#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uls n LEU 3 N 0.00 1.99 -4.39 0.55 4.77 0.15 -4.62 117.00 115.45 1uls n LEU 3 Ca 0.00 -3.05 -0.53 0.00 -0.03 0.00 0.00 56.01 52.40 1uls n LEU 3 Cb 0.00 -0.33 -0.09 0.00 -2.33 0.00 0.00 43.42 40.67 1uls n LEU 3 CO 0.00 0.97 1.80 1.17 -1.33 0.00 0.00 177.39 180.00 1uls n LYS 4 N -0.64 0.69 -0.43 3.23 3.00 -0.91 -1.35 118.16 121.75 1uls n LYS 4 Ca 0.14 0.18 0.00 0.00 -0.00 0.00 0.00 58.31 58.63 1uls n LYS 4 Cb 0.81 -2.14 0.00 0.00 0.00 0.00 0.00 35.03 33.69 1uls n LYS 4 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1uls n ASP 5 N 9.29 0.00 -4.74 3.14 10.43 -0.01 -4.95 116.55 129.69 1uls n ASP 5 Ca 0.47 0.00 -0.41 0.00 2.57 0.00 0.00 54.79 57.41 1uls n ASP 5 Cb 0.14 -0.97 -0.03 0.00 1.84 0.00 0.00 41.12 42.10 1uls n ASP 5 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1uls s LYS 6 N -0.26 4.33 -0.33 -1.24 1.02 -0.46 -4.62 119.74 118.17 1uls s LYS 6 Ca 0.00 2.19 -0.20 0.00 0.02 0.00 0.00 55.97 57.98 1uls s LYS 6 Cb 0.00 -3.14 -0.00 0.00 -0.52 0.00 0.00 37.83 34.16 1uls s LYS 6 CO 0.00 -0.33 0.62 0.00 -0.92 0.00 0.00 175.35 174.71 1uls s ALA 7 N -0.03 3.50 -0.03 5.17 0.00 -1.26 -0.83 121.76 128.28 1uls s ALA 7 Ca 0.58 -0.76 0.04 0.00 0.00 0.00 0.00 51.96 51.81 1uls s ALA 7 Cb -0.39 -3.11 -0.00 0.00 0.00 0.00 0.00 23.12 19.61 1uls s ALA 7 CO 0.42 -1.18 -0.14 0.08 0.00 0.00 0.00 175.76 174.93 1uls s VAL 8 N 2.62 1.19 -0.07 0.00 1.01 -0.58 -0.08 120.40 124.48 1uls s VAL 8 Ca 0.24 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.63 1uls s VAL 8 Cb -0.15 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.18 1uls s VAL 8 CO 0.13 0.35 -0.06 -0.22 0.00 0.00 0.00 175.10 175.29 1uls s LEU 9 N -0.02 3.19 -0.07 3.92 0.20 -0.93 -1.51 118.68 123.48 1uls s LEU 9 Ca -0.01 -0.02 0.02 0.00 0.69 0.00 0.00 54.13 54.81 1uls s LEU 9 Cb -0.09 -1.70 0.02 0.00 -0.43 0.00 0.00 46.19 43.98 1uls s LEU 9 CO 0.01 0.36 -0.10 -0.63 -0.29 0.00 0.00 176.35 175.70 1uls s ILE 10 N -0.78 0.99 0.37 6.68 1.01 -0.37 -1.81 121.20 127.30 1uls s ILE 10 Ca 0.12 -0.38 0.01 0.00 0.00 0.00 0.00 60.65 60.40 1uls s ILE 10 Cb -0.11 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.40 1uls s ILE 10 CO 0.02 0.33 0.57 0.42 0.00 0.00 0.00 174.94 176.28 1uls s THR 11 N 0.85 4.66 -1.54 2.92 -4.23 -0.71 -0.02 115.64 117.57 1uls s THR 11 Ca -0.11 -0.55 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 1uls s THR 11 Cb -0.15 -3.69 0.00 0.00 1.34 0.00 0.00 72.50 69.99 1uls s THR 11 CO 0.01 -0.44 0.00 0.61 -0.54 0.00 0.00 174.62 174.27 1uls n GLY 12 N -1.85 -0.08 0.00 3.99 0.00 0.07 -3.77 105.19 103.55 1uls n GLY 12 Ca -0.03 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.04 1uls n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uls n ALA 13 N -1.51 1.48 0.03 4.61 0.00 -0.51 -2.75 120.51 121.86 1uls n ALA 13 Ca -0.20 -0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.15 1uls n ALA 13 Cb 0.64 -1.16 -0.11 0.00 0.00 0.00 0.00 19.45 18.82 1uls n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uls h ALA 14 N 2.36 0.58 -2.17 0.00 0.00 -1.88 -3.02 119.26 115.12 1uls h ALA 14 Ca 0.00 -1.06 -0.46 0.00 0.00 0.00 0.00 54.91 53.38 1uls h ALA 14 Cb 0.16 0.14 0.05 0.00 0.00 0.00 0.00 17.79 18.14 1uls h ALA 14 CO 0.00 1.27 0.09 -1.01 0.00 0.00 0.00 179.25 179.61 1uls s HIS 15 N -2.72 3.14 0.00 0.00 3.76 -1.11 -4.69 115.29 113.68 1uls s HIS 15 Ca -0.01 0.43 0.00 0.00 -0.15 0.00 0.00 55.06 55.33 1uls s HIS 15 Cb 0.09 -2.71 0.00 0.00 1.11 0.00 0.00 32.58 31.07 1uls s HIS 15 CO 0.81 -0.81 0.16 0.41 -0.85 0.00 0.00 174.74 174.46 1uls n GLY 16 N -2.48 -0.97 0.17 -2.22 0.00 -1.26 0.10 105.19 98.52 1uls n GLY 16 Ca 0.05 0.20 -0.06 0.00 0.00 0.00 0.00 46.02 46.21 1uls n GLY 16 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1uls h ILE 17 N 0.00 0.97 -0.53 -0.61 2.04 -1.89 0.14 117.51 117.63 1uls h ILE 17 Ca 0.00 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 1uls h ILE 17 Cb 0.00 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 1uls h ILE 17 CO 0.00 0.07 0.22 1.23 0.00 0.00 0.00 178.15 179.68 1uls h GLY 18 N 0.40 0.84 0.98 5.37 0.00 -1.53 -0.78 103.07 108.35 1uls h GLY 18 Ca 0.17 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1uls h GLY 18 CO -0.12 0.42 0.05 -0.09 0.00 0.00 0.00 176.54 176.80 1uls h ARG 19 N 0.72 0.11 -0.48 4.80 9.65 0.10 0.05 114.38 129.32 1uls h ARG 19 Ca 0.18 -0.01 0.02 0.00 -1.10 0.00 0.00 59.98 59.07 1uls h ARG 19 Cb 0.18 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.71 1uls h ARG 19 CO -0.02 0.10 0.32 0.00 2.80 0.00 0.00 179.97 183.17 1uls h ALA 20 N 1.00 1.72 -0.13 2.80 0.00 -0.50 -1.72 119.26 122.43 1uls h ALA 20 Ca 0.03 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1uls h ALA 20 Cb 0.02 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1uls h ALA 20 CO -0.01 0.24 -0.68 1.15 0.00 0.00 0.00 179.25 179.95 1uls h THR 21 N 0.59 1.34 -0.35 0.00 2.02 -0.54 -2.31 112.91 113.67 1uls h THR 21 Ca 0.19 -2.00 -0.00 0.00 0.77 0.00 0.00 66.41 65.36 1uls h THR 21 Cb 0.02 1.98 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 1uls h THR 21 CO -0.04 0.61 0.20 -0.07 0.37 0.00 0.00 175.52 176.59 1uls h LEU 22 N 0.38 0.42 -0.30 2.58 3.38 -0.16 -0.79 115.31 120.83 1uls h LEU 22 Ca -0.02 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1uls h LEU 22 Cb 1.26 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 1uls h LEU 22 CO 0.13 0.37 0.17 -0.33 0.09 0.00 0.00 178.44 178.87 1uls h GLU 23 N 0.44 0.40 0.16 1.13 5.08 -1.33 -0.55 114.58 119.92 1uls h GLU 23 Ca 0.12 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1uls h GLU 23 Cb 0.03 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1uls h GLU 23 CO -0.02 0.32 -0.08 1.25 -1.00 0.00 0.00 179.01 179.49 1uls h LEU 24 N 0.37 -0.18 -1.49 1.33 6.46 -1.27 -2.02 115.31 118.50 1uls h LEU 24 Ca 0.11 -0.07 0.01 0.00 -0.12 0.00 0.00 57.88 57.80 1uls h LEU 24 Cb 0.03 0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 39.98 1uls h LEU 24 CO -0.02 -0.04 0.34 -0.26 -0.62 0.00 0.00 178.44 177.84 1uls h PHE 25 N -0.31 0.65 -0.32 1.25 -1.00 -1.08 -0.60 116.94 115.54 1uls h PHE 25 Ca -0.02 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.75 1uls h PHE 25 Cb 0.24 -0.22 -0.01 0.00 3.61 0.00 0.00 35.95 39.57 1uls h PHE 25 CO -0.04 0.41 0.09 0.00 -1.61 0.00 0.00 178.31 177.16 1uls h ALA 26 N 1.68 0.42 0.00 2.45 0.00 -0.87 -1.83 119.26 121.11 1uls h ALA 26 Ca 0.19 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1uls h ALA 26 Cb -0.08 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1uls h ALA 26 CO -0.04 0.06 -0.15 0.87 0.00 0.00 0.00 179.25 180.00 1uls h LYS 27 N 0.36 0.00 -0.45 0.00 1.57 -0.55 -1.69 116.57 115.81 1uls h LYS 27 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1uls h LYS 27 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1uls h LYS 27 CO -0.00 0.15 0.00 0.39 -0.57 0.00 0.00 179.45 179.41 1uls n GLU 28 N -3.94 1.81 -1.14 3.15 -0.58 -0.33 -4.91 120.64 114.70 1uls n GLU 28 Ca -0.02 -0.93 -0.04 0.00 -0.42 0.00 0.00 57.16 55.75 1uls n GLU 28 Cb 0.24 -1.38 -0.02 0.00 -0.57 0.00 0.00 31.44 29.71 1uls n GLU 28 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1uls n GLY 29 N 0.66 0.64 3.83 0.62 0.00 -0.63 -0.68 105.19 109.64 1uls n GLY 29 Ca 0.09 -0.90 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 1uls n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uls s ALA 30 N -2.14 3.08 -0.45 4.61 0.00 -0.76 -0.83 121.76 125.26 1uls s ALA 30 Ca 0.00 0.26 -0.15 0.00 0.00 0.00 0.00 51.96 52.07 1uls s ALA 30 Cb 0.00 -3.10 0.06 0.00 0.00 0.00 0.00 23.12 20.07 1uls s ALA 30 CO 0.00 -0.04 0.36 1.03 0.00 0.00 0.00 175.76 177.11 1uls s ARG 31 N -3.62 2.96 0.08 0.00 0.52 -0.01 -4.74 118.95 114.14 1uls s ARG 31 Ca 0.60 -1.26 0.02 0.00 -0.52 0.00 0.00 55.73 54.57 1uls s ARG 31 Cb -0.10 -4.07 -0.04 0.00 0.52 0.00 0.00 34.95 31.27 1uls s ARG 31 CO 0.23 -0.94 0.12 -0.51 0.02 0.00 0.00 175.30 174.22 1uls s LEU 32 N 1.64 3.98 -0.13 2.53 1.43 -1.26 -1.52 118.68 125.34 1uls s LEU 32 