#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 1.61 -4.58 0.55 4.77 -0.32 -4.62 117.00 114.40 1uls n LEU 3 Ca 0.00 -2.66 -0.54 0.00 -0.03 0.00 0.00 56.01 52.78 1uls n LEU 3 Cb 0.00 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 40.87 1uls n LEU 3 CO 0.00 0.82 1.55 1.17 -1.33 0.00 0.00 177.39 179.61 1uls n LYS 4 N -0.05 1.21 -0.90 3.23 4.81 -1.01 -1.06 118.16 124.39 1uls n LYS 4 Ca 0.11 0.40 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 1uls n LYS 4 Cb 0.99 -2.29 0.00 0.00 0.02 0.00 0.00 35.03 33.76 1uls n LYS 4 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1uls n ASP 5 N 7.39 -4.24 -4.71 3.14 9.92 0.06 -4.96 116.55 123.15 1uls n ASP 5 Ca 0.33 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 54.17 1uls n ASP 5 Cb 0.18 -2.86 -0.03 0.00 -0.64 0.00 0.00 41.12 37.78 1uls n ASP 5 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1uls s LYS 6 N -1.51 4.43 -0.28 -1.24 1.02 -0.22 -4.69 119.74 117.24 1uls s LYS 6 Ca 0.00 1.70 -0.25 0.00 0.02 0.00 0.00 55.97 57.44 1uls s LYS 6 Cb 0.00 -3.42 0.00 0.00 -0.52 0.00 0.00 37.83 33.89 1uls s LYS 6 CO 0.00 -0.28 0.84 0.00 -0.92 0.00 0.00 175.35 174.99 1uls s ALA 7 N 1.38 3.58 0.03 5.17 0.00 -1.26 -1.19 121.76 129.47 1uls s ALA 7 Ca 0.57 -0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.33 1uls s ALA 7 Cb -0.27 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.49 1uls s ALA 7 CO 0.27 -1.12 -0.15 0.08 0.00 0.00 0.00 175.76 174.84 1uls s VAL 8 N 3.00 1.16 -0.07 0.00 1.01 -0.60 -0.58 120.40 124.32 1uls s VAL 8 Ca 0.35 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.43 1uls s VAL 8 Cb -0.14 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 1uls s VAL 8 CO 0.11 0.08 -0.18 -0.22 0.00 0.00 0.00 175.10 174.89 1uls s LEU 9 N -0.98 2.46 -0.05 3.92 0.20 -0.86 -1.84 118.68 121.53 1uls s LEU 9 Ca 0.03 -0.35 0.04 0.00 0.69 0.00 0.00 54.13 54.53 1uls s LEU 9 Cb -0.07 -1.49 0.00 0.00 -0.43 0.00 0.00 46.19 44.19 1uls s LEU 9 CO 0.01 0.26 -0.16 -0.63 -0.29 0.00 0.00 176.35 175.54 1uls s ILE 10 N -0.24 1.39 0.19 6.68 1.01 -0.85 -1.06 121.20 128.32 1uls s ILE 10 Ca 0.00 -0.68 0.05 0.00 0.00 0.00 0.00 60.65 60.02 1uls s ILE 10 Cb -0.13 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 1uls s ILE 10 CO 0.03 0.40 0.23 0.42 0.00 0.00 0.00 174.94 176.02 1uls s THR 11 N 0.17 4.83 -1.76 2.92 -4.23 -0.79 -0.32 115.64 116.46 1uls s THR 11 Ca -0.07 -1.03 -0.01 0.00 -1.18 0.00 0.00 61.69 59.41 1uls s THR 11 Cb -0.13 -3.53 0.00 0.00 1.34 0.00 0.00 72.50 70.19 1uls s THR 11 CO 0.03 -0.19 0.11 0.61 -0.54 0.00 0.00 174.62 174.63 1uls n GLY 12 N -0.75 -0.50 0.00 3.99 0.00 -0.30 -3.63 105.19 103.99 1uls n GLY 12 Ca -0.08 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.29 1.85 0.02 4.61 0.00 -0.50 -3.16 120.51 121.04 1uls n ALA 13 Ca -0.23 -0.07 -0.14 0.00 0.00 0.00 0.00 53.44 53.00 1uls n ALA 13 Cb 0.68 -1.28 -0.14 0.00 0.00 0.00 0.00 19.45 18.71 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 2.68 0.47 -2.06 0.00 0.00 -1.89 -2.92 119.26 115.55 1uls h ALA 14 Ca 0.00 -1.27 -0.45 0.00 0.00 0.00 0.00 54.91 53.19 1uls h ALA 14 Cb 0.26 0.41 0.06 0.00 0.00 0.00 0.00 17.79 18.51 1uls h ALA 14 CO 0.00 1.33 0.07 -1.01 0.00 0.00 0.00 179.25 179.64 1uls s HIS 15 N -2.61 2.94 0.00 0.00 3.76 -1.19 -4.58 115.29 113.62 1uls s HIS 15 Ca -0.10 0.22 0.00 0.00 -0.15 0.00 0.00 55.06 55.03 1uls s HIS 15 Cb 0.07 -2.88 0.00 0.00 1.11 0.00 0.00 32.58 30.89 1uls s HIS 15 CO 0.82 -1.02 0.00 0.41 -0.85 0.00 0.00 174.74 174.10 1uls n GLY 16 N -2.55 0.00 0.19 -2.22 0.00 -1.26 0.11 105.19 99.46 1uls n GLY 16 Ca 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.05 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 0.85 -0.01 -0.61 2.04 -1.89 0.43 117.51 118.31 1uls h ILE 17 Ca 0.00 -0.11 0.01 0.00 1.00 0.00 0.00 64.86 65.76 1uls h ILE 17 Cb 0.00 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1uls h ILE 17 CO 0.00 0.06 -0.05 1.23 0.00 0.00 0.00 178.15 179.39 1uls h GLY 18 N 0.33 -0.04 0.41 5.37 0.00 -1.47 -0.05 103.07 107.62 1uls h GLY 18 Ca 0.22 0.06 0.06 0.00 0.00 0.00 0.00 47.33 47.66 1uls h GLY 18 CO -0.22 -0.06 -0.08 -0.09 0.00 0.00 0.00 176.54 176.09 1uls h ARG 19 N -0.08 -0.01 -0.59 4.80 9.65 0.13 0.25 114.38 128.53 1uls h ARG 19 Ca 0.03 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.90 1uls h ARG 19 Cb 0.12 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.67 1uls h ARG 19 CO -0.06 -0.01 0.32 0.00 2.80 0.00 0.00 179.97 183.02 1uls h ALA 20 N 1.26 1.46 -0.35 2.80 0.00 -0.67 -1.52 119.26 122.25 1uls h ALA 20 Ca 0.14 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 1uls h ALA 20 Cb 0.22 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1uls h ALA 20 CO -0.30 0.45 -0.36 1.15 0.00 0.00 0.00 179.25 180.18 1uls h THR 21 N 0.82 1.28 -0.58 0.00 2.02 0.06 -1.46 112.91 115.06 1uls h THR 21 Ca 0.21 -1.53 0.03 0.00 0.77 0.00 0.00 66.41 65.89 1uls h THR 21 Cb 0.02 1.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.79 1uls h THR 21 CO -0.03 0.50 0.34 0.25 0.37 0.00 0.00 175.52 176.95 1uls h LEU 22 N 0.67 0.55 0.01 2.58 6.46 0.40 -0.23 115.31 125.74 1uls h LEU 22 Ca 0.06 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.83 1uls h LEU 22 Cb 0.92 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.75 1uls h LEU 22 CO 0.08 0.38 -0.00 -0.33 -0.62 0.00 0.00 178.44 177.95 1uls h GLU 23 N 0.67 -0.01 -0.30 1.25 5.08 -1.16 -1.80 114.58 118.31 1uls h GLU 23 Ca 0.24 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.62 1uls h GLU 23 Cb 0.05 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1uls h GLU 23 CO -0.11 0.33 0.15 1.25 -1.00 0.00 0.00 179.01 179.63 1uls h LEU 24 N -0.35 0.23 -0.66 1.33 6.46 -1.13 -1.28 115.31 119.91 1uls h LEU 24 Ca -0.00 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.75 1uls h LEU 24 Cb 0.34 -0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.21 1uls h LEU 24 CO 0.00 0.17 0.35 -0.26 -0.62 0.00 0.00 178.44 178.08 1uls h PHE 25 N 0.32 0.93 -0.66 1.25 -1.00 -1.07 -1.16 116.94 115.55 1uls h PHE 25 Ca 0.12 -0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.91 1uls h PHE 25 Cb 0.03 -0.29 -0.04 0.00 3.61 0.00 0.00 35.95 39.26 1uls h PHE 25 CO -0.09 0.67 0.40 0.00 -1.61 0.00 0.00 178.31 177.68 1uls h ALA 26 N 1.17 0.87 -0.33 2.45 0.00 -0.96 0.15 119.26 122.60 1uls h ALA 26 Ca 0.23 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1uls h ALA 26 Cb 0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1uls h ALA 26 CO -0.03 0.15 0.04 0.87 0.00 0.00 0.00 179.25 180.27 1uls h LYS 27 N 0.79 0.50 -0.65 0.00 1.57 -0.74 -1.04 116.57 117.00 1uls h LYS 27 Ca 0.27 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1uls h LYS 27 Cb 0.04 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1uls h LYS 27 CO -0.12 0.50 0.00 0.39 -0.57 0.00 0.00 179.45 179.65 1uls n GLU 28 N -4.31 0.94 -2.34 3.15 -0.58 0.01 -4.87 120.64 112.64 1uls n GLU 28 Ca 0.02 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.62 1uls n GLU 28 Cb 0.21 -1.32 -0.00 0.00 -0.57 0.00 0.00 31.44 29.76 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 0.16 -0.17 3.87 0.62 0.00 -0.39 -1.18 105.19 108.11 1uls n GLY 29 Ca 0.00 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.72 3.34 -0.45 4.61 0.00 -1.02 -0.76 121.76 124.75 1uls s ALA 30 Ca 0.03 -0.18 -0.15 0.00 0.00 0.00 0.00 51.96 51.67 1uls s ALA 30 Cb -0.02 -2.72 0.06 0.00 0.00 0.00 0.00 23.12 20.44 1uls s ALA 30 CO 0.04 0.00 0.36 1.03 0.00 0.00 0.00 175.76 177.20 1uls s ARG 31 N -3.81 2.97 0.16 0.00 0.52 -0.33 -4.74 118.95 113.72 1uls s ARG 31 Ca 0.52 -1.25 0.05 0.00 -0.52 0.00 0.00 55.73 54.53 1uls s ARG 31 Cb -0.10 -4.07 -0.04 0.00 0.52 0.00 0.00 34.95 31.25 1uls s ARG 31 CO 0.31 -0.94 0.13 -0.51 0.02 0.00 0.00 175.30 174.31 1uls s LEU 32 N 1.65 3.81 -0.17 2.53 1.43 -1.26 -1.56 118.68 125.09 1uls s LEU 32 Ca 0.04 -0.12 -0.00 0.00 -1.03 0.00 0.00 54.13 53.02 1uls s LEU 32 Cb -0.23 -2.42 0.04 0.00 0.03 0.00 0.00 46.19 43.62 1uls s LEU 