00 61.69 61.43 1xad s THR 154 Cb -0.03 -2.85 -0.03 0.00 0.01 0.00 0.00 72.50 69.61 1xad s THR 154 CO -0.13 0.48 0.73 -0.70 -0.69 0.00 0.00 174.62 174.30 1xad s GLU 155 N 0.37 4.32 -0.04 4.92 2.56 -1.26 -3.48 118.70 126.09 1xad s GLU 155 Ca -0.02 0.85 -0.02 0.00 0.00 0.00 0.00 54.97 55.78 1xad s GLU 155 Cb -0.14 -3.53 0.02 0.00 2.00 0.00 0.00 34.13 32.48 1xad s GLU 155 CO 0.02 -0.16 0.08 0.50 -0.56 0.00 0.00 175.26 175.14 1xad s ARG 156 N 1.60 0.07 -0.02 4.30 3.52 -1.26 -4.85 118.95 122.32 1xad s ARG 156 Ca 0.35 0.18 -0.05 0.00 -0.13 0.00 0.00 55.73 56.08 1xad s ARG 156 Cb -0.17 -0.05 0.00 0.00 -1.56 0.00 0.00 34.95 33.18 1xad s ARG 156 CO 0.14 -0.07 0.11 0.71 -0.81 0.00 0.00 175.30 175.38 1xad s TYR 157 N 0.45 -0.00 0.23 5.12 2.02 -1.26 -3.40 117.35 120.50 1xad s TYR 157 Ca -0.03 0.00 0.08 0.00 -0.37 0.00 0.00 57.07 56.75 1xad s TYR 157 Cb -0.05 -0.03 -0.04 0.00 -0.40 0.00 0.00 41.96 41.44 1xad s TYR 157 CO -0.02 -0.18 0.06 -1.12 -1.57 0.00 0.00 175.55 172.72 1xad s SER 158 N -0.80 4.92 0.20 2.29 0.01 -1.26 -5.02 113.70 114.03 1xad s SER 158 Ca -0.09 -0.44 -0.14 0.00 1.31 0.00 0.00 55.95 56.59 1xad s SER 158 Cb -0.05 -1.07 0.20 0.00 0.21 0.00 0.00 66.02 65.31 1xad s SER 158 CO 0.01 0.02 1.65 0.50 0.41 0.00 0.00 173.24 175.83 1xad h LYS 159 N 2.04 0.03 -0.30 12.44 3.64 -2.00 -2.33 116.57 130.11 1xad h LYS 159 Ca -0.46 -0.00 0.07 0.00 -1.27 0.00 0.00 60.65 58.98 1xad h LYS 159 Cb 1.23 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.97 1xad h LYS 159 CO 0.60 0.02 -0.22 -1.00 -2.27 0.00 0.00 179.45 176.58 1xad h PRO 160 N 0.03 -0.19 0.00 1.90 0.13 -1.98 0.42 132.00 132.31 1xad h PRO 160 Ca 0.27 0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.41 1xad h PRO 160 Cb 0.42 0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.59 1xad h PRO 160 CO -0.53 -0.12 -0.02 0.93 -0.23 0.00 0.00 178.00 178.03 1xad h GLU 161 N -0.19 0.00 0.20 0.86 5.08 -1.83 -0.43 114.58 118.26 1xad h GLU 161 Ca 0.16 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.20 1xad h GLU 161 Cb 0.43 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.71 1xad h GLU 161 CO -0.41 0.02 -1.41 0.28 -1.00 0.00 0.00 179.01 176.49 1xad h VAL 162 N 0.00 1.35 -0.06 3.13 2.07 0.04 -3.26 116.25 119.51 1xad h VAL 162 Ca -0.00 -2.84 -0.10 0.00 0.82 0.00 0.00 66.70 64.58 1xad h VAL 162 Cb 0.03 2.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 1xad h VAL 162 CO 0.00 0.85 -0.41 -0.33 0.02 0.00 0.00 177.57 177.70 1xad h GLU 163 N 0.11 0.12 0.23 1.57 5.08 -0.25 -1.87 114.58 119.58 1xad h GLU 163 Ca -0.21 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.08 1xad h GLU 163 Cb 2.08 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.33 1xad h GLU 163 CO 0.24 0.52 -0.11 0.00 -1.00 0.00 0.00 179.01 178.65 1xad h ARG 164 N 0.11 -0.30 0.00 2.33 3.08 -1.15 -1.50 114.38 116.95 1xad h ARG 164 Ca 0.01 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1xad h ARG 164 Cb 0.77 0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.89 1xad h ARG 164 CO 0.06 -0.20 -0.00 -0.24 -1.07 0.00 0.00 179.97 178.52 1xad h VAL 165 N -0.32 0.72 -0.48 2.04 3.04 -1.62 -0.11 116.25 119.53 1xad h VAL 165 Ca -0.03 -0.00 -0.10 0.00 -1.01 0.00 0.00 66.70 65.56 1xad h VAL 165 Cb 0.24 1.00 -0.02 0.00 -2.01 0.00 0.00 31.29 30.51 1xad h VAL 165 CO 0.05 0.00 -0.10 0.00 -1.01 0.00 0.00 177.57 176.51 1xad h ALA 166 N 2.00 0.66 -0.45 3.17 0.00 -1.10 -2.57 119.26 120.96 1xad h ALA 166 Ca -0.00 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1xad h ALA 166 Cb 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1xad h ALA 166 CO 0.00 0.55 -0.05 0.00 0.00 0.00 0.00 179.25 179.75 1xad h ARG 167 N 0.76 0.78 -0.91 0.00 3.08 0.07 0.05 114.38 118.20 1xad h ARG 167 Ca 0.12 -0.23 0.07 0.00 0.07 0.00 0.00 59.98 60.01 1xad h ARG 167 Cb 0.65 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.56 1xad h ARG 167 CO 0.04 0.82 0.59 0.28 -1.07 0.00 0.00 179.97 180.64 1xad h VAL 168 N 0.71 1.06 -0.39 2.04 2.07 -1.54 0.26 116.25 120.46 1xad h VAL 168 Ca 0.13 -0.35 -0.14 0.00 0.82 0.00 0.00 66.70 67.16 1xad h VAL 168 Cb 0.51 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1xad h VAL 168 CO 0.03 0.19 -0.30 0.00 0.02 0.00 0.00 177.57 177.51 1xad h ALA 169 N 1.51 0.57 -0.00 1.67 0.00 -0.59 0.65 119.26 123.06 1xad h ALA 169 Ca 0.40 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1xad h ALA 169 Cb 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1xad h ALA 169 CO -0.15 0.61 -0.25 0.74 0.00 0.00 0.00 179.25 180.20 1xad h PHE 170 N 0.71 0.26 -0.46 0.00 0.04 -0.55 -0.88 116.94 116.06 1xad h PHE 170 Ca 0.07 -0.14 0.03 0.00 2.80 0.00 0.00 57.97 60.74 1xad h PHE 170 Cb 0.88 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.97 1xad h PHE 170 CO 0.06 0.93 0.30 0.93 -0.60 0.00 0.00 178.31 179.94 1xad h GLU 171 N -0.49 0.50 0.00 1.51 4.39 -0.55 0.20 114.58 120.14 1xad h GLU 171 Ca -0.03 -0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.55 1xad h GLU 171 Cb 0.99 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.52 1xad h GLU 171 CO 0.05 0.33 -0.43 0.00 -1.16 0.00 0.00 179.01 177.79 1xad h ALA 172 N 1.73 1.20 -0.17 3.43 0.00 0.60 -3.05 119.26 123.01 1xad h ALA 172 Ca 0.18 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1xad h ALA 172 Cb 0.09 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1xad h ALA 172 CO -0.04 0.54 -0.18 0.00 0.00 0.00 0.00 179.25 179.57 1xad h ALA 173 N 1.57 0.25 -1.06 0.00 0.00 0.75 -3.10 119.26 117.65 1xad h ALA 173 Ca -0.00 -0.34 0.28 0.00 0.00 0.00 0.00 54.91 54.84 1xad h ALA 173 Cb 0.81 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.45 1xad h ALA 173 CO 0.06 0.16 0.69 0.00 0.00 0.00 0.00 179.25 180.16 1xad h ARG 174 N 0.06 0.33 0.00 0.00 3.08 -0.85 -1.06 114.38 115.94 1xad h ARG 174 Ca 0.02 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xad h ARG 174 Cb 0.73 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.70 1xad h ARG 174 CO 0.04 0.22 -0.15 1.63 -1.07 0.00 0.00 179.97 180.64 1xad n LYS 175 N -4.60 0.21 0.00 0.04 5.02 -1.17 -4.76 118.16 112.90 1xad n LYS 175 Ca 0.26 0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.69 1xad n LYS 175 Cb 0.94 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 34.23 1xad n LYS 175 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1xad n ARG 176 N -2.07 2.45 0.00 1.97 1.85 -0.46 -5.02 116.66 115.38 1xad n ARG 176 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.90 1xad n ARG 176 Cb 0.41 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.82 1xad n ARG 176 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1xad n ARG 177 N 0.00 0.63 -3.44 2.89 1.74 -1.25 -4.86 116.66 112.37 1xad n ARG 177 Ca 0.00 