Ca 0.04 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 1uls s LEU 32 Cb -0.23 -2.63 0.02 0.00 0.03 0.00 0.00 46.19 43.38 1uls s LEU 32 CO 0.07 0.17 -0.16 -0.69 0.23 0.00 0.00 176.35 175.97 1uls s VAL 33 N -1.44 1.64 -0.20 -1.59 1.01 -0.57 -1.41 120.40 117.85 1uls s VAL 33 Ca 0.31 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.50 1uls s VAL 33 Cb -0.12 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 1uls s VAL 33 CO 0.24 0.47 0.10 0.00 0.00 0.00 0.00 175.10 175.90 1uls s ALA 34 N 1.18 3.52 0.02 5.51 0.00 0.00 -1.24 121.76 130.75 1uls s ALA 34 Ca -0.01 -0.75 0.07 0.00 0.00 0.00 0.00 51.96 51.27 1uls s ALA 34 Cb -0.14 -2.05 -0.02 0.00 0.00 0.00 0.00 23.12 20.90 1uls s ALA 34 CO -0.06 0.12 -0.21 0.00 0.00 0.00 0.00 175.76 175.60 1uls s ASP 36 N -0.90 -0.03 0.02 0.00 -1.08 -1.22 -0.75 116.67 112.71 1uls s ASP 36 Ca 0.08 -0.24 -0.17 0.00 -0.52 0.00 0.00 52.55 51.70 1uls s ASP 36 Cb -0.09 0.21 -0.35 0.00 -1.46 0.00 0.00 42.92 41.24 1uls s ASP 36 CO 0.01 -0.41 0.99 -0.29 0.52 0.00 0.00 175.17 175.98 1uls h ILE 37 N 2.00 1.31 -3.67 4.11 6.09 -1.95 -3.40 117.51 122.00 1uls h ILE 37 Ca -0.27 -2.67 -0.65 0.00 -1.37 0.00 0.00 64.86 59.90 1uls h ILE 37 Cb 1.20 3.06 -0.16 0.00 0.47 0.00 0.00 36.82 41.39 1uls h ILE 37 CO 0.30 0.80 -0.25 -1.61 -3.07 0.00 0.00 178.15 174.32 1uls s GLU 38 N -2.58 3.68 0.14 2.19 2.02 -1.26 -4.95 118.70 117.93 1uls s GLU 38 Ca -0.10 -0.28 -0.18 0.00 0.02 0.00 0.00 54.97 54.43 1uls s GLU 38 Cb 0.04 -3.77 0.00 0.00 0.10 0.00 0.00 34.13 30.50 1uls s GLU 38 CO 0.93 -0.48 1.76 1.49 0.02 0.00 0.00 175.26 178.98 1uls h GLU 39 N 8.40 0.25 -0.07 1.61 4.81 -1.98 -2.08 114.58 125.51 1uls h GLU 39 Ca -0.30 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 58.92 1uls h GLU 39 Cb 1.15 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 1uls h GLU 39 CO 0.69 0.17 -0.10 0.78 -0.73 0.00 0.00 179.01 179.82 1uls h GLY 40 N 0.26 -1.79 2.00 1.92 0.00 -2.00 0.31 103.07 103.77 1uls h GLY 40 Ca 0.12 0.82 -0.02 0.00 0.00 0.00 0.00 47.33 48.25 1uls h GLY 40 CO -0.11 -0.64 -0.11 -0.56 0.00 0.00 0.00 176.54 175.13 1uls h PRO 41 N -0.07 0.00 0.05 4.80 0.13 -1.99 -2.87 132.00 132.06 1uls h PRO 41 Ca 0.01 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1uls h PRO 41 Cb 0.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.23 1uls h PRO 41 CO -0.10 0.11 -0.03 1.25 -0.23 0.00 0.00 178.00 179.00 1uls h LEU 42 N 0.00 -0.06 -0.86 1.56 6.46 -0.54 -1.81 115.31 120.05 1uls h LEU 42 Ca -0.00 -0.38 0.07 0.00 -0.12 0.00 0.00 57.88 57.45 1uls h LEU 42 Cb 0.36 0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 40.24 1uls h LEU 42 CO 0.01 0.36 0.53 0.03 -0.62 0.00 0.00 178.44 178.75 1uls h ARG 43 N -0.49 0.92 -0.23 1.25 3.08 -0.30 -0.62 114.38 117.99 1uls h ARG 43 Ca -0.01 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 1uls h ARG 43 Cb 0.44 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1uls h ARG 43 CO 0.01 0.61 -0.05 1.49 -1.07 0.00 0.00 179.97 180.96 1uls h GLU 44 N 0.95 0.45 -0.18 0.04 4.22 -1.49 -0.75 114.58 117.81 1uls h GLU 44 Ca 0.38 -0.17 -0.07 0.00 0.08 0.00 0.00 59.36 59.59 1uls h GLU 44 Cb 0.21 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1uls h GLU 44 CO -0.19 0.68 -0.19 0.00 -2.18 0.00 0.00 179.01 177.13 1uls h ALA 45 N 0.76 1.34 -0.13 2.92 0.00 -1.01 -2.22 119.26 120.91 1uls h ALA 45 Ca 0.06 -0.27 -0.18 0.00 0.00 0.00 0.00 54.91 54.51 1uls h ALA 45 Cb 0.51 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.21 1uls h ALA 45 CO 0.02 0.45 -0.63 0.00 0.00 0.00 0.00 179.25 179.09 1uls h ALA 46 N 1.51 0.25 -0.32 0.00 0.00 -1.01 -3.27 119.26 116.42 1uls h ALA 46 Ca 0.05 -0.55 -0.10 0.00 0.00 0.00 0.00 54.91 54.31 1uls h ALA 46 Cb 0.51 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1uls h ALA 46 CO 0.03 0.53 -0.22 0.93 0.00 0.00 0.00 179.25 180.52 1uls h GLU 47 N 0.33 0.62 0.00 0.00 5.08 -0.96 0.85 114.58 120.49 1uls h GLU 47 Ca -0.04 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1uls h GLU 47 Cb 1.27 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1uls h GLU 47 CO 0.13 0.80 0.00 0.00 -1.00 0.00 0.00 179.01 178.94 1uls h ALA 48 N 1.21 1.00 0.00 3.43 0.00 -1.47 -3.06 119.26 120.37 1uls h ALA 48 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1uls h ALA 48 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1uls h ALA 48 CO 0.05 0.00 -0.86 0.28 0.00 0.00 0.00 179.25 178.72 1uls n VAL 49 N -2.79 0.00 -0.68 0.00 0.31 -1.01 -5.01 118.33 109.15 1uls n VAL 49 Ca -0.00 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1uls n VAL 49 Cb 0.18 0.66 0.00 0.00 -0.91 0.00 0.00 33.84 33.77 1uls n VAL 49 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1uls n GLY 50 N 1.62 0.66 3.95 2.92 0.00 -0.06 -4.93 105.19 109.35 1uls n GLY 50 Ca -0.00 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 1uls n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uls s ALA 51 N -2.00 3.72 -0.31 4.61 0.00 0.09 -4.81 121.76 123.06 1uls s ALA 51 Ca 0.00 -1.03 -0.13 0.00 0.00 0.00 0.00 51.96 50.80 1uls s ALA 51 Cb 0.00 -2.18 -0.03 0.00 0.00 0.00 0.00 23.12 20.91 1uls s ALA 51 CO 0.00 -0.42 0.27 -1.58 0.00 0.00 0.00 175.76 174.03 1uls s HIS 52 N -2.60 3.22 0.10 0.00 2.46 -0.50 -4.46 115.29 113.52 1uls s HIS 52 Ca 0.49 0.06 -0.30 0.00 0.47 0.00 0.00 55.06 55.78 1uls s HIS 52 Cb -0.10 -2.50 -0.06 0.00 -0.13 0.00 0.00 32.58 29.79 1uls s HIS 52 CO 0.39 -0.28 1.08 -1.25 -2.47 0.00 0.00 174.74 172.20 1uls s PRO 53 N 1.87 4.56 -0.14 2.88 0.04 -1.26 -0.82 135.00 142.13 1uls s PRO 53 Ca 0.09 1.62 -0.03 0.00 0.04 0.00 0.00 61.00 62.72 1uls s PRO 53 Cb -0.16 -3.35 0.05 0.00 0.04 0.00 0.00 34.50 31.07 1uls s PRO 53 CO 0.11 -0.01 0.05 0.08 0.04 0.00 0.00 177.00 177.26 1uls s VAL 54 N 0.41 0.19 0.95 -0.36 1.01 0.49 -4.92 120.40 118.17 1uls s VAL 54 Ca 0.52 -0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.25 1uls s VAL 54 Cb -0.27 -0.64 0.16 0.00 0.00 0.00 0.00 36.38 35.64 1uls s VAL 54 CO 0.31 -0.07 1.09 -0.69 0.00 0.00 0.00 175.10 175.73 1uls s VAL 55 N 2.02 2.43 -0.38 2.92 1.01 -1.26 -3.46 120.40 123.68 1uls s VAL 55 Ca 0.02 0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.21 1uls s VAL 55 Cb -0.15 -2.53 0.18 0.00 0.00 0.00 0.00 36.38 33.88 1uls s VAL 55 CO -0.07 -0.18 0.58 -0.62 0.00 0.00 0.00 175.10 174.81 1uls s ASP 57 N -3.25 -1.09 0.21 3.32 -1.08 -1.26 -4.78 116.67 108.74 1uls s ASP 57 Ca 0.65 -0.73 0.10 0.00 -0.52 0.00 0.00 52.55 52.05 1uls s ASP 57 Cb -0.19 1.74 0.54 0.00 -1.46 0.00 0.00 42.92 43.54 1uls s ASP 57 CO 0.58 -0.21 1.20 1.33 0.52 0.00 0.00 175.17 178.59 1uls n VAL 58 N 4.59 0.96 0.65 1.11 0.24 -1.26 0.58 118.33 125.19 1uls n VAL 58 Ca 0.10 0.66 0.13 0.00 -2.04 0.00 0.00 64.34 63.18 1uls n VAL 58 Cb 0.55 -1.66 0.31 0.00 -1.47 0.00 0.00 33.84 31.57 1uls n VAL 58 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1uls n ALA 59 N -1.52 2.64 -2.87 2.33 0.00 -1.26 -4.32 120.51 115.50 1uls n ALA 59 Ca -0.01 -0.15 -0.39 0.00 0.00 0.00 0.00 53.44 52.89 1uls n ALA 59 Cb 0.21 -1.32 -0.11 0.00 0.00 0.00 0.00 19.45 18.23 1uls n ALA 59 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1uls s ASP 60 N -4.21 5.60 0.22 0.00 3.68 0.20 -4.96 116.67 117.19 1uls s ASP 60 Ca 0.09 -0.75 -0.09 0.00 2.13 0.00 0.00 52.55 53.93 1uls s ASP 60 Cb 0.14 -2.00 0.33 0.00 -1.45 0.00 0.00 42.92 39.94 1uls s ASP 60 CO 0.65 -0.28 1.69 -0.65 0.13 0.00 0.00 175.17 176.71 1uls h PRO 61 N 8.38 0.22 -0.17 4.34 0.11 -1.85 -0.19 132.00 142.84 1uls h PRO 61 Ca -0.29 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.71 1uls h PRO 61 Cb 1.13 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1uls h PRO 61 CO 0.64 0.14 -0.32 0.00 -0.21 0.00 0.00 178.00 178.25 1uls h ALA 62 N 1.53 1.13 -0.29 -0.75 0.00 -1.94 -0.52 119.26 118.43 1uls h ALA 62 Ca 0.34 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1uls h ALA 62 Cb 0.54 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1uls h ALA 62 CO -0.46 0.56 -0.22 1.03 0.00 0.00 0.00 179.25 180.16 1uls h SER 63 N 0.30 0.69 -0.56 0.00 0.87 -1.55 0.28 113.55 113.58 1uls h SER 63 Ca 0.04 -0.45 -0.01 0.00 -1.23 0.00 0.00 61.79 60.14 1uls h SER 63 Cb 0.72 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.46 1uls h SER 63 CO 0.05 0.99 0.30 0.58 -0.53 0.00 0.00 176.83 178.23 1uls h VAL 64 N 0.39 1.19 0.49 2.23 2.07 -0.83 0.12 116.25 121.90 1uls h VAL 64 Ca 0.05 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 1uls h VAL 64 Cb 0.77 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1uls h VAL 64 CO 0.06 0.20 -0.23 -0.08 0.02 0.00 0.00 177.57 177.54 1uls h GLU 65 N 0.75 -0.63 -0.82 1.57 4.81 -0.93 -1.29 114.58 118.04 1uls h GLU 65 Ca 0.20 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.54 1uls h GLU 65 Cb 0.05 0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.51 1uls h GLU 65 CO -0.03 -0.37 0.50 0.00 -0.73 0.00 0.00 179.01 178.38 1uls h ARG 66 N -0.75 0.88 -0.18 1.92 3.08 -0.84 -2.32 114.38 116.16 1uls h ARG 66 Ca -0.07 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 59.98 1uls h ARG 66 Cb 0.55 -0.20 -0.06 0.00 0.08 0.00 0.00 29.97 30.34 1uls h ARG 66 CO 0.11 0.58 -0.25 0.78 -1.07 0.00 0.00 179.97 180.12 1uls h GLY 67 N 0.90 -0.23 2.00 0.04 0.00 -0.44 -1.57 103.07 103.77 1uls h GLY 67 Ca 0.37 0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.95 1uls h GLY 67 CO -0.18 -0.20 -0.23 0.74 0.00 0.00 0.00 176.54 176.67 1uls h PHE 68 N -0.29 0.00 -0.37 5.60 -1.00 -0.89 -1.19 116.94 118.80 1uls h PHE 68 Ca 0.12 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.84 1uls h PHE 68 Cb 0.47 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.01 1uls h PHE 68 CO -0.37 0.23 0.03 0.00 -1.61 0.00 0.00 178.31 176.58 1uls h ALA 69 N 1.77 0.50 -0.45 2.45 0.00 -0.81 0.11 119.26 122.83 1uls h ALA 69 Ca -0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1uls h ALA 69 Cb 0.45 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1uls h ALA 69 CO 0.03 0.24 0.17 0.93 0.00 0.00 0.00 179.25 180.62 1uls h GLU 70 N 0.47 0.67 -0.06 0.00 5.08 -0.74 0.22 114.58 120.22 1uls h GLU 70 Ca 0.11 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1uls h GLU 70 Cb 0.42 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1uls h GLU 70 CO 0.01 0.63 0.03 0.00 -1.00 0.00 0.00 179.01 178.68 1uls h ALA 71 N 1.01 0.07 -0.52 3.43 0.00 -1.05 -0.59 119.26 121.62 1uls h ALA 71 Ca 0.15 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1uls h ALA 71 Cb 0.22 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1uls h ALA 71 CO -0.01 -0.44 0.06 -0.07 0.00 0.00 0.00 179.25 178.79 1uls h LEU 72 N 0.07 0.78 -1.10 0.00 -0.00 -0.60 0.41 115.31 114.87 1uls h LEU 72 Ca 0.02 -0.17 -0.07 0.00 -0.00 0.00 0.00 57.88 57.67 1uls h LEU 72 Cb -0.00 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 40.44 1uls h LEU 72 CO -0.01 0.81 -0.08 0.00 -0.00 0.00 0.00 178.44 179.15 1uls h ALA 73 N 1.28 1.25 0.23 1.53 0.00 -0.23 0.31 119.26 123.63 1uls h ALA 73 Ca 0.16 -0.25 -0.34 0.00 0.00 0.00 0.00 54.91 54.48 1uls h ALA 73 Cb 0.38 -0.14 0.03 0.00 0.00 0.00 0.00 17.79 18.06 1uls h ALA 73 CO 0.01 0.49 -1.57 1.25 0.00 0.00 0.00 179.25 179.43 1uls h HIS 74 N 0.50 0.87 0.02 0.00 -0.00 -0.51 -3.39 115.15 112.65 1uls h HIS 74 Ca 0.10 -0.64 -0.31 0.00 -0.00 0.00 0.00 60.37 59.52 1uls h HIS 74 Cb 0.45 -0.03 -0.05 0.00 -0.00 0.00 0.00 27.41 27.78 1uls h HIS 74 CO 0.02 1.59 -1.80 1.28 -0.00 0.00 0.00 177.93 179.01 1uls n LEU 75 N -3.66 1.08 0.00 0.26 4.77 0.14 -4.98 117.00 114.61 1uls n LEU 75 Ca -0.19 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1uls n LEU 75 Cb 1.09 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.19 1uls n LEU 75 CO 0.57 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.71 1uls n GLY 76 N 1.64 2.25 3.62 -0.72 0.00 0.11 -4.92 105.19 107.17 1uls n GLY 76 Ca -0.20 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.79 1uls n GLY 76 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1uls s ARG 77 N -0.16 0.57 -0.07 1.61 1.70 -1.26 -5.05 118.95 116.29 1uls s ARG 77 Ca 0.00 -0.28 -0.00 0.00 -0.47 0.00 0.00 55.73 54.98 1uls s ARG 77 Cb 0.00 0.22 0.02 0.00 -0.57 0.00 0.00 34.95 34.62 1uls s ARG 77 CO 0.00 -0.26 -0.04 -1.17 -1.08 0.00 0.00 175.30 172.75 1uls s LEU 78 N -2.69 1.02 -0.05 -1.89 0.20 -1.26 -4.78 118.68 109.23 1uls s LEU 78 Ca 0.11 -0.16 0.17 0.00 0.69 0.00 0.00 54.13 54.94 1uls s LEU 78 Cb 0.01 -0.56 -0.25 0.00 -0.43 0.00 0.00 46.19 44.96 1uls s LEU 78 CO -0.04 -0.12 0.32 0.47 -0.29 0.00 0.00 176.35 176.69 1uls n ASP 79 N 4.68 1.10 -3.53 3.68 8.00 0.88 -4.90 116.55 126.47 1uls n ASP 79 Ca -0.15 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.27 1uls n ASP 79 Cb 0.50 1.62 -0.03 0.00 -0.02 0.00 0.00 41.12 43.20 1uls n ASP 79 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1uls s GLY 80 N -4.14 -0.41 -0.03 0.44 0.00 -1.01 -1.62 107.32 100.55 1uls s GLY 80 Ca -0.07 1.29 -0.01 0.00 0.00 0.00 0.00 44.72 45.93 1uls s GLY 80 CO 0.70 0.51 0.06 0.14 0.00 0.00 0.00 173.10 174.51 1uls s VAL 81 N -2.60 -0.03 -0.24 1.40 1.01 -0.88 -2.18 120.40 116.88 1uls s VAL 81 Ca 0.04 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.13 1uls s VAL 81 Cb -0.01 -0.10 0.05 0.00 0.00 0.00 0.00 36.38 36.32 1uls s VAL 81 CO -0.06 0.04 -0.12 -0.69 0.00 0.00 0.00 175.10 174.27 1uls s VAL 82 N 0.51 2.03 -0.29 2.92 1.01 -0.75 -0.59 120.40 125.25 1uls s VAL 82 Ca -0.04 -1.43 -0.11 0.00 0.00 0.00 0.00 61.98 60.41 1uls s VAL 82 Cb -0.06 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 1uls s VAL 82 CO -0.02 0.07 0.18 -2.28 0.00 0.00 0.00 175.10 173.05 1uls s HIS 83 N 1.19 3.20 -0.12 5.22 5.04 -0.28 -1.74 115.29 127.80 1uls s HIS 83 Ca -0.06 -0.03 -0.08 0.00 -1.54 0.00 0.00 55.06 53.36 1uls s HIS 83 Cb -0.18 -2.38 -0.05 0.00 0.04 0.00 0.00 32.58 30.01 1uls s HIS 83 CO -0.07 -0.23 -0.19 0.66 -2.34 0.00 0.00 174.74 172.58 1uls n TYR 84 N 5.05 0.00 0.00 3.88 0.53 -1.25 -1.85 117.16 123.52 1uls n TYR 84 Ca -0.14 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.74 1uls n TYR 84 Cb 0.51 -0.45 0.00 0.00 -1.03 0.00 0.00 39.34 38.37 1uls n TYR 84 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1uls n ALA 85 N -3.75 0.00 -3.32 -0.72 0.00 -1.26 -4.85 120.51 106.61 1uls n ALA 85 Ca -0.23 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.11 1uls n ALA 85 Cb 0.58 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.00 1uls n ALA 85 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1uls s GLY 86 N 0.00 -0.34 0.20 0.00 0.00 -1.26 -4.76 107.32 101.16 1uls s GLY 86 Ca 0.00 0.09 -0.09 0.00 0.00 0.00 0.00 44.72 44.72 1uls s GLY 86 CO 0.00 -0.10 0.33 -0.26 0.00 0.00 0.00 173.10 173.07 1uls s ILE 87 N -3.81 0.03 0.10 0.90 -4.36 -1.26 -5.06 121.20 107.73 1uls s ILE 87 Ca 0.05 -1.51 0.02 0.00 -0.26 0.00 0.00 60.65 58.95 1uls s ILE 87 Cb -0.01 -2.11 -0.04 0.00 1.25 0.00 0.00 42.46 41.56 1uls s ILE 87 CO -0.08 -0.12 -0.07 0.42 0.24 0.00 0.00 174.94 175.32 1uls s THR 88 N -4.02 0.75 -0.47 8.37 -4.23 -1.26 -4.92 115.64 109.85 1uls s THR 88 Ca 0.23 -1.84 0.06 0.00 -1.18 0.00 0.00 61.69 58.97 1uls s THR 88 Cb 0.02 -1.56 0.21 0.00 1.34 0.00 0.00 72.50 72.51 1uls s THR 88 CO 0.06 -0.78 0.68 0.54 -0.54 0.00 0.00 174.62 174.58 1uls n ARG 89 N 0.15 0.58 -1.53 3.99 3.00 -1.26 -5.05 116.66 116.54 1uls n ARG 89 Ca -0.13 -2.31 -0.32 0.00 -0.01 0.00 0.00 57.85 55.07 1uls n ARG 89 Cb 0.60 -1.47 0.07 0.00 0.00 0.00 0.00 32.46 31.66 1uls n ARG 89 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1uls s ASP 90 N -0.39 4.75 0.00 0.55 1.01 -1.26 -4.90 116.67 116.43 1uls s ASP 90 Ca 0.32 1.98 0.00 0.00 0.71 0.00 0.00 52.55 55.56 1uls s ASP 90 Cb 0.11 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.49 1uls s ASP 90 CO -0.15 -1.87 0.00 0.59 0.21 0.00 0.00 175.17 173.95 1uls n ASN 91 N -2.87 0.00 -4.76 0.27 3.02 -0.06 -5.04 115.26 105.83 1uls n ASN 91 Ca 0.10 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.29 1uls n ASN 91 Cb 0.52 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.72 1uls n ASN 91 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1uls s PHE 92 N -1.64 2.43 