32 CO 0.08 0.07 -0.07 -0.69 0.23 0.00 0.00 176.35 175.96 1uls s VAL 33 N -1.73 1.31 -0.20 -1.59 1.01 -0.76 -1.07 120.40 117.37 1uls s VAL 33 Ca 0.31 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.42 1uls s VAL 33 Cb -0.10 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.80 1uls s VAL 33 CO 0.23 0.17 0.24 0.00 0.00 0.00 0.00 175.10 175.74 1uls s ALA 34 N 1.55 3.61 0.04 5.51 0.00 0.09 -2.00 121.76 130.56 1uls s ALA 34 Ca 0.00 -0.63 0.09 0.00 0.00 0.00 0.00 51.96 51.42 1uls s ALA 34 Cb -0.15 -2.37 -0.03 0.00 0.00 0.00 0.00 23.12 20.57 1uls s ALA 34 CO -0.08 -0.04 -0.25 0.00 0.00 0.00 0.00 175.76 175.39 1uls s ASP 36 N -1.24 -0.14 0.15 0.00 -1.08 -1.24 -1.15 116.67 111.98 1uls s ASP 36 Ca 0.12 -0.10 -0.11 0.00 -0.52 0.00 0.00 52.55 51.94 1uls s ASP 36 Cb -0.10 0.23 -0.00 0.00 -1.46 0.00 0.00 42.92 41.58 1uls s ASP 36 CO 0.02 -0.40 1.54 -0.29 0.52 0.00 0.00 175.17 176.57 1uls h ILE 37 N 2.00 1.27 -3.76 4.11 6.09 -1.94 -3.39 117.51 121.88 1uls h ILE 37 Ca -0.21 -1.37 -0.67 0.00 -1.37 0.00 0.00 64.86 61.25 1uls h ILE 37 Cb 1.20 1.16 -0.18 0.00 0.47 0.00 0.00 36.82 39.46 1uls h ILE 37 CO 0.26 0.47 -0.48 -1.61 -3.07 0.00 0.00 178.15 173.72 1uls s GLU 38 N -4.67 3.62 0.21 2.19 2.02 -1.26 -4.94 118.70 115.88 1uls s GLU 38 Ca -0.12 -0.55 -0.09 0.00 0.02 0.00 0.00 54.97 54.24 1uls s GLU 38 Cb 0.12 -3.77 0.24 0.00 0.10 0.00 0.00 34.13 30.82 1uls s GLU 38 CO 0.86 -0.38 1.83 1.49 0.02 0.00 0.00 175.26 179.09 1uls h GLU 39 N 8.46 0.76 0.00 1.61 4.81 -1.98 -2.16 114.58 126.08 1uls h GLU 39 Ca -0.32 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 1uls h GLU 39 Cb 1.17 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.37 1uls h GLU 39 CO 0.61 0.51 0.00 0.41 -0.73 0.00 0.00 179.01 179.81 1uls n GLY 40 N -1.29 -3.09 0.15 1.92 0.00 -1.26 -1.14 105.19 100.48 1uls n GLY 40 Ca 0.09 0.43 0.12 0.00 0.00 0.00 0.00 46.02 46.65 1uls n GLY 40 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uls n PRO 41 N -1.99 0.18 -0.02 1.61 -0.04 -1.24 -2.89 135.00 130.62 1uls n PRO 41 Ca 0.00 0.52 -0.13 0.00 -0.04 0.00 0.00 63.50 63.84 1uls n PRO 41 Cb 0.00 -1.92 -0.10 0.00 -0.04 0.00 0.00 33.50 31.44 1uls n PRO 41 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1uls h LEU 42 N 0.00 0.04 -1.20 1.53 6.46 -0.68 -2.19 115.31 119.27 1uls h LEU 42 Ca 0.00 -0.55 -0.07 0.00 -0.12 0.00 0.00 57.88 57.14 1uls h LEU 42 Cb 0.22 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.13 1uls h LEU 42 CO 0.00 0.58 -0.18 0.03 -0.62 0.00 0.00 178.44 178.25 1uls h ARG 43 N -0.51 0.33 -0.15 1.25 3.08 -0.99 -0.03 114.38 117.36 1uls h ARG 43 Ca 0.00 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1uls h ARG 43 Cb 0.58 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1uls h ARG 43 CO 0.00 0.51 0.04 1.49 -1.07 0.00 0.00 179.97 180.95 1uls h GLU 44 N 0.30 0.24 -0.57 0.04 4.81 -1.51 0.45 114.58 118.34 1uls h GLU 44 Ca 0.05 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1uls h GLU 44 Cb 0.50 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1uls h GLU 44 CO 0.03 0.37 0.20 0.00 -0.73 0.00 0.00 179.01 178.88 1uls h ALA 45 N 0.86 0.74 -0.29 2.92 0.00 -1.05 -2.15 119.26 120.29 1uls h ALA 45 Ca 0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1uls h ALA 45 Cb 0.23 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1uls h ALA 45 CO -0.00 0.38 0.06 0.00 0.00 0.00 0.00 179.25 179.69 1uls h ALA 46 N 1.06 0.38 -0.56 0.00 0.00 -0.89 -3.16 119.26 116.09 1uls h ALA 46 Ca 0.19 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1uls h ALA 46 Cb 0.24 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1uls h ALA 46 CO -0.01 0.05 0.05 0.93 0.00 0.00 0.00 179.25 180.27 1uls h GLU 47 N 0.30 0.94 0.00 0.00 5.08 -0.84 0.37 114.58 120.42 1uls h GLU 47 Ca 0.09 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1uls h GLU 47 Cb 0.31 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1uls h GLU 47 CO 0.00 0.90 0.00 0.00 -1.00 0.00 0.00 179.01 178.91 1uls h ALA 48 N 1.17 1.00 0.00 3.43 0.00 -1.35 -3.07 119.26 120.44 1uls h ALA 48 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1uls h ALA 48 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1uls h ALA 48 CO 0.02 0.00 0.00 1.55 0.00 0.00 0.00 179.25 180.82 1uls n VAL 49 N -2.32 0.00 -0.64 0.00 3.14 -0.93 -5.02 118.33 112.56 1uls n VAL 49 Ca -0.01 -0.28 0.00 0.00 -2.96 0.00 0.00 64.34 61.09 1uls n VAL 49 Cb 0.07 1.35 0.00 0.00 -1.06 0.00 0.00 33.84 34.20 1uls n VAL 49 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1uls n GLY 50 N 0.11 0.63 3.93 7.55 0.00 -0.24 -4.94 105.19 112.23 1uls n GLY 50 Ca 0.00 -0.41 -0.25 0.00 0.00 0.00 0.00 46.02 45.36 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 3.50 -0.32 4.61 0.00 -0.05 -4.76 121.76 122.74 1uls s ALA 51 Ca 0.00 -0.79 -0.11 0.00 0.00 0.00 0.00 51.96 51.06 1uls s ALA 51 Cb 0.00 -2.41 -0.01 0.00 0.00 0.00 0.00 23.12 20.69 1uls s ALA 51 CO 0.00 -0.53 0.19 -1.58 0.00 0.00 0.00 175.76 173.84 1uls s HIS 52 N -2.76 3.20 0.07 0.00 2.46 -0.23 -4.40 115.29 113.64 1uls s HIS 52 Ca 0.50 -0.38 -0.31 0.00 0.47 0.00 0.00 55.06 55.34 1uls s HIS 52 Cb -0.10 -2.41 -0.06 0.00 -0.13 0.00 0.00 32.58 29.88 1uls s HIS 52 CO 0.42 -0.40 1.28 -1.25 -2.47 0.00 0.00 174.74 172.32 1uls s PRO 53 N 1.67 4.38 -0.22 2.88 0.04 -1.26 -0.73 135.00 141.76 1uls s PRO 53 Ca 0.05 1.88 -0.04 0.00 0.04 0.00 0.00 61.00 62.93 1uls s PRO 53 Cb -0.17 -3.34 0.07 0.00 0.04 0.00 0.00 34.50 31.11 1uls s PRO 53 CO 0.08 -0.35 0.10 0.08 0.04 0.00 0.00 177.00 176.95 1uls s VAL 54 N 1.21 0.03 1.05 -0.36 1.01 0.26 -4.92 120.40 118.68 1uls s VAL 54 Ca 0.61 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 62.02 1uls s VAL 54 Cb -0.32 -0.80 0.22 0.00 0.00 0.00 0.00 36.38 35.48 1uls s VAL 54 CO 0.29 -0.43 1.08 -0.69 0.00 0.00 0.00 175.10 175.34 1uls s VAL 55 N 2.07 2.09 -0.31 2.92 1.01 -1.26 -3.62 120.40 123.30 1uls s VAL 55 Ca 0.04 0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.09 1uls s VAL 55 Cb -0.16 -2.10 0.17 0.00 0.00 0.00 0.00 36.38 34.29 1uls s VAL 55 CO -0.19 -0.04 0.48 -0.62 0.00 0.00 0.00 175.10 174.74 1uls s ASP 57 N -2.64 -0.30 0.13 3.32 -1.08 -1.26 -4.79 116.67 110.05 1uls s ASP 57 Ca 0.67 -0.41 0.09 0.00 -0.52 0.00 0.00 52.55 52.38 1uls s ASP 57 Cb -0.24 1.40 0.47 0.00 -1.46 0.00 0.00 42.92 43.09 1uls s ASP 57 CO 0.62 -0.31 1.27 1.33 0.52 0.00 0.00 175.17 178.59 1uls n VAL 58 N 5.14 1.61 1.03 1.11 0.24 -1.26 -0.74 118.33 125.46 1uls n VAL 58 Ca 0.04 0.60 0.12 0.00 -2.04 0.00 0.00 64.34 63.06 1uls n VAL 58 Cb 0.51 -1.60 0.30 0.00 -1.47 0.00 0.00 33.84 31.59 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 -1.61 3.39 -3.06 2.33 0.00 -1.26 -4.30 120.51 115.99 1uls n ALA 59 Ca -0.01 -0.33 -0.39 0.00 0.00 0.00 0.00 53.44 52.72 1uls n ALA 59 Cb 0.01 -1.16 -0.12 0.00 0.00 0.00 0.00 19.45 18.19 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 -2.95 5.45 0.29 0.00 3.68 0.08 -4.96 116.67 118.25 1uls s ASP 60 Ca 0.13 -0.99 0.03 0.00 2.13 0.00 0.00 52.55 53.85 1uls s ASP 60 Cb 0.18 -1.93 0.71 0.00 -1.45 0.00 0.00 42.92 40.43 1uls s ASP 60 CO 0.67 -0.32 1.71 -0.65 0.13 0.00 0.00 175.17 176.71 1uls h PRO 61 N 8.31 0.44 -0.22 4.34 0.11 -1.86 0.25 132.00 143.37 1uls h PRO 61 Ca -0.26 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.68 1uls h PRO 61 Cb 1.10 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1uls h PRO 61 CO 0.63 0.29 -0.47 0.00 -0.21 0.00 0.00 178.00 178.23 1uls h ALA 62 N 1.69 0.77 -0.03 -0.75 0.00 -1.94 -2.04 119.26 116.96 1uls h ALA 62 Ca 0.55 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1uls h ALA 62 Cb 1.01 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1uls h ALA 62 CO -0.50 0.67 0.00 1.03 0.00 0.00 0.00 179.25 180.45 1uls h SER 63 N 0.45 0.05 -0.65 0.00 0.87 -1.26 -0.35 113.55 112.67 1uls h SER 63 Ca 0.03 -0.30 0.02 0.00 -1.23 0.00 0.00 61.79 60.31 1uls h SER 63 Cb 0.99 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.90 1uls h SER 63 CO 0.09 0.34 0.41 0.58 -0.53 0.00 0.00 176.83 177.72 1uls h VAL 64 N -0.23 1.10 0.26 2.23 2.07 -1.30 0.26 116.25 120.63 1uls h VAL 64 Ca 0.01 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1uls h VAL 64 Cb 0.31 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1uls h VAL 64 CO 0.00 0.15 -0.12 -0.08 0.02 0.00 0.00 177.57 177.54 1uls h GLU 65 N 0.81 -0.33 -0.19 1.57 4.81 -1.23 -0.86 114.58 119.16 1uls h GLU 65 Ca 0.26 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 1uls h GLU 65 Cb -0.01 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1uls h GLU 65 CO -0.09 -0.21 0.12 0.00 -0.73 0.00 0.00 179.01 178.10 1uls h ARG 66 N -0.36 0.25 -0.37 1.92 3.08 -0.78 -2.50 114.38 115.61 1uls h ARG 66 Ca -0.04 -0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.08 1uls h ARG 66 Cb 0.28 -0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.18 1uls h ARG 66 CO 0.06 0.16 -0.23 0.78 -1.07 0.00 0.00 179.97 179.67 1uls h GLY 67 N 0.25 -0.01 2.00 0.04 0.00 -0.28 -0.32 103.07 104.76 1uls h GLY 67 Ca 0.07 0.29 -0.03 0.00 0.00 0.00 0.00 47.33 47.66 1uls h GLY 67 CO -0.02 -0.20 -0.12 0.74 0.00 0.00 0.00 176.54 176.94 1uls h PHE 68 N -0.17 0.00 -0.17 5.60 -1.00 -1.03 -1.07 116.94 119.10 1uls h PHE 68 Ca 0.18 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.93 1uls h PHE 68 Cb 0.46 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.01 1uls h PHE 68 CO -0.45 0.12 -0.03 0.00 -1.61 0.00 0.00 178.31 176.34 1uls h ALA 69 N 1.88 0.23 0.23 2.45 0.00 -0.63 -1.04 119.26 122.37 1uls h ALA 69 Ca -0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1uls h ALA 69 Cb 0.41 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1uls h ALA 69 CO 0.02 -0.02 -0.11 0.93 0.00 0.00 0.00 179.25 180.07 1uls h GLU 70 N 0.03 -0.30 -0.71 0.00 5.08 -0.70 0.92 114.58 118.91 1uls h GLU 70 Ca 0.04 0.02 0.14 0.00 -1.00 0.00 0.00 59.36 58.56 1uls h GLU 70 Cb 0.46 0.07 -0.10 0.00 0.50 0.00 0.00 28.75 29.68 1uls h GLU 70 CO 0.02 -0.19 0.23 0.00 -1.00 0.00 0.00 179.01 178.07 1uls h ALA 71 N 0.43 0.95 -0.24 3.43 0.00 -1.16 0.57 119.26 123.23 1uls h ALA 71 Ca -0.03 0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 1uls h ALA 71 Cb 0.26 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1uls h ALA 71 CO 0.05 -0.27 -0.46 -0.07 0.00 0.00 0.00 179.25 178.51 1uls h LEU 72 N 0.35 0.68 -0.86 0.00 -0.00 -0.95 0.61 115.31 115.15 1uls h LEU 72 Ca 0.39 -0.33 -0.07 0.00 -0.00 0.00 0.00 57.88 57.87 1uls h LEU 72 Cb 0.61 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 41.05 1uls h LEU 72 CO -0.43 1.04 0.05 0.00 -0.00 0.00 0.00 178.44 179.10 1uls h ALA 73 N 0.99 1.06 0.13 1.53 0.00 0.10 1.01 119.26 124.08 1uls h ALA 73 Ca 0.03 -0.26 -0.21 0.00 0.00 0.00 0.00 54.91 54.47 1uls h ALA 73 Cb 0.99 -0.21 0.02 0.00 0.00 0.00 0.00 17.79 18.59 1uls h ALA 73 CO 0.09 0.60 -0.89 1.25 0.00 0.00 0.00 179.25 180.30 1uls h HIS 74 N 0.84 0.64 0.03 0.00 -0.00 0.33 -3.37 115.15 113.63 1uls h HIS 74 Ca 0.17 -0.45 -0.29 0.00 -0.00 0.00 0.00 60.37 59.80 1uls h HIS 74 Cb 0.43 -0.04 -0.04 0.00 -0.00 0.00 0.00 27.41 27.77 1uls h HIS 74 CO 0.03 1.33 -1.63 -0.07 -0.00 0.00 0.00 177.93 177.58 1uls h LEU 75 N -0.22 0.11 0.00 0.26 3.38 0.26 -3.48 115.31 115.62 1uls h LEU 75 Ca -0.15 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1uls h LEU 75 Cb 1.68 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.39 1uls h LEU 75 CO 0.17 1.18 0.00 0.61 0.09 0.00 0.00 178.44 180.49 1uls n GLY 76 N 1.60 2.18 3.59 0.83 0.00 0.35 -4.93 105.19 108.81 1uls n GLY 76 Ca -0.17 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.17 0.53 -0.09 1.61 1.70 -1.26 -5.01 118.95 116.26 1uls s ARG 77 Ca 0.00 -0.22 0.01 0.00 -0.47 0.00 0.00 55.73 55.04 1uls s ARG 77 Cb 0.00 0.23 0.02 0.00 -0.57 0.00 0.00 34.95 34.63 1uls s ARG 77 CO 0.00 -0.24 -0.10 -0.51 -1.08 0.00 0.00 175.30 173.38 1uls s LEU 78 N -2.44 1.40 -0.15 -1.89 1.43 -1.26 -4.76 118.68 111.01 1uls s LEU 78 Ca 0.09 -0.30 0.17 0.00 -1.03 0.00 0.00 54.13 53.06 1uls s LEU 78 Cb -0.00 -0.83 -0.24 0.00 0.03 0.00 0.00 46.19 45.15 1uls s LEU 78 CO -0.05 -0.05 0.14 0.47 0.23 0.00 0.00 176.35 177.09 1uls n ASP 79 N 4.42 0.48 -3.54 2.29 8.00 0.26 -4.88 116.55 123.57 1uls n ASP 79 Ca -0.18 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.25 1uls n ASP 79 Cb 0.51 1.14 -0.02 0.00 -0.02 0.00 0.00 41.12 42.73 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 -5.06 -0.43 -0.05 0.44 0.00 -1.06 -1.52 107.32 99.63 1uls s GLY 80 Ca -0.09 0.87 -0.04 0.00 0.00 0.00 0.00 44.72 45.46 1uls s GLY 80 CO 0.77 0.28 0.14 0.14 0.00 0.00 0.00 173.10 174.42 1uls s VAL 81 N -3.15 -0.01 -0.21 1.40 1.01 -0.85 -2.04 120.40 116.56 1uls s VAL 81 Ca 0.06 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.08 1uls s VAL 81 Cb -0.01 -0.20 0.04 0.00 0.00 0.00 0.00 36.38 36.21 1uls s VAL 81 CO -0.07 0.01 -0.15 -0.69 0.00 0.00 0.00 175.10 174.20 1uls s VAL 82 N 0.20 1.97 -0.24 2.92 1.01 -0.22 -0.78 120.40 125.25 1uls s VAL 82 Ca -0.01 -1.16 -0.11 0.00 0.00 0.00 0.00 61.98 60.70 1uls s VAL 82 Cb -0.02 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 1uls s VAL 82 CO -0.01 0.27 0.19 -2.28 0.00 0.00 0.00 175.10 173.27 1uls s HIS 83 N 1.27 3.31 0.00 5.22 2.46 -0.23 -1.89 115.29 125.43 1uls s HIS 83 Ca -0.01 0.25 -0.01 0.00 0.47 0.00 0.00 55.06 55.77 1uls s HIS 83 Cb -0.16 -2.31 -0.00 0.00 -0.13 0.00 0.00 32.58 29.98 1uls s HIS 83 CO -0.09 0.03 -0.01 0.66 -2.47 0.00 0.00 174.74 172.86 1uls n TYR 84 N 4.41 0.00 -0.04 3.88 0.53 -1.24 -2.14 117.16 122.56 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 0.52 -0.02 0.00 0.00 -1.03 0.00 0.00 39.34 38.81 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 -2.65 -0.07 -2.19 -0.72 0.00 -1.26 -4.84 120.51 108.78 1uls n ALA 85 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.32 1uls n ALA 85 Cb 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.37 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 0.97 0.14 0.00 0.00 -1.26 -4.68 107.32 102.49 1uls s GLY 86 Ca 0.00 -1.46 -0.03 0.00 0.00 0.00 0.00 44.72 43.23 1uls s GLY 86 CO 0.00 -1.46 0.11 -0.26 0.00 0.00 0.00 173.10 171.49 1uls s ILE 87 N -3.73 0.09 0.04 0.90 -4.36 -1.26 -5.05 121.20 107.83 1uls s ILE 87 Ca 0.19 -1.81 0.03 0.00 -0.26 0.00 0.00 60.65 58.79 1uls s ILE 87 Cb 0.06 -2.04 -0.02 0.00 1.25 0.00 0.00 42.46 41.71 1uls s ILE 87 CO -0.00 -0.40 -0.09 0.42 0.24 0.00 0.00 174.94 175.11 1uls s THR 88 N -4.04 0.67 -0.42 8.37 -4.23 -1.26 -4.92 115.64 109.81 1uls s THR 88 Ca 0.24 -1.06 0.07 0.00 -1.18 0.00 0.00 61.69 59.75 1uls s THR 88 Cb 0.07 -0.70 0.23 0.00 1.34 0.00 0.00 72.50 73.43 1uls s THR 88 CO 0.02 -0.30 0.58 0.54 -0.54 0.00 0.00 174.62 174.93 1uls n ARG 89 N 1.55 0.63 -1.93 3.99 3.00 -1.26 -5.06 116.66 117.57 1uls n ARG 89 Ca -0.22 -2.83 -0.38 0.00 -0.01 0.00 0.00 57.85 54.42 1uls n ARG 89 Cb 0.55 -1.35 0.03 0.00 0.00 0.00 0.00 32.46 31.69 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 -0.98 5.47 0.00 0.55 1.01 -1.26 -4.91 116.67 116.55 1uls s ASP 90 Ca 0.34 2.60 0.00 0.00 0.71 0.00 0.00 52.55 56.20 1uls s ASP 90 Cb 0.15 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.46 1uls s ASP 90 CO -0.15 -1.42 0.00 0.59 0.21 0.00 0.00 175.17 174.40 1uls n ASN 91 N -0.98 0.00 -4.76 0.27 3.02 0.11 -5.03 115.26 107.88 1uls n ASN 91 Ca 0.10 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.30 1uls n ASN 91 Cb 0.46 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.66 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 -1.80 2.54 0.36 3.10 0.40 -1.26 -3.97 117.98 117.35 1uls s PHE 92 Ca 0.00 1.54 0.11 0.00 -0.60 0.00 0.00 56.93 57.98 1uls s PHE 92 Cb 0.00 -3.34 0.87 0.00 0.51 0.00 0.00 43.02 41.06 1uls s PHE 92 CO 0.00 -1.85 1.84 1.12 0.70 0.00 0.00 175.22 177.03 1uls h HIS 93 N 0.82 0.80 0.00 0.36 2.07 -2.00 -1.13 115.15 116.07 1uls h HIS 93 Ca -0.49 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 1uls h HIS 93 Cb 1.27 -0.25 0.00 0.00 2.57 0.00 0.00 27.41 31.00 1uls h HIS 93 CO 0.50 0.24 0.00 -2.67 -3.07 