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.88 1xad n ARG 177 Cb 0.00 -1.20 0.07 0.00 -1.02 0.00 0.00 32.46 30.31 1xad n ARG 177 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1xad n LYS 178 N -0.07 -6.88 -3.76 5.56 5.02 -0.88 -4.97 118.16 112.18 1xad n LYS 178 Ca 0.00 0.73 -0.14 0.00 -2.02 0.00 0.00 58.31 56.89 1xad n LYS 178 Cb 0.10 -5.49 -0.15 0.00 -0.02 0.00 0.00 35.03 29.48 1xad n LYS 178 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1xad s HIS 179 N -3.29 -0.13 -0.02 2.13 0.09 -1.26 -1.88 115.29 110.93 1xad s HIS 179 Ca 0.44 0.42 -0.00 0.00 -0.00 0.00 0.00 55.06 55.92 1xad s HIS 179 Cb -0.19 -0.10 -0.04 0.00 -0.00 0.00 0.00 32.58 32.25 1xad s HIS 179 CO 0.64 -0.15 0.06 0.08 -0.00 0.00 0.00 174.74 175.38 1xad s VAL 180 N 1.09 4.61 -0.19 -0.90 1.01 -0.19 -1.18 120.40 124.66 1xad s VAL 180 Ca -0.09 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.50 1xad s VAL 180 Cb -0.11 -3.08 0.03 0.00 0.00 0.00 0.00 36.38 33.22 1xad s VAL 180 CO -0.05 0.39 -0.17 -0.69 0.00 0.00 0.00 175.10 174.58 1xad s VAL 181 N -1.14 1.93 0.10 2.92 1.01 -0.54 -2.56 120.40 122.13 1xad s VAL 181 Ca 0.21 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 61.11 1xad s VAL 181 Cb -0.12 -1.82 -0.06 0.00 0.00 0.00 0.00 36.38 34.38 1xad s VAL 181 CO 0.12 0.42 0.45 -0.55 0.00 0.00 0.00 175.10 175.53 1xad s SER 182 N 1.32 6.70 -0.17 3.32 0.15 -0.16 -1.65 113.70 123.21 1xad s SER 182 Ca 0.03 0.89 -0.03 0.00 0.70 0.00 0.00 55.95 57.54 1xad s SER 182 Cb -0.14 -2.21 -0.02 0.00 -1.71 0.00 0.00 66.02 61.93 1xad s SER 182 CO -0.11 0.15 -0.06 -0.69 1.20 0.00 0.00 173.24 173.72 1xad s VAL 183 N -1.43 3.53 0.17 4.45 1.01 -0.84 -0.68 120.40 126.62 1xad s VAL 183 Ca 0.35 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.83 1xad s VAL 183 Cb -0.14 -2.55 0.01 0.00 0.00 0.00 0.00 36.38 33.70 1xad s VAL 183 CO 0.18 0.48 0.26 -0.90 0.00 0.00 0.00 175.10 175.13 1xad n ASP 184 N 3.89 -0.74 -2.73 3.32 5.68 -0.56 -4.48 116.55 120.92 1xad n ASP 184 Ca -0.18 -1.87 -0.20 0.00 -0.50 0.00 0.00 54.79 52.04 1xad n ASP 184 Cb 0.52 1.33 -0.00 0.00 -1.14 0.00 0.00 41.12 41.83 1xad n ASP 184 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1xad n LYS 185 N -0.27 2.35 0.25 0.11 3.00 -1.26 -1.09 118.16 121.25 1xad n LYS 185 Ca -0.01 -4.04 0.12 0.00 -0.00 0.00 0.00 58.31 54.39 1xad n LYS 185 Cb 0.28 -1.87 0.67 0.00 0.00 0.00 0.00 35.03 34.10 1xad n LYS 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1xad h ALA 186 N 2.85 1.21 -0.00 3.14 0.00 -1.76 0.53 119.26 125.22 1xad h ALA 186 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1xad h ALA 186 Cb 0.92 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1xad h ALA 186 CO 0.69 0.18 -0.04 0.27 0.00 0.00 0.00 179.25 180.35 1xad n ASN 187 N -3.56 0.22 0.00 0.00 0.23 -1.26 -4.44 115.26 106.45 1xad n ASN 187 Ca -0.01 -0.54 0.00 0.00 -0.53 0.00 0.00 54.58 53.50 1xad n ASN 187 Cb 0.28 -0.14 0.00 0.00 -2.08 0.00 0.00 39.78 37.85 1xad n ASN 187 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 1xad n VAL 188 N -1.05 0.00 -3.93 3.53 0.31 -0.99 -5.11 118.33 111.09 1xad n VAL 188 Ca 0.17 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.22 1xad n VAL 188 Cb 0.23 -0.72 -0.03 0.00 -0.91 0.00 0.00 33.84 32.41 1xad n VAL 188 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1xad s LEU 189 N -4.95 4.35 -0.01 7.52 1.43 0.14 -5.02 118.68 122.14 1xad s LEU 189 Ca 0.00 0.21 0.14 0.00 -1.03 0.00 0.00 54.13 53.45 1xad s LEU 189 Cb 0.00 -2.93 -0.20 0.00 0.03 0.00 0.00 46.19 43.08 1xad s LEU 189 CO 0.00 0.09 0.71 -1.84 0.23 0.00 0.00 176.35 175.54 1xad n GLU 190 N -0.27 0.63 -0.29 1.70 0.00 -1.26 -2.78 120.64 118.36 1xad n GLU 190 Ca -0.06 0.28 0.11 0.00 0.00 0.00 0.00 57.16 57.48 1xad n GLU 190 Cb 0.53 -1.80 0.27 0.00 0.00 0.00 0.00 31.44 30.44 1xad n GLU 190 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1xad h VAL 191 N 0.00 0.52 0.00 3.84 2.07 -1.93 0.33 116.25 121.08 1xad h VAL 191 Ca -0.25 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 1xad h VAL 191 Cb 1.89 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1xad h VAL 191 CO 0.07 0.07 -0.03 1.23 0.02 0.00 0.00 177.57 178.93 1xad h GLY 192 N 0.41 0.00 1.22 2.17 0.00 -1.78 -0.01 103.07 105.08 1xad h GLY 192 Ca 0.52 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.63 1xad h GLY 192 CO -0.50 0.00 -0.77 0.83 0.00 0.00 0.00 176.54 176.11 1xad h GLU 193 N 0.00 0.76 0.53 4.80 5.08 -0.20 -2.38 114.58 123.17 1xad h GLU 193 Ca -0.00 -0.62 -0.03 0.00 -1.00 0.00 0.00 59.36 57.72 1xad h GLU 193 Cb 0.70 0.13 0.01 0.00 0.50 0.00 0.00 28.75 30.09 1xad h GLU 193 CO 0.00 1.23 -0.25 0.35 -1.00 0.00 0.00 179.01 179.34 1xad h PHE 194 N 0.52 -0.66 -0.93 4.33 3.57 -1.20 0.63 116.94 123.20 1xad h PHE 194 Ca -0.05 -0.02 0.22 0.00 3.53 0.00 0.00 57.97 61.66 1xad h PHE 194 Cb 1.39 0.22 -0.17 0.00 2.79 0.00 0.00 35.95 40.17 1xad h PHE 194 CO 0.08 -0.41 -0.07 2.35 -2.23 0.00 0.00 178.31 178.03 1xad h TRP 195 N -0.73 -0.21 -0.40 0.41 2.91 -1.13 -1.04 115.95 115.77 1xad h TRP 195 Ca -0.07 0.07 -0.03 0.00 1.13 0.00 0.00 58.89 59.99 1xad h TRP 195 Cb 0.54 0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 29.42 1xad h TRP 195 CO 0.10 -0.39 0.12 -0.09 -1.03 0.00 0.00 178.44 177.16 1xad h ARG 196 N 0.02 0.62 -0.13 2.65 2.43 -0.84 -1.48 114.38 117.65 1xad h ARG 196 Ca 0.51 -0.13 -0.21 0.00 -0.81 0.00 0.00 59.98 59.34 1xad h ARG 196 Cb 0.94 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.41 1xad h ARG 196 CO -0.89 0.62 -0.74 1.57 -1.51 0.00 0.00 179.97 179.01 1xad h LYS 197 N 0.49 0.64 0.22 0.20 2.10 0.36 -2.74 116.57 117.84 1xad h LYS 197 Ca 0.13 -0.51 -0.01 0.00 -2.00 0.00 0.00 60.65 58.25 1xad h LYS 197 Cb 0.26 0.10 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 1xad h LYS 197 CO -0.00 1.13 -0.10 1.15 -2.00 0.00 0.00 179.45 179.63 1xad h THR 198 N 0.44 0.81 -0.24 0.07 2.02 -1.27 0.11 112.91 114.86 1xad h THR 198 Ca -0.04 -0.13 0.07 0.00 0.77 0.00 0.00 66.41 67.08 1xad h THR 198 Cb 1.35 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.64 1xad h THR 198 CO 0.14 0.03 0.33 0.58 0.37 0.00 0.00 175.52 176.97 1xad h VAL 199 N -0.35 0.31 0.00 3.16 2.07 -1.26 0.48 116.25 120.66 1xad h VAL 199 Ca -0.03 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.34 1xad h VAL 199 Cb 0.27 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1xad h VAL 199 CO 0.05 0.00 -1.07 -0.33 0.02 0.00 0.00 177.57 176.24 1xad h GLU 200 N 0.00 0.00 0.11 1.57 4.39 -0.71 -2.52 114.58 117.43 1xad h GLU 200 Ca 0.11 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 1xad h GLU 200 Cb 0.77 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 1xad h GLU 200 CO -0.00 0.41 -0.05 1.49 -1.16 0.00 0.00 179.01 