0.31 3.10 0.40 -1.26 -4.12 117.98 117.19 1uls s PHE 92 Ca 0.00 1.51 0.06 0.00 -0.60 0.00 0.00 56.93 57.89 1uls s PHE 92 Cb 0.00 -3.49 0.72 0.00 0.51 0.00 0.00 43.02 40.76 1uls s PHE 92 CO 0.00 -2.19 1.81 1.12 0.70 0.00 0.00 175.22 176.66 1uls h HIS 93 N 1.03 1.04 0.00 0.36 2.07 -2.00 -0.23 115.15 117.42 1uls h HIS 93 Ca -0.50 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 1uls h HIS 93 Cb 1.29 -0.32 0.00 0.00 2.57 0.00 0.00 27.41 30.95 1uls h HIS 93 CO 0.47 0.30 0.00 -2.67 -3.07 0.00 0.00 177.93 172.96 1uls n TRP 94 N -4.69 0.00 -3.83 6.12 2.14 -1.26 -4.80 117.44 111.12 1uls n TRP 94 Ca 0.21 0.00 -0.32 0.00 2.07 0.00 0.00 57.50 59.46 1uls n TRP 94 Cb 0.51 -0.48 -0.11 0.00 -0.81 0.00 0.00 31.31 30.42 1uls n TRP 94 CO 0.00 0.00 0.00 0.15 2.07 0.00 0.00 177.69 179.91 1uls s LYS 95 N -2.97 2.48 -0.05 -2.67 1.02 -0.10 -5.18 119.74 112.27 1uls s LYS 95 Ca 0.07 -2.94 -0.04 0.00 0.02 0.00 0.00 55.97 53.08 1uls s LYS 95 Cb 0.09 -3.55 0.01 0.00 -0.52 0.00 0.00 37.83 33.85 1uls s LYS 95 CO 0.24 -1.20 0.13 -1.25 -0.92 0.00 0.00 175.35 172.34 1uls s PRO 97 N -0.78 0.15 0.27 -1.68 0.04 -1.26 -4.87 135.00 126.87 1uls s PRO 97 Ca 0.21 0.17 -0.04 0.00 0.04 0.00 0.00 61.00 61.38 1uls s PRO 97 Cb -0.15 0.07 0.54 0.00 0.04 0.00 0.00 34.50 35.00 1uls s PRO 97 CO -0.08 -0.02 1.61 1.25 0.04 0.00 0.00 177.00 179.81 1uls h LEU 98 N 5.94 -0.42 -0.79 -3.56 6.46 -1.99 0.13 115.31 121.08 1uls h LEU 98 Ca -0.25 0.23 0.17 0.00 -0.12 0.00 0.00 57.88 57.91 1uls h LEU 98 Cb 1.20 0.40 -0.11 0.00 -0.73 0.00 0.00 40.66 41.43 1uls h LEU 98 CO 0.43 -0.24 0.28 -0.33 -0.62 0.00 0.00 178.44 177.96 1uls h GLU 99 N 0.07 0.36 -0.64 1.25 5.08 -2.03 0.12 114.58 118.79 1uls h GLU 99 Ca 0.48 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.76 1uls h GLU 99 Cb 0.88 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.03 1uls h GLU 99 CO -0.77 0.24 0.17 -0.44 -1.00 0.00 0.00 179.01 177.21 1uls h ASP 100 N 0.38 0.95 -0.52 1.42 5.19 -1.16 -0.63 116.42 122.05 1uls h ASP 100 Ca 0.45 -0.22 -0.04 0.00 -0.62 0.00 0.00 57.03 56.60 1uls h ASP 100 Cb 0.76 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 40.00 1uls h ASP 100 CO -0.47 0.93 0.16 -0.25 -3.12 0.00 0.00 179.24 176.49 1uls h TRP 101 N 0.93 0.84 0.00 4.55 2.91 -0.52 -2.86 115.95 121.81 1uls h TRP 101 Ca 0.20 -0.09 -0.12 0.00 1.13 0.00 0.00 58.89 60.02 1uls h TRP 101 Cb 0.34 -0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 28.73 1uls h TRP 101 CO 0.02 0.72 -0.56 0.93 -1.03 0.00 0.00 178.44 178.52 1uls h GLU 102 N 0.72 0.00 -0.01 2.65 5.08 -0.70 -3.06 114.58 119.25 1uls h GLU 102 Ca 0.17 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1uls h GLU 102 Cb 0.28 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1uls h GLU 102 CO -0.00 0.56 -0.01 1.25 -1.00 0.00 0.00 179.01 179.81 1uls h LEU 103 N 0.00 0.03 -1.18 1.33 5.85 -0.98 -1.05 115.31 119.31 1uls h LEU 103 Ca -0.01 -0.43 -0.04 0.00 0.84 0.00 0.00 57.88 58.24 1uls h LEU 103 Cb 1.13 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 1uls h LEU 103 CO 0.07 0.46 0.11 -0.37 -0.34 0.00 0.00 178.44 178.37 1uls h VAL 104 N -0.39 1.20 -0.29 1.05 -1.51 -1.59 0.06 116.25 114.79 1uls h VAL 104 Ca 0.00 -0.71 -0.06 0.00 -1.23 0.00 0.00 66.70 64.70 1uls h VAL 104 Cb 0.45 0.74 -0.01 0.00 -2.13 0.00 0.00 31.29 30.33 1uls h VAL 104 CO 0.00 0.26 -0.05 -0.07 -1.23 0.00 0.00 177.57 176.48 1uls h LEU 105 N 0.66 0.54 -0.34 4.19 3.38 -1.51 0.37 115.31 122.61 1uls h LEU 105 Ca 0.15 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1uls h LEU 105 Cb 0.25 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1uls h LEU 105 CO -0.00 0.76 0.22 -0.09 0.09 0.00 0.00 178.44 179.42 1uls h ARG 106 N 0.31 0.44 0.10 1.13 2.43 -0.78 0.19 114.38 118.20 1uls h ARG 106 Ca 0.07 -0.03 -0.19 0.00 -0.81 0.00 0.00 59.98 59.03 1uls h ARG 106 Cb 0.52 -0.10 0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1uls h ARG 106 CO 0.02 0.30 -0.79 0.28 -1.51 0.00 0.00 179.97 178.28 1uls h VAL 107 N 0.45 1.46 0.00 0.20 2.07 -0.96 -1.72 116.25 117.76 1uls h VAL 107 Ca 0.12 -2.38 -0.01 0.00 0.82 0.00 0.00 66.70 65.26 1uls h VAL 107 Cb -0.04 2.95 -0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1uls h VAL 107 CO -0.03 0.68 -0.05 0.78 0.02 0.00 0.00 177.57 178.98 1uls h ASN 108 N -0.22 0.00 0.00 0.57 2.35 -0.26 -3.05 115.58 114.97 1uls h ASN 108 Ca -0.13 -0.76 -0.05 0.00 -0.55 0.00 0.00 56.30 54.82 1uls h ASN 108 Cb 1.57 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.93 1uls h ASN 108 CO 0.15 0.91 -0.29 0.25 -1.65 0.00 0.00 177.43 176.80 1uls h LEU 109 N -1.00 0.00 -0.90 1.61 5.85 -0.80 -2.87 115.31 117.19 1uls h LEU 109 Ca -0.01 -0.75 -0.12 0.00 0.84 0.00 0.00 57.88 57.84 1uls h LEU 109 Cb 0.79 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 1uls h LEU 109 CO -0.01 1.04 -0.53 0.74 -0.34 0.00 0.00 178.44 179.35 1uls h THR 110 N -1.00 1.37 -0.51 1.05 2.02 -1.04 -2.21 112.91 112.60 1uls h THR 110 Ca -0.08 -1.80 -0.06 0.00 0.77 0.00 0.00 66.41 65.24 1uls h THR 110 Cb 0.94 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 69.28 1uls h THR 110 CO -0.05 0.52 0.09 1.23 0.37 0.00 0.00 175.52 177.68 1uls h GLY 111 N 1.53 0.90 1.75 2.16 0.00 -1.19 -0.70 103.07 107.52 1uls h GLY 111 Ca -0.00 -0.59 -0.05 0.00 0.00 0.00 0.00 47.33 46.69 1uls h GLY 111 CO 0.07 0.55 -0.10 1.76 0.00 0.00 0.00 176.54 178.82 1uls h SER 112 N 0.71 0.29 -0.14 0.19 0.02 -1.28 -1.34 113.55 112.00 1uls h SER 112 Ca 0.15 -0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 61.00 1uls h SER 112 Cb 0.39 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 1uls h SER 112 CO 0.01 0.43 -0.10 0.15 -1.14 0.00 0.00 176.83 176.18 1uls h PHE 113 N 0.29 0.37 -0.60 3.45 3.57 -0.82 -1.31 116.94 121.90 1uls h PHE 113 Ca 0.06 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.44 1uls h PHE 113 Cb 0.36 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1uls h PHE 113 CO 0.01 0.68 0.29 -0.07 -2.23 0.00 0.00 178.31 176.98 1uls h LEU 114 N -0.04 0.79 -0.13 0.59 3.38 -0.81 0.03 115.31 119.12 1uls h LEU 114 Ca 0.03 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1uls h LEU 114 Cb 0.60 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1uls h LEU 114 CO 0.03 0.70 -0.01 0.58 0.09 0.00 0.00 178.44 179.82 1uls h VAL 115 N 0.82 1.27 -0.73 1.22 2.07 -1.25 -1.67 116.25 117.98 1uls h VAL 115 Ca 0.21 -0.89 -0.06 0.00 0.82 0.00 0.00 66.70 66.78 1uls h VAL 115 Cb 0.12 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 1uls h VAL 115 CO -0.03 0.26 0.24 0.00 0.02 0.00 0.00 177.57 178.06 1uls h ALA 116 N 0.73 1.04 -0.71 1.67 0.00 -1.16 0.27 119.26 121.09 1uls h ALA 116 Ca 0.03 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1uls h ALA 116 Cb 0.40 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1uls h ALA 116 CO 0.01 0.65 0.20 -0.22 0.00 0.00 0.00 179.25 179.89 1uls h LYS 117 N 1.08 1.12 -0.19 0.00 3.64 -0.92 0.12 116.57 121.41 1uls h LYS 117 Ca 0.24 -0.25 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 1uls h LYS 117 Cb 0.29 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1uls h LYS 117 CO -0.01 0.97 -0.29 0.00 -2.27 0.00 0.00 179.45 177.85 1uls h ALA 118 N 1.14 0.30 -0.29 5.00 0.00 -0.97 -1.27 119.26 123.16 1uls h ALA 118 Ca 0.23 -0.40 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1uls h ALA 118 Cb 0.33 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 1uls h ALA 118 CO -0.00 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.55 1uls h ALA 119 N 0.61 0.26 -0.37 0.00 0.00 -0.67 -1.30 119.26 117.79 1uls h ALA 119 Ca 0.02 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1uls h ALA 119 Cb 0.86 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1uls h ALA 119 CO 0.07 -0.41 0.19 1.03 0.00 0.00 0.00 179.25 180.13 1uls h SER 120 N 0.09 0.28 -0.93 0.00 0.87 -0.71 -2.35 113.55 110.80 1uls h SER 120 Ca 0.14 0.02 0.10 0.00 -1.23 0.00 0.00 61.79 60.82 1uls h SER 120 Cb 0.18 -0.04 -0.08 0.00 -0.44 0.00 0.00 62.40 62.03 1uls h SER 120 CO -0.23 0.21 0.57 -0.08 -0.53 0.00 0.00 