#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d1y h LEU 3 N 0.00 0.00 -2.84 0.99 3.38 -1.96 -2.54 115.31 112.35 2d1y h LEU 3 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2d1y h LEU 3 Cb 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 2d1y h LEU 3 CO 0.00 0.00 -0.40 0.49 0.09 0.00 0.00 178.44 178.62 2d1y n PHE 4 N -3.71 0.00 -1.68 1.13 3.72 -0.99 -4.87 117.46 111.07 2d1y n PHE 4 Ca -0.01 -0.93 -0.49 0.00 -0.05 0.00 0.00 57.45 55.97 2d1y n PHE 4 Cb 0.20 -0.17 -0.05 0.00 -0.94 0.00 0.00 39.48 38.52 2d1y n PHE 4 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2d1y n ALA 5 N -0.81 0.81 -0.89 4.37 0.00 -0.96 -1.05 120.51 121.98 2d1y n ALA 5 Ca 0.13 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2d1y n ALA 5 Cb 0.74 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.79 2d1y n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d1y n GLY 6 N 4.00 0.73 3.80 0.00 0.00 -0.83 -4.88 105.19 108.00 2d1y n GLY 6 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 2d1y n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d1y s LYS 7 N -0.26 4.36 -0.19 1.61 -0.14 -0.21 -4.81 119.74 120.11 2d1y s LYS 7 Ca 0.00 0.92 -0.22 0.00 -1.36 0.00 0.00 55.97 55.30 2d1y s LYS 7 Cb 0.00 -3.25 -0.02 0.00 -1.68 0.00 0.00 37.83 32.88 2d1y s LYS 7 CO 0.00 0.61 0.71 0.20 -0.76 0.00 0.00 175.35 176.11 2d1y s GLY 8 N -1.13 2.07 -0.09 -3.33 0.00 -1.26 -0.69 107.32 102.90 2d1y s GLY 8 Ca 0.32 -0.15 0.03 0.00 0.00 0.00 0.00 44.72 44.91 2d1y s GLY 8 CO 0.22 1.44 -0.17 0.14 0.00 0.00 0.00 173.10 174.73 2d1y s VAL 9 N 1.99 1.58 -0.19 1.40 1.01 -0.35 -0.20 120.40 125.64 2d1y s VAL 9 Ca 0.32 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.50 2d1y s VAL 9 Cb -0.16 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 2d1y s VAL 9 CO 0.11 0.46 0.07 -0.76 0.00 0.00 0.00 175.10 174.98 2d1y s LEU 10 N 0.68 3.83 -0.11 3.92 1.43 0.09 -0.84 118.68 127.68 2d1y s LEU 10 Ca -0.13 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 2d1y s LEU 10 Cb -0.16 -1.98 0.02 0.00 0.03 0.00 0.00 46.19 44.10 2d1y s LEU 10 CO 0.03 0.16 -0.10 -0.69 0.23 0.00 0.00 176.35 175.98 2d1y s VAL 11 N 0.48 1.19 0.17 -1.59 1.01 -0.39 -0.45 120.40 120.82 2d1y s VAL 11 Ca 0.04 -0.41 -0.12 0.00 0.00 0.00 0.00 61.98 61.48 2d1y s VAL 11 Cb -0.12 -1.16 -0.07 0.00 0.00 0.00 0.00 36.38 35.02 2d1y s VAL 11 CO 0.01 0.39 0.54 0.42 0.00 0.00 0.00 175.10 176.46 2d1y s THR 12 N 1.48 4.90 -1.14 3.92 -4.23 -0.93 -1.88 115.64 117.75 2d1y s THR 12 Ca 0.02 0.68 -0.04 0.00 -1.18 0.00 0.00 61.69 61.16 2d1y s THR 12 Cb -0.13 -3.69 0.00 0.00 1.34 0.00 0.00 72.50 70.03 2d1y s THR 12 CO -0.07 0.13 0.98 0.61 -0.54 0.00 0.00 174.62 175.73 2d1y n GLY 13 N 0.46 -0.33 0.69 3.99 0.00 0.28 -2.67 105.19 107.61 2d1y n GLY 13 Ca -0.03 0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.17 2d1y n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d1y n GLY 14 N -1.52 0.70 0.19 -0.02 0.00 -0.78 -4.06 105.19 99.70 2d1y n GLY 14 Ca -0.11 -0.44 0.01 0.00 0.00 0.00 0.00 46.02 45.48 2d1y n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d1y h ALA 15 N 3.87 1.29 -3.23 4.61 0.00 -1.89 -3.21 119.26 120.70 2d1y h ALA 15 Ca 0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.43 2d1y h ALA 15 Cb 0.54 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2d1y h ALA 15 CO 0.00 0.52 0.09 2.89 0.00 0.00 0.00 179.25 182.75 2d1y n ARG 16 N -4.06 0.82 0.00 0.00 1.85 -1.26 -4.66 116.66 109.35 2d1y n ARG 16 Ca -0.02 -2.09 0.00 0.00 -1.00 0.00 0.00 57.85 54.74 2d1y n ARG 16 Cb 0.44 2.34 0.00 0.00 -1.05 0.00 0.00 32.46 34.19 2d1y n ARG 16 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2d1y n GLY 17 N -0.47 2.22 0.37 2.89 0.00 -1.26 -2.17 105.19 106.77 2d1y n GLY 17 Ca -0.04 -0.37 -0.02 0.00 0.00 0.00 0.00 46.02 45.59 2d1y n GLY 17 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2d1y h ILE 18 N 0.00 1.24 -0.74 -0.61 2.04 -1.91 -2.08 117.51 115.45 2d1y h ILE 18 Ca 0.00 -0.48 0.02 0.00 1.00 0.00 0.00 64.86 65.39 2d1y h ILE 18 Cb 0.00 -0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 35.97 2d1y h ILE 18 CO 0.00 0.24 0.48 1.23 0.00 0.00 0.00 178.15 180.11 2d1y h GLY 19 N 1.25 1.06 0.99 5.37 0.00 -1.67 0.13 103.07 110.19 2d1y h GLY 19 Ca 0.33 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 47.24 2d1y h GLY 19 CO -0.07 0.35 0.16 -0.09 0.00 0.00 0.00 176.54 176.89 2d1y h ARG 20 N 0.97 0.83 -0.61 4.80 2.43 -0.96 -0.77 114.38 121.07 2d1y h ARG 20 Ca 0.28 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.23 2d1y h ARG 20 Cb -0.06 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.34 2d1y h ARG 20 CO -0.08 0.77 0.22 0.00 -1.51 0.00 0.00 179.97 179.37 2d1y h ALA 21 N 1.02 1.24 -0.19 2.80 0.00 -0.73 -0.97 119.26 122.44 2d1y h ALA 21 Ca 0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2d1y h ALA 21 Cb 0.30 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2d1y h ALA 21 CO -0.00 0.55 -0.01 0.82 0.00 0.00 0.00 179.25 180.61 2d1y h ILE 22 N 0.88 1.26 -0.48 0.00 2.04 -0.36 -0.99 117.51 119.85 2d1y h ILE 22 Ca 0.20 -0.88 0.01 0.00 1.00 0.00 0.00 64.86 65.19 2d1y h ILE 22 Cb 0.21 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 2d1y h ILE 22 CO -0.01 0.27 0.30 0.00 0.00 0.00 0.00 178.15 178.70 2d1y h ALA 23 N 0.78 0.62 -0.88 1.87 0.00 -0.85 -1.35 119.26 119.45 2d1y h ALA 23 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2d1y