0.00 0.00 177.93 172.94 1uls n TRP 94 N -4.59 0.07 -3.75 6.12 4.27 -1.26 -4.84 117.44 113.46 1uls n TRP 94 Ca 0.19 0.03 -0.33 0.00 -3.89 0.00 0.00 57.50 53.50 1uls n TRP 94 Cb 0.56 -0.54 -0.09 0.00 -1.36 0.00 0.00 31.31 29.88 1uls n TRP 94 CO 0.00 0.00 0.00 0.21 -2.29 0.00 0.00 177.69 175.61 1uls s LYS 95 N -3.02 2.84 0.01 -2.67 2.20 -0.43 -5.19 119.74 113.47 1uls s LYS 95 Ca 0.09 -3.15 -0.01 0.00 -0.36 0.00 0.00 55.97 52.53 1uls s LYS 95 Cb 0.12 -3.72 -0.01 0.00 -1.51 0.00 0.00 37.83 32.71 1uls s LYS 95 CO 0.34 -1.25 0.01 -1.25 -0.36 0.00 0.00 175.35 172.84 1uls s PRO 97 N -1.13 0.26 0.27 4.03 0.04 -1.26 -4.90 135.00 132.32 1uls s PRO 97 Ca 0.24 -0.42 0.01 0.00 0.04 0.00 0.00 61.00 60.87 1uls s PRO 97 Cb -0.10 0.10 0.59 0.00 0.04 0.00 0.00 34.50 35.13 1uls s PRO 97 CO -0.12 -0.05 1.75 1.25 0.04 0.00 0.00 177.00 179.88 1uls h LEU 98 N 4.96 0.53 -0.58 -3.56 6.46 -1.99 -1.05 115.31 120.08 1uls h LEU 98 Ca -0.30 0.10 0.12 0.00 -0.12 0.00 0.00 57.88 57.68 1uls h LEU 98 Cb 1.21 0.02 -0.09 0.00 -0.73 0.00 0.00 40.66 41.07 1uls h LEU 98 CO 0.43 0.19 0.05 -0.33 -0.62 0.00 0.00 178.44 178.16 1uls h GLU 99 N 0.61 0.16 -0.64 1.25 5.08 -2.03 0.21 114.58 119.22 1uls h GLU 99 Ca 0.49 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.79 1uls h GLU 99 Cb 0.75 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.94 1uls h GLU 99 CO -0.39 0.10 0.19 -0.44 -1.00 0.00 0.00 179.01 177.47 1uls h ASP 100 N 0.16 0.91 -0.01 1.42 5.19 -1.61 0.48 116.42 122.96 1uls h ASP 100 Ca 0.30 -0.16 -0.00 0.00 -0.62 0.00 0.00 57.03 56.55 1uls h ASP 100 Cb 0.47 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 39.74 1uls h ASP 100 CO -0.46 0.86 -0.00 -0.25 -3.12 0.00 0.00 179.24 176.28 1uls h TRP 101 N 0.94 0.03 0.00 4.55 2.91 -0.83 -2.93 115.95 120.62 1uls h TRP 101 Ca 0.21 -0.00 -0.04 0.00 1.13 0.00 0.00 58.89 60.18 1uls h TRP 101 Cb 0.29 -0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 28.92 1uls h TRP 101 CO 0.02 0.33 -0.21 0.93 -1.03 0.00 0.00 178.44 178.48 1uls h GLU 102 N -0.28 0.00 -0.06 2.65 5.08 -0.81 -2.70 114.58 118.45 1uls h GLU 102 Ca 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1uls h GLU 102 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1uls h GLU 102 CO 0.00 0.21 -0.16 1.25 -1.00 0.00 0.00 179.01 179.31 1uls h LEU 103 N 0.00 0.24 -1.07 1.33 5.85 -0.87 -1.28 115.31 119.52 1uls h LEU 103 Ca -0.00 -0.60 -0.08 0.00 0.84 0.00 0.00 57.88 58.04 1uls h LEU 103 Cb 0.70 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1uls h LEU 103 CO 0.03 0.81 -0.17 -0.37 -0.34 0.00 0.00 178.44 178.39 1uls h VAL 104 N -0.31 1.24 -0.26 1.05 -1.51 -1.47 -0.73 116.25 114.28 1uls h VAL 104 Ca -0.00 -1.09 -0.05 0.00 -1.23 0.00 0.00 66.70 64.32 1uls h VAL 104 Cb 0.78 1.24 -0.01 0.00 -2.13 0.00 0.00 31.29 31.17 1uls h VAL 104 CO 0.04 0.35 -0.04 -0.07 -1.23 0.00 0.00 177.57 176.61 1uls h LEU 105 N 0.42 0.48 -0.29 4.19 3.38 -1.50 0.23 115.31 122.22 1uls h LEU 105 Ca 0.07 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 57.72 1uls h LEU 105 Cb 0.55 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1uls h LEU 105 CO 0.04 0.72 0.09 -0.09 0.09 0.00 0.00 178.44 179.29 1uls h ARG 106 N 0.24 0.21 0.10 1.13 2.43 -0.88 0.13 114.38 117.74 1uls h ARG 106 Ca 0.07 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1uls h ARG 106 Cb 0.50 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1uls h ARG 106 CO 0.02 0.14 -0.05 0.28 -1.51 0.00 0.00 179.97 178.85 1uls h VAL 107 N 0.22 0.94 0.12 0.20 2.07 -1.12 -1.84 116.25 116.83 1uls h VAL 107 Ca 0.13 -1.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 1uls h VAL 107 Cb 0.10 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1uls h VAL 107 CO -0.14 0.27 -0.06 0.78 0.02 0.00 0.00 177.57 178.45 1uls h ASN 108 N -0.89 -0.13 0.03 0.57 4.21 -0.57 -2.86 115.58 115.94 1uls h ASN 108 Ca -0.01 -0.43 -0.00 0.00 1.21 0.00 0.00 56.30 57.07 1uls h ASN 108 Cb 0.55 0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.78 1uls h ASN 108 CO 0.02 0.42 -0.01 0.25 -1.29 0.00 0.00 177.43 176.82 1uls h LEU 109 N -0.76 -0.03 -1.22 1.61 5.85 -0.90 -2.99 115.31 116.88 1uls h LEU 109 Ca -0.02 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.57 1uls h LEU 109 Cb 0.55 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1uls h LEU 109 CO 0.03 0.50 -0.23 0.74 -0.34 0.00 0.00 178.44 179.14 1uls h THR 110 N -1.01 1.23 -0.59 1.05 2.02 -1.22 -2.00 112.91 112.40 1uls h THR 110 Ca -0.00 -1.06 -0.01 0.00 0.77 0.00 0.00 66.41 66.10 1uls h THR 110 Cb 0.09 1.37 -0.03 0.00 -1.74 0.00 0.00 68.15 67.85 1uls h THR 110 CO 0.01 0.33 0.31 1.23 0.37 0.00 0.00 175.52 177.76 1uls h GLY 111 N 0.93 0.88 1.53 2.16 0.00 -1.08 0.11 103.07 107.60 1uls h GLY 111 Ca 0.04 -0.41 -0.08 0.00 0.00 0.00 0.00 47.33 46.88 1uls h GLY 111 CO 0.04 0.39 -0.16 1.76 0.00 0.00 0.00 176.54 178.56 1uls h SER 112 N 0.79 0.55 -0.09 0.19 0.02 -1.29 -0.96 113.55 112.77 1uls h SER 112 Ca 0.21 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1uls h SER 112 Cb 0.06 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.45 1uls h SER 112 CO -0.03 0.73 0.03 0.15 -1.14 0.00 0.00 176.83 176.57 1uls h PHE 113 N 0.51 0.14 -0.06 3.45 3.57 -0.68 0.83 116.94 124.69 1uls h PHE 113 Ca 0.09 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.59 1uls h PHE 113 Cb 0.58 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 1uls h PHE 113 CO 0.02 0.28 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.29 1uls h LEU 114 N -0.04 -0.09 -0.49 0.59 3.38 -0.53 0.13 115.31 118.25 1uls h LEU 114 Ca 0.03 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 1uls h LEU 114 Cb 0.21 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1uls h LEU 114 CO -0.00 -0.04 0.12 0.58 0.09 0.00 0.00 178.44 179.19 1uls h VAL 115 N -0.02 1.24 -0.41 1.22 2.07 -1.13 -1.61 116.25 117.60 1uls h VAL 115 Ca 0.03 -0.84 -0.12 0.00 0.82 0.00 0.00 66.70 66.60 1uls h VAL 115 Cb 0.07 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1uls h VAL 115 CO -0.08 0.30 -0.22 0.00 0.02 0.00 0.00 177.57 177.60 1uls h ALA 116 N 0.99 0.85 -0.28 1.67 0.00 -0.69 -0.40 119.26 121.40 1uls h ALA 116 Ca 0.15 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1uls h ALA 116 Cb 0.33 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1uls h ALA 116 CO 0.00 0.64 0.16 -0.22 0.00 0.00 0.00 179.25 179.83 1uls h LYS 117 N 0.71 0.39 -0.49 0.00 3.64 -0.59 0.11 116.57 120.34 1uls h LYS 117 Ca 0.10 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.39 1uls h LYS 117 Cb 0.74 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.46 1uls h LYS 117 CO 0.06 0.32 0.12 0.00 -2.27 0.00 0.00 179.45 177.68 1uls h ALA 118 N 1.05 0.65 -0.53 5.00 0.00 -1.14 -0.24 119.26 124.04 1uls h ALA 118 Ca 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1uls h ALA 118 Cb 0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1uls h ALA 118 CO -0.02 0.33 0.29 0.00 0.00 0.00 0.00 179.25 179.86 1uls h ALA 119 N 0.99 0.68 -0.43 0.00 0.00 -0.81 -1.84 119.26 117.84 1uls h ALA 119 Ca 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1uls h ALA 119 Cb 0.32 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1uls h ALA 119 CO 0.00 0.19 0.24 1.03 0.00 0.00 0.00 179.25 180.72 1uls h SER 120 N 0.71 0.54 -0.85 0.00 0.87 -0.57 -2.70 113.55 111.55 1uls h SER 120 Ca 0.19 -0.08 0.03 0.00 -1.23 0.00 0.00 61.79 60.69 1uls h SER 120 Cb 0.04 -0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 61.82 1uls h SER 120 CO -0.03 0.47 0.56 -0.08 -0.53 0.00 0.00 176.83 177.22 1uls h GLU 121 N 0.57 1.04 -0.47 2.24 4.22 -0.73 0.37 114.58 121.82 1uls h GLU 121 Ca 0.15 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 59.53 1uls h GLU 121 Cb 0.04 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.06 1uls h GLU 121 CO -0.03 0.69 0.00 0.00 -2.18 0.00 0.00 179.01 177.49 1uls n ALA 122 N -2.41 2.17 -0.83 2.92 0.00 -0.72 -4.98 120.51 116.66 1uls n ALA 122 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1uls