176.83 176.76 1uls h GLU 121 N 0.39 0.92 -0.25 2.24 4.22 -0.59 0.52 114.58 122.02 1uls h GLU 121 Ca 0.16 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 59.54 1uls h GLU 121 Cb 0.06 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.10 1uls h GLU 121 CO -0.11 0.61 0.00 0.00 -2.18 0.00 0.00 179.01 177.33 1uls n ALA 122 N -2.36 2.04 -1.05 2.92 0.00 -0.55 -5.00 120.51 116.51 1uls n ALA 122 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1uls n ALA 122 Cb 0.29 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1uls n ALA 122 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1uls n ARG 124 N -0.21 0.00 -1.09 0.00 0.63 0.18 -4.64 116.66 111.53 1uls n ARG 124 Ca 0.00 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.90 1uls n ARG 124 Cb 0.06 -0.35 -0.01 0.00 0.45 0.00 0.00 32.46 32.61 1uls n ARG 124 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1uls n GLU 125 N 1.03 -1.23 -0.06 -0.14 1.02 -1.26 -4.79 120.64 115.21 1uls n GLU 125 Ca 0.00 0.47 -0.13 0.00 -0.02 0.00 0.00 57.16 57.48 1uls n GLU 125 Cb 0.00 -4.48 -0.04 0.00 -0.02 0.00 0.00 31.44 26.90 1uls n GLU 125 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1uls n LYS 126 N -0.87 0.30 -3.49 3.49 4.01 -1.26 -5.10 118.16 115.24 1uls n LYS 126 Ca -0.03 0.13 -0.10 0.00 -0.51 0.00 0.00 58.31 57.80 1uls n LYS 126 Cb 0.36 -1.01 -0.02 0.00 -0.51 0.00 0.00 35.03 33.84 1uls n LYS 126 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1uls s ASN 127 N -6.23 -0.47 0.96 4.39 4.22 -1.26 -5.16 114.94 111.39 1uls s ASN 127 Ca -0.19 -0.07 -0.12 0.00 -2.14 0.00 0.00 52.86 50.34 1uls s ASN 127 Cb 0.07 0.55 0.17 0.00 1.28 0.00 0.00 41.25 43.31 1uls s ASN 127 CO 0.25 -0.90 1.10 -2.16 -2.04 0.00 0.00 177.10 173.34 1uls s PRO 128 N -3.58 0.72 0.02 3.55 0.04 -1.26 -4.57 135.00 129.92 1uls s PRO 128 Ca 0.03 0.54 -0.28 0.00 0.04 0.00 0.00 61.00 61.33 1uls s PRO 128 Cb -0.01 -1.77 0.10 0.00 0.04 0.00 0.00 34.50 32.86 1uls s PRO 128 CO -0.10 -2.54 1.24 0.20 0.04 0.00 0.00 177.00 175.85 1uls s GLY 129 N -3.55 -0.23 -0.04 0.56 0.00 -1.03 -4.82 107.32 98.21 1uls s GLY 129 Ca 0.65 0.29 0.01 0.00 0.00 0.00 0.00 44.72 45.67 1uls s GLY 129 CO 0.57 2.47 -0.02 -0.45 0.00 0.00 0.00 173.10 175.67 1uls s SER 130 N -3.34 0.76 -0.13 1.64 0.15 -0.64 -0.36 113.70 111.78 1uls s SER 130 Ca 0.21 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.78 1uls s SER 130 Cb 0.02 -0.35 -0.01 0.00 -1.71 0.00 0.00 66.02 63.97 1uls s SER 130 CO -0.01 -0.08 -0.14 -0.63 1.20 0.00 0.00 173.24 173.58 1uls s ILE 131 N 1.03 3.00 -0.21 6.45 1.01 0.27 -2.07 121.20 130.66 1uls s ILE 131 Ca -0.10 -0.68 0.02 0.00 0.00 0.00 0.00 60.65 59.89 1uls s ILE 131 Cb -0.14 -2.26 0.04 0.00 0.01 0.00 0.00 42.46 40.11 1uls s ILE 131 CO -0.01 0.53 -0.16 -0.69 0.00 0.00 0.00 174.94 174.61 1uls s VAL 132 N 0.35 2.14 -0.10 2.92 1.01 0.25 -0.87 120.40 126.10 1uls s VAL 132 Ca -0.11 -1.21 -0.04 0.00 0.00 0.00 0.00 61.98 60.61 1uls s VAL 132 Cb -0.16 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 1uls s VAL 132 CO 0.06 0.31 0.07 -0.76 0.00 0.00 0.00 175.10 174.78 1uls s LEU 133 N 1.22 3.99 -0.26 3.92 1.43 -0.18 -1.13 118.68 127.66 1uls s LEU 133 Ca -0.01 0.31 -0.13 0.00 -1.03 0.00 0.00 54.13 53.28 1uls s LEU 133 Cb -0.16 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 1uls s LEU 133 CO -0.10 0.39 0.26 -0.89 0.23 0.00 0.00 176.35 176.25 1uls s THR 134 N -0.95 5.26 0.00 5.49 2.01 -0.77 -0.74 115.64 125.94 1uls s THR 134 Ca 0.14 0.35 0.00 0.00 0.31 0.00 0.00 61.69 62.49 1uls s THR 134 Cb -0.12 -3.60 0.00 0.00 0.01 0.00 0.00 72.50 68.79 1uls s THR 134 CO 0.03 0.23 0.00 0.00 -0.69 0.00 0.00 174.62 174.19 1uls n ALA 135 N 5.00 0.00 -3.62 7.40 0.00 0.47 -4.91 120.51 124.85 1uls n ALA 135 Ca -0.12 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.28 1uls n ALA 135 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 1uls n ALA 135 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1uls s SER 136 N -0.36 -0.13 0.66 0.00 0.15 -1.25 -4.40 113.70 108.38 1uls s SER 136 Ca 0.00 0.13 0.39 0.00 0.70 0.00 0.00 55.95 57.17 1uls s SER 136 Cb 0.00 0.11 2.12 0.00 -1.71 0.00 0.00 66.02 66.53 1uls s SER 136 CO 0.00 -0.13 2.21 -0.09 1.20 0.00 0.00 173.24 176.43 1uls h ARG 137 N 2.18 0.00 0.00 5.44 1.12 -1.41 -0.47 114.38 121.24 1uls h ARG 137 Ca -0.11 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.76 1uls h ARG 137 Cb 1.18 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.14 1uls h ARG 137 CO 0.24 0.00 0.00 0.28 -3.11 0.00 0.00 179.97 177.38 1uls n VAL 138 N -3.09 0.71 0.20 0.20 0.31 -1.26 -2.99 118.33 112.40 1uls n VAL 138 Ca -0.02 0.17 0.09 0.00 -0.01 0.00 0.00 64.34 64.56 1uls n VAL 138 Cb 0.19 -0.86 0.43 0.00 -0.91 0.00 0.00 33.84 32.69 1uls n VAL 138 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1uls n TYR 139 N -1.56 0.55 1.26 3.52 0.18 -0.18 0.24 117.16 121.17 1uls n TYR 139 Ca 0.04 0.27 0.08 0.00 1.88 0.00 0.00 57.90 60.17 1uls n TYR 139 Cb 0.23 -0.93 0.29 0.00 -0.38 0.00 0.00 39.34 38.54 1uls n TYR 139 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1uls n LEU 140 N -2.05 1.41 0.00 -3.48 4.77 -1.16 -4.57 117.00 111.92 1uls n LEU 140 Ca -0.00 -0.64 0.00 0.00 -0.03 0.00 0.00 56.01 55.33 1uls n LEU 140 Cb 0.07 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1uls n LEU 140 CO 0.10 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1uls n GLY 141 N 1.01 1.22 3.64 -0.72 0.00 0.14 -5.09 105.19 105.38 1uls n GLY 141 Ca 0.13 -1.48 -0.10 0.00 0.00 0.00 0.00 46.02 44.57 1uls n GLY 141 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1uls s ASN 142 N -0.32 -0.80 0.09 1.61 2.47 -1.26 -4.86 114.94 111.88 1uls s ASN 142 Ca 0.00 1.39 -0.36 0.00 0.42 0.00 0.00 52.86 54.30 1uls s ASN 142 Cb 0.00 1.37 -0.17 0.00 -1.45 0.00 0.00 41.25 40.99 1uls s ASN 142 CO 0.00 -0.23 1.18 0.18 -3.72 0.00 0.00 177.10 174.51 1uls n LEU 143 N 3.44 0.99 -0.62 3.21 4.77 -1.26 -1.66 117.00 125.88 1uls n LEU 143 Ca -0.17 1.14 -0.08 0.00 -0.03 0.00 0.00 56.01 56.87 1uls n LEU 143 Cb 0.57 -1.11 -0.03 0.00 -2.33 0.00 0.00 43.42 40.52 1uls n LEU 143 CO 0.01 -1.45 -0.08 0.61 -1.33 0.00 0.00 177.39 175.15 1uls n GLY 144 N 2.09 0.96 2.51 -0.72 0.00 -1.26 -4.91 105.19 103.86 1uls n GLY 144 Ca 0.18 -0.33 -0.03 0.00 0.00 0.00 0.00 46.02 45.84 1uls n GLY 144 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1uls n GLN 145 N -2.07 1.77 -0.22 1.61 6.02 -0.66 -0.88 117.38 122.94 1uls n GLN 145 Ca -0.08 -3.41 0.02 0.00 -0.01 0.00 0.00 57.00 53.53 1uls n GLN 145 Cb 0.35 -1.50 0.13 0.00 1.02 0.00 0.00 30.24 30.24 1uls n GLN 145 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uls h ALA 146 N 2.32 0.73 -0.11 -1.58 0.00 -1.81 0.42 119.26 119.23 1uls h ALA 146 Ca -0.08 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1uls h ALA 146 Cb 1.38 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.43 1uls h ALA 146 CO 0.24 -0.36 0.00 -2.95 0.00 0.00 0.00 179.25 176.18 1uls h ASN 147 N 0.19 0.19 -0.09 0.00 -1.07 -1.91 -0.83 115.58 112.07 1uls h ASN 147 Ca 0.35 -0.30 0.00 0.00 0.07 0.00 0.00 56.30 56.42 1uls h ASN 147 Cb 0.57 -0.05 -0.00 0.00 -2.07 0.00 0.00 38.32 36.77 1uls h ASN 147 CO -0.50 0.45 0.05 0.22 0.07 0.00 0.00 177.43 177.72 1uls h TYR 148 N -0.07 0.11 -0.28 4.14 3.20 -1.68 -1.35 116.97 121.04 1uls h TYR 148 Ca 0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1uls h TYR 148 Cb 0.35 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 1uls h TYR 148 CO 0.03 0.09 0.18 0.00 -1.64 0.00 0.00 178.16 176.82 1uls h ALA 149 N 1.01 0.36 -0.78 1.82 0.00 -0.20 -2.91 119.26 118.55 1uls h ALA 149 Ca 0.03 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1uls h ALA 149 Cb 0.01 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1uls h ALA 149 CO -0.01 -0.15 0.51 0.00 0.00 0.00 0.00 179.25 179.60 1uls h ALA 150 N 1.08 0.99 0.00 0.00 0.00 -1.03 0.12 119.26 120.41 1uls h ALA 150 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1uls h ALA 150 Cb -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.46 1uls h ALA 