h ALA 23 Cb 0.40 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2d1y h ALA 23 CO 0.01 0.01 0.46 1.96 0.00 0.00 0.00 179.25 181.70 2d1y h GLN 24 N 0.61 1.24 -0.40 0.00 4.20 -1.10 -1.87 115.11 117.79 2d1y h GLN 24 Ca 0.19 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 2d1y h GLN 24 Cb -0.02 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.51 2d1y h GLN 24 CO -0.07 0.92 0.11 0.00 -0.67 0.00 0.00 178.83 179.12 2d1y h ALA 25 N 1.27 0.52 -0.48 3.87 0.00 -0.60 0.13 119.26 123.97 2d1y h ALA 25 Ca 0.31 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 2d1y h ALA 25 Cb 0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2d1y h ALA 25 CO -0.05 0.18 0.08 0.74 0.00 0.00 0.00 179.25 180.21 2d1y h PHE 26 N 0.50 0.85 -0.83 0.00 0.04 -1.11 -1.93 116.94 114.46 2d1y h PHE 26 Ca 0.13 -0.12 -0.01 0.00 2.80 0.00 0.00 57.97 60.77 2d1y h PHE 26 Cb 0.29 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 38.16 2d1y h PHE 26 CO 0.01 0.78 0.46 0.00 -0.60 0.00 0.00 178.31 178.96 2d1y h ALA 27 N 0.97 1.06 0.00 2.45 0.00 -1.20 -0.39 119.26 122.14 2d1y h ALA 27 Ca 0.15 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2d1y h ALA 27 Cb 0.38 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2d1y h ALA 27 CO 0.01 0.56 -0.02 -0.09 0.00 0.00 0.00 179.25 179.71 2d1y h ARG 28 N 1.15 0.00 -0.58 0.00 2.43 -0.57 -0.50 114.38 116.31 2d1y h ARG 28 Ca 0.29 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 2d1y h ARG 28 Cb 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2d1y h ARG 28 CO -0.05 0.02 0.00 0.39 -1.51 0.00 0.00 179.97 178.82 2d1y n GLU 29 N -4.01 2.69 -0.60 0.20 -0.58 -0.26 -4.85 120.64 113.24 2d1y n GLU 29 Ca -0.03 -2.01 0.00 0.00 -0.42 0.00 0.00 57.16 54.70 2d1y n GLU 29 Cb 0.10 -1.60 0.00 0.00 -0.57 0.00 0.00 31.44 29.37 2d1y n GLU 29 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2d1y n GLY 30 N 1.08 0.73 3.83 0.62 0.00 -0.19 -0.60 105.19 110.66 2d1y n GLY 30 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 2d1y n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d1y s ALA 31 N -2.33 2.89 -0.43 4.61 0.00 -0.61 -1.97 121.76 123.92 2d1y s ALA 31 Ca 0.00 0.14 -0.17 0.00 0.00 0.00 0.00 51.96 51.93 2d1y s ALA 31 Cb 0.00 -3.15 0.03 0.00 0.00 0.00 0.00 23.12 20.00 2d1y s ALA 31 CO 0.00 -0.75 0.43 -0.51 0.00 0.00 0.00 175.76 174.93 2d1y s LEU 32 N -4.84 5.00 -0.17 0.00 1.02 0.14 -4.47 118.68 115.36 2d1y s LEU 32 Ca 0.59 -0.81 -0.08 0.00 0.02 0.00 0.00 54.13 53.85 2d1y s LEU 32 Cb -0.13 -2.33 -0.05 0.00 0.02 0.00 0.00 46.19 43.70 2d1y s LEU 32 CO 0.44 -0.60 0.12 -0.69 0.02 0.00 0.00 176.35 175.65 2d1y s VAL 33 N 2.05 5.34 -0.19 -1.59 1.01 -1.26 -1.21 120.40 124.56 2d1y s VAL 33 Ca 0.10 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.25 2d1y s VAL 33 Cb -0.18 -3.39 0.03 0.00 0.00 0.00 0.00 36.38 32.84 2d1y s VAL 33 CO 0.12 0.51 -0.15 0.00 0.00 0.00 0.00 175.10 175.58 2d1y s ALA 34 N -0.16 2.19 0.16 5.51 0.00 -0.02 -0.10 121.76 129.34 2d1y s ALA 34 Ca 0.10 -1.23 0.11 0.00 0.00 0.00 0.00 51.96 50.94 2d1y s ALA 34 Cb -0.11 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.73 2d1y s ALA 34 CO 0.00 -0.58 -0.24 -0.48 0.00 0.00 0.00 175.76 174.46 2d1y s LEU 35 N 1.33 2.38 0.20 0.00 2.34 -0.09 -1.26 118.68 123.58 2d1y s LEU 35 Ca 0.02 -0.81 0.05 0.00 0.06 0.00 0.00 54.13 53.45 2d1y s LEU 35 Cb -0.15 -1.13 -0.05 0.00 -0.56 0.00 0.00 46.19 44.30 2d1y s LEU 35 CO -0.10 0.12 -0.06 0.00 -1.06 0.00 0.00 176.35 175.25 2d1y s ASP 37 N -3.28 -0.13 0.22 0.00 -1.08 -1.03 -0.56 116.67 110.82 2d1y s ASP 37 Ca 0.24 0.02 0.17 0.00 -0.52 0.00 0.00 52.55 52.46 2d1y s ASP 37 Cb 0.03 0.13 0.03 0.00 -1.46 0.00 0.00 42.92 41.65 2d1y s ASP 37 CO 0.06 -0.20 1.23 0.25 0.52 0.00 0.00 175.17 177.02 2d1y h LEU 38 N 2.03 0.00 -9.22 -1.34 5.85 -1.85 -1.07 115.31 109.72 2d1y h LEU 38 Ca -0.09 0.00 -0.56 0.00 0.84 0.00 0.00 57.88 58.07 2d1y h LEU 38 Cb 1.16 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.15 2d1y h LEU 38 CO 0.23 0.41 0.69 -0.13 -0.34 0.00 0.00 178.44 179.29 2d1y s ARG 39 N -3.03 4.35 0.60 1.25 0.52 -1.26 -4.83 118.95 116.55 2d1y s ARG 39 Ca 0.02 1.47 0.31 0.00 -0.52 0.00 0.00 55.73 57.01 2d1y s ARG 39 Cb 0.08 -3.59 1.87 0.00 0.52 0.00 0.00 34.95 33.82 2d1y s ARG 39 CO 0.76 -0.46 2.24 -1.00 0.02 0.00 0.00 175.30 176.87 2d1y h PRO 40 N 7.37 0.00 0.00 3.54 0.13 -2.00 -2.60 132.00 138.44 2d1y h PRO 40 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2d1y h PRO 40 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2d1y h PRO 40 CO 0.90 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.82 2d1y n GLU 41 N -3.74 0.06 0.29 0.86 0.00 -1.26 -1.85 120.64 115.00 2d1y n GLU 41 Ca -0.02 0.28 0.17 0.00 0.00 0.00 0.00 57.16 57.58 2d1y n GLU 41 Cb 0.12 -1.50 0.89 0.00 0.00 0.00 0.00 31.44 30.96 2d1y n GLU 41 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 2d1y h GLY 42 N 1.07 0.00 1.01 -1.84 0.00 -1.73 -1.67 103.07 99.91 2d1y h GLY 42 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.34 2d1y h GLY 42 CO 0.00 0.00 0.63 1.70 0.00 0.00 0.00 176.54 178.87 2d1y h LYS 43 N 0.00 1.24 -0.76 4.80 1.63 -1.64 -1.89 116.57 119.96 2d1y h LYS 43 Ca -0.00 -0.08 -0.03 0.00 -0.85 0.00 0.00 60.65 59.70 2d1y h LYS 43 Cb 0.21 -0.28 -0.03 0.00 -0.60 0.00 0.00 32.23 31.53 2d1y h LYS 43 CO 0.01 0.82 0.37 0.93 -3.45 0.00 0.00 179.45 178.13 2d1y h