179.70 1xad h GLU 201 N 0.00 -0.14 0.00 2.33 4.81 0.12 -3.16 114.58 118.54 1xad h GLU 201 Ca -0.10 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1xad h GLU 201 Cb 1.53 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.94 1xad h GLU 201 CO 0.06 0.34 -0.01 0.28 -0.73 0.00 0.00 179.01 178.95 1xad h VAL 202 N -0.74 0.61 0.00 0.32 2.07 -1.29 0.25 116.25 117.46 1xad h VAL 202 Ca -0.01 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1xad h VAL 202 Cb 0.55 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1xad h VAL 202 CO 0.02 0.01 0.00 0.61 0.02 0.00 0.00 177.57 178.24 1xad n GLY 203 N -1.30 -1.29 0.20 2.17 0.00 -0.95 -2.37 105.19 101.64 1xad n GLY 203 Ca -0.03 0.04 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 1xad n GLY 203 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1xad h ARG 204 N 0.00 0.17 0.00 1.61 3.08 -1.02 -1.93 114.38 116.30 1xad h ARG 204 Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1xad h ARG 204 Cb 0.40 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1xad h ARG 204 CO 0.00 0.53 0.00 0.41 -1.07 0.00 0.00 179.97 179.84 1xad n GLY 205 N -0.32 -1.43 2.37 0.04 0.00 -1.00 -3.90 105.19 100.95 1xad n GLY 205 Ca -0.01 -0.08 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 1xad n GLY 205 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1xad n TYR 206 N -1.61 3.13 -0.06 1.61 4.02 -0.72 -4.92 117.16 118.61 1xad n TYR 206 Ca 0.06 -2.72 0.18 0.00 -0.01 0.00 0.00 57.90 55.42 1xad n TYR 206 Cb 0.32 -0.43 0.28 0.00 -0.02 0.00 0.00 39.34 39.49 1xad n TYR 206 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1xad n PRO 207 N -0.60 0.02 -0.02 -0.72 -0.04 -1.25 -1.77 135.00 130.61 1xad n PRO 207 Ca 0.45 0.91 0.12 0.00 -0.04 0.00 0.00 63.50 64.94 1xad n PRO 207 Cb 0.71 -2.33 0.56 0.00 -0.04 0.00 0.00 33.50 32.40 1xad n PRO 207 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1xad n ASP 208 N -2.86 0.73 -4.15 3.54 5.75 -1.26 -4.81 116.55 113.49 1xad n ASP 208 Ca 0.15 -1.44 -0.26 0.00 -0.01 0.00 0.00 54.79 53.23 1xad n ASP 208 Cb 1.27 -0.03 -0.16 0.00 -1.03 0.00 0.00 41.12 41.16 1xad n ASP 208 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1xad s VAL 209 N -1.94 1.44 0.06 2.12 1.01 -0.73 -4.90 120.40 117.47 1xad s VAL 209 Ca 0.34 -0.74 -0.21 0.00 0.00 0.00 0.00 61.98 61.38 1xad s VAL 209 Cb 0.17 -1.23 -0.06 0.00 0.00 0.00 0.00 36.38 35.26 1xad s VAL 209 CO 0.27 0.41 0.61 0.00 0.00 0.00 0.00 175.10 176.40 1xad s ALA 210 N -0.06 3.53 -0.03 5.51 0.00 -0.79 -4.95 121.76 124.97 1xad s ALA 210 Ca -0.01 0.08 0.05 0.00 0.00 0.00 0.00 51.96 52.08 1xad s ALA 210 Cb -0.11 -2.72 -0.02 0.00 0.00 0.00 0.00 23.12 20.27 1xad s ALA 210 CO 0.02 0.30 -0.18 -1.17 0.00 0.00 0.00 175.76 174.73 1xad s LEU 211 N -0.79 2.50 0.10 0.00 2.96 -1.26 -1.02 118.68 121.17 1xad s LEU 211 Ca 0.31 -0.30 -0.03 0.00 -0.22 0.00 0.00 54.13 53.89 1xad s LEU 211 Cb -0.20 -1.48 -0.03 0.00 0.50 0.00 0.00 46.19 44.98 1xad s LEU 211 CO 0.19 0.33 0.07 -0.70 -1.32 0.00 0.00 176.35 174.92 1xad s GLU 212 N -0.75 0.83 0.16 1.98 2.12 -1.06 -5.00 118.70 116.97 1xad s GLU 212 Ca 0.11 -1.27 0.08 0.00 0.36 0.00 0.00 54.97 54.25 1xad s GLU 212 Cb -0.10 0.26 -0.04 0.00 0.26 0.00 0.00 34.13 34.50 1xad s GLU 212 CO 0.00 -0.22 -0.17 -1.01 -0.54 0.00 0.00 175.26 173.31 1xad s HIS 213 N -3.97 1.75 0.08 5.30 3.76 -1.26 -0.99 115.29 119.96 1xad s HIS 213 Ca 0.15 -0.49 -0.13 0.00 -0.15 0.00 0.00 55.06 54.45 1xad s HIS 213 Cb 0.07 -0.88 0.02 0.00 1.11 0.00 0.00 32.58 32.90 1xad s HIS 213 CO -0.04 0.30 0.29 -0.65 -0.85 0.00 0.00 174.74 173.79 1xad s GLN 214 N -2.80 0.89 0.21 1.40 -0.21 0.15 -4.86 119.66 114.43 1xad s GLN 214 Ca 0.15 -0.72 -0.13 0.00 0.02 0.00 0.00 55.36 54.68 1xad s GLN 214 Cb -0.05 0.38 -0.07 0.00 1.00 0.00 0.00 33.01 34.26 1xad s GLN 214 CO 0.06 -0.30 0.58 0.71 -2.12 0.00 0.00 175.29 174.22 1xad s TYR 215 N -3.34 3.51 0.43 0.91 2.02 -1.26 -1.50 117.35 118.12 1xad s TYR 215 Ca 0.01 1.03 0.15 0.00 -0.37 0.00 0.00 57.07 57.89 1xad s TYR 215 Cb 0.02 -2.36 1.05 0.00 -0.40 0.00 0.00 41.96 40.27 1xad s TYR 215 CO -0.08 0.32 1.93 -0.24 -1.57 0.00 0.00 175.55 175.90 1xad h VAL 216 N 2.37 0.80 0.00 0.71 3.04 -1.45 -0.05 116.25 121.68 1xad h VAL 216 Ca -0.48 -0.14 -0.23 0.00 -1.01 0.00 0.00 66.70 64.84 1xad h VAL 216 Cb 1.18 0.35 0.00 0.00 -2.01 0.00 0.00 31.29 30.82 1xad h VAL 216 CO 0.67 0.08 -0.95 -2.24 -1.01 0.00 0.00 177.57 174.12 1xad h ASP 217 N 0.42 0.54 0.56 3.17 3.04 -1.94 0.89 116.42 123.09 1xad h ASP 217 Ca 0.36 -0.43 -0.17 0.00 -3.24 0.00 0.00 57.03 53.55 1xad h ASP 217 Cb 0.82 -0.16 -0.01 0.00 -1.04 0.00 0.00 39.33 38.93 1xad h ASP 217 CO -0.11 1.23 -0.76 0.00 -2.04 0.00 0.00 179.24 177.56 1xad h ALA 218 N 0.73 0.68 -0.09 4.15 0.00 -1.44 -2.92 119.26 120.38 1xad h ALA 218 Ca -0.08 -0.66 -0.18 0.00 0.00 0.00 0.00 54.91 53.99 1xad h ALA 218 Cb 1.59 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 1xad h ALA 218 CO 0.16 0.86 -0.71 1.98 0.00 0.00 0.00 179.25 181.55 1xad h MET 219 N 0.10 0.41 -0.16 0.00 1.85 -1.19 -0.97 114.93 114.97 1xad h MET 219 Ca -0.02 -0.32 -0.00 0.00 -0.61 0.00 0.00 59.70 58.74 1xad h MET 219 Cb 1.34 0.06 -0.01 0.00 0.43 0.00 0.00 31.60 33.42 1xad h MET 219 CO 0.11 0.96 0.08 0.00 -0.40 0.00 0.00 176.91 177.66 1xad h ALA 220 N 0.95 1.85 0.06 0.39 0.00 -0.75 -1.68 119.26 120.09 1xad h ALA 220 Ca -0.03 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.59 1xad h ALA 220 Cb 1.27 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1xad h ALA 220 CO 0.12 0.13 -1.29 0.52 0.00 0.00 0.00 179.25 178.73 1xad h MET 221 N 0.21 0.14 -0.09 0.00 2.86 -1.23 -3.30 114.93 113.53 1xad h MET 221 Ca 0.06 -0.23 -0.08 0.00 -2.06 0.00 0.00 59.70 57.38 1xad h MET 221 Cb 0.02 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 1xad h MET 221 CO -0.01 1.03 -0.31 0.45 1.06 0.00 0.00 176.91 179.13 1xad h HIS 222 N 0.04 0.18 0.00 -0.22 3.86 -0.62 -0.96 115.15 117.44 1xad h HIS 222 Ca -0.14 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.04 1xad h HIS 222 Cb 1.92 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 30.34 1xad h HIS 222 CO 0.03 0.46 0.00 1.28 0.86 0.00 0.00 177.93 180.56 1xad n LEU 223 N -4.13 0.19 -0.05 2.43 4.77 -0.69 -1.15 117.00 118.38 1xad n LEU 223 Ca -0.01 0.56 -0.07 0.00 -0.03 0.00 0.00 56.01 56.46 1xad n LEU 223 Cb 0.39 -0.55 -0.06 0.00 -2.33 0.00 0.00 43.42 40.87 1xad n LEU 223 CO 0.40 -0.44 -0.85 0.52 -1.33 0.00 0.00 177.39 175.69 1xad n VAL 224 N -1.73 0.66 0.09 4.08 0.31 -0.93 -4.28 118.33 116.54 1xad n VAL 224 Ca 0.02 -0.32 -0.22 0.00 -0.01 0.00 0.00 64.34 63.81 1xad n VAL 224 Cb 0.13 -0.85 -0.14 0.00 -0.91 0.00 0.00 33.84 32.07 1xad n VAL 224 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1xad