150 CO -0.02 0.41 0.00 -1.13 0.00 0.00 0.00 179.25 178.51 1uls n SER 151 N -4.53 0.66 0.00 0.00 3.41 -0.52 -1.38 113.62 111.27 1uls n SER 151 Ca 0.08 -0.74 0.00 0.00 -0.26 0.00 0.00 58.87 57.95 1uls n SER 151 Cb 0.02 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 1uls n SER 151 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uls n ALA 153 N 0.51 0.00 0.00 7.33 0.00 0.40 -1.79 120.51 126.97 1uls n ALA 153 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1uls n ALA 153 Cb 0.13 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.64 1uls n ALA 153 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1uls h GLY 154 N 0.00 0.62 1.05 0.00 0.00 -1.46 -2.20 103.07 101.08 1uls h GLY 154 Ca 0.00 -0.70 -0.05 0.00 0.00 0.00 0.00 47.33 46.58 1uls h GLY 154 CO 0.00 0.63 0.28 -2.08 0.00 0.00 0.00 176.54 175.37 1uls h VAL 155 N 0.44 1.26 -0.60 4.60 2.07 -1.63 0.37 116.25 122.76 1uls h VAL 155 Ca 0.01 -0.87 -0.04 0.00 0.82 0.00 0.00 66.70 66.63 1uls h VAL 155 Cb 1.06 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1uls h VAL 155 CO 0.10 0.35 0.22 0.58 0.02 0.00 0.00 177.57 178.84 1uls h VAL 156 N 1.14 1.23 -0.65 2.57 2.07 -1.81 0.13 116.25 120.93 1uls h VAL 156 Ca 0.25 -0.75 -0.07 0.00 0.82 0.00 0.00 66.70 66.95 1uls h VAL 156 Cb 0.26 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1uls h VAL 156 CO -0.02 0.29 0.13 1.23 0.02 0.00 0.00 177.57 179.22 1uls h GLY 157 N 0.84 1.14 0.93 2.17 0.00 -0.74 -1.95 103.07 105.45 1uls h GLY 157 Ca 0.20 -0.74 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 1uls h GLY 157 CO -0.01 0.68 0.09 -2.00 0.00 0.00 0.00 176.54 175.30 1uls h LEU 158 N 0.97 0.22 -0.62 3.11 5.85 0.10 -2.15 115.31 122.79 1uls h LEU 158 Ca 0.20 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.86 1uls h LEU 158 Cb 0.40 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1uls h LEU 158 CO 0.01 0.25 0.37 0.74 -0.34 0.00 0.00 178.44 179.47 1uls h THR 159 N 0.17 1.03 0.18 1.05 2.02 -0.61 0.98 112.91 117.73 1uls h THR 159 Ca 0.06 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 1uls h THR 159 Cb 0.08 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 66.76 1uls h THR 159 CO -0.01 0.13 -0.09 0.03 0.37 0.00 0.00 175.52 175.95 1uls h ARG 160 N 0.71 -0.23 -0.40 6.66 3.08 -1.21 0.12 114.38 123.11 1uls h ARG 160 Ca 0.26 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.36 1uls h ARG 160 Cb 0.08 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 1uls h ARG 160 CO -0.13 -0.13 0.19 1.15 -1.07 0.00 0.00 179.97 179.98 1uls h THR 161 N -0.27 0.96 -0.90 2.04 2.02 -1.12 -1.92 112.91 113.72 1uls h THR 161 Ca -0.02 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 67.04 1uls h THR 161 Cb 0.21 0.54 -0.05 0.00 -1.74 0.00 0.00 68.15 67.12 1uls h THR 161 CO 0.04 0.07 0.59 -0.07 0.37 0.00 0.00 175.52 176.52 1uls h LEU 162 N 0.38 1.02 -1.23 2.58 4.07 -0.63 -1.88 115.31 119.62 1uls h LEU 162 Ca 0.17 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.11 1uls h LEU 162 Cb 0.09 -0.25 -0.04 0.00 1.08 0.00 0.00 40.66 41.54 1uls h LEU 162 CO -0.13 0.73 0.47 0.00 -1.08 0.00 0.00 178.44 178.43 1uls h ALA 163 N 1.33 1.43 -0.30 1.53 0.00 -0.11 -0.10 119.26 123.04 1uls h ALA 163 Ca 0.33 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 1uls h ALA 163 Cb -0.12 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.36 1uls h ALA 163 CO -0.08 0.51 -0.44 -0.07 0.00 0.00 0.00 179.25 179.18 1uls h LEU 164 N 1.01 0.90 -0.42 0.00 3.38 -0.68 -1.55 115.31 117.96 1uls h LEU 164 Ca 0.27 -0.51 -0.09 0.00 0.09 0.00 0.00 57.88 57.64 1uls h LEU 164 Cb -0.08 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1uls h LEU 164 CO -0.05 1.23 -0.41 -0.33 0.09 0.00 0.00 178.44 178.97 1uls h GLU 165 N 0.59 0.00 0.00 1.13 5.08 -0.98 -3.32 114.58 117.08 1uls h GLU 165 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1uls h GLU 165 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1uls h GLU 165 CO 0.10 0.41 -1.50 1.28 -1.00 0.00 0.00 179.01 178.31 1uls n LEU 166 N -3.32 0.44 -0.25 1.33 4.77 -0.08 -4.62 117.00 115.27 1uls n LEU 166 Ca 0.01 -0.23 0.05 0.00 -0.03 0.00 0.00 56.01 55.81 1uls n LEU 166 Cb 0.63 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.88 1uls n LEU 166 CO 0.38 0.11 0.87 1.23 -1.33 0.00 0.00 177.39 178.65 1uls h GLY 167 N 4.27 0.92 2.00 -0.72 0.00 -1.36 0.25 103.07 108.43 1uls h GLY 167 Ca 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 1uls h GLY 167 CO 0.00 -0.25 -0.02 0.07 0.00 0.00 0.00 176.54 176.34 1uls h ARG 168 N 0.17 0.00 -0.51 4.80 0.11 -1.82 -2.02 114.38 115.11 1uls h ARG 168 Ca 0.41 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.49 1uls h ARG 168 Cb 0.72 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.80 1uls h ARG 168 CO -0.59 0.02 0.00 0.91 0.10 0.00 0.00 179.97 180.41 1uls n TRP 169 N -3.20 0.72 -0.99 4.08 7.02 0.06 -4.90 117.44 120.23 1uls n TRP 169 Ca -0.02 -0.33 0.00 0.00 -1.02 0.00 0.00 57.50 56.13 1uls n TRP 169 Cb 0.18 -0.05 0.00 0.00 -2.42 0.00 0.00 31.31 29.02 1uls n TRP 169 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1uls n GLY 170 N 1.12 0.40 3.62 6.99 0.00 -0.76 -4.41 105.19 112.15 1uls n GLY 170 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1uls n GLY 170 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uls s ILE 171 N -1.86 5.31 -0.09 -0.61 1.01 -1.14 -2.46 121.20 121.35 1uls s ILE 171 Ca 0.00 0.17 -0.09 0.00 0.00 0.00 0.00 60.65 60.73 1uls s ILE 171 Cb 0.00 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.93 1uls s ILE 171 CO 0.00 0.30 0.21 -0.13 0.00 0.00 0.00 174.94 175.32 1uls s ARG 172 N 1.37 3.58 -0.13 2.79 0.52 0.52 -3.70 118.95 123.90 1uls s ARG 172 Ca 0.07 0.00 -0.00 0.00 -0.52 0.00 0.00 55.73 55.28 1uls s ARG 172 Cb -0.15 -3.20 0.02 0.00 0.52 0.00 0.00 34.95 32.14 1uls s ARG 172 CO 0.07 0.74 -0.11 0.08 0.02 0.00 0.00 175.30 176.11 1uls s VAL 173 N -1.00 1.30 0.16 3.52 1.01 -1.26 0.93 120.40 125.07 1uls s VAL 173 Ca 0.17 -0.46 0.04 0.00 0.00 0.00 0.00 61.98 61.73 1uls s VAL 173 Cb -0.13 -1.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.94 1uls s VAL 173 CO 0.06 0.41 -0.07 0.20 0.00 0.00 0.00 175.10 175.70 1uls s ASN 174 N 1.60 1.72 -0.07 3.32 0.01 -0.04 -0.19 114.94 121.28 1uls s ASN 174 Ca 0.05 -1.07 0.02 0.00 -0.71 0.00 0.00 52.86 51.15 1uls s ASN 174 Cb -0.13 0.01 0.01 0.00 0.41 0.00 0.00 41.25 41.56 1uls s ASN 174 CO -0.09 -0.39 -0.12 0.28 -1.51 0.00 0.00 177.10 175.26 1uls s THR 175 N -3.39 1.12 -0.02 1.60 -1.32 0.40 -1.01 115.64 113.02 1uls s THR 175 Ca 0.19 -0.45 -0.21 0.00 -1.21 0.00 0.00 61.69 60.01 1uls s THR 175 Cb 0.04 -1.04 -0.05 0.00 -1.51 0.00 0.00 72.50 69.94 1uls s THR 175 CO 0.02 0.36 0.61 -0.76 -2.21 0.00 0.00 174.62 172.64 1uls s LEU 176 N 0.80 4.39 -0.66 9.08 1.43 0.08 -0.98 118.68 132.82 1uls s LEU 176 Ca -0.12 1.16 0.05 0.00 -1.03 0.00 0.00 54.13 54.19 1uls s LEU 176 Cb -0.15 -2.95 0.20 0.00 0.03 0.00 0.00 46.19 43.32 1uls s LEU 176 CO 0.02 0.05 0.58 0.00 0.23 0.00 0.00 176.35 177.23 1uls n ALA 177 N 2.97 3.59 -1.23 4.21 0.00 -0.35 0.18 120.51 129.89 1uls n ALA 177 Ca -0.06 -4.50 -0.33 0.00 0.00 0.00 0.00 53.44 48.55 1uls n ALA 177 Cb 0.51 -0.96 0.10 0.00 0.00 0.00 0.00 19.45 19.10 1uls n ALA 177 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1uls s PRO 178 N -1.75 1.97 0.00 0.00 0.04 -1.26 -2.40 135.00 131.60 1uls s PRO 178 Ca 0.31 1.63 0.00 0.00 0.04 0.00 0.00 61.00 62.99 1uls s PRO 178 Cb 0.04 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.75 1uls s PRO 178 CO -0.11 -1.93 0.00 0.41 0.04 0.00 0.00 177.00 175.40 1uls n GLY 179 N 0.14 0.74 3.41 0.56 0.00 -0.26 -1.69 105.19 108.10 1uls n GLY 179 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 1uls n GLY 179 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1uls s PHE 180 N 2.89 3.02 -0.12 1.61 5.36 -1.26 -4.91 117.98 124.56 1uls s PHE 180 Ca 0.00 -0.73 -0.04 0.00 -0.96 0.00 0.00 56.93 55.19 1uls s PHE 180 Cb 0.00 -3.76 -0.04 0.00 -0.34 0.00 0.00 43.02 38.89 1uls s PHE 180 CO 0.00 -1.16 0.03 0.42 -1.46 0.00 