GLU 44 N 1.28 1.09 -0.35 1.90 5.08 -1.53 -1.16 114.58 120.90 2d1y h GLU 44 Ca 0.35 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 2d1y h GLU 44 Cb -0.15 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 28.89 2d1y h GLU 44 CO -0.07 0.84 0.12 0.28 -1.00 0.00 0.00 179.01 179.18 2d1y h VAL 45 N 1.07 1.20 -0.78 3.13 2.07 -1.45 -0.59 116.25 120.89 2d1y h VAL 45 Ca 0.26 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 67.15 2d1y h VAL 45 Cb 0.11 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2d1y h VAL 45 CO -0.03 0.22 0.51 0.00 0.02 0.00 0.00 177.57 178.29 2d1y h ALA 46 N 0.96 0.99 -0.45 1.67 0.00 -1.07 -1.93 119.26 119.43 2d1y h ALA 46 Ca 0.11 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2d1y h ALA 46 Cb 0.22 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2d1y h ALA 46 CO -0.01 0.42 0.00 0.93 0.00 0.00 0.00 179.25 180.59 2d1y h GLU 47 N 1.06 0.79 -0.96 0.00 5.08 -0.98 0.62 114.58 120.19 2d1y h GLU 47 Ca 0.29 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2d1y h GLU 47 Cb -0.11 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.02 2d1y h GLU 47 CO -0.06 0.85 0.60 0.00 -1.00 0.00 0.00 179.01 179.41 2d1y h ALA 48 N 0.91 1.22 -0.02 3.43 0.00 -0.76 -2.69 119.26 121.35 2d1y h ALA 48 Ca 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2d1y h ALA 48 Cb 0.50 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2d1y h ALA 48 CO 0.02 0.65 -0.09 0.44 0.00 0.00 0.00 179.25 180.28 2d1y n ILE 49 N -4.38 0.00 -1.60 0.00 -5.35 -0.76 -4.96 119.36 102.32 2d1y n ILE 49 Ca 0.11 -0.34 -0.05 0.00 -0.27 0.00 0.00 62.75 62.19 2d1y n ILE 49 Cb 0.04 1.00 -0.01 0.00 -1.74 0.00 0.00 39.64 38.93 2d1y n ILE 49 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2d1y n GLY 50 N 1.30 0.49 0.00 3.28 0.00 0.30 -4.95 105.19 105.60 2d1y n GLY 50 Ca 0.15 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2d1y n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d1y n GLY 51 N -1.71 2.82 3.40 -0.02 0.00 0.19 -4.84 105.19 105.03 2d1y n GLY 51 Ca -0.06 -2.05 -0.31 0.00 0.00 0.00 0.00 46.02 43.60 2d1y n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d1y s ALA 52 N -2.00 2.43 0.02 4.61 0.00 0.85 -4.51 121.76 123.16 2d1y s ALA 52 Ca 0.00 -1.21 0.08 0.00 0.00 0.00 0.00 51.96 50.84 2d1y s ALA 52 Cb 0.00 -0.63 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 2d1y s ALA 52 CO 0.00 0.55 -0.25 0.12 0.00 0.00 0.00 175.76 176.19 2d1y s PHE 53 N -0.84 2.37 -0.07 0.00 5.36 -1.26 -0.91 117.98 122.63 2d1y s PHE 53 Ca 0.13 -0.39 -0.01 0.00 -0.96 0.00 0.00 56.93 55.70 2d1y s PHE 53 Cb -0.10 -1.45 0.03 0.00 -0.34 0.00 0.00 43.02 41.16 2d1y s PHE 53 CO 0.03 0.09 -0.01 -0.06 -1.46 0.00 0.00 175.22 173.82 2d1y s PHE 54 N -0.75 0.72 -0.21 10.12 0.08 -0.37 -4.97 117.98 122.60 2d1y s PHE 54 Ca 0.12 -0.21 -0.29 0.00 0.12 0.00 0.00 56.93 56.67 2d1y s PHE 54 Cb -0.10 -0.82 0.00 0.00 -0.57 0.00 0.00 43.02 41.54 2d1y s PHE 54 CO 0.01 -0.33 1.10 -1.14 -0.10 0.00 0.00 175.22 174.76 2d1y s GLN 55 N 1.86 4.25 -0.02 0.44 0.74 -1.26 -2.46 119.66 123.21 2d1y s GLN 55 Ca 0.04 1.44 -0.02 0.00 0.05 0.00 0.00 55.36 56.86 2d1y s GLN 55 Cb -0.12 -3.67 0.01 0.00 1.10 0.00 0.00 33.01 30.32 2d1y s GLN 55 CO -0.05 -0.65 0.07 0.08 -0.55 0.00 0.00 175.29 174.19 2d1y s VAL 56 N 3.26 0.00 -0.51 1.34 1.01 -0.41 -4.91 120.40 120.19 2d1y s VAL 56 Ca 0.47 -0.04 -0.13 0.00 0.00 0.00 0.00 61.98 62.28 2d1y s VAL 56 Cb -0.17 -0.11 0.12 0.00 0.00 0.00 0.00 36.38 36.22 2d1y s VAL 56 CO 0.08 -0.02 0.43 -0.62 0.00 0.00 0.00 175.10 174.97 2d1y s ASP 57 N -0.03 5.97 0.00 3.32 -1.08 -1.26 -2.83 116.67 120.76 2d1y s ASP 57 Ca -0.01 -1.84 0.02 0.00 -0.52 0.00 0.00 52.55 50.21 2d1y s ASP 57 Cb -0.01 -2.12 0.11 0.00 -1.46 0.00 0.00 42.92 39.44 2d1y s ASP 57 CO 0.00 -0.78 0.94 0.18 0.52 0.00 0.00 175.17 176.03 2d1y n LEU 58 N 5.09 0.00 0.20 -1.34 4.77 -1.26 -1.44 117.00 123.02 2d1y n LEU 58 Ca -0.11 0.36 0.13 0.00 -0.03 0.00 0.00 56.01 56.35 2d1y n LEU 58 Cb 0.40 -0.36 0.26 0.00 -2.33 0.00 0.00 43.42 41.40 2d1y n LEU 58 CO 0.49 -0.33 0.84 -0.08 -1.33 0.00 0.00 177.39 176.98 2d1y h GLU 59 N 0.00 0.00 -5.01 3.23 4.81 -1.92 -3.44 114.58 112.26 2d1y h GLU 59 Ca 0.00 0.00 -0.65 0.00 -0.13 0.00 0.00 59.36 58.58 2d1y h GLU 59 Cb 0.03 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.24 2d1y h GLU 59 CO 0.00 0.00 -0.29 0.34 -0.73 0.00 0.00 179.01 178.33 2d1y s ASP 60 N -5.75 6.19 0.38 1.04 -1.08 -0.52 -4.95 116.67 111.98 2d1y s ASP 60 Ca 0.07 -0.08 0.06 0.00 -0.52 0.00 0.00 52.55 52.09 2d1y s ASP 60 Cb 0.07 -2.20 0.77 0.00 -1.46 0.00 0.00 42.92 40.11 2d1y s ASP 60 CO 0.64 -0.28 2.00 1.05 0.52 0.00 0.00 175.17 179.10 2d1y h GLU 61 N 8.38 0.68 -0.66 4.34 4.11 -1.86 -1.70 114.58 127.87 2d1y h GLU 61 Ca -0.31 -0.04 -0.08 0.00 0.07 0.00 0.00 59.36 59.00 2d1y h GLU 61 Cb 1.15 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 30.22 2d1y h GLU 61 CO 0.67 0.45 0.09 0.00 0.07 0.00 0.00 179.01 180.29 2d1y h ARG 62 N 0.70 1.11 0.00 1.06 2.47 -1.94 -1.93 114.38 115.85 2d1y h ARG 62 Ca 0.25 -0.31 -0.11 0.00 -1.26 0.00 0.00 59.98 58.55 2d1y h ARG 62 Cb 0.11 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.29 2d1y h ARG 62 CO -0.07 1.02 -0.54 0.93 0.56 0.00 0.00 179.97 181.87 2d1y h GLU 63 N 1.03 0.00 -0.33 0.04 5.08 -1.69 -1.68 114.58 117.04 2d1y h GLU 63 Ca 0.20 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.46 2d1y h GLU 63 Cb 0.