n ALA 122 Cb 0.09 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.54 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 -0.11 0.00 -0.97 0.00 0.63 0.13 -4.52 116.66 111.83 1uls n ARG 124 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1uls n ARG 124 Cb 0.12 -0.28 0.00 0.00 0.45 0.00 0.00 32.46 32.75 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 0.81 -0.56 -0.04 -0.14 1.02 -1.26 -4.81 120.64 115.65 1uls n GLU 125 Ca 0.00 0.14 -0.10 0.00 -0.02 0.00 0.00 57.16 57.18 1uls n GLU 125 Cb 0.00 -3.60 -0.03 0.00 -0.02 0.00 0.00 31.44 27.79 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 -1.70 0.21 -3.60 3.49 4.01 -1.26 -5.11 118.16 114.20 1uls n LYS 126 Ca 0.00 0.09 -0.08 0.00 -0.51 0.00 0.00 58.31 57.81 1uls n LYS 126 Cb 0.14 -0.85 -0.02 0.00 -0.51 0.00 0.00 35.03 33.79 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 -5.90 -0.36 1.00 4.39 4.22 -1.26 -5.16 114.94 111.87 1uls s ASN 127 Ca -0.13 -0.20 -0.13 0.00 -2.14 0.00 0.00 52.86 50.26 1uls s ASN 127 Cb 0.05 0.53 0.19 0.00 1.28 0.00 0.00 41.25 43.30 1uls s ASN 127 CO 0.17 -0.92 1.11 -2.16 -2.04 0.00 0.00 177.10 173.26 1uls s PRO 128 N -3.48 0.42 -0.02 3.55 0.04 -1.26 -4.58 135.00 129.67 1uls s PRO 128 Ca 0.07 0.41 -0.24 0.00 0.04 0.00 0.00 61.00 61.27 1uls s PRO 128 Cb -0.02 -1.75 0.08 0.00 0.04 0.00 0.00 34.50 32.85 1uls s PRO 128 CO -0.05 -2.71 1.09 0.41 0.04 0.00 0.00 177.00 175.78 1uls n GLY 129 N -1.33 0.28 2.91 0.56 0.00 -0.97 -4.81 105.19 101.82 1uls n GLY 129 Ca 0.06 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.93 1uls n GLY 129 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uls s SER 130 N -3.41 -0.09 -0.12 1.61 0.15 -0.57 -0.96 113.70 110.31 1uls s SER 130 Ca 0.26 0.26 0.03 0.00 0.70 0.00 0.00 55.95 57.19 1uls s SER 130 Cb -0.01 0.16 -0.00 0.00 -1.71 0.00 0.00 66.02 64.46 1uls s SER 130 CO -0.01 -0.14 -0.21 -0.63 1.20 0.00 0.00 173.24 173.46 1uls s ILE 131 N 1.05 2.27 -0.18 6.45 1.01 0.67 -2.01 121.20 130.46 1uls s ILE 131 Ca -0.08 -0.93 -0.01 0.00 0.00 0.00 0.00 60.65 59.63 1uls s ILE 131 Cb -0.11 -1.90 0.00 0.00 0.01 0.00 0.00 42.46 40.47 1uls s ILE 131 CO -0.05 0.55 -0.14 -0.69 0.00 0.00 0.00 174.94 174.61 1uls s VAL 132 N 0.49 2.64 -0.12 2.92 1.01 0.04 -1.13 120.40 126.24 1uls s VAL 132 Ca -0.14 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.07 1uls s VAL 132 Cb -0.17 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1uls s VAL 132 CO 0.05 0.50 -0.07 -0.76 0.00 0.00 0.00 175.10 174.83 1uls s LEU 133 N 1.15 3.11 -0.20 3.92 1.43 0.15 -1.07 118.68 127.17 1uls s LEU 133 Ca 0.01 -0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 52.84 1uls s LEU 133 Cb -0.14 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 1uls s LEU 133 CO -0.05 0.24 0.32 -0.89 0.23 0.00 0.00 176.35 176.20 1uls s THR 134 N -0.07 5.26 0.00 5.49 2.01 -0.91 -1.31 115.64 126.11 1uls s THR 134 Ca 0.00 0.56 0.00 0.00 0.31 0.00 0.00 61.69 62.56 1uls s THR 134 Cb -0.13 -3.66 0.00 0.00 0.01 0.00 0.00 72.50 68.72 1uls s THR 134 CO 0.03 0.31 0.00 0.00 -0.69 0.00 0.00 174.62 174.27 1uls n ALA 135 N 4.18 0.00 -3.63 7.40 0.00 0.17 -4.91 120.51 123.72 1uls n ALA 135 Ca -0.11 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.29 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 -0.02 -0.12 0.55 0.00 0.15 -1.25 -4.49 113.70 108.53 1uls s SER 136 Ca 0.00 0.13 0.25 0.00 0.70 0.00 0.00 55.95 57.03 1uls s SER 136 Cb 0.00 0.10 1.45 0.00 -1.71 0.00 0.00 66.02 65.86 1uls s SER 136 CO 0.00 -0.11 2.03 -0.09 1.20 0.00 0.00 173.24 176.28 1uls h ARG 137 N 2.20 0.00 0.00 5.44 1.12 -1.00 -1.35 114.38 120.79 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 -4.20 1.34 0.20 0.20 0.31 -1.26 -2.61 118.33 112.31 1uls n VAL 138 Ca 0.06 0.47 0.11 0.00 -0.01 0.00 0.00 64.34 64.97 1uls n VAL 138 Cb 0.48 -1.41 0.57 0.00 -0.91 0.00 0.00 33.84 32.57 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 -1.83 0.74 1.51 3.52 0.18 -0.51 -0.03 117.16 120.74 1uls n TYR 139 Ca 0.01 0.37 0.12 0.00 1.88 0.00 0.00 57.90 60.27 1uls n TYR 139 Cb 0.08 -1.09 0.50 0.00 -0.38 0.00 0.00 39.34 38.45 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 -2.25 1.17 0.00 -3.48 4.77 -1.07 -4.56 117.00 111.57 1uls n LEU 140 Ca -0.01 -0.45 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 1uls n LEU 140 Cb 0.07 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1uls n LEU 140 CO 0.11 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1uls n GLY 141 N 1.07 2.14 3.63 -0.72 0.00 0.96 -5.13 105.19 107.13 1uls n GLY 141 Ca 0.17 -1.50 -0.13 0.00 0.00 0.00 0.00 46.02 44.56 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 0.00 -0.76 0.12 1.61 2.47 -1.26 -4.85 114.94 112.27 1uls s ASN 142 Ca 0.00 1.45 -0.35 0.00 0.42 0.00 0.00 52.86 54.37 1uls s ASN 142 Cb 0.00 1.46 -0.15 0.00 -1.45 0.00 0.00 41.25 41.10 1uls s ASN 142 CO 0.00 -0.25 1.44 0.18 -3.72 0.00 0.00 177.10 174.75 1uls n LEU 143 N 2.81 2.26 -0.09 3.21 4.77 -1.26 -1.76 117.00 126.94 1uls n LEU 143 Ca -0.14 1.10 -0.01 0.00 -0.03 0.00 0.00 56.01 56.93 1uls n LEU 143 Cb 0.55 -1.29 -0.01 0.00 -2.33 0.00 0.00 43.42 40.35 1uls n LEU 143 CO 0.03 -0.73 -0.01 0.61 -1.33 0.00 0.00 177.39 175.96 1uls n GLY 144 N 2.88 0.45 2.55 -0.72 0.00 -1.26 -4.92 105.19 104.17 1uls n GLY 144 Ca 0.18 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.04 2.38 -0.25 1.61 6.02 -0.72 0.04 117.38 124.42 1uls n GLN 145 Ca -0.01 -3.74 0.02 0.00 -0.01 0.00 0.00 57.00 53.26 1uls n GLN 145 Cb 0.15 -1.83 0.15 0.00 1.02 0.00 0.00 30.24 29.73 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 2.48 1.00 -0.15 -1.58 0.00 -1.78 0.35 119.26 119.58 1uls h ALA 146 Ca 0.04 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1uls h ALA 146 Cb 1.35 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1uls h ALA 146 CO 0.41 -0.11 -0.03 -2.95 0.00 0.00 0.00 179.25 176.57 1uls h ASN 147 N 0.54 0.28 -0.59 0.00 -1.07 -1.90 -1.33 115.58 111.50 1uls h ASN 147 Ca 0.37 -0.36 -0.04 0.00 0.07 0.00 0.00 56.30 56.34 1uls h ASN 147 Cb 0.45 -0.08 -0.03 0.00 -2.07 0.00 0.00 38.32 36.60 1uls h ASN 147 CO -0.31 0.57 0.21 0.22 0.07 0.00 0.00 177.43 178.19 1uls h TYR 148 N -0.01 0.93 -0.61 4.14 3.20 -1.79 -0.60 116.97 122.22 1uls h TYR 148 Ca 0.04 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.78 1uls h TYR 148 Cb 0.44 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 1uls h TYR 148 CO 0.05 0.76 0.21 0.00 -1.64 0.00 0.00 178.16 177.54 1uls h ALA 149 N 1.07 0.80 -0.35 1.82 0.00 -0.29 -3.02 119.26 119.29 1uls h ALA 149 Ca 0.19 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 1uls h ALA 149 Cb 0.25 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1uls h ALA 149 CO -0.01 0.45 -0.45 0.00 0.00 0.00 0.00 179.25 179.24 1uls h ALA 150 N 1.07 0.53 0.00 0.00 0.00 -1.08 -0.46 119.26 119.32 1uls h ALA 150 Ca 0.20 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1uls h ALA 150 Cb 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1uls h ALA 150 CO -0.01 0.68 0.00 -1.13 0.00 0.00 0.00 179.25 178.79 1uls n SER 151 N -4.04 0.36 0.00 0.00 3.41 -0.25 -1.45 113.62 111.66 1uls n SER 151 Ca -0.03 -0.59 0.00 0.00 -0.26 0.00 0.00 58.87 57.99 1uls n SER 151 Cb 0.58 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 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 0.41 0.00 0.07 7.33 0.00 -0.18 -2.30 120.51 125.84 1uls n ALA 153 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1uls n ALA 153 Cb 0.08 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.79 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 0.34 1.26 0.00 0.00 -1.49 -1.97 103.07 101.22 1uls h GLY 154 Ca 0.00 -0.28 -0.14 0.00 0.00 0.00 0.00 47.33 46.91 1uls h GLY 154 CO 0.00 0.25 -0.35 -2.08 0.00 0.00 0.00 176.54 174.37 1uls h VAL 155 N 0.28 1.28 -0.81 4.60 2.07 -1.73 0.14 116.25 122.08 1uls h VAL 155 Ca 0.04 -1.