0.00 175.22 173.06 1uls s ILE 181 N 2.66 4.57 0.24 3.12 -1.09 -1.26 0.11 121.20 129.55 1uls s ILE 181 Ca 0.13 -0.14 -0.31 0.00 -2.23 0.00 0.00 60.65 58.11 1uls s ILE 181 Cb -0.21 -2.98 -0.11 0.00 -1.58 0.00 0.00 42.46 37.57 1uls s ILE 181 CO 0.09 0.56 1.65 -0.70 -1.23 0.00 0.00 174.94 175.31 1uls s GLU 182 N -0.45 4.13 0.00 2.79 2.56 0.28 -4.84 118.70 123.16 1uls s GLU 182 Ca 0.09 2.57 0.00 0.00 0.00 0.00 0.00 54.97 57.63 1uls s GLU 182 Cb -0.12 -3.06 0.00 0.00 2.00 0.00 0.00 34.13 32.95 1uls s GLU 182 CO 0.02 -0.69 0.00 2.41 -0.56 0.00 0.00 175.26 176.44 1uls n THR 183 N 3.24 -0.11 0.00 -1.70 -1.04 -1.26 -4.63 114.28 108.78 1uls n THR 183 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 1uls n THR 183 Cb 0.36 -0.93 0.00 0.00 -1.82 0.00 0.00 70.33 67.94 1uls n THR 183 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1uls n PRO 190 N 1.79 0.00 0.00 -2.82 -0.04 -1.26 -4.78 135.00 127.89 1uls n PRO 190 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1uls n PRO 190 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1uls n PRO 190 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1uls n GLU 191 N 0.00 0.00 0.04 0.54 4.07 -1.26 -4.92 120.64 119.11 1uls n GLU 191 Ca 0.00 0.00 0.13 0.00 -0.06 0.00 0.00 57.16 57.23 1uls n GLU 191 Cb 0.00 0.00 0.45 0.00 -0.06 0.00 0.00 31.44 31.83 1uls n GLU 191 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1uls n LYS 192 N -1.21 0.11 0.15 5.31 3.00 -1.26 -2.82 118.16 121.45 1uls n LYS 192 Ca 0.00 0.07 0.03 0.00 -0.00 0.00 0.00 58.31 58.41 1uls n LYS 192 Cb 0.00 -1.61 0.13 0.00 0.00 0.00 0.00 35.03 33.55 1uls n LYS 192 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1uls h VAL 193 N 0.00 0.94 0.01 3.15 2.07 -2.01 -3.25 116.25 117.16 1uls h VAL 193 Ca 0.00 -2.06 -0.00 0.00 0.82 0.00 0.00 66.70 65.46 1uls h VAL 193 Cb 0.60 2.28 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 1uls h VAL 193 CO 0.00 0.49 -0.00 -0.09 0.02 0.00 0.00 177.57 177.98 1uls h ARG 194 N 0.00 -0.01 -0.47 1.57 2.43 -1.88 -2.84 114.38 113.19 1uls h ARG 194 Ca -0.00 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.22 1uls h ARG 194 Cb 1.24 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.74 1uls h ARG 194 CO 0.06 0.50 0.18 0.93 -1.51 0.00 0.00 179.97 180.13 1uls h GLU 195 N -0.51 0.35 -0.60 0.20 4.39 -1.63 0.73 114.58 117.51 1uls h GLU 195 Ca -0.00 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 1uls h GLU 195 Cb 0.51 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.05 1uls h GLU 195 CO 0.00 0.23 0.34 -0.22 -1.16 0.00 0.00 179.01 178.20 1uls h LYS 196 N 0.36 0.82 0.55 2.33 1.63 -1.64 0.27 116.57 120.89 1uls h LYS 196 Ca 0.22 -0.09 -0.03 0.00 -0.85 0.00 0.00 60.65 59.91 1uls h LYS 196 Cb 0.21 -0.17 0.01 0.00 -0.60 0.00 0.00 32.23 31.68 1uls h LYS 196 CO -0.22 0.62 -0.27 0.00 -3.45 0.00 0.00 179.45 176.13 1uls h ALA 197 N 1.16 -0.74 0.00 5.00 0.00 -1.13 -1.50 119.26 122.05 1uls h ALA 197 Ca 0.21 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1uls h ALA 197 Cb 0.02 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1uls h ALA 197 CO -0.04 -0.92 -0.12 0.82 0.00 0.00 0.00 179.25 178.99 1uls h ILE 198 N -0.74 1.04 -0.17 0.00 2.04 -0.76 -1.43 117.51 117.49 1uls h ILE 198 Ca -0.08 -0.42 -0.11 0.00 1.00 0.00 0.00 64.86 65.25 1uls h ILE 198 Cb 0.57 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1uls h ILE 198 CO 0.12 0.12 -0.38 0.00 0.00 0.00 0.00 178.15 178.01 1uls h ALA 199 N 1.88 1.04 -0.29 1.87 0.00 -0.13 -2.21 119.26 121.41 1uls h ALA 199 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1uls h ALA 199 Cb 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1uls h ALA 199 CO 0.02 0.60 0.00 0.00 0.00 0.00 0.00 179.25 179.86 1uls n ALA 200 N -2.48 2.51 -3.44 0.00 0.00 -0.57 -4.77 120.51 111.76 1uls n ALA 200 Ca -0.01 -0.55 -0.36 0.00 0.00 0.00 0.00 53.44 52.52 1uls n ALA 200 Cb 0.47 -0.98 -0.13 0.00 0.00 0.00 0.00 19.45 18.81 1uls n ALA 200 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1uls s THR 201 N -1.61 3.39 0.31 0.00 2.01 -0.83 -4.37 115.64 114.54 1uls s THR 201 Ca 0.20 -1.21 0.07 0.00 0.31 0.00 0.00 61.69 61.06 1uls s THR 201 Cb 0.11 -2.91 0.30 0.00 0.01 0.00 0.00 72.50 70.01 1uls s THR 201 CO 0.13 -0.11 1.73 -0.65 -0.69 0.00 0.00 174.62 175.03 1uls h PRO 202 N 8.11 0.56 0.00 4.92 0.11 -1.77 0.53 132.00 144.46 1uls h PRO 202 Ca -0.23 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1uls h PRO 202 Cb 1.08 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1uls h PRO 202 CO 0.57 0.37 0.00 1.28 -0.21 0.00 0.00 178.00 180.01 1uls n LEU 203 N -4.90 0.00 -3.65 2.35 4.77 -1.05 -4.92 117.00 109.60 1uls n LEU 203 Ca 0.25 0.07 -0.27 0.00 -0.03 0.00 0.00 56.01 56.02 1uls n LEU 203 Cb 0.68 -0.07 0.04 0.00 -2.33 0.00 0.00 43.42 41.74 1uls n LEU 203 CO 0.17 -0.02 0.11 0.61 -1.33 0.00 0.00 177.39 176.93 1uls n GLY 204 N 0.53 -0.51 3.75 -0.72 0.00 0.19 -4.97 105.19 103.45 1uls n GLY 204 Ca 0.16 0.19 -0.03 0.00 0.00 0.00 0.00 46.02 46.34 1uls n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1uls s ARG 205 N -6.36 1.12 0.48 1.61 1.70 -1.26 -5.02 118.95 111.23 1uls s ARG 205 Ca 0.57 -0.63 -0.12 0.00 -0.47 0.00 0.00 55.73 55.09 1uls s ARG 205 Cb -0.28 0.38 -0.06 0.00 -0.57 0.00 0.00 34.95 34.42 1uls s ARG 205 CO 0.70 -0.52 0.87 0.00 -1.08 0.00 0.00 175.30 175.28 1uls s ALA 206 N -3.14 3.24 0.42 7.88 0.00 -1.26 -4.88 121.76 124.02 1uls s ALA 206 Ca 0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.97 1uls s ALA 206 Cb -0.01 -2.86 -0.02 0.00 0.00 0.00 0.00 23.12 20.23 1uls s ALA 206 CO 0.02 -0.22 0.65 0.20 0.00 0.00 0.00 175.76 176.40 1uls s GLY 207 N -3.41 1.45 0.11 0.00 0.00 0.31 -4.84 107.32 100.94 1uls s GLY 207 Ca 0.53 -0.88 0.05 0.00 0.00 0.00 0.00 44.72 44.43 1uls s GLY 207 CO 0.36 -0.75 0.01 0.54 0.00 0.00 0.00 173.10 173.27 1uls s LYS 208 N -4.50 2.56 0.38 2.90 1.02 -1.26 0.98 119.74 121.82 1uls s LYS 208 Ca 0.45 -0.88 0.10 0.00 0.02 0.00 0.00 55.97 55.65 1uls s LYS 208 Cb -0.10 -2.53 0.87 0.00 -0.52 0.00 0.00 37.83 35.55 1uls s LYS 208 CO 0.39 0.52 1.92 -1.00 -0.92 0.00 0.00 175.35 176.26 1uls h PRO 209 N 3.21 0.60 -0.72 -1.68 0.13 -1.92 -1.63 132.00 129.99 1uls h PRO 209 Ca -0.48 -0.04 0.09 0.00 -0.87 0.00 0.00 66.00 64.71 1uls h PRO 209 Cb 1.17 -0.14 -0.07 0.00 0.13 0.00 0.00 31.00 32.10 1uls h PRO 209 CO 0.60 0.40 0.38 1.25 -0.23 0.00 0.00 178.00 180.39 1uls h LEU 210 N 0.62 0.51 -1.39 1.56 6.46 -1.91 0.57 115.31 121.73 1uls h LEU 210 Ca 0.37 0.05 -0.03 0.00 -0.12 0.00 0.00 57.88 58.16 1uls h LEU 210 Cb 0.58 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.45 1uls h LEU 210 CO -0.14 0.30 0.12 -0.33 -0.62 0.00 0.00 178.44 177.77 1uls h GLU 211 N 0.65 0.53 -0.00 1.25 5.08 -1.71 0.18 114.58 120.56 1uls h GLU 211 Ca 0.35 -0.07 -0.19 0.00 -1.00 0.00 0.00 59.36 58.45 1uls h GLU 211 Cb 0.34 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1uls h GLU 211 CO -0.25 0.46 -0.84 0.28 -1.00 0.00 0.00 179.01 177.66 1uls h VAL 212 N 0.53 1.51 -0.67 3.13 2.07 -1.15 -2.96 116.25 118.71 1uls h VAL 212 Ca 0.13 -2.63 -0.08 0.00 0.82 0.00 0.00 66.70 64.94 1uls h VAL 212 Cb 0.15 2.45 -0.03 0.00 -1.52 0.00 0.00 31.29 32.35 1uls h VAL 212 CO -0.01 0.76 0.11 0.00 0.02 0.00 0.00 177.57 178.45 1uls h ALA 213 N 1.05 0.89 -0.31 1.67 0.00 0.46 -2.00 119.26 121.03 1uls h ALA 213 Ca -0.03 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1uls h ALA 213 Cb 1.46 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1uls h ALA 213 CO 0.12 0.67 0.01 1.88 0.00 0.00 0.00 179.25 181.93 1uls h TYR 214 N 1.04 0.47 -0.09 0.00 0.99 -0.63 0.14 116.97 118.89 1uls h TYR 214 Ca 0.20 -0.04 -0.12 0.00 2.00 0.00 0.00 58.73 60.77 1uls h TYR 214 Cb 0.45 -0.14 -0.01 0.00 1.00 0.00 0.00 36.73 38.03 1uls h TYR 214 CO 0.03 0.46 -0.49 0.00 -0.00 0.00 0.00 178.16 178.17 1uls h ALA 215 N 1.57 1.01 -0.20 3.88 0.00 -1.27 -1.73 119.26 122.53 1uls h ALA 215 Ca 0.10 -0.46 -0.20 0.00 0.00 0.00 0.00 54.91 54.34 1uls h ALA 215 Cb 0.27 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1uls