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2d1y h GLU 63 CO 0.02 0.54 -0.17 0.00 -1.00 0.00 0.00 179.01 178.39 2d1y h ARG 64 N 0.00 0.69 -0.21 2.33 3.08 -0.97 -0.13 114.38 119.18 2d1y h ARG 64 Ca -0.01 -0.31 -0.01 0.00 0.07 0.00 0.00 59.98 59.73 2d1y h ARG 64 Cb 1.00 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 2d1y h ARG 64 CO 0.07 0.91 0.10 0.28 -1.07 0.00 0.00 179.97 180.26 2d1y h VAL 65 N 0.46 1.14 -0.75 2.04 2.07 -1.22 -2.66 116.25 117.33 2d1y h VAL 65 Ca 0.07 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 2d1y h VAL 65 Cb 0.71 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 2d1y h VAL 65 CO 0.05 0.13 0.46 -0.09 0.02 0.00 0.00 177.57 178.15 2d1y h ARG 66 N 0.21 1.01 0.06 1.57 2.43 -1.21 -2.23 114.38 116.21 2d1y h ARG 66 Ca 0.07 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2d1y h ARG 66 Cb 0.12 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 2d1y h ARG 66 CO -0.01 0.70 -0.03 0.35 -1.51 0.00 0.00 179.97 179.47 2d1y h PHE 67 N 1.03 -0.07 -0.77 2.20 3.57 -0.73 -0.12 116.94 122.05 2d1y h PHE 67 Ca 0.27 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.73 2d1y h PHE 67 Cb -0.06 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 2d1y h PHE 67 CO 0.00 0.04 0.32 0.28 -2.23 0.00 0.00 178.31 176.72 2d1y h VAL 68 N -0.17 1.26 0.20 1.41 2.07 -1.31 0.82 116.25 120.52 2d1y h VAL 68 Ca -0.01 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 2d1y h VAL 68 Cb 0.14 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 2d1y h VAL 68 CO 0.01 0.33 -0.09 -0.33 0.02 0.00 0.00 177.57 177.50 2d1y h GLU 69 N 1.12 -0.25 -0.38 1.57 5.08 -1.24 -0.21 114.58 120.26 2d1y h GLU 69 Ca 0.26 0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.52 2d1y h GLU 69 Cb 0.20 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2d1y h GLU 69 CO -0.02 -0.10 -0.25 0.93 -1.00 0.00 0.00 179.01 178.57 2d1y h GLU 70 N -0.35 0.78 -0.41 2.33 5.08 -0.92 -1.81 114.58 119.28 2d1y h GLU 70 Ca -0.03 -0.33 -0.07 0.00 -1.00 0.00 0.00 59.36 57.93 2d1y h GLU 70 Cb 0.27 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2d1y h GLU 70 CO 0.04 0.94 -0.02 0.00 -1.00 0.00 0.00 179.01 178.98 2d1y h ALA 71 N 1.05 0.56 -0.90 3.43 0.00 -0.79 -0.80 119.26 121.81 2d1y h ALA 71 Ca 0.09 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2d1y h ALA 71 Cb 0.77 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 2d1y h ALA 71 CO 0.06 0.36 0.49 0.00 0.00 0.00 0.00 179.25 180.16 2d1y h ALA 72 N 0.88 1.15 -0.19 0.00 0.00 -0.92 -0.32 119.26 119.85 2d1y h ALA 72 Ca 0.11 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2d1y h ALA 72 Cb 0.51 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2d1y h ALA 72 CO 0.03 0.65 0.06 -0.92 0.00 0.00 0.00 179.25 179.06 2d1y h TYR 73 N 1.25 0.31 -0.77 0.00 3.20 -1.08 0.18 116.97 120.06 2d1y h TYR 73 Ca 0.32 -0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.11 2d1y h TYR 73 Cb 0.02 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 2d1y h TYR 73 CO 0.01 0.40 0.32 0.00 -1.64 0.00 0.00 178.16 177.24 2d1y h ALA 74 N 0.88 1.00 0.06 1.82 0.00 -0.79 -3.16 119.26 119.07 2d1y h ALA 74 Ca 0.06 -0.19 -0.27 0.00 0.00 0.00 0.00 54.91 54.52 2d1y h ALA 74 Cb 0.23 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2d1y h ALA 74 CO -0.00 0.61 -1.32 -0.07 0.00 0.00 0.00 179.25 178.47 2d1y h LEU 75 N 1.11 0.21 0.00 0.00 3.38 -1.03 -3.48 115.31 115.51 2d1y h LEU 75 Ca 0.26 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2d1y h LEU 75 Cb 0.20 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2d1y h LEU 75 CO -0.02 1.22 0.00 0.61 0.09 0.00 0.00 178.44 180.34 2d1y n GLY 76 N 1.52 1.00 3.55 0.83 0.00 0.62 -4.95 105.19 107.76 2d1y n GLY 76 Ca -0.09 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.86 2d1y n GLY 76 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2d1y s ARG 77 N -0.77 0.58 -0.12 1.61 1.70 -1.22 -4.99 118.95 115.74 2d1y s ARG 77 Ca 0.00 -0.22 -0.01 0.00 -0.47 0.00 0.00 55.73 55.03 2d1y s ARG 77 Cb 0.00 0.26 0.03 0.00 -0.57 0.00 0.00 34.95 34.68 2d1y s ARG 77 CO 0.00 -0.25 -0.03 0.08 -1.08 0.00 0.00 175.30 174.02 2d1y s VAL 78 N -2.78 0.75 -0.06 4.99 1.01 -1.26 -4.24 120.40 118.80 2d1y s VAL 78 Ca 0.07 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 61.86 2d1y s VAL 78 Cb -0.01 -0.91 -0.08 0.00 0.00 0.00 0.00 36.38 35.38 2d1y s VAL 78 CO -0.07 0.21 0.02 0.47 0.00 0.00 0.00 175.10 175.73 2d1y n ASP 79 N 5.01 3.42 -3.96 3.32 8.00 0.72 -3.77 116.55 129.30 2d1y n ASP 79 Ca -0.10 -0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.26 2d1y n ASP 79 Cb 0.49 0.61 -0.13 0.00 -0.02 0.00 0.00 41.12 42.07 2d1y n ASP 79 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2d1y s VAL 80 N -2.16 0.29 -0.06 2.53 1.01 -0.75 -1.52 120.40 119.74 2d1y s VAL 80 Ca -0.04 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.52 2d1y s VAL 80 Cb 0.02 -0.31 0.02 0.00 0.00 0.00 0.00 36.38 36.11 2d1y s VAL 80 CO 0.26 -0.10 -0.10 -0.22 0.00 0.00 0.00 175.10 174.93 2d1y s LEU 81 N -0.58 1.55 -0.23 3.92 2.96 -0.82 -0.73 118.68 124.75 2d1y s LEU 81 Ca -0.03 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 2d1y s LEU 81 Cb -0.04 -0.75 0.04 0.00 0.50 0.00 0.00 46.19 45.94 2d1y s LEU 81 CO -0.00 0.01 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.23 2d1y s VAL 82 N 0.78 2.38 -0.83 1.68 1.01 0.40 -1.17 120.40 124.65 2d1y s VAL 82 Ca -0.13 -1.23 -0.20 0.00 0.00 0.00 0.00 61.98 60.43 2d1y s VAL 82 Cb -0.15 -2.22 0.11 0.00 0.00 0.00 0.00 36.38 34.12 2d1y s VAL 82 CO 0.02 0.21 1.05 0.20 0.00 0.00 0.00 175.10 176.58 2d1y s ASN 83 N 1.23 6.48 -0.15 3.32 0.01 -0.32 -2.18 114.94 123.33 2d1y s ASN 83 Ca -0.02 -1.73 0.08 0.00 -0.71 0.00 0.00 52.86 50.48 2d1y s ASN 83 Cb -0.17 -2.40 -0.15 0.00 0.41 0.00 0.00 41.25 38.95 2d1y s ASN 83 CO -0.07 -1.16 -0.04 -3.20 -1.51 0.00 0.00 177.10 171.12 2d1y n ASN 84 N 6.81 2.00 -4.70 -1.22 5.15 -1.25 -0.87 115.26 121.18 2d1y n ASN 84 Ca 0.14 -0.04 -0.43 0.00 -0.60 0.00 0.00 54.58 53.66 2d1y n ASN 84 Cb 0.48 0.39 -0.01 0.00 -0.53 0.00 0.00 39.78 40.11 2d1y n ASN 84 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2d1y n ALA 85 N -2.72 1.38 -3.48 5.20 0.00 -1.09 -4.89 120.51 114.91 2d1y n ALA 85 Ca -0.26 0.36 -0.10 0.00 0.00 0.00 0.00 53.44 53.44 2d1y n ALA 85 Cb 0.90 -2.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.06 2d1y n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d1y s ALA 86 N -0.99 -1.70 0.20 0.00 0.00 -1.26 -4.71 121.76 113.29 2d1y s ALA 86 Ca 0.56 0.71 -0.01 0.00 0.00 0.00 0.00 51.96 53.22 2d1y s ALA 86 Cb -0.57 0.66 -0.04 0.00 0.00 0.00 0.00 23.12 23.17 2d1y s ALA 86 CO 0.61 -0.74 0.13 0.96 0.00 0.00 0.00 175.76 176.71 2d1y s ILE 87 N -3.44 0.01 0.13 0.00 -4.36 -1.26 -5.05 121.20 107.21 2d1y s ILE 87 Ca 0.03 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.42 2d1y s ILE 87 Cb -0.01 -2.49 -0.04 0.00 1.25 0.00 0.00 42.46 41.17 2d1y s ILE 87 CO -0.10 -0.01 0.02 0.00 0.24 0.00 0.00 174.94 175.09 2d1y s ALA 88 N -4.15 0.93 -0.32 2.27 0.00 -1.26 -4.81 121.76 114.42 2d1y s ALA 88 Ca 0.39 -1.46 -0.02 0.00 0.00 0.00 0.00 51.96 50.87 2d1y s ALA 88 Cb 0.07 0.67 0.11 0.00 0.00 0.00 0.00 23.12 23.97 2d1y s ALA 88 CO 0.12 -0.42 0.16 0.00 0.00 0.00 0.00 175.76 175.61 2d1y s ALA 89 N -3.92 0.86 0.21 0.00 0.00 -1.26 -5.02 121.76 112.63 2d1y s ALA 89 Ca 0.21 -1.44 -0.31 0.00 0.00 0.00 0.00 51.96 50.43 2d1y s ALA 89 Cb 0.07 -1.50 -0.16 0.00 0.00 0.00 0.00 23.12 21.54 2d1y s ALA 89 CO 0.00 -1.81 0.98 -2.30 0.00 0.00 0.00 175.76 172.63 2d1y n PRO 90 N 4.78 0.94 0.00 0.00 -0.02 -1.26 -4.55 135.00 134.89 2d1y n PRO 90 Ca 0.00 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2d1y n PRO 90 Cb 0.40 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 2d1y n PRO 90 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2d1y n GLY 91 N 1.70 4.05 3.97 -1.23 0.00 0.07 -4.63 105.19 109.12 2d1y n GLY 91 Ca 0.14 -1.50 -0.27 0.00 0.00 0.00 0.00 46.02 44.39 2d1y n GLY 91 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d1y s SER 92 N 0.00 3.49 0.59 1.61 1.04 -1.26 -2.06 113.70 117.12 2d1y s SER 92 Ca 0.00 -0.14 0.33 0.00 0.48 0.00 0.00 55.95 56.62 2d1y s SER 92 Cb 0.00 0.02 1.86 0.00 0.10 0.00 0.00 66.02 68.00 2d1y s SER 92 CO 0.00 -2.46 2.23 0.00 0.98 0.00 0.00 173.24 174.00 2d1y h ALA 93 N -1.21 1.33 0.00 5.32 0.00 -1.97 -0.78 119.26 121.95 2d1y h ALA 93 Ca -0.40 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 2d1y h ALA 93 Cb 1.24 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 2d1y h ALA 93 CO 0.35 0.04 -0.57 -0.07 0.00 0.00 0.00 179.25 178.99 2d1y h LEU 94 N 0.00 0.00 0.00 0.00 3.38 -2.03 -3.37 115.31 113.29 2d1y h LEU 94 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2d1y h LEU 94 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2d1y h LEU 94 CO 0.00 0.57 -0.99 0.35 0.09 0.00 0.00 178.44 178.47 2d1y n THR 95 N -3.58 0.00 -2.08 0.22 -2.24 -0.81 -5.03 114.28 100.76 2d1y n THR 95 Ca -0.00 -0.16 -0.39 0.00 -2.27 0.00 0.00 64.05 61.22 2d1y n THR 95 Cb 0.64 0.53 -0.00 0.00 -2.10 0.00 0.00 70.33 69.39 2d1y n THR 95 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2d1y s VAL 96 N -2.11 2.68 0.07 2.28 0.11 -0.36 -4.91 120.40 118.16 2d1y s VAL 96 Ca -0.01 0.60 -0.22 0.00 -2.93 0.00 0.00 61.98 59.41 2d1y s VAL 96 Cb 0.03 -3.34 -0.06 0.00 -1.53 0.00 0.00 36.38 31.47 2d1y s VAL 96 CO 0.18 0.07 0.66 -0.13 -3.33 0.00 0.00 175.10 172.55 2d1y s ARG 97 N -2.31 4.37 0.24 1.54 0.52 -1.26 -4.97 118.95 117.07 2d1y s ARG 97 Ca 0.58 0.89 -0.06 0.00 -0.52 0.00 0.00 55.73 56.63 2d1y s ARG 97 Cb -0.37 -3.30 0.43 0.00 0.52 0.00 0.00 34.95 32.24 2d1y s ARG 97 CO 0.47 0.48 1.70 -0.07 0.02 0.00 0.00 175.30 177.89 2d1y h LEU 98 N 5.03 0.06 -0.83 2.53 3.38 -1.98 -1.28 115.31 122.22 2d1y h LEU 98 Ca -0.47 0.13 0.02 0.00 0.09 0.00 0.00 57.88 57.65 2d1y h LEU 98 Cb 1.21 0.17 -0.04 0.00 0.09 0.00 0.00 40.66 42.08 2d1y h LEU 98 CO 0.67 -0.00 0.55 -0.65 0.09 0.00 0.00 178.44 179.10 2d1y h PRO 99 N 0.30 1.06 -0.23 1.13 0.11 -1.99 0.03 132.00 132.41 2d1y h PRO 99 Ca 0.40 -0.06 -0.14 0.00 0.11 0.00 0.00 66.00 66.31 2d1y h PRO 99 Cb 0.65 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 2d1y h PRO 99 CO -0.47 0.70 -0.42 1.05 -0.21 0.00 0.00 178.00 178.65 2d1y h GLU 100 N 1.10 0.56 -0.20 1.05 4.11 -1.78 -1.22 114.58 118.19 2d1y h GLU 100 Ca 0.31 -0.29 -0.01 0.00 0.07 0.00 0.00 59.36 59.45 2d1y h GLU 100 Cb -0.08 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2d1y h GLU 100 CO -0.08 0.88 0.10 2.35 0.07 0.00 0.00 179.01 182.33 2d1y h TRP 101 N 0.45 0.28 -0.57 2.06 2.91 -0.75 -1.49 115.95 118.85 2d1y h TRP 101 Ca 0.04 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 60.01 2d1y h TRP 101 Cb 0.93 -0.09 -0.03 0.00 -0.51 0.00 0.00 29.16 29.47 2d1y h TRP 101 CO 0.04 0.27 0.20 0.00 -1.03 0.00 0.00 178.44 177.91 2d1y h ARG 102 N 0.21 0.84 -0.74 2.65 3.08 -0.86 -2.05 114.38 117.51 2d1y h ARG 102 Ca 0.07 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 59.91 2d1y h ARG 102 Cb 0.09 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 29.96 2d1y h ARG 102 CO -0.01 0.71 0.22 -0.09 -1.07 0.00 0.00 179.97 179.73 2d1y h ARG 103 N 0.82 1.15 -0.60 0.04 2.43 -0.89 -0.49 114.38 116.84 2d1y h ARG 103 Ca 0.19 -0.25 -0.07 0.00 -0.81 0.00 0.00 59.98 59.04 2d1y h ARG 103 Cb 0.21 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 2d1y h ARG 103 CO -0.01 0.98 0.09 0.28 -1.51 0.00 0.00 179.97 179.80 2d1y h VAL 104 N 1.10 1.26 -0.58 0.20 2.07 -0.85 -1.51 116.25 117.94 2d1y h VAL 104 Ca 0.24 -1.01 -0.08 0.00 0.82 0.00 0.00 66.70 66.67 2d1y h VAL 104 Cb 0.32 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 2d1y h VAL 104 CO -0.01 0.37 0.05 -0.07 0.02 0.00 0.00 177.57 177.94 2d1y h LEU 105 N 0.90 0.92 -0.22 2.57 3.38 -1.03 0.06 115.31 121.89 2d1y h LEU 105 Ca 0.18 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2d1y h LEU 105 Cb 0.43 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2d1y h LEU 105 CO 0.01 0.95 0.09 -0.08 0.09 0.00 0.00 178.44 179.50 2d1y h GLU 106 N 0.89 0.33 0.01 1.13 4.57 -0.72 -0.87 114.58 119.91 2d1y h GLU 106 Ca 0.17 -0.06 -0.20 0.00 -1.18 0.00 0.00 59.36 58.09 2d1y h GLU 106 Cb 0.45 -0.05 0.02 0.00 -0.16 0.00 0.00 28.75 29.01 2d1y h GLU 106 CO 0.02 0.38 -0.79 0.28 -1.18 0.00 0.00 179.01 177.72 2d1y h VAL 107 N 0.20 1.37 0.00 0.32 2.07 -1.20 0.16 116.25 119.17 2d1y h VAL 107 Ca 0.07 -2.17 -0.10 0.00 0.82 0.00 0.00 66.70 65.33 2d1y h VAL 107 Cb 0.18 2.54 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 2d1y h VAL 107 CO -0.01 0.65 -0.66 0.78 0.02 0.00 0.00 177.57 178.35 2d1y h ASN 108 N 0.09 0.00 0.00 0.57 4.21 -1.05 -3.37 115.58 116.03 2d1y h ASN 108 Ca -0.10 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.41 2d1y h ASN 108 Cb 1.49 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.69 2d1y h ASN 108 CO 0.16 0.43 -0.65 -0.11 -1.29 0.00 0.00 177.43 175.97 2d1y n LEU 109 N -3.11 0.15 -0.17 1.61 7.94 -0.45 -4.64 117.00 118.33 2d1y n LEU 109 Ca -0.00 0.04 -0.10 0.00 -1.11 0.00 0.00 56.01 54.84 2d1y n LEU 109 Cb 0.72 -0.03 0.00 0.00 0.53 0.00 0.00 43.42 44.64 2d1y n LEU 109 CO 0.40 -0.22 0.79 0.74 -1.11 0.00 0.00 177.39 177.99 2d1y h THR 110 N 0.00 1.26 -0.11 1.96 2.02 -1.17 -2.69 112.91 114.18 2d1y h THR 110 Ca 0.00 -1.09 0.01 0.00 0.77 0.00 0.00 66.41 66.10 2d1y h THR 110 Cb 0.65 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.05 2d1y h THR 110 CO 0.00 0.38 0.02 0.00 0.37 0.00 0.00 175.52 176.29 2d1y h ALA 111 N 0.92 0.11 -0.66 6.16 0.00 -0.83 -0.85 119.26 124.10 2d1y h ALA 111 Ca 0.13 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2d1y h ALA 111 Cb 0.53 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2d1y h ALA 111 CO 0.03 -0.44 0.44 -1.35 0.00 0.00 0.00 179.25 177.92 2d1y h PRO 112 N 0.06 0.85 0.25 0.00 0.11 -1.75 0.76 132.00 132.27 2d1y h PRO 112 Ca 0.05 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 2d1y h PRO 112 Cb 0.05 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 30.97 2d1y h PRO 112 CO -0.07 0.56 -0.12 1.98 -0.21 0.00 0.00 178.00 180.14 2d1y h MET 113 N 0.87 -0.32 0.02 1.05 4.05 -1.09 -1.07 114.93 118.45 2d1y h MET 113 Ca 0.25 0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.69 2d1y h MET 113 Cb -0.07 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 30.80 2d1y h MET 113 CO -0.06 -0.10 -0.01 1.25 0.23 0.00 0.00 176.91 178.22 2d1y h HIS 114 N -0.48 -0.02 -0.72 1.39 6.17 -0.85 -2.35 115.15 118.28 2d1y h HIS 114 Ca -0.03 -0.00 -0.00 0.00 0.71 0.00 0.00 60.37 61.04 2d1y h HIS 114 Cb 0.36 0.01 -0.04 0.00 2.52 0.00 0.00 27.41 30.26 2d1y h HIS 114 CO -0.02 -0.00 0.44 -0.07 0.71 0.00 0.00 177.93 178.99 2d1y h LEU 115 N -0.03 0.86 -0.70 0.26 3.38 -0.87 -0.87 115.31 117.34 2d1y h LEU 115 Ca -0.00 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2d1y h LEU 115 Cb 0.03 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2d1y h LEU 115 CO 0.00 0.66 0.25 0.28 0.09 0.00 0.00 178.44 179.73 2d1y h SER 116 N 1.00 0.98 -0.17 -0.43 0.02 -0.93 0.21 113.55 114.24 2d1y h SER 116 Ca 0.26 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 2d1y h SER 116 Cb -0.05 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.23 2d1y h SER 116 CO -0.05 0.91 0.04 0.00 -1.14 0.00 0.00 176.83 176.58 2d1y h ALA 117 N 1.12 0.22 -0.43 3.77 0.00 -0.87 0.58 119.26 123.65 2d1y h ALA 117 Ca 0.23 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2d1y h ALA 117 Cb 0.25 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2d1y h ALA 117 CO -0.01 -0.13 0.23 -0.07 0.00 0.00 0.00 179.25 179.26 2d1y h LEU 118 N 0.07 0.54 -0.78 0.00 3.38 -0.93 -2.74 115.31 114.86 2d1y h LEU 118 Ca 0.05 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 2d1y h LEU 118 Cb 0.27 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2d1y h LEU 118 CO 0.00 0.49 -0.21 0.00 0.09 0.00 0.00 178.44 178.81 2d1y h ALA 119 N 1.08 0.96 -0.47 1.53 0.00 -0.52 -3.01 119.26 118.82 2d1y h ALA 119 Ca 0.15 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2d1y h ALA 119 Cb 0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2d1y h ALA 119 CO -0.02 0.61 0.24 0.00 