h ARG 225 N 0.00 0.53 -1.67 5.55 3.08 -1.14 -3.42 114.38 117.30 1xad h ARG 225 Ca -0.26 -0.78 -0.44 0.00 0.07 0.00 0.00 59.98 58.57 1xad h ARG 225 Cb 1.48 0.27 -0.40 0.00 0.08 0.00 0.00 29.97 31.40 1xad h ARG 225 CO -0.02 1.36 -1.19 -1.13 -1.07 0.00 0.00 179.97 177.92 1xad n SER 226 N -3.87 0.96 0.26 7.04 3.41 -0.30 -4.93 113.62 116.20 1xad n SER 226 Ca -0.14 -2.93 0.14 0.00 -0.26 0.00 0.00 58.87 55.68 1xad n SER 226 Cb 0.97 -0.56 0.67 0.00 -0.26 0.00 0.00 64.21 65.03 1xad n SER 226 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1xad h PRO 227 N 3.00 0.00 -0.33 4.33 0.13 -1.59 -2.76 132.00 134.78 1xad h PRO 227 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1xad h PRO 227 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1xad h PRO 227 CO 0.49 0.12 0.00 0.00 -0.23 0.00 0.00 178.00 178.38 1xad n ALA 228 N -2.20 1.53 0.34 -0.56 0.00 -1.26 -2.91 120.51 115.44 1xad n ALA 228 Ca -0.01 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.48 1xad n ALA 228 Cb 0.30 -1.00 0.05 0.00 0.00 0.00 0.00 19.45 18.80 1xad n ALA 228 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1xad n ARG 229 N 0.29 0.49 -4.35 0.00 0.63 -1.04 -4.88 116.66 107.80 1xad n ARG 229 Ca 0.00 -1.12 -0.26 0.00 -0.92 0.00 0.00 57.85 55.55 1xad n ARG 229 Cb 0.08 -1.18 -0.10 0.00 0.45 0.00 0.00 32.46 31.72 1xad n ARG 229 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1xad s PHE 230 N -0.78 2.51 0.00 -0.14 0.08 -1.15 -5.05 117.98 113.45 1xad s PHE 230 Ca 0.11 -0.27 0.00 0.00 0.12 0.00 0.00 56.93 56.89 1xad s PHE 230 Cb 0.08 -1.20 0.00 0.00 -0.57 0.00 0.00 43.02 41.32 1xad s PHE 230 CO 0.12 0.54 0.00 -3.47 -0.10 0.00 0.00 175.22 172.31 1xad n ASP 231 N -0.06 0.00 -4.69 1.36 2.03 -1.26 -4.46 116.55 109.47 1xad n ASP 231 Ca -0.10 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 54.87 1xad n ASP 231 Cb 0.56 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.87 1xad n ASP 231 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1xad s VAL 232 N 0.00 4.31 -0.08 5.18 1.01 -0.32 -0.33 120.40 130.18 1xad s VAL 232 Ca 0.00 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.67 1xad s VAL 232 Cb 0.00 -2.86 -0.00 0.00 0.00 0.00 0.00 36.38 33.52 1xad s VAL 232 CO 0.00 0.52 -0.23 -0.69 0.00 0.00 0.00 175.10 174.70 1xad s VAL 233 N -0.97 1.95 -0.04 2.92 1.01 -0.24 -1.46 120.40 123.57 1xad s VAL 233 Ca 0.16 -0.98 0.06 0.00 0.00 0.00 0.00 61.98 61.21 1xad s VAL 233 Cb -0.11 -1.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.58 1xad s VAL 233 CO 0.06 0.54 -0.22 0.54 0.00 0.00 0.00 175.10 176.02 1xad s VAL 234 N 0.13 1.77 0.35 2.92 0.11 -0.66 -0.62 120.40 124.40 1xad s VAL 234 Ca -0.11 -0.92 -0.10 0.00 -2.93 0.00 0.00 61.98 57.92 1xad s VAL 234 Cb -0.16 -1.50 0.02 0.00 -1.53 0.00 0.00 36.38 33.22 1xad s VAL 234 CO 0.06 0.50 0.61 0.28 -3.33 0.00 0.00 175.10 173.22 1xad s THR 235 N -0.18 0.00 0.00 5.04 -1.32 -0.71 -1.98 115.64 116.48 1xad s THR 235 Ca -0.01 -1.31 0.00 0.00 -1.21 0.00 0.00 61.69 59.16 1xad s THR 235 Cb -0.12 -2.65 0.00 0.00 -1.51 0.00 0.00 72.50 68.22 1xad s THR 235 CO 0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 1xad n GLY 236 N -0.53 -1.40 0.20 6.08 0.00 -1.26 -1.64 105.19 106.64 1xad n GLY 236 Ca -0.03 -1.62 -0.07 0.00 0.00 0.00 0.00 46.02 44.29 1xad n GLY 236 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1xad h ASN 237 N -0.21 -0.39 -0.14 1.61 -0.73 -1.84 0.35 115.58 114.24 1xad h ASN 237 Ca 0.00 0.01 -0.10 0.00 1.87 0.00 0.00 56.30 58.09 1xad h ASN 237 Cb 0.00 0.10 -0.01 0.00 0.27 0.00 0.00 38.32 38.68 1xad h ASN 237 CO 0.00 -0.12 -0.22 -0.29 -0.37 0.00 0.00 177.43 176.43 1xad h ILE 238 N -0.77 1.26 0.00 2.57 2.10 -1.89 0.20 117.51 120.98 1xad h ILE 238 Ca -0.05 -1.26 -0.13 0.00 1.08 0.00 0.00 64.86 64.51 1xad h ILE 238 Cb 0.35 1.27 -0.02 0.00 -1.09 0.00 0.00 36.82 37.33 1xad h ILE 238 CO 0.08 0.41 -0.60 -0.26 -1.08 0.00 0.00 178.15 176.70 1xad h PHE 239 N 0.51 0.00 -0.09 2.19 0.04 -1.96 0.11 116.94 117.74 1xad h PHE 239 Ca 0.08 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.68 1xad h PHE 239 Cb 0.66 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.80 1xad h PHE 239 CO 0.03 0.60 -0.66 0.78 -0.60 0.00 0.00 178.31 178.46 1xad h GLY 240 N 2.36 0.41 0.89 -1.45 0.00 0.97 -0.83 103.07 105.42 1xad h GLY 240 Ca -0.01 -0.53 -0.09 0.00 0.00 0.00 0.00 47.33 46.70 1xad h GLY 240 CO 0.08 0.48 -0.19 -1.80 0.00 0.00 0.00 176.54 175.10 1xad h ASP 241 N 0.27 0.62 0.17 0.19 1.82 -0.48 0.15 116.42 119.15 1xad h ASP 241 Ca -0.02 -0.45 -0.01 0.00 -0.39 0.00 0.00 57.03 56.17 1xad h ASP 241 Cb 1.20 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 41.04 1xad h ASP 241 CO 0.11 0.93 -0.08 0.40 -1.61 0.00 0.00 179.24 178.99 1xad h ILE 242 N 0.31 0.96 0.00 2.25 2.04 -0.88 -2.92 117.51 119.26 1xad h ILE 242 Ca 0.05 -0.88 -0.04 0.00 1.00 0.00 0.00 64.86 64.99 1xad h ILE 242 Cb 0.73 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1xad h ILE 242 CO 0.05 0.19 -0.17 -0.07 0.00 0.00 0.00 178.15 178.16 1xad h LEU 243 N -0.68 0.00 -0.11 1.44 3.38 -1.14 -1.44 115.31 116.76 1xad h LEU 243 Ca -0.02 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 1xad h LEU 243 Cb 0.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.25 1xad h LEU 243 CO 0.04 0.17 -0.45 0.28 0.09 0.00 0.00 178.44 178.56 1xad h SER 244 N 0.00 0.58 -0.36 -0.43 0.02 -0.77 -0.79 113.55 111.80 1xad h SER 244 Ca -0.00 -0.63 -0.01 0.00 -0.84 0.00 0.00 61.79 60.30 1xad h SER 244 Cb 0.47 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1xad h SER 244 CO 0.02 1.12 0.17 0.44 -1.14 0.00 0.00 176.83 177.44 1xad h ASP 245 N 0.08 0.47 -0.21 3.07 5.19 -1.26 0.88 116.42 124.65 1xad h ASP 245 Ca -0.03 -0.13 0.03 0.00 -0.62 0.00 0.00 57.03 56.28 1xad h ASP 245 Cb 1.09 -0.12 -0.03 0.00 0.18 0.00 0.00 39.33 40.45 1xad h ASP 245 CO 0.09 0.47 0.04 0.25 -3.12 0.00 0.00 179.24 176.97 1xad h LEU 246 N 0.44 0.01 -2.03 1.55 6.46 -1.33 -1.36 115.31 119.04 1xad h LEU 246 Ca 0.12 0.03 0.04 0.00 -0.12 0.00 0.00 57.88 57.96 1xad h LEU 246 Cb 0.12 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.09 1xad h LEU 246 CO -0.01 0.03 0.11 0.00 -0.62 0.00 0.00 178.44 177.95 1xad h ALA 247 N 1.15 2.10 0.00 1.25 0.00 -1.03 -2.40 119.26 120.33 1xad h ALA 247 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1xad h ALA 247 Cb 0.