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.03 1uls h VAL 155 Cb 0.65 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.76 1uls h VAL 155 CO 0.05 0.50 0.42 0.58 0.02 0.00 0.00 177.57 179.14 1uls h VAL 156 N 0.68 1.24 -0.40 2.57 2.07 -1.77 0.54 116.25 121.18 1uls h VAL 156 Ca 0.07 -0.63 -0.15 0.00 0.82 0.00 0.00 66.70 66.81 1uls h VAL 156 Cb 0.90 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1uls h VAL 156 CO 0.08 0.28 -0.32 1.23 0.02 0.00 0.00 177.57 178.86 1uls h GLY 157 N 1.16 1.00 0.95 2.17 0.00 -0.97 -2.51 103.07 104.88 1uls h GLY 157 Ca 0.28 -0.99 -0.02 0.00 0.00 0.00 0.00 47.33 46.60 1uls h GLY 157 CO -0.04 0.89 0.17 -2.00 0.00 0.00 0.00 176.54 175.56 1uls h LEU 158 N 0.74 0.55 -0.42 3.11 5.85 -0.55 -2.23 115.31 122.37 1uls h LEU 158 Ca 0.07 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.66 1uls h LEU 158 Cb 0.91 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 1uls h LEU 158 CO 0.08 0.56 0.22 0.74 -0.34 0.00 0.00 178.44 179.71 1uls h THR 159 N 0.51 1.00 -0.45 1.05 2.02 -0.83 0.20 112.91 116.40 1uls h THR 159 Ca 0.13 -0.15 -0.05 0.00 0.77 0.00 0.00 66.41 67.11 1uls h THR 159 Cb 0.18 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1uls h THR 159 CO -0.01 0.08 0.06 0.03 0.37 0.00 0.00 175.52 176.05 1uls h ARG 160 N 0.45 0.70 -0.17 6.66 3.08 -1.33 0.90 114.38 124.68 1uls h ARG 160 Ca 0.17 -0.15 -0.11 0.00 0.07 0.00 0.00 59.98 59.96 1uls h ARG 160 Cb 0.06 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1uls h ARG 160 CO -0.11 0.68 -0.32 1.15 -1.07 0.00 0.00 179.97 180.30 1uls h THR 161 N 0.68 1.35 -0.28 2.04 2.02 -0.91 -2.66 112.91 115.15 1uls h THR 161 Ca 0.15 -1.56 -0.06 0.00 0.77 0.00 0.00 66.41 65.71 1uls h THR 161 Cb 0.32 1.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.66 1uls h THR 161 CO 0.01 0.47 -0.07 -0.07 0.37 0.00 0.00 175.52 176.23 1uls h LEU 162 N 0.15 0.43 -0.44 2.58 4.07 -0.36 -2.06 115.31 119.68 1uls h LEU 162 Ca 0.01 -0.09 -0.09 0.00 0.08 0.00 0.00 57.88 57.79 1uls h LEU 162 Cb 0.91 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.53 1uls h LEU 162 CO 0.07 0.54 -0.07 0.00 -1.08 0.00 0.00 178.44 177.91 1uls h ALA 163 N 1.51 0.60 -0.17 1.53 0.00 -0.78 -1.01 119.26 120.94 1uls h ALA 163 Ca 0.09 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1uls h ALA 163 Cb 0.39 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1uls h ALA 163 CO 0.02 0.46 0.05 -0.07 0.00 0.00 0.00 179.25 179.71 1uls h LEU 164 N 0.66 0.25 -1.10 0.00 3.38 -1.18 -1.07 115.31 116.25 1uls h LEU 164 Ca 0.12 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 1uls h LEU 164 Cb 0.59 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1uls h LEU 164 CO 0.04 0.39 -0.27 -0.33 0.09 0.00 0.00 178.44 178.36 1uls h GLU 165 N 0.09 0.30 0.00 1.13 5.08 -1.33 -3.27 114.58 116.58 1uls h GLU 165 Ca 0.05 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1uls h GLU 165 Cb 0.23 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1uls h GLU 165 CO -0.00 0.55 -0.94 1.28 -1.00 0.00 0.00 179.01 178.90 1uls n LEU 166 N -4.14 0.88 -0.18 1.33 4.77 -0.39 -4.61 117.00 114.66 1uls n LEU 166 Ca -0.01 -0.39 -0.12 0.00 -0.03 0.00 0.00 56.01 55.47 1uls n LEU 166 Cb 0.38 -0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.35 1uls n LEU 166 CO 0.40 0.22 0.52 1.23 -1.33 0.00 0.00 177.39 178.43 1uls h GLY 167 N 4.96 -0.80 1.56 -0.72 0.00 -1.24 0.73 103.07 107.57 1uls h GLY 167 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 47.33 48.00 1uls h GLY 167 CO 0.00 -0.12 0.16 -0.96 0.00 0.00 0.00 176.54 175.61 1uls n ARG 168 N -5.38 0.11 -0.42 4.80 1.85 -1.26 -0.56 116.66 115.79 1uls n ARG 168 Ca -0.01 0.59 0.10 0.00 -1.00 0.00 0.00 57.85 57.53 1uls n ARG 168 Cb 0.34 -2.00 0.32 0.00 -1.05 0.00 0.00 32.46 30.06 1uls n ARG 168 CO 0.00 0.00 0.00 0.91 -0.01 0.00 0.00 177.63 178.53 1uls n TRP 169 N -2.10 1.07 -1.14 2.89 7.02 0.24 -4.92 117.44 120.49 1uls n TRP 169 Ca -0.01 -0.49 -0.05 0.00 -1.02 0.00 0.00 57.50 55.93 1uls n TRP 169 Cb 0.18 -0.07 -0.02 0.00 -2.42 0.00 0.00 31.31 28.98 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 1.46 0.68 3.50 6.99 0.00 0.27 -4.41 105.19 113.68 1uls n GLY 170 Ca 0.24 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.87 4.85 0.12 -0.61 1.01 -1.15 -2.29 121.20 121.26 1uls s ILE 171 Ca 0.00 -0.17 -0.10 0.00 0.00 0.00 0.00 60.65 60.37 1uls s ILE 171 Cb 0.00 -3.39 -0.06 0.00 0.01 0.00 0.00 42.46 39.02 1uls s ILE 171 CO 0.00 0.16 0.45 -0.13 0.00 0.00 0.00 174.94 175.42 1uls s ARG 172 N 1.67 3.80 -0.06 2.79 0.52 -0.14 -3.84 118.95 123.70 1uls s ARG 172 Ca 0.06 0.24 -0.01 0.00 -0.52 0.00 0.00 55.73 55.49 1uls s ARG 172 Cb -0.16 -2.92 0.03 0.00 0.52 0.00 0.00 34.95 32.41 1uls s ARG 172 CO 0.08 0.50 0.02 0.08 0.02 0.00 0.00 175.30 176.00 1uls s VAL 173 N -1.49 0.23 0.15 3.52 1.01 -1.26 -0.24 120.40 122.33 1uls s VAL 173 Ca 0.37 0.20 0.03 0.00 0.00 0.00 0.00 61.98 62.57 1uls s VAL 173 Cb -0.14 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 1uls s VAL 173 CO 0.19 0.23 -0.04 0.20 0.00 0.00 0.00 175.10 175.68 1uls s ASN 174 N 1.96 1.37 -0.05 3.32 0.01 -0.29 0.40 114.94 121.67 1uls s ASN 174 Ca 0.04 -1.09 0.03 0.00 -0.71 0.00 0.00 52.86 51.13 1uls s ASN 174 Cb -0.12 0.07 0.00 0.00 0.41 0.00 0.00 41.25 41.62 1uls s ASN 174 CO -0.04 -0.48 -0.14 0.28 -1.51 0.00 0.00 177.10 175.21 1uls s THR 175 N -3.55 1.22 0.14 1.60 -1.32 0.51 -0.68 115.64 113.56 1uls s THR 175 Ca 0.19 -0.57 -0.14 0.00 -1.21 0.00 0.00 61.69 59.96 1uls s THR 175 Cb 0.05 -1.07 -0.07 0.00 -1.51 0.00 0.00 72.50 69.90 1uls s THR 175 CO 0.01 0.36 0.55 -0.76 -2.21 0.00 0.00 174.62 172.57 1uls s LEU 176 N 0.29 4.34 -0.57 9.08 1.43 -0.43 -0.33 118.68 132.50 1uls s LEU 176 Ca -0.08 1.08 0.05 0.00 -1.03 0.00 0.00 54.13 54.15 1uls s LEU 176 Cb -0.13 -3.25 0.19 0.00 0.03 0.00 0.00 46.19 43.03 1uls s LEU 176 CO 0.03 0.11 0.49 0.00 0.23 0.00 0.00 176.35 177.20 1uls n ALA 177 N 0.83 3.23 -1.37 4.21 0.00 0.13 0.43 120.51 127.96 1uls n ALA 177 Ca -0.05 -3.98 -0.33 0.00 0.00 0.00 0.00 53.44 49.08 1uls n ALA 177 Cb 0.52 -0.89 0.07 0.00 0.00 0.00 0.00 19.45 19.15 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 -1.10 2.42 0.00 0.00 0.04 -1.26 -1.67 135.00 133.43 1uls s PRO 178 Ca 0.31 1.44 0.00 0.00 0.04 0.00 0.00 61.00 62.79 1uls s PRO 178 Cb 0.04 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.68 1uls s PRO 178 CO -0.15 -1.55 0.00 0.41 0.04 0.00 0.00 177.00 175.75 1uls n GLY 179 N -0.39 0.83 3.52 0.56 0.00 -0.78 -0.66 105.19 108.27 1uls n GLY 179 Ca 0.11 0.00 -0.43 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 3.32 2.92 -0.20 1.61 5.36 -1.26 -4.89 117.98 124.83 1uls s PHE 180 Ca 0.00 -0.04 -0.02 0.00 -0.96 0.00 0.00 56.93 55.91 1uls s PHE 180 Cb 0.00 -3.81 0.00 0.00 -0.34 0.00 0.00 43.02 38.87 1uls s PHE 180 CO 0.00 -1.15 -0.11 0.42 -1.46 0.00 0.00 175.22 172.91 1uls s ILE 181 N 3.45 2.81 -0.08 3.12 -1.09 -1.26 -0.32 121.20 127.83 1uls s ILE 181 Ca 0.27 -0.69 -0.29 0.00 -2.23 0.00 0.00 60.65 57.71 1uls s ILE 181 Cb -0.14 -2.24 -0.06 0.00 -1.58 0.00 0.00 42.46 38.45 1uls s ILE 181 CO 0.19 0.48 1.78 -0.70 -1.23 0.00 0.00 174.94 175.46 1uls s GLU 182 N 1.33 3.98 0.36 2.79 2.56 -0.35 -4.83 118.70 124.55 1uls s GLU 182 Ca 0.04 2.16 -0.03 0.00 0.00 0.00 0.00 54.97 57.15 1uls s GLU 182 Cb -0.14 -4.08 0.01 0.00 2.00 0.00 0.00 34.13 31.92 1uls s GLU 182 CO -0.07 -1.10 0.52 0.95 -0.56 0.00 0.00 175.26 175.01 1uls s THR 183 N 4.83 0.00 0.00 -1.70 -4.23 -1.26 -4.45 115.64 108.83 1uls s THR 183 Ca 0.79 -1.54 -0.00 0.00 -1.18 0.00 0.00 61.69 59.76 1uls s THR 183 Cb -0.34 -2.72 -0.00 0.00 1.34 0.00 0.00 72.50 70.78 1uls s THR 183 CO 0.33 0.00 0.23 -1.14 -0.54 0.00 0.00 174.62 173.49 1uls n ARG 184 N -0.59 0.06 0.00 3.99 0.63 -1.26 -3.23 116.66 116.26 1uls n ARG 184 Ca 0.00 -0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1uls n ARG 184 Cb 0.61 -1.49 0.00 0.00 0.45 0.00 0.00 32.46 32.03 1uls n ARG 184 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 1uls n THR 186 N 2.20 0.00 0.18 5.15 -2.24 -1.26 -4.66 114.28 113.65 1uls n THR 186 Ca 0.00 