0.00 0.00 0.00 179.25 180.08 2d1y h ALA 120 N 1.15 1.54 0.00 0.00 0.00 -0.62 -0.08 119.26 121.26 2d1y h ALA 120 Ca 0.09 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2d1y h ALA 120 Cb 0.69 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2d1y h ALA 120 CO 0.05 0.38 -0.32 0.00 0.00 0.00 0.00 179.25 179.36 2d1y h ARG 121 N 0.66 0.00 0.23 0.00 3.08 -1.35 -1.32 114.38 115.67 2d1y h ARG 121 Ca 0.17 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.89 2d1y h ARG 121 Cb 0.04 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.13 2d1y h ARG 121 CO -0.03 0.32 -1.43 0.93 -1.07 0.00 0.00 179.97 178.70 2d1y h GLU 122 N 0.00 0.48 -0.34 0.04 4.39 -1.24 -3.27 114.58 114.64 2d1y h GLU 122 Ca -0.00 -0.82 -0.02 0.00 0.34 0.00 0.00 59.36 58.85 2d1y h GLU 122 Cb 0.60 0.31 -0.02 0.00 -0.10 0.00 0.00 28.75 29.53 2d1y h GLU 122 CO 0.04 1.39 0.12 0.52 -1.16 0.00 0.00 179.01 179.93 2d1y h MET 123 N 0.13 0.48 -0.24 2.33 2.86 -0.70 -1.71 114.93 118.09 2d1y h MET 123 Ca -0.23 -0.06 0.07 0.00 -2.06 0.00 0.00 59.70 57.42 2d1y h MET 123 Cb 2.13 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 33.69 2d1y h MET 123 CO 0.26 0.41 0.18 -0.09 1.06 0.00 0.00 176.91 178.73 2d1y h ARG 124 N 0.48 0.00 0.00 1.72 2.43 -1.30 -0.10 114.38 117.60 2d1y h ARG 124 Ca 0.12 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 2d1y h ARG 124 Cb 0.12 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2d1y h ARG 124 CO -0.01 0.00 -0.20 0.87 -1.51 0.00 0.00 179.97 179.12 2d1y h LYS 125 N 0.00 0.00 -0.24 0.20 1.57 -1.43 -3.06 116.57 113.61 2d1y h LYS 125 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2d1y h LYS 125 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2d1y h LYS 125 CO -0.00 0.20 0.00 1.33 -0.57 0.00 0.00 179.45 180.41 2d1y n VAL 126 N -3.49 2.03 -0.73 0.50 0.24 -0.18 -4.97 118.33 111.73 2d1y n VAL 126 Ca -0.01 -1.78 0.00 0.00 -2.04 0.00 0.00 64.34 60.52 2d1y n VAL 126 Cb 0.36 -0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.61 2d1y n VAL 126 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2d1y n GLY 127 N -0.47 0.56 0.00 7.63 0.00 -1.04 -4.93 105.19 106.94 2d1y n GLY 127 Ca 0.19 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.54 2d1y n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d1y n GLY 128 N -2.73 -0.09 0.00 -0.02 0.00 -0.42 -4.79 105.19 97.14 2d1y n GLY 128 Ca 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.75 2d1y n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d1y n GLY 129 N 0.00 -0.66 3.19 -0.02 0.00 -0.87 -4.69 105.19 102.14 2d1y n GLY 129 Ca 0.00 -0.52 -0.13 0.00 0.00 0.00 0.00 46.02 45.37 2d1y n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d1y s ALA 130 N -1.00 -0.68 -0.03 4.61 0.00 -0.58 -2.06 121.76 122.02 2d1y s ALA 130 Ca 0.00 0.43 0.05 0.00 0.00 0.00 0.00 51.96 52.44 2d1y s ALA 130 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 2d1y s ALA 130 CO 0.00 -0.21 -0.18 0.42 0.00 0.00 0.00 175.76 175.79 2d1y s ILE 131 N -0.79 1.47 -0.11 0.00 1.01 0.21 -1.94 121.20 121.04 2d1y s ILE 131 Ca -0.09 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 59.81 2d1y s ILE 131 Cb -0.04 -1.25 0.02 0.00 0.01 0.00 0.00 42.46 41.20 2d1y s ILE 131 CO 0.02 0.42 -0.11 -0.69 0.00 0.00 0.00 174.94 174.58 2d1y s VAL 132 N -0.16 1.23 -0.16 2.92 1.01 -0.32 -1.73 120.40 123.19 2d1y s VAL 132 Ca 0.01 -0.45 -0.10 0.00 0.00 0.00 0.00 61.98 61.44 2d1y s VAL 132 Cb -0.10 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.06 2d1y s VAL 132 CO 0.01 0.39 0.17 0.20 0.00 0.00 0.00 175.10 175.88 2d1y s ASN 133 N 1.33 6.34 -0.57 3.32 0.01 0.28 -1.17 114.94 124.48 2d1y s ASN 133 Ca -0.01 0.39 -0.19 0.00 -0.71 0.00 0.00 52.86 52.34 2d1y s ASN 133 Cb -0.14 -2.11 0.09 0.00 0.41 0.00 0.00 41.25 39.51 2d1y s ASN 133 CO -0.05 0.25 0.70 -0.69 -1.51 0.00 0.00 177.10 175.80 2d1y s VAL 134 N -0.16 4.80 0.00 1.60 1.01 -0.05 -1.47 120.40 126.12 2d1y s VAL 134 Ca 0.12 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.29 2d1y s VAL 134 Cb -0.12 -4.45 0.00 0.00 0.00 0.00 0.00 36.38 31.81 2d1y s VAL 134 CO 0.02 -1.06 0.00 0.00 0.00 0.00 0.00 175.10 174.06 2d1y n ALA 135 N 6.38 0.00 -3.63 5.51 0.00 0.08 -4.84 120.51 124.01 2d1y n ALA 135 Ca -0.08 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.33 2d1y n ALA 135 Cb 0.43 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.86 2d1y n ALA 135 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2d1y s SER 136 N -1.00 -0.06 0.57 0.00 0.15 -1.25 -4.46 113.70 107.65 2d1y s SER 136 Ca 0.00 0.01 0.30 0.00 0.70 0.00 0.00 55.95 56.96 2d1y s SER 136 Cb 0.00 0.06 1.71 0.00 -1.71 0.00 0.00 66.02 66.08 2d1y s SER 136 CO 0.00 -0.10 2.19 -0.37 1.20 0.00 0.00 173.24 176.16 2d1y h VAL 137 N 2.01 0.50 0.00 4.45 -1.51 -1.48 0.45 116.25 120.67 2d1y h VAL 137 Ca -0.05 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 65.19 2d1y h VAL 137 Cb 1.15 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 31.45 2d1y h VAL 137 CO 0.21 0.05 0.00 0.00 -1.23 0.00 0.00 177.57 176.59 2d1y n GLN 138 N -3.70 0.90 -0.00 5.19 6.02 -1.26 -1.32 117.38 123.21 2d1y n GLN 138 Ca -0.02 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.02 2d1y n GLN 138 Cb 0.15 -1.27 -0.07 0.00 1.02 0.00 0.00 30.24 30.07 2d1y n GLN 138 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2d1y n GLY 139 N 0.19 -0.23 0.02 1.08 0.00 0.15 -4.31 