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1xad h ALA 247 CO -0.13 -0.18 0.00 -1.13 0.00 0.00 0.00 179.25 177.81 1xad n SER 248 N -4.43 0.00 0.04 0.00 3.41 0.29 -2.51 113.62 110.42 1xad n SER 248 Ca 0.00 -0.05 0.11 0.00 -0.26 0.00 0.00 58.87 58.68 1xad n SER 248 Cb 0.23 -0.20 0.06 0.00 -0.26 0.00 0.00 64.21 64.04 1xad n SER 248 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1xad n VAL 249 N -1.20 0.23 -0.21 -3.33 0.24 -0.90 -4.34 118.33 108.82 1xad n VAL 249 Ca 0.07 -0.27 -0.02 0.00 -2.04 0.00 0.00 64.34 62.09 1xad n VAL 249 Cb 0.09 0.10 0.20 0.00 -1.47 0.00 0.00 33.84 32.75 1xad n VAL 249 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1xad h LEU 250 N 0.00 0.89 -0.74 1.34 4.07 -1.65 -2.50 115.31 116.71 1xad h LEU 250 Ca 0.00 -0.08 -0.08 0.00 0.08 0.00 0.00 57.88 57.80 1xad h LEU 250 Cb 0.75 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 42.24 1xad h LEU 250 CO 0.00 0.73 0.10 -0.65 -1.08 0.00 0.00 178.44 177.54 1xad h PRO 251 N 0.99 1.06 0.00 1.13 0.11 -1.80 -3.42 132.00 130.07 1xad h PRO 251 Ca 0.25 -0.28 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1xad h PRO 251 Cb 0.06 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.04 1xad h PRO 251 CO -0.04 0.97 0.00 0.41 -0.21 0.00 0.00 178.00 179.14 1xad n GLY 252 N -0.61 1.97 3.55 -0.55 0.00 -0.94 -3.57 105.19 105.04 1xad n GLY 252 Ca 0.04 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 1xad n GLY 252 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xad s SER 253 N -2.25 5.23 0.91 1.61 1.04 -1.25 -4.90 113.70 114.09 1xad s SER 253 Ca 0.00 0.01 -0.15 0.00 0.48 0.00 0.00 55.95 56.30 1xad s SER 253 Cb 0.00 -2.54 0.16 0.00 0.10 0.00 0.00 66.02 63.74 1xad s SER 253 CO 0.00 -2.50 1.27 -1.48 0.98 0.00 0.00 173.24 171.52 1xad s LEU 254 N 9.40 2.63 0.00 2.42 0.05 -1.26 -4.26 118.68 127.66 1xad s LEU 254 Ca 0.68 0.45 0.00 0.00 0.05 0.00 0.00 54.13 55.31 1xad s LEU 254 Cb -0.11 -2.64 0.00 0.00 -2.05 0.00 0.00 46.19 41.39 1xad s LEU 254 CO 0.14 -2.45 0.00 0.61 -0.55 0.00 0.00 176.35 174.10 1xad n GLY 255 N -3.60 3.17 0.22 -3.48 0.00 -1.26 -4.94 105.19 95.29 1xad n GLY 255 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1xad n GLY 255 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xad n LEU 256 N 0.00 0.26 -4.45 0.99 4.77 -1.26 -4.37 117.00 112.94 1xad n LEU 256 Ca 0.00 -0.13 -0.33 0.00 -0.03 0.00 0.00 56.01 55.52 1xad n LEU 256 Cb 0.00 -0.13 -0.14 0.00 -2.33 0.00 0.00 43.42 40.82 1xad n LEU 256 CO 0.00 0.07 -0.47 -0.76 -1.33 0.00 0.00 177.39 174.90 1xad s LEU 257 N -0.57 2.64 0.17 2.23 1.43 -1.26 -4.21 118.68 119.11 1xad s LEU 257 Ca 0.00 -0.24 -0.00 0.00 -1.03 0.00 0.00 54.13 52.86 1xad s LEU 257 Cb 0.00 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 1xad s LEU 257 CO 0.00 0.33 0.34 -2.16 0.23 0.00 0.00 176.35 175.09 1xad s PRO 258 N -0.67 3.50 0.08 1.29 0.04 -1.26 -0.58 135.00 137.39 1xad s PRO 258 Ca 0.10 -0.40 0.01 0.00 0.04 0.00 0.00 61.00 60.75 1xad s PRO 258 Cb -0.11 -2.90 -0.04 0.00 0.04 0.00 0.00 34.50 31.50 1xad s PRO 258 CO 0.01 0.46 -0.06 0.45 0.04 0.00 0.00 177.00 177.90 1xad s SER 259 N -3.05 0.94 -0.20 6.66 0.15 -0.21 -4.08 113.70 113.90 1xad s SER 259 Ca 0.37 -0.90 -0.08 0.00 0.70 0.00 0.00 55.95 56.04 1xad s SER 259 Cb -0.11 0.10 0.08 0.00 -1.71 0.00 0.00 66.02 64.38 1xad s SER 259 CO 0.28 -0.43 0.44 0.00 1.20 0.00 0.00 173.24 174.73 1xad s ALA 260 N -3.16 -1.20 -0.14 5.45 0.00 -0.95 -1.73 121.76 120.03 1xad s ALA 260 Ca 0.06 1.59 -0.13 0.00 0.00 0.00 0.00 51.96 53.48 1xad s ALA 260 Cb 0.02 -1.24 -0.05 0.00 0.00 0.00 0.00 23.12 21.85 1xad s ALA 260 CO -0.05 -0.62 0.28 -1.12 0.00 0.00 0.00 175.76 174.26 1xad s SER 261 N 2.26 6.47 0.27 0.00 0.01 -0.41 -0.87 113.70 121.42 1xad s SER 261 Ca -0.04 0.55 0.03 0.00 1.31 0.00 0.00 55.95 57.79 1xad s SER 261 Cb -0.11 -2.17 -0.06 0.00 0.21 0.00 0.00 66.02 63.90 1xad s SER 261 CO -0.13 0.18 0.04 -0.76 0.41 0.00 0.00 173.24 172.98 1xad s LEU 262 N 0.04 2.03 0.00 2.44 1.02 -1.03 -1.58 118.68 121.61 1xad s LEU 262 Ca 0.17 -1.31 0.00 0.00 0.02 0.00 0.00 54.13 53.01 1xad s LEU 262 Cb -0.13 -0.22 0.00 0.00 0.02 0.00 0.00 46.19 45.86 1xad s LEU 262 CO 0.05 -0.60 0.00 0.61 0.02 0.00 0.00 176.35 176.43 1xad n GLY 263 N -0.51 -0.12 0.17 -3.19 0.00 -1.26 -0.63 105.19 99.65 1xad n GLY 263 Ca -0.03 -1.00 -0.21 0.00 0.00 0.00 0.00 46.02 44.78 1xad n GLY 263 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1xad h ARG 264 N 0.00 0.58 0.00 1.61 3.08 -1.36 -3.46 114.38 114.83 1xad h ARG 264 Ca 0.00 -0.77 0.00 0.00 0.07 0.00 0.00 59.98 59.28 1xad h ARG 264 Cb 0.00 0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1xad h ARG 264 CO 0.00 1.34 0.00 0.41 -1.07 0.00 0.00 179.97 180.65 1xad n GLY 265 N 1.35 1.25 3.68 0.04 0.00 0.13 -4.99 105.19 106.64 1xad n GLY 265 Ca -0.13 -1.68 -0.43 0.00 0.00 0.00 0.00 46.02 43.79 1xad n GLY 265 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xad s THR 266 N 1.25 4.27 0.27 2.61 2.01 -1.26 -4.97 115.64 119.82 1xad s THR 266 Ca 0.00 1.57 -0.30 0.00 0.31 0.00 0.00 61.69 63.26 1xad s THR 266 Cb 0.00 -4.01 -0.11 0.00 0.01 0.00 0.00 72.50 68.39 1xad s THR 266 CO 0.00 -0.06 1.62 -2.16 -0.69 0.00 0.00 174.62 173.33 1xad s PRO 267 N 2.77 4.13 -0.14 4.92 0.04 -1.26 -4.81 135.00 140.65 1xad s PRO 267 Ca 0.55 2.57 -0.08 0.00 0.04 0.00 0.00 61.00 64.07 1xad s PRO 267 Cb -0.23 -3.04 -0.04 0.00 0.04 0.00 0.00 34.50 31.22 1xad s PRO 267 CO 0.19 -0.65 0.16 0.08 0.04 0.00 0.00 177.00 176.81 1xad s VAL 268 N 0.31 5.45 -0.02 -0.36 1.01 -0.61 -1.77 120.40 124.41 1xad s VAL 268 Ca 0.66 0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.96 1xad s VAL 268 Cb -0.48 -3.44 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 1xad s VAL 268 CO 0.43 0.56 -0.23 -0.36 0.00 0.00 0.00 175.10 175.50 1xad s PHE 269 N -0.60 2.07 0.15 5.22 0.40 -1.11 -1.28 117.98 122.83 1xad s PHE 269 Ca 0.14 -0.39 -0.19 0.00 -0.60 0.00 0.00 56.93 55.89 1xad s PHE 269 Cb -0.12 -1.33 0.05 0.00 0.51 0.00 0.00 43.02 42.12 1xad s PHE 269 CO 0.03 -0.03 0.49 -1.83 0.70 0.00 0.00 175.22 174.58 1xad s GLU 270 N -0.55 1.20 0.38 0.44 -1.05 -0.71 -1.54 118.70 116.86 1xad s GLU 270 Ca 0.09 -0.65 -0.23 0.00 -0.15 0.00 0.00 54.97 54.03 1xad s GLU 270 Cb -0.09 0.52 -0.10 0.00 -0.44 0.00 0.00 34.13 34.02 1xad s GLU 270 CO -0.01 -0.50 0.93 -1.25 0.95 0.00 0.00 175.26 175.38 1xad s PRO 271 N -3.80 4.35 -0.29 -4.83 0.04 -1.26 -1.05 135.00 128.17 1xad s PRO 271 Ca 0.03 1.16 -0.21 0.00 0.04 0.00 0.00 61.00 62.03 1xad s PRO 271 Cb 0.00 -2.46 -0.01 0.00 0.04 0.00 0.00 34.50 32.08 1xad s PRO 271 CO -0.11 0.11 0.65 0.08 0.04 0.00 0.00 177.00 177.78 1xad s VAL 272 N -1.93 4.93 0.00 -0.36 1.01 0.25 -4.82 120.40 119.48 1xad s VAL 272 Ca 0.56 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.56 1xad s VAL 272 Cb -0.13 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.25 1xad s VAL 272 CO 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 175.10 175.18 1xad n HIS 273 N 5.86 0.00 -0.93 5.22 1.44 -1.26 -4.30 115.22 121.26 1xad n HIS 273 Ca -0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1xad