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 1uls n THR 186 Cb 0.03 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.19 1uls n THR 186 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uls h ALA 187 N 0.00 -0.51 0.00 6.98 0.00 -1.97 -2.33 119.26 121.42 1uls h ALA 187 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1uls h ALA 187 Cb 0.00 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1uls h ALA 187 CO 0.00 -0.82 0.00 1.63 0.00 0.00 0.00 179.25 180.06 1uls n LYS 188 N -5.37 0.63 -2.07 0.00 4.01 -1.26 -4.80 118.16 109.31 1uls n LYS 188 Ca -0.09 0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.29 1uls n LYS 188 Cb 0.28 -1.11 -0.03 0.00 -0.51 0.00 0.00 35.03 33.66 1uls n LYS 188 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1uls s VAL 189 N -2.00 3.55 0.07 -0.18 1.01 -0.88 -4.92 120.40 117.05 1uls s VAL 189 Ca 0.07 0.80 -0.35 0.00 0.00 0.00 0.00 61.98 62.50 1uls s VAL 189 Cb 0.03 -3.52 -0.14 0.00 0.00 0.00 0.00 36.38 32.75 1uls s VAL 189 CO 0.05 -0.04 1.58 -0.81 0.00 0.00 0.00 175.10 175.88 1uls n PRO 190 N 6.40 1.85 -0.25 2.72 -0.04 -1.26 -4.73 135.00 139.68 1uls n PRO 190 Ca 0.16 0.67 0.05 0.00 -0.04 0.00 0.00 63.50 64.34 1uls n PRO 190 Cb 0.43 -2.42 0.16 0.00 -0.04 0.00 0.00 33.50 31.63 1uls n PRO 190 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1uls h GLU 191 N 6.21 0.10 -0.68 0.54 4.39 -1.95 0.39 114.58 123.57 1uls h GLU 191 Ca -0.46 -0.01 0.15 0.00 0.34 0.00 0.00 59.36 59.38 1uls h GLU 191 Cb 1.28 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.87 1uls h GLU 191 CO 0.88 0.07 0.47 0.87 -1.16 0.00 0.00 179.01 180.13 1uls h LYS 192 N 0.11 0.27 0.18 2.33 6.56 -1.99 0.20 116.57 124.23 1uls h LYS 192 Ca 0.41 -0.02 -0.28 0.00 -1.06 0.00 0.00 60.65 59.70 1uls h LYS 192 Cb 0.72 -0.06 0.03 0.00 -0.57 0.00 0.00 32.23 32.35 1uls h LYS 192 CO -0.65 0.18 -1.22 0.28 -2.06 0.00 0.00 179.45 175.98 1uls h VAL 193 N 0.27 1.34 -0.91 0.50 2.07 -0.69 -3.05 116.25 115.78 1uls h VAL 193 Ca 0.33 -2.57 0.01 0.00 0.82 0.00 0.00 66.70 65.30 1uls h VAL 193 Cb 0.92 2.97 -0.05 0.00 -1.52 0.00 0.00 31.29 33.61 1uls h VAL 193 CO -0.08 0.76 0.61 -0.09 0.02 0.00 0.00 177.57 178.79 1uls h ARG 194 N 0.04 1.19 0.00 1.57 2.43 0.78 -0.74 114.38 119.65 1uls h ARG 194 Ca -0.20 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1uls h ARG 194 Cb 1.94 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 31.22 1uls h ARG 194 CO 0.23 0.79 0.00 0.93 -1.51 0.00 0.00 179.97 180.41 1uls h GLU 195 N 1.22 0.00 0.05 0.20 5.08 -0.76 -2.39 114.58 117.99 1uls h GLU 195 Ca 0.34 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.41 1uls h GLU 195 Cb -0.11 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 1uls h GLU 195 CO -0.08 0.00 -1.57 -0.22 -1.00 0.00 0.00 179.01 176.14 1uls h LYS 196 N 0.00 0.11 -0.08 2.33 1.63 -1.08 -2.89 116.57 116.60 1uls h LYS 196 Ca 0.00 -0.20 -0.03 0.00 -0.85 0.00 0.00 60.65 59.57 1uls h LYS 196 Cb 0.66 0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 32.36 1uls h LYS 196 CO 0.00 0.87 -0.07 0.00 -3.45 0.00 0.00 179.45 176.80 1uls h ALA 197 N 0.72 0.11 -0.52 5.00 0.00 -1.08 -2.69 119.26 120.80 1uls h ALA 197 Ca -0.24 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1uls h ALA 197 Cb 1.98 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.72 1uls h ALA 197 CO 0.12 -0.09 0.28 0.82 0.00 0.00 0.00 179.25 180.38 1uls h ILE 198 N -0.24 1.16 0.00 0.00 2.04 -1.57 -0.94 117.51 117.97 1uls h ILE 198 Ca 0.01 -0.40 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 1uls h ILE 198 Cb 0.57 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1uls h ILE 198 CO 0.02 0.18 -0.18 0.00 0.00 0.00 0.00 178.15 178.17 1uls h ALA 199 N 1.60 1.49 -0.18 1.87 0.00 -1.38 -1.23 119.26 121.43 1uls h ALA 199 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1uls h ALA 199 Cb 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1uls h ALA 199 CO -0.03 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.44 1uls n ALA 200 N -2.41 2.51 -3.18 0.00 0.00 -0.38 -4.79 120.51 112.26 1uls n ALA 200 Ca -0.02 -0.59 -0.39 0.00 0.00 0.00 0.00 53.44 52.44 1uls n ALA 200 Cb 0.26 -1.05 -0.11 0.00 0.00 0.00 0.00 19.45 18.54 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 -1.77 4.07 0.41 0.00 2.01 -0.46 -4.30 115.64 115.59 1uls s THR 201 Ca 0.33 -1.19 0.21 0.00 0.31 0.00 0.00 61.69 61.35 1uls s THR 201 Cb 0.19 -3.37 0.41 0.00 0.01 0.00 0.00 72.50 69.73 1uls s THR 201 CO 0.28 -0.31 1.75 -0.65 -0.69 0.00 0.00 174.62 174.99 1uls h PRO 202 N 8.32 0.32 0.00 4.92 0.11 -1.77 1.17 132.00 145.07 1uls h PRO 202 Ca -0.23 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1uls h PRO 202 Cb 1.09 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1uls h PRO 202 CO 0.67 0.21 0.00 1.28 -0.21 0.00 0.00 178.00 179.95 1uls n LEU 203 N -4.64 0.00 -3.79 2.35 4.77 -1.03 -4.91 117.00 109.76 1uls n LEU 203 Ca 0.27 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.96 1uls n LEU 203 Cb 0.98 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.05 1uls n LEU 203 CO 0.25 0.00 -0.04 0.61 -1.33 0.00 0.00 177.39 176.88 1uls n GLY 204 N 0.47 -0.46 3.67 -0.72 0.00 0.40 -4.93 105.19 103.61 1uls n GLY 204 Ca 0.12 0.10 -0.06 0.00 0.00 0.00 0.00 46.02 46.18 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 -6.45 1.21 0.53 1.61 1.70 -1.26 -5.00 118.95 111.29 1uls s ARG 205 Ca 0.56 -0.60 -0.14 0.00 -0.47 0.00 0.00 55.73 55.09 1uls s ARG 205 Cb -0.31 0.46 -0.06 0.00 -0.57 0.00 0.00 34.95 34.47 1uls s ARG 205 CO 0.69 -0.55 0.97 0.00 -1.08 0.00 0.00 175.30 175.33 1uls s ALA 206 N -3.41 3.12 0.50 7.88 0.00 -1.26 -4.91 121.76 123.68 1uls s ALA 206 Ca 0.09 0.03 -0.03 0.00 0.00 0.00 0.00 51.96 52.05 1uls s ALA 206 Cb -0.02 -3.04 -0.00 0.00 0.00 0.00 0.00 23.12 20.05 1uls s ALA 206 CO -0.02 -0.35 0.77 0.20 0.00 0.00 0.00 175.76 176.35 1uls s GLY 207 N -3.46 1.57 0.02 0.00 0.00 0.57 -4.88 107.32 101.13 1uls s GLY 207 Ca 0.56 -0.85 0.04 0.00 0.00 0.00 0.00 44.72 44.47 1uls s GLY 207 CO 0.39 -0.65 -0.06 0.54 0.00 0.00 0.00 173.10 173.32 1uls s LYS 208 N -4.73 2.52 0.31 2.90 1.02 -1.26 -1.21 119.74 119.29 1uls s LYS 208 Ca 0.50 -0.75 0.06 0.00 0.02 0.00 0.00 55.97 55.80 1uls s LYS 208 Cb -0.10 -2.49 0.73 0.00 -0.52 0.00 0.00 37.83 35.44 1uls s LYS 208 CO 0.41 0.59 1.81 -1.00 -0.92 0.00 0.00 175.35 176.25 1uls h PRO 209 N 4.38 0.77 -0.98 -1.68 0.13 -1.93 -0.69 132.00 132.00 1uls h PRO 209 Ca -0.48 -0.05 0.14 0.00 -0.87 0.00 0.00 66.00 64.74 1uls h PRO 209 Cb 1.17 -0.17 -0.09 0.00 0.13 0.00 0.00 31.00 32.04 1uls h PRO 209 CO 0.54 0.51 0.62 1.25 -0.23 0.00 0.00 178.00 180.69 1uls h LEU 210 N 0.79 0.84 -1.32 1.56 6.46 -1.92 0.12 115.31 121.84 1uls h LEU 210 Ca 0.53 0.06 -0.04 0.00 -0.12 0.00 0.00 57.88 58.31 1uls h LEU 210 Cb 0.79 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.59 1uls h LEU 210 CO -0.31 0.41 0.06 -0.33 -0.62 0.00 0.00 178.44 177.66 1uls h GLU 211 N 0.88 0.52 -0.13 1.25 5.08 -1.54 0.06 114.58 120.70 1uls h GLU 211 Ca 0.50 -0.09 -0.21 0.00 -1.00 0.00 0.00 59.36 58.56 1uls h GLU 211 Cb 0.63 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.80 1uls h GLU 211 CO -0.27 0.50 -0.77 0.28 -1.00 0.00 0.00 179.01 177.75 1uls h VAL 212 N 0.51 1.30 -0.66 3.13 2.07 -0.77 -3.00 116.25 118.84 1uls h VAL 212 Ca 0.12 -2.02 0.01 0.00 0.82 0.00 0.00 66.70 65.63 1uls h VAL 212 Cb 0.24 2.