h ALA 215 CO 0.01 0.65 -0.67 0.00 0.00 0.00 0.00 179.25 179.23 1uls h ALA 216 N 1.31 0.43 -0.22 0.00 0.00 -0.58 -2.27 119.26 117.94 1uls h ALA 216 Ca 0.01 -0.56 0.02 0.00 0.00 0.00 0.00 54.91 54.38 1uls h ALA 216 Cb 0.93 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1uls h ALA 216 CO 0.08 0.69 0.07 1.25 0.00 0.00 0.00 179.25 181.33 1uls h LEU 217 N 0.55 0.07 0.40 0.00 6.46 -0.41 -0.89 115.31 121.48 1uls h LEU 217 Ca -0.02 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.75 1uls h LEU 217 Cb 1.28 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 41.22 1uls h LEU 217 CO 0.14 0.07 -0.29 0.15 -0.62 0.00 0.00 178.44 177.89 1uls h PHE 218 N 0.17 -0.77 -0.45 1.25 3.57 -1.28 -0.08 116.94 119.34 1uls h PHE 218 Ca 0.09 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.65 1uls h PHE 218 Cb 0.07 0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 1uls h PHE 218 CO -0.13 -0.43 0.30 -0.07 -2.23 0.00 0.00 178.31 175.75 1uls h LEU 219 N -0.68 0.34 0.00 0.59 3.38 -1.24 -2.92 115.31 114.77 1uls h LEU 219 Ca -0.04 -0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.76 1uls h LEU 219 Cb 0.58 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1uls h LEU 219 CO 0.01 0.22 -1.36 0.25 0.09 0.00 0.00 178.44 177.65 1uls h LEU 220 N 0.38 0.00-10.44 1.67 6.46 -0.97 -3.45 115.31 108.97 1uls h LEU 220 Ca 0.19 0.00 -0.48 0.00 -0.12 0.00 0.00 57.88 57.48 1uls h LEU 220 Cb 0.28 0.00 0.12 0.00 -0.73 0.00 0.00 40.66 40.33 1uls h LEU 220 CO -0.05 0.62 0.31 -0.94 -0.62 0.00 0.00 178.44 177.77 1uls s SER 221 N -5.89 4.03 0.00 1.25 1.04 -0.06 -4.74 113.70 109.33 1uls s SER 221 Ca -0.02 1.18 0.18 0.00 0.48 0.00 0.00 55.95 57.77 1uls s SER 221 Cb 0.09 -1.85 1.08 0.00 0.10 0.00 0.00 66.02 65.43 1uls s SER 221 CO 0.81 -2.25 1.50 0.47 0.98 0.00 0.00 173.24 174.75 1uls n ASP 222 N -3.60 0.00 0.14 7.02 8.00 -1.26 -2.69 116.55 124.16 1uls n ASP 222 Ca 0.07 -0.51 0.13 0.00 0.71 0.00 0.00 54.79 55.18 1uls n ASP 222 Cb 0.57 -0.03 0.42 0.00 -0.02 0.00 0.00 41.12 42.06 1uls n ASP 222 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1uls h GLU 223 N 0.00 0.00 -0.27 -1.24 5.08 -1.91 -2.86 114.58 113.38 1uls h GLU 223 Ca 0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 1uls h GLU 223 Cb 0.02 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.22 1uls h GLU 223 CO 0.00 0.00 -0.04 -1.13 -1.00 0.00 0.00 179.01 176.84 1uls n SER 224 N -2.45 3.09 0.01 1.42 3.41 -1.09 -4.78 113.62 113.22 1uls n SER 224 Ca 0.04 -3.36 0.23 0.00 -0.26 0.00 0.00 58.87 55.52 1uls n SER 224 Cb 0.38 -0.57 0.68 0.00 -0.26 0.00 0.00 64.21 64.44 1uls n SER 224 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1uls h SER 225 N 1.25 0.00 -0.46 4.04 4.64 -1.68 0.19 113.55 121.54 1uls h SER 225 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1uls h SER 225 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 1uls h SER 225 CO 0.27 0.00 0.00 0.33 -0.87 0.00 0.00 176.83 176.56 1uls n PHE 226 N -3.62 1.00 -3.91 4.77 7.35 -1.26 -4.92 117.46 116.87 1uls n PHE 226 Ca 0.12 -0.63 -0.35 0.00 -0.76 0.00 0.00 57.45 55.82 1uls n PHE 226 Cb 0.85 -0.18 -0.14 0.00 0.35 0.00 0.00 39.48 40.36 1uls n PHE 226 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1uls s ILE 227 N -1.77 3.28 0.02 -2.13 1.01 0.68 -5.10 121.20 117.19 1uls s ILE 227 Ca 0.40 -0.66 -0.15 0.00 0.00 0.00 0.00 60.65 60.24 1uls s ILE 227 Cb 0.26 -2.56 0.02 0.00 0.01 0.00 0.00 42.46 40.20 1uls s ILE 227 CO 0.18 0.33 0.32 0.28 0.00 0.00 0.00 174.94 176.06 1uls s THR 228 N 1.44 0.07 -0.60 2.92 -1.32 -1.26 -4.78 115.64 112.10 1uls s THR 228 Ca 0.04 -0.56 0.00 0.00 -1.21 0.00 0.00 61.69 59.96 1uls s THR 228 Cb -0.15 -0.80 0.00 0.00 -1.51 0.00 0.00 72.50 70.04 1uls s THR 228 CO -0.03 -0.31 0.00 0.61 -2.21 0.00 0.00 174.62 172.68 1uls n GLY 229 N 0.88 0.82 3.85 6.08 0.00 0.73 -4.97 105.19 112.57 1uls n GLY 229 Ca -0.20 -0.71 -0.27 0.00 0.00 0.00 0.00 46.02 44.84 1uls n GLY 229 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1uls s GLN 230 N -2.37 3.09 -0.28 1.61 -1.52 -1.26 -4.80 119.66 114.14 1uls s GLN 230 Ca 0.00 -0.75 -0.06 0.00 -1.95 0.00 0.00 55.36 52.60 1uls s GLN 230 Cb 0.00 -2.77 0.00 0.00 -0.22 0.00 0.00 33.01 30.03 1uls s GLN 230 CO 0.00 0.51 0.05 0.08 -0.25 0.00 0.00 175.29 175.68 1uls s VAL 231 N -1.71 3.86 -0.37 1.09 1.01 -1.26 -0.45 120.40 122.56 1uls s VAL 231 Ca 0.32 -0.62 -0.06 0.00 0.00 0.00 0.00 61.98 61.61 1uls s VAL 231 Cb -0.11 -2.93 0.06 0.00 0.00 0.00 0.00 36.38 33.40 1uls s VAL 231 CO 0.25 0.17 0.16 -0.22 0.00 0.00 0.00 175.10 175.46 1uls s LEU 232 N 1.50 4.71 0.04 3.92 2.96 -0.15 -4.96 118.68 126.70 1uls s LEU 232 Ca 0.03 -1.41 -0.30 0.00 -0.22 0.00 0.00 54.13 52.23 1uls s LEU 232 Cb -0.16 -1.89 -0.04 0.00 0.50 0.00 0.00 46.19 44.59 1uls s LEU 232 CO 0.01 -0.43 1.05 -0.36 -1.32 0.00 0.00 176.35 175.31 1uls s PHE 233 N 1.36 3.60 -0.57 5.38 0.40 -1.26 -1.21 117.98 125.69 1uls s PHE 233 Ca 0.01 1.58 0.07 0.00 -0.60 0.00 0.00 56.93 57.99 1uls s PHE 233 Cb -0.21 -3.21 0.25 0.00 0.51 0.00 0.00 43.02 40.36 1uls s PHE 233 CO 0.01 -0.41 0.69 0.28 0.70 0.00 0.00 175.22 176.49 1uls n VAL 234 N 3.73 1.51 -0.86 -0.44 0.31 -1.01 -4.83 118.33 116.74 1uls n VAL 234 Ca 0.06 -4.89 0.02 0.00 -0.01 0.00 0.00 64.34 59.53 1uls n VAL 234 Cb 0.49 -2.02 0.03 0.00 -0.91 0.00 0.00 33.84 31.43 1uls n VAL 234 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1uls n ASP 235 N 0.96 1.21 -1.15 4.52 3.85 -1.26 -1.10 116.55 123.59 1uls n ASP 235 Ca 0.27 -2.00 -0.14 0.00 -0.71 0.00 0.00 54.79 52.21 1uls n ASP 235 Cb 0.45 -0.14 -0.06 0.00 -1.35 0.00 0.00 41.12 40.02 1uls n ASP 235 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1uls n GLY 236 N -0.50 1.35 1.55 6.12 0.00 -1.26 -2.30 105.19 110.16 1uls n GLY 236 Ca 0.04 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1uls n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uls n GLY 237 N -1.19 0.61 0.34 -0.02 0.00 -1.26 -2.52 105.19 101.15 1uls n GLY 237 Ca -0.15 -0.03 0.21 0.00 0.00 0.00 0.00 46.02 46.06 1uls n GLY 237 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1uls h ARG 238 N 1.61 0.00 -0.02 1.61 1.12 -1.66 -1.95 114.38 115.09 1uls h ARG 238 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1uls h ARG 238 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 29.96 1uls h ARG 238 CO 0.00 0.00 -0.17 -2.37 -3.11 0.00 0.00 179.97 174.32 1uls n THR 239 N -3.07 0.00 -1.96 0.20 5.66 -1.26 -4.91 114.28 108.94 1uls n THR 239 Ca -0.03 -0.42 -0.42 0.00 -3.05 0.00 0.00 64.05 60.14 1uls n THR 239 Cb 0.13 1.40 -0.03 0.00 -1.55 0.00 0.00 70.33 70.29 1uls n THR 239 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1uls s ILE 240 N -2.11 2.65 0.00 1.09 1.01 -0.73 -2.19 121.20 120.92 1uls s ILE 240 Ca 0.24 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.38 1uls s ILE 240 Cb 0.19 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 39.34 1uls s ILE 240 CO 0.39 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.99 1uls n GLY 241 N 3.24 0.15 3.86 6.18 0.00 -1.26 -5.06 105.19 112.31 1uls n GLY 241 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1uls n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uls s ALA 242 N -2.03 3.83 0.22 4.61 0.00 -0.93 -5.05 121.76 122.42 1uls s ALA 242 Ca 0.00 -0.60 -0.32 0.00 0.00 0.00 0.00 51.96 51.05 1uls s ALA 242 Cb 0.00 -2.04 -0.12 0.00 0.00 0.00 0.00 23.12 20.95 1uls s ALA 242 CO 0.00 0.55 1.69 0.00 0.00 0.00 0.00 175.76 177.99 1uls n ALA 243 N 2.16 2.67 -1.82 0.00 0.00 -1.26 -4.96 120.51 117.29 1uls n ALA 243 Ca -0.19 0.40 -0.32 0.00 0.00 0.00 0.00 53.44 53.33 1uls n ALA 243 Cb 0.54 -2.50 -0.02 0.00 0.00 0.00 0.00 19.45 17.48 1uls n ALA 243 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1uls s PRO 244 N 0.78 3.76 0.00 0.00 0.04 -1.26 -5.05 135.00 133.27 1uls s PRO 244 Ca 0.73 0.94 0.00 0.00 0.04 0.00 0.00 61.00 62.71 1uls s PRO 244 Cb -0.52 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 31.92 1uls s PRO 244 CO 0.36 -0.43 0.37 0.00 0.04 0.00 0.00 177.00 177.34