n HIS 273 Cb 0.49 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.60 1xad n HIS 273 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1xad n GLY 274 N -1.47 1.41 0.37 -1.39 0.00 -1.26 -4.87 105.19 97.98 1xad n GLY 274 Ca 0.00 -1.82 0.06 0.00 0.00 0.00 0.00 46.02 44.26 1xad n GLY 274 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xad h SER 275 N 0.00 0.94 -6.38 1.61 0.02 -1.81 -3.46 113.55 104.47 1xad h SER 275 Ca 0.00 0.03 -0.48 0.00 -0.84 0.00 0.00 61.79 60.51 1xad h SER 275 Cb 0.00 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 1xad h SER 275 CO 0.00 0.54 -0.89 0.00 -1.14 0.00 0.00 176.83 175.34 1xad n ALA 276 N -2.36 -2.10 -0.13 3.77 0.00 -1.26 -0.30 120.51 118.12 1xad n ALA 276 Ca 0.17 -0.25 0.18 0.00 0.00 0.00 0.00 53.44 53.54 1xad n ALA 276 Cb 0.30 -1.96 0.57 0.00 0.00 0.00 0.00 19.45 18.36 1xad n ALA 276 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1xad h PRO 277 N -1.86 0.27 -1.18 0.00 0.11 -1.92 -1.24 132.00 126.19 1xad h PRO 277 Ca -0.63 -0.02 0.34 0.00 0.11 0.00 0.00 66.00 65.80 1xad h PRO 277 Cb 1.37 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 32.34 1xad h PRO 277 CO 0.59 0.18 0.81 0.38 -0.21 0.00 0.00 178.00 179.75 1xad h ASP 278 N 0.28 0.19 0.00 -2.05 2.03 -1.99 -2.65 116.42 112.22 1xad h ASP 278 Ca 0.35 0.05 0.00 0.00 -0.73 0.00 0.00 57.03 56.70 1xad h ASP 278 Cb 0.98 0.02 0.00 0.00 -0.83 0.00 0.00 39.33 39.50 1xad h ASP 278 CO -0.09 0.01 -0.00 2.30 -1.03 0.00 0.00 179.24 180.43 1xad n ILE 279 N -4.39 0.99 -1.81 4.15 -5.35 -0.47 -5.02 119.36 107.46 1xad n ILE 279 Ca 0.27 -1.02 -0.42 0.00 -0.27 0.00 0.00 62.75 61.32 1xad n ILE 279 Cb 1.16 0.48 -0.03 0.00 -1.74 0.00 0.00 39.64 39.52 1xad n ILE 279 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xad s ALA 280 N -1.06 3.50 0.00 -1.28 0.00 -1.00 -3.27 121.76 118.64 1xad s ALA 280 Ca 0.03 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.07 1xad s ALA 280 Cb 0.02 -3.83 0.00 0.00 0.00 0.00 0.00 23.12 19.31 1xad s ALA 280 CO 0.00 -1.64 0.00 0.41 0.00 0.00 0.00 175.76 174.53 1xad n GLY 281 N 4.52 2.36 0.17 0.00 0.00 -1.26 -4.89 105.19 106.08 1xad n GLY 281 Ca 0.20 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.31 1xad n GLY 281 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xad h LYS 282 N 0.77 0.00 0.00 1.61 1.57 -1.95 -3.47 116.57 115.10 1xad h LYS 282 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xad h LYS 282 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1xad h LYS 282 CO 0.00 0.13 0.00 0.41 -0.57 0.00 0.00 179.45 179.42 1xad n GLY 283 N 1.17 0.65 0.00 3.86 0.00 -1.26 -4.91 105.19 104.70 1xad n GLY 283 Ca 0.01 -0.42 0.04 0.00 0.00 0.00 0.00 46.02 45.65 1xad n GLY 283 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1xad n ILE 284 N -2.60 0.00 -1.50 -0.61 -5.35 -1.26 -1.13 119.36 106.90 1xad n ILE 284 Ca 0.00 -0.28 -0.46 0.00 -0.27 0.00 0.00 62.75 61.74 1xad n ILE 284 Cb 0.00 0.86 -0.02 0.00 -1.74 0.00 0.00 39.64 38.74 1xad n ILE 284 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xad n ALA 285 N -1.32 -1.39 -2.67 -1.28 0.00 -1.26 -4.35 120.51 108.24 1xad n ALA 285 Ca 0.01 0.39 -0.39 0.00 0.00 0.00 0.00 53.44 53.45 1xad n ALA 285 Cb 0.15 -1.83 -0.06 0.00 0.00 0.00 0.00 19.45 17.70 1xad n ALA 285 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1xad s ASN 286 N -0.77 6.63 0.00 0.00 3.84 -1.26 -3.67 114.94 119.71 1xad s ASN 286 Ca 0.61 0.76 0.24 0.00 0.21 0.00 0.00 52.86 54.68 1xad s ASN 286 Cb -0.78 -2.31 0.72 0.00 -0.55 0.00 0.00 41.25 38.33 1xad s ASN 286 CO 0.58 -0.17 1.55 -0.81 -2.79 0.00 0.00 177.10 175.46 1xad n PRO 287 N 4.63 1.91 -0.20 0.43 -0.04 -1.26 -4.50 135.00 135.96 1xad n PRO 287 Ca -0.04 -1.35 0.08 0.00 -0.04 0.00 0.00 63.50 62.16 1xad n PRO 287 Cb 0.50 -1.45 0.37 0.00 -0.04 0.00 0.00 33.50 32.88 1xad n PRO 287 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1xad h THR 288 N 2.94 0.96 0.02 0.52 2.02 -1.91 -0.31 112.91 117.15 1xad h THR 288 Ca 0.00 -0.25 -0.21 0.00 0.77 0.00 0.00 66.41 66.72 1xad h THR 288 Cb 0.63 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1xad h THR 288 CO 0.00 0.13 -0.94 0.00 0.37 0.00 0.00 175.52 175.08 1xad h ALA 289 N 1.60 0.43 0.24 6.16 0.00 -1.76 -1.20 119.26 124.73 1xad h ALA 289 Ca 0.35 -0.76 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1xad h ALA 289 Cb 0.40 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1xad h ALA 289 CO -0.13 0.94 -0.11 0.00 0.00 0.00 0.00 179.25 179.95 1xad h ALA 290 N 0.90 -0.32 -0.82 0.00 0.00 -1.68 -0.64 119.26 116.71 1xad h ALA 290 Ca -0.06 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 54.79 1xad h ALA 290 Cb 1.60 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 19.45 1xad h ALA 290 CO 0.15 -0.47 0.54 0.82 0.00 0.00 0.00 179.25 180.28 1xad h ILE 291 N -0.73 0.85 0.00 0.00 2.04 -1.10 0.20 117.51 118.78 1xad h ILE 291 Ca -0.03 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1xad h ILE 291 Cb 0.49 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1xad h ILE 291 CO 0.05 0.11 -0.05 0.18 0.00 0.00 0.00 178.15 178.45 1xad n LEU 292 N -4.52 0.45 0.09 1.44 4.77 -0.45 -2.16 117.00 116.61 1xad n LEU 292 Ca 0.15 0.51 -0.11 0.00 -0.03 0.00 0.00 56.01 56.53 1xad n LEU 292 Cb 0.45 -0.39 -0.09 0.00 -2.33 0.00 0.00 43.42 41.07 1xad n LEU 292 CO 0.31 -0.09 0.11 0.77 -1.33 0.00 0.00 177.39 177.17 1xad h SER 293 N 0.00 0.26 -0.23 -1.43 4.64 0.99 -2.70 113.55 115.08 1xad h SER 293 Ca 0.00 -0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 61.07 1xad h SER 293 Cb 0.63 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.63 1xad h SER 293 CO 0.00 1.14 0.12 0.00 -0.87 0.00 0.00 176.83 177.22 1xad h ALA 294 N 0.83 0.29 -0.41 5.18 0.00 -1.09 -1.40 119.26 122.67 1xad h ALA 294 Ca -0.07 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.84 1xad h ALA 294 Cb 1.74 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.42 1xad h ALA 294 CO 0.16 -0.16 0.28 0.00 0.00 0.00 0.00 179.25 179.52 1xad h ALA 295 N 1.00 2.09 0.00 0.00 0.00 -1.45 -0.43 119.26 120.47 1xad h ALA 295 Ca 0.08 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1xad h ALA 295 Cb 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1xad h ALA 295 CO -0.01 -0.18 -0.34 0.52 0.00 0.00 0.00 179.25 179.24 1xad h MET 296 N 0.22 0.00 -0.08 0.00 2.86 -0.95 -2.18 114.93 114.81 1xad h MET 296 Ca 0.18 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.73 1xad h MET 296 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1xad h MET 296 CO -0.03 0.34 -0.30 1.98 1.06 0.00 0.00 176.91 179.96 1xad h MET 297 N 0.00 0.35 -0.62 1.72 -1.53 -0.11 0.11 114.93 114.85 1xad h MET 297 Ca -0.00 -0.26 -0.00 0.00 -3.44 0.00 0.00 59.70 