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.99 1uls h VAL 212 CO 0.00 0.63 0.44 0.00 0.02 0.00 0.00 177.57 178.66 1uls h ALA 213 N 0.66 0.84 -0.77 1.67 0.00 -0.19 -1.59 119.26 119.89 1uls h ALA 213 Ca -0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1uls h ALA 213 Cb 1.38 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 1uls h ALA 213 CO 0.15 0.26 0.45 1.88 0.00 0.00 0.00 179.25 181.98 1uls h TYR 214 N 0.89 1.01 -0.67 0.00 -1.99 -0.98 0.18 116.97 115.42 1uls h TYR 214 Ca 0.25 -0.01 -0.03 0.00 2.00 0.00 0.00 58.73 60.94 1uls h TYR 214 Cb -0.09 -0.33 -0.03 0.00 2.00 0.00 0.00 36.73 38.28 1uls h TYR 214 CO -0.03 0.68 0.30 0.00 -0.00 0.00 0.00 178.16 179.12 1uls h ALA 215 N 1.43 0.86 -0.52 3.88 0.00 -1.23 -1.41 119.26 122.28 1uls h ALA 215 Ca 0.27 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1uls h ALA 215 Cb -0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1uls h ALA 215 CO -0.05 0.44 0.22 0.00 0.00 0.00 0.00 179.25 179.86 1uls h ALA 216 N 1.14 0.67 -0.17 0.00 0.00 -0.33 -2.20 119.26 118.38 1uls h ALA 216 Ca 0.23 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1uls h ALA 216 Cb 0.15 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 1uls h ALA 216 CO -0.03 0.27 -0.22 1.25 0.00 0.00 0.00 179.25 180.52 1uls h LEU 217 N 0.70 -0.70 0.07 0.00 6.46 -0.12 0.16 115.31 121.88 1uls h LEU 217 Ca 0.17 0.12 0.03 0.00 -0.12 0.00 0.00 57.88 58.08 1uls h LEU 217 Cb 0.18 0.32 -0.05 0.00 -0.73 0.00 0.00 40.66 40.38 1uls h LEU 217 CO -0.02 -0.27 -0.36 0.15 -0.62 0.00 0.00 178.44 177.33 1uls h PHE 218 N -0.26 -0.99 -0.14 1.25 3.57 -1.02 0.11 116.94 119.46 1uls h PHE 218 Ca 0.11 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 1uls h PHE 218 Cb 0.43 0.43 -0.01 0.00 2.79 0.00 0.00 35.95 39.59 1uls h PHE 218 CO -0.35 -0.46 -0.02 -0.07 -2.23 0.00 0.00 178.31 175.19 1uls h LEU 219 N -0.55 0.18 0.07 0.59 3.38 -1.03 -3.08 115.31 114.87 1uls h LEU 219 Ca 0.04 -0.02 -0.28 0.00 0.09 0.00 0.00 57.88 57.71 1uls h LEU 219 Cb 0.61 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1uls h LEU 219 CO -0.24 0.24 -1.45 0.25 0.09 0.00 0.00 178.44 177.33 1uls h LEU 220 N 0.20 0.25-10.34 1.67 6.46 -0.54 -3.45 115.31 109.55 1uls h LEU 220 Ca 0.05 -0.34 -0.51 0.00 -0.12 0.00 0.00 57.88 56.96 1uls h LEU 220 Cb 0.18 -0.08 0.11 0.00 -0.73 0.00 0.00 40.66 40.14 1uls h LEU 220 CO 0.01 1.29 0.34 -0.94 -0.62 0.00 0.00 178.44 178.51 1uls s SER 221 N -6.78 4.75 0.00 1.25 1.04 0.35 -4.74 113.70 109.56 1uls s SER 221 Ca -0.06 1.60 0.06 0.00 0.48 0.00 0.00 55.95 58.03 1uls s SER 221 Cb 0.08 -2.38 0.30 0.00 0.10 0.00 0.00 66.02 64.12 1uls s SER 221 CO 0.84 -1.85 1.06 0.47 0.98 0.00 0.00 173.24 174.75 1uls n ASP 222 N -3.38 0.00 0.27 7.02 8.00 -1.26 -2.54 116.55 124.65 1uls n ASP 222 Ca 0.08 0.24 0.15 0.00 0.71 0.00 0.00 54.79 55.96 1uls n ASP 222 Cb 0.54 -0.31 0.68 0.00 -0.02 0.00 0.00 41.12 42.01 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 -0.47 -1.24 5.08 -1.91 -2.40 114.58 113.64 1uls h GLU 223 Ca 0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.13 1uls h GLU 223 Cb 0.06 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.18 1uls h GLU 223 CO 0.00 0.09 0.06 -1.13 -1.00 0.00 0.00 179.01 177.03 1uls n SER 224 N -3.29 2.85 0.17 1.42 3.41 -1.05 -4.76 113.62 112.37 1uls n SER 224 Ca -0.00 -3.68 0.18 0.00 -0.26 0.00 0.00 58.87 55.11 1uls n SER 224 Cb 0.30 -0.67 0.76 0.00 -0.26 0.00 0.00 64.21 64.34 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 1.10 0.00 -0.40 4.04 4.64 -1.61 0.16 113.55 121.48 1uls h SER 225 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1uls h SER 225 Cb 1.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.96 1uls h SER 225 CO 0.51 0.00 0.00 0.33 -0.87 0.00 0.00 176.83 176.80 1uls n PHE 226 N -3.42 1.12 -4.00 4.77 7.35 -1.26 -4.92 117.46 117.10 1uls n PHE 226 Ca 0.04 -0.73 -0.34 0.00 -0.76 0.00 0.00 57.45 55.66 1uls n PHE 226 Cb 0.55 -0.28 -0.15 0.00 0.35 0.00 0.00 39.48 39.96 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 -2.28 2.69 0.05 -2.13 1.01 0.56 -5.10 121.20 116.00 1uls s ILE 227 Ca 0.42 -0.90 -0.14 0.00 0.00 0.00 0.00 60.65 60.03 1uls s ILE 227 Cb 0.31 -2.28 0.02 0.00 0.01 0.00 0.00 42.46 40.52 1uls s ILE 227 CO 0.14 0.35 0.31 0.28 0.00 0.00 0.00 174.94 176.02 1uls s THR 228 N 1.34 0.08 -0.95 2.92 -1.32 -1.26 -4.75 115.64 111.69 1uls s THR 228 Ca 0.03 -0.68 0.00 0.00 -1.21 0.00 0.00 61.69 59.82 1uls s THR 228 Cb -0.15 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 69.88 1uls s THR 228 CO -0.07 -0.38 0.00 0.61 -2.21 0.00 0.00 174.62 172.57 1uls n GLY 229 N 0.52 0.94 3.91 6.08 0.00 0.16 -4.95 105.19 111.85 1uls n GLY 229 Ca -0.18 -0.60 -0.21 0.00 0.00 0.00 0.00 46.02 45.03 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 -3.02 3.08 -0.22 1.61 -1.52 -1.26 -4.75 119.66 113.58 1uls s GLN 230 Ca 0.00 -1.01 0.01 0.00 -1.95 0.00 0.00 55.36 52.41 1uls s GLN 230 Cb 0.00 -2.70 0.03 0.00 -0.22 0.00 0.00 33.01 30.13 1uls s GLN 230 CO 0.00 0.28 -0.15 0.08 -0.25 0.00 0.00 175.29 175.25 1uls s VAL 231 N -2.13 2.21 -0.35 1.09 1.01 -1.26 -0.36 120.40 120.61 1uls s VAL 231 Ca 0.37 -1.18 -0.08 0.00 0.00 0.00 0.00 61.98 61.09 1uls s VAL 231 Cb -0.08 -2.08 0.03 0.00 0.00 0.00 0.00 36.38 34.25 1uls s VAL 231 CO 0.28 0.31 0.15 -0.22 0.00 0.00 0.00 175.10 175.61 1uls s LEU 232 N 1.23 4.47 -0.07 3.92 2.96 0.55 -4.94 118.68 126.80 1uls s LEU 232 Ca -0.00 -1.07 -0.29 0.00 -0.22 0.00 0.00 54.13 52.55 1uls s LEU 232 Cb -0.16 -1.93 -0.02 0.00 0.50 0.00 0.00 46.19 44.58 1uls s LEU 232 CO -0.09 -0.35 0.95 -0.36 -1.32 0.00 0.00 176.35 175.18 1uls s PHE 233 N 1.47 3.56 -0.65 5.38 0.40 -1.26 0.22 117.98 127.10 1uls s PHE 233 Ca -0.00 1.56 0.06 0.00 -0.60 0.00 0.00 56.93 57.94 1uls s PHE 233 Cb -0.19 -3.11 0.22 0.00 0.51 0.00 0.00 43.02 40.44 1uls s PHE 233 CO 0.04 -0.13 0.62 0.28 0.70 0.00 0.00 175.22 176.74 1uls n VAL 234 N 4.29 1.81 -1.29 -0.44 0.31 -0.67 -4.83 118.33 117.49 1uls n VAL 234 Ca 0.06 -4.96 0.02 0.00 -0.01 0.00 0.00 64.34 59.46 1uls n VAL 234 Cb 0.50 -2.11 0.03 0.00 -0.91 0.00 0.00 33.84 31.35 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 1.38 0.84 -1.37 4.52 3.85 -1.26 -1.86 116.55 122.64 1uls n ASP 235 Ca 0.26 -2.05 -0.17 0.00 -0.71 0.00 0.00 54.79 52.12 1uls n ASP 235 Cb 0.40 -0.19 -0.06 0.00 -1.35 0.00 0.00 41.12 39.91 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 -0.42 1.44 1.37 6.12 0.00 -1.26 -2.25 105.19 110.19 1uls n GLY 236 Ca 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.91 0.71 0.34 -0.02 0.00 -1.26 -2.45 105.19 101.59 1uls n GLY 237 Ca -0.17 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.04 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 2.41 0.00 -0.29 1.61 9.65 -1.64 -2.36 114.38 123.76 1uls h ARG 238 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1uls h ARG 238 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1uls h ARG 238 CO 0.00 0.00 0.00 -2.37 2.80 0.00 0.00 179.97 180.40 1uls n THR 239 N -3.07 1.23 -0.04 0.20 5.66 -1.26 -4.49 114.28 112.51 1uls n THR 239 Ca -0.02 -1.17 -0.06 0.00 -3.05 0.00 0.00 64.05 59.76 1uls n THR 239 Cb 0.23 0.36 0.15 0.00 -1.55 0.00 0.00 70.33 69.51 1uls n THR 239 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 1uls h ILE 240 N 1.73 1.27 -3.44 1.09 2.04 -1.80 -3.44 117.51 114.95 1uls h ILE 240 Ca 0.00 -1.29 -0.32 0.00 1.00 0.00 0.00 64.86 64.24 1uls h ILE 240 Cb 0.83 1.27 -0.15 0.00 -0.74 0.00 0.00 36.82 38.03 1uls h ILE 240 CO 0.04 0.42 -0.70 -0.83 0.00 0.00 0.00 178.15 177.08 1uls s GLY 241 N -3.92 1.13 0.35 5.37 0.00 -1.26 -5.13 107.32 103.86 1uls s GLY 241 Ca -0.08 -1.53 -0.26 0.00 0.00 0.00 0.00 44.72 42.84 1uls s GLY 241 CO 0.81 -1.59 1.08 0.00 0.00 0.00 0.00 173.10 173.41 1uls s ALA 242 N -3.40 3.22 -0.07 3.20 0.00 -1.26 -4.97 121.76 118.49 1uls s ALA 242 Ca 0.19 0.81 -0.14 0.00 0.00 0.00 0.00 51.96 52.81 1uls s ALA 242 Cb 0.04 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.80 1uls s ALA 242 CO 0.02 -0.22 0.37 0.00 0.00 0.00 0.00 175.76 175.93 1uls s ALA 243 N -1.43 3.65 0.71 0.00 0.00 -1.26 -5.09 121.76 118.34 1uls s ALA 243 Ca 0.52 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1uls s ALA 243 Cb -0.27 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.45 1uls s ALA 243 CO 0.34 0.32 0.00 -0.35 0.00 0.00 0.00 175.76 176.07 1uls n PRO 244 N 2.56 2.10 -0.75 0.00 -0.04 -1.26 -5.14 135.00 132.47 1uls n PRO 244 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 1uls n PRO 244 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1uls n PRO 244 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46