55.99 1xad h MET 297 Cb 1.02 0.05 -0.03 0.00 -0.55 0.00 0.00 31.60 32.09 1xad h MET 297 CO 0.04 0.89 0.38 -0.07 0.14 0.00 0.00 176.91 178.29 1xad h LEU 298 N -0.12 0.75 -0.24 3.39 3.38 -1.34 0.51 115.31 121.63 1xad h LEU 298 Ca -0.01 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.72 1xad h LEU 298 Cb 0.93 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1xad h LEU 298 CO 0.06 0.59 -0.52 -0.08 0.09 0.00 0.00 178.44 178.59 1xad h GLU 299 N 0.85 0.78 0.00 1.13 4.81 -1.37 0.35 114.58 121.13 1xad h GLU 299 Ca 0.22 -0.51 -0.37 0.00 -0.13 0.00 0.00 59.36 58.58 1xad h GLU 299 Cb -0.02 0.07 -0.07 0.00 0.63 0.00 0.00 28.75 29.36 1xad h GLU 299 CO -0.04 1.14 -2.35 0.72 -0.73 0.00 0.00 179.01 177.74 1xad n HIS 300 N -4.09 0.06 -0.09 0.92 8.25 0.38 -2.82 115.22 117.83 1xad n HIS 300 Ca -0.05 0.02 -0.17 0.00 -0.26 0.00 0.00 57.72 57.26 1xad n HIS 300 Cb 0.61 -1.01 -0.11 0.00 1.12 0.00 0.00 29.99 30.60 1xad n HIS 300 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1xad h ALA 301 N 0.99 0.13 -0.02 -1.41 0.00 -0.17 -3.40 119.26 115.38 1xad h ALA 301 Ca -0.54 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 53.55 1xad h ALA 301 Cb 2.23 0.40 0.00 0.00 0.00 0.00 0.00 17.79 20.42 1xad h ALA 301 CO 0.03 0.38 -0.02 1.19 0.00 0.00 0.00 179.25 180.82 1xad n PHE 302 N -4.53 0.00 -1.22 0.00 3.72 -0.87 -4.96 117.46 109.60 1xad n PHE 302 Ca -0.20 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.12 1xad n PHE 302 Cb 0.54 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.05 1xad n PHE 302 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xad n GLY 303 N 1.06 0.93 2.71 1.37 0.00 -0.44 -4.89 105.19 105.94 1xad n GLY 303 Ca 0.11 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 1xad n GLY 303 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xad n LEU 304 N -0.85 7.25 -0.33 0.99 4.32 0.11 -4.74 117.00 123.74 1xad n LEU 304 Ca -0.08 -5.03 0.12 0.00 -0.02 0.00 0.00 56.01 51.01 1xad n LEU 304 Cb 0.30 -1.32 0.31 0.00 -1.62 0.00 0.00 43.42 41.09 1xad n LEU 304 CO 0.11 1.84 1.15 0.58 -1.22 0.00 0.00 177.39 179.86 1xad h VAL 305 N 2.92 0.67 -0.20 4.08 2.07 -1.82 -0.78 116.25 123.19 1xad h VAL 305 Ca 0.49 -0.23 -0.08 0.00 0.82 0.00 0.00 66.70 67.70 1xad h VAL 305 Cb 0.44 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1xad h VAL 305 CO 1.41 0.12 -0.21 -0.08 0.02 0.00 0.00 177.57 178.83 1xad h GLU 306 N 0.68 0.35 0.13 1.57 4.81 -1.96 -2.01 114.58 118.14 1xad h GLU 306 Ca 0.56 -0.11 -0.23 0.00 -0.13 0.00 0.00 59.36 59.45 1xad h GLU 306 Cb 0.90 -0.03 0.03 0.00 0.63 0.00 0.00 28.75 30.27 1xad h GLU 306 CO -0.40 0.55 -0.99 -0.07 -0.73 0.00 0.00 179.01 177.36 1xad h LEU 307 N 0.32 0.65 -0.92 1.64 3.38 -1.59 -3.05 115.31 115.74 1xad h LEU 307 Ca 0.05 -0.88 0.17 0.00 0.09 0.00 0.00 57.88 57.31 1xad h LEU 307 Cb 0.56 -0.21 -0.10 0.00 0.09 0.00 0.00 40.66 41.00 1xad h LEU 307 CO 0.04 1.47 0.51 0.00 0.09 0.00 0.00 178.44 180.55 1xad h ALA 308 N 0.18 1.44 -0.05 1.53 0.00 -1.11 0.46 119.26 121.71 1xad h ALA 308 Ca -0.16 0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 1xad h ALA 308 Cb 1.74 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 1xad h ALA 308 CO 0.19 -0.08 -0.53 0.00 0.00 0.00 0.00 179.25 178.83 1xad h ARG 309 N 0.68 0.15 -0.01 0.00 2.47 -1.43 -0.86 114.38 115.38 1xad h ARG 309 Ca 0.51 -0.09 -0.18 0.00 -1.26 0.00 0.00 59.98 58.96 1xad h ARG 309 Cb 0.76 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.07 1xad h ARG 309 CO -0.38 0.65 -0.81 -0.22 0.56 0.00 0.00 179.97 179.77 1xad h LYS 310 N 0.12 0.15 -0.13 0.04 3.64 -1.16 -0.37 116.57 118.85 1xad h LYS 310 Ca 0.00 -0.15 -0.21 0.00 -1.27 0.00 0.00 60.65 59.02 1xad h LYS 310 Cb 0.98 0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.85 1xad h LYS 310 CO 0.08 0.88 -0.76 0.28 -2.27 0.00 0.00 179.45 177.65 1xad h VAL 311 N 0.09 1.31 -0.17 2.00 2.07 -0.63 -1.85 116.25 119.07 1xad h VAL 311 Ca -0.03 -2.02 -0.06 0.00 0.82 0.00 0.00 66.70 65.40 1xad h VAL 311 Cb 1.41 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 33.19 1xad h VAL 311 CO 0.12 0.63 -0.18 -0.33 0.02 0.00 0.00 177.57 177.83 1xad h GLU 312 N 0.45 0.28 -0.12 1.57 5.08 -1.04 -1.53 114.58 119.27 1xad h GLU 312 Ca -0.04 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1xad h GLU 312 Cb 1.37 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.59 1xad h GLU 312 CO 0.15 0.46 -0.00 -0.44 -1.00 0.00 0.00 179.01 178.18 1xad h ASP 313 N 0.26 0.22 -0.59 1.42 5.19 -0.96 -1.15 116.42 120.81 1xad h ASP 313 Ca 0.05 -0.32 0.11 0.00 -0.62 0.00 0.00 57.03 56.25 1xad h ASP 313 Cb 0.48 -0.06 -0.08 0.00 0.18 0.00 0.00 39.33 39.85 1xad h ASP 313 CO 0.03 0.48 0.15 0.00 -3.12 0.00 0.00 179.24 176.78 1xad h ALA 314 N 0.74 0.71 -0.26 3.45 0.00 -1.02 0.21 119.26 123.10 1xad h ALA 314 Ca 0.04 0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 1xad h ALA 314 Cb 0.37 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1xad h ALA 314 CO 0.01 -0.28 -0.35 -0.39 0.00 0.00 0.00 179.25 178.23 1xad h VAL 315 N 0.29 1.29 -0.21 0.00 -1.51 -1.34 0.12 116.25 114.89 1xad h VAL 315 Ca 0.31 -1.49 0.02 0.00 -1.23 0.00 0.00 66.70 64.31 1xad h VAL 315 Cb 0.44 1.48 -0.02 0.00 -2.13 0.00 0.00 31.29 31.05 1xad h VAL 315 CO -0.37 0.47 0.08 0.00 -1.23 0.00 0.00 177.57 176.52 1xad h ALA 316 N 1.13 0.24 -0.39 5.19 0.00 0.28 -0.69 119.26 125.02 1xad h ALA 316 Ca 0.05 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1xad h ALA 316 Cb 0.84 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1xad h ALA 316 CO 0.07 -0.34 0.23 0.87 0.00 0.00 0.00 179.25 180.09 1xad h LYS 317 N 0.19 0.46 -0.85 0.00 1.79 -0.45 -1.39 116.57 116.32 1xad h LYS 317 Ca 0.09 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1xad h LYS 317 Cb 0.04 -0.10 -0.04 0.00 -1.58 0.00 0.00 32.23 30.55 1xad h LYS 317 CO -0.08 0.31 0.52 0.00 -1.08 0.00 0.00 179.45 179.12 1xad h ALA 318 N 1.16 1.08 -0.18 3.86 0.00 -0.63 0.92 119.26 125.48 1xad h ALA 318 Ca 0.15 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1xad h ALA 318 Cb -0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1xad h ALA 318 CO -0.06 0.53 -0.14 -0.07 0.00 0.00 0.00 179.25 179.51 1xad h LEU 319 N 1.16 0.27 0.11 0.00 3.38 -0.22 0.16 115.31 120.17 1xad h LEU 319 Ca 0.31 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 1xad h LEU 319 Cb -0.07 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1xad h LEU 319 CO -0.06 0.43 -0.06 0.25 0.09 0.00 0.00 178.44 179.10 1xad h LEU 320 N 0.27 -0.13 -0.89 1.67 5.85 -0.93 -3.27 115.31 117.87 1xad h LEU 320 Ca 0.05 -0.44 -0.09 0.00 0.84 0.00 0.00 57.88 58.25 1xad h LEU 320 Cb 0.41 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 1xad h LEU 320 CO 0.02 0.47 -0.13 -0.33 -0.34 0.00 0.00 178.44 178.14 1xad h GLU 321 N -0.84 0.67 -2.20 1.25 5.08 -0.34 -3.40 114.58 114.80 1xad h GLU 321 Ca -0.02 -0.22 -0.55 0.00 -1.00 0.00 0.00 59.36 57.58 1xad h GLU 321 Cb 0.56 -0.06 -0.36 0.00 0.50 0.00 0.00 28.75 29.39 1xad h GLU 321 CO 0.03 0.78 -0.94 0.25 -1.00 0.00 0.00 179.01 178.13 1xad n THR 322 N -4.17 -1.08 -1.71 1.13 -2.24 0.50 -5.08 114.28 101.64 1xad n THR 322 Ca 0.01 -3.22 -0.42 0.00 -2.27 0.00 0.00 64.05 58.14 1xad n THR 322 Cb 0.36 -1.41 -0.01 0.00 -2.10 0.00 0.00 70.33 67.18 1xad n THR 322 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1xad n PRO 323 N 2.76 2.17 -1.17 -0.78 -0.04 -1.23 -4.63 135.00 132.08 1xad n PRO 323 Ca 0.28 0.76 -0.29 0.00 -0.04 0.00 0.00 63.50 64.22 1xad n PRO 323 Cb 0.49 -2.36 0.18 0.00 -0.04 0.00 0.00 33.50 31.77 1xad n PRO 323 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1xad s PRO 324 N -1.91 0.38 0.18 0.54 0.02 -1.26 -2.25 135.00 130.70 1xad s PRO 324 Ca 0.55 0.49 -0.14 0.00 0.02 0.00 0.00 61.00 61.93 1xad s PRO 324 Cb -0.56 -1.73 0.17 0.00 0.02 0.00 0.00 34.50 32.40 1xad s PRO 324 CO 0.62 -2.76 1.69 -1.35 -0.33 0.00 0.00 177.00 174.87 1xad h PRO 325 N -1.91 0.13 0.00 5.54 0.11 -1.60 -1.31 132.00 132.95 1xad h PRO 325 Ca -0.55 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.55 1xad h PRO 325 Cb 1.33 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1xad h PRO 325 CO 0.58 0.08 0.01 -0.40 -0.21 0.00 0.00 178.00 178.06 1xad n ASP 326 N -5.20 0.00 -1.67 -2.05 5.75 -1.26 -0.52 116.55 111.60 1xad n ASP 326 Ca 0.05 0.05 0.02 0.00 -0.01 0.00 0.00 54.79 54.89 1xad n ASP 326 Cb 0.25 -0.05 0.05 0.00 -1.03 0.00 0.00 41.12 40.34 1xad n ASP 326 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1xad n LEU 327 N -1.00 1.56 -3.20 -2.12 4.32 -0.78 -4.96 117.00 110.82 1xad n LEU 327 Ca 0.00 -2.62 -0.18 0.00 -0.02 0.00 0.00 56.01 53.19 1xad n LEU 327 Cb 0.01 0.01 0.07 0.00 -1.62 0.00 0.00 43.42 41.89 1xad n LEU 327 CO 0.00 0.82 0.16 0.61 -1.22 0.00 0.00 177.39 177.76 1xad n GLY 328 N -0.02 -0.32 0.00 -0.72 0.00 0.32 -4.71 105.19 99.74 1xad n GLY 328 Ca 0.10 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1xad n GLY 328 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xad n GLY 329 N -1.50 4.74 0.00 -0.02 0.00 -0.56 -4.94 105.19 102.91 1xad n GLY 329 Ca -0.12 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.41 1xad n GLY 329 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xad n SER 330 N -1.07 0.10 -4.62 1.61 3.41 -0.95 -2.75 113.62 109.33 1xad n SER 330 Ca 0.00 -0.97 -0.43 0.00 -0.26 0.00 0.00 58.87 57.21 1xad n SER 330 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 1xad n SER 330 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xad s ALA 331 N -0.00 3.25 1.00 7.33 0.00 -1.15 -4.63 121.76 127.56 1xad s ALA 331 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1xad s ALA 331 Cb 0.00 -3.84 0.00 0.00 0.00 0.00 0.00 23.12 19.28 1xad s ALA 331 CO 0.00 -1.98 0.00 0.41 0.00 0.00 0.00 175.76 174.19 1xad n GLY 332 N 4.63 -1.42 0.18 0.00 0.00 -1.26 -3.75 105.19 103.56 1xad n GLY 332 Ca 0.17 -1.61 -0.09 0.00 0.00 0.00 0.00 46.02 44.49 1xad n GLY 332 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xad h THR 333 N -1.01 0.65 0.49 2.61 2.02 -1.20 -0.00 112.91 116.47 1xad h THR 333 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1xad h THR 333 Cb 0.00 0.65 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1xad h THR 333 CO 0.00 0.00 -0.24 -0.08 0.37 0.00 0.00 175.52 175.57 1xad h GLU 334 N -0.15 -0.64 -0.90 6.66 4.57 -1.91 0.17 114.58 122.39 1xad h GLU 334 Ca 0.09 0.04 0.23 0.00 -1.18 0.00 0.00 59.36 58.54 1xad h GLU 334 Cb 0.28 0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 28.96 1xad h GLU 334 CO -0.22 -0.37 0.61 0.00 -1.18 0.00 0.00 179.01 177.86 1xad h ALA 335 N -0.98 2.49 -0.02 2.92 0.00 -1.87 0.60 119.26 122.40 1xad h ALA 335 Ca -0.07 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1xad h ALA 335 Cb 0.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1xad h ALA 335 CO 0.11 -0.77 -0.14 0.35 0.00 0.00 0.00 179.25 178.80 1xad h PHE 336 N 0.22 0.18 -0.54 0.00 3.57 -0.77 -2.96 116.94 116.65 1xad h PHE 336 Ca 0.45 -0.08 0.16 0.00 3.53 0.00 0.00 57.97 62.02 1xad h PHE 336 Cb 1.42 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 40.11 1xad h PHE 336 CO -0.00 0.80 0.39 1.15 -2.23 0.00 0.00 178.31 178.42 1xad h THR 337 N -0.49 0.71 0.77 4.41 2.02 0.95 -2.45 112.91 118.83 1xad h THR 337 Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 1xad h THR 337 Cb 0.82 0.73 0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1xad h THR 337 CO 0.03 0.00 -0.37 0.00 0.37 0.00 0.00 175.52 175.55 1xad h ALA 338 N 1.72 -1.15 0.00 6.16 0.00 -0.82 -2.16 119.26 123.01 1xad h ALA 338 Ca 0.26 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1xad h ALA 338 Cb 1.04 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 19.22 1xad h ALA 338 CO -0.00 -1.07 -0.03 0.00 0.00 0.00 0.00 179.25 178.15 1xad h THR 339 N -1.14 0.51 -0.23 0.00 1.03 -1.32 0.42 112.91 112.18 1xad h THR 339 Ca -0.11 -0.13 -0.02 0.00 -0.01 0.00 0.00 66.41 66.14 1xad h THR 339 Cb 0.79 1.08 -0.01 0.00 -1.07 0.00 0.00 68.15 68.94 1xad h THR 339 CO 0.17 0.03 0.07 0.58 -0.01 0.00 0.00 175.52 176.36 1xad h VAL 340 N 0.00 1.20 -0.33 0.00 2.07 -1.23 -1.15 116.25 116.81 1xad h VAL 340 Ca -0.00 -0.64 -0.11 0.00 0.82 0.00 0.00 66.70 66.77 1xad h VAL 340 Cb 0.08 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1xad h VAL 340 CO 0.00 0.21 -0.22 -0.07 0.02 0.00 0.00 177.57 177.51 1xad h LEU 341 N 0.21 0.76 -1.87 2.57 3.38 -0.23 -1.59 115.31 118.54 1xad h LEU 341 Ca 0.07 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1xad h LEU 341 Cb 0.25 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1xad h LEU 341 CO -0.00 1.03 0.05 -0.09 0.09 0.00 0.00 178.44 179.52 1xad h ARG 342 N 0.50 0.00 0.00 1.13 2.43 -0.02 0.37 114.38 118.78 1xad h ARG 342 Ca 0.06 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1xad h ARG 342 Cb 0.78 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1xad h ARG 342 CO 0.06 0.00 -1.05 0.72 -1.51 0.00 0.00 179.97 178.19 1xad n HIS 343 N -2.51 0.16 -1.63 2.20 8.25 -0.46 -4.39 115.22 116.84 1xad n HIS 343 Ca -0.02 0.05 -0.01 0.00 -0.26 0.00 0.00 57.72 57.47 1xad n HIS 343 Cb 0.10 -0.32 0.18 0.00 1.12 0.00 0.00 29.99 31.06 1xad n HIS 343 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 1xad n LEU 344 N -1.84 3.41 -0.77 2.41 -0.00 0.13 -4.87 117.00 115.47 1xad n LEU 344 Ca 0.02 -4.01 0.10 0.00 -0.00 0.00 0.00 56.01 52.12 1xad n LEU 344 Cb 0.41 -0.53 0.08 0.00 -0.00 0.00 0.00 43.42 43.38 1xad n LEU 344 CO 0.41 1.48 0.56 0.00 -0.00 0.00 0.00 177.39 179.84