105.19 102.09 2d1y n GLY 139 Ca 0.00 -0.27 0.05 0.00 0.00 0.00 0.00 46.02 45.80 2d1y n GLY 139 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d1y n LEU 140 N -1.56 0.00 -4.19 0.99 4.77 -0.60 -3.85 117.00 112.56 2d1y n LEU 140 Ca -0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 2d1y n LEU 140 Cb 0.22 0.06 -0.09 0.00 -2.33 0.00 0.00 43.42 41.28 2d1y n LEU 140 CO 0.22 0.06 -0.17 -0.36 -1.33 0.00 0.00 177.39 175.81 2d1y s PHE 141 N -2.90 1.17 0.41 -1.77 0.08 -0.43 -5.14 117.98 109.40 2d1y s PHE 141 Ca -0.06 -1.36 0.05 0.00 0.12 0.00 0.00 56.93 55.69 2d1y s PHE 141 Cb 0.08 -0.49 -0.06 0.00 -0.57 0.00 0.00 43.02 41.98 2d1y s PHE 141 CO 0.61 -0.73 0.03 0.00 -0.10 0.00 0.00 175.22 175.03 2d1y s ALA 142 N -4.00 3.13 0.18 5.36 0.00 -1.26 -4.22 121.76 120.95 2d1y s ALA 142 Ca 0.37 -1.89 -0.00 0.00 0.00 0.00 0.00 51.96 50.44 2d1y s ALA 142 Cb 0.05 0.28 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 2d1y s ALA 142 CO 0.14 -0.16 0.09 -1.83 0.00 0.00 0.00 175.76 174.00 2d1y s GLU 143 N -3.78 1.14 0.46 0.00 -1.05 -1.26 -5.05 118.70 109.17 2d1y s GLU 143 Ca 0.30 -1.58 -0.23 0.00 -0.15 0.00 0.00 54.97 53.31 2d1y s GLU 143 Cb 0.08 0.10 -0.07 0.00 -0.44 0.00 0.00 34.13 33.80 2d1y s GLU 143 CO 0.15 -0.30 1.18 -0.65 0.95 0.00 0.00 175.26 176.59 2d1y s GLN 144 N -4.07 3.73 -1.47 -4.83 -0.21 -1.26 -3.93 119.66 107.62 2d1y s GLN 144 Ca 0.32 1.81 -0.00 0.00 0.02 0.00 0.00 55.36 57.51 2d1y s GLN 144 Cb 0.07 -2.41 0.00 0.00 1.00 0.00 0.00 33.01 31.68 2d1y s GLN 144 CO 0.08 -0.58 0.25 0.39 -2.12 0.00 0.00 175.29 173.31 2d1y n GLU 145 N -0.50 -2.35 -2.64 2.91 1.02 -1.26 -4.86 120.64 112.97 2d1y n GLU 145 Ca 0.07 0.28 -0.01 0.00 -0.02 0.00 0.00 57.16 57.48 2d1y n GLU 145 Cb 0.48 -4.16 0.08 0.00 -0.02 0.00 0.00 31.44 27.82 2d1y n GLU 145 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2d1y n ASN 146 N -2.94 0.23 -0.08 1.62 5.15 -1.11 -0.75 115.26 117.37 2d1y n ASN 146 Ca -0.31 -2.10 -0.07 0.00 -0.60 0.00 0.00 54.58 51.50 2d1y n ASN 146 Cb 0.69 0.03 -0.01 0.00 -0.53 0.00 0.00 39.78 39.96 2d1y n ASN 146 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2d1y h ALA 147 N 1.79 -0.03 -0.52 5.20 0.00 -1.69 -1.21 119.26 122.80 2d1y h ALA 147 Ca -0.28 0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.77 2d1y h ALA 147 Cb 1.32 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 19.57 2d1y h ALA 147 CO 0.01 -0.62 0.28 0.00 0.00 0.00 0.00 179.25 178.92 2d1y h ALA 148 N 0.95 0.67 -0.20 0.00 0.00 -1.80 0.66 119.26 119.55 2d1y h ALA 148 Ca 0.16 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2d1y h ALA 148 Cb 0.45 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2d1y h ALA 148 CO -0.43 -0.05 0.06 -0.92 0.00 0.00 0.00 179.25 177.91 2d1y h TYR 149 N 0.55 0.32 -0.81 0.00 3.20 -1.80 -0.70 116.97 117.73 2d1y h TYR 149 Ca 0.22 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 2d1y h TYR 149 Cb 0.10 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.24 2d1y h TYR 149 CO -0.09 0.40 0.37 -0.91 -1.64 0.00 0.00 178.16 176.29 2d1y h ASN 150 N 0.15 1.08 -0.16 -2.11 -0.26 -0.90 -0.65 115.58 112.72 2d1y h ASN 150 Ca 0.06 -0.15 -0.07 0.00 -0.56 0.00 0.00 56.30 55.59 2d1y h ASN 150 Cb 0.23 -0.28 -0.00 0.00 -1.06 0.00 0.00 38.32 37.21 2d1y h ASN 150 CO -0.00 0.93 -0.16 0.00 -1.06 0.00 0.00 177.43 177.14 2d1y h ALA 151 N 1.20 0.24 -0.61 -0.83 0.00 -0.79 -1.79 119.26 116.68 2d1y h ALA 151 Ca 0.28 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2d1y h ALA 151 Cb 0.15 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2d1y h ALA 151 CO -0.03 0.13 0.07 0.66 0.00 0.00 0.00 179.25 180.07 2d1y h SER 152 N 0.04 1.00 0.39 0.00 4.64 -1.00 -0.91 113.55 117.71 2d1y h SER 152 Ca 0.03 -0.28 -0.12 0.00 -0.47 0.00 0.00 61.79 60.95 2d1y h SER 152 Cb 0.69 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 2d1y h SER 152 CO 0.04 1.03 -0.50 0.11 -0.87 0.00 0.00 176.83 176.63 2d1y h LYS 153 N 0.94 0.14 -0.51 4.77 1.79 -1.17 -0.23 116.57 122.29 2d1y h LYS 153 Ca 0.18 -0.08 -0.13 0.00 -2.18 0.00 0.00 60.65 58.45 2d1y h LYS 153 Cb 0.47 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.11 2d1y h LYS 153 CO 0.02 0.61 -0.17 0.78 -1.08 0.00 0.00 179.45 179.61 2d1y h GLY 154 N 1.43 1.10 1.30 3.86 0.00 -1.03 -1.70 103.07 108.02 2d1y h GLY 154 Ca 0.00 -0.94 -0.10 0.00 0.00 0.00 0.00 47.33 46.29 2d1y h GLY 154 CO 0.07 0.86 -0.14 -1.33 0.00 0.00 0.00 176.54 176.00 2d1y h GLY 155 N 0.90 0.89 1.60 4.60 0.00 -0.77 -2.80 103.07 107.48 2d1y h GLY 155 Ca 0.12 -0.70 -0.05 0.00 0.00 0.00 0.00 47.33 46.71 2d1y h GLY 155 CO 0.06 0.64 -0.00 -2.00 0.00 0.00 0.00 176.54 175.24 2d1y h LEU 156 N 0.73 0.47 -0.09 3.11 5.85 -0.72 0.58 115.31 125.23 2d1y h LEU 156 Ca 0.12 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2d1y h LEU 156 Cb 0.65 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 2d1y h LEU 156 CO 0.05 0.54 0.03 0.58 -0.34 0.00 0.00 178.44 179.29 2d1y h VAL 157 N 0.48 1.16 0.00 1.05 2.07 -1.06 -0.91 116.25 119.05 2d1y h VAL 157 Ca 0.10 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 67.06 2d1y h VAL 157 Cb 0.32 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 2d1y h VAL 157 CO 0.01 0.14 -0.36 -1.13 0.02 0.00 0.00 177.57 176.26 2d1y h ASN 158 N -0.03 0.00 -0.14 0.57 -1.24 -1.35 -2.68 115.58 110.70 2d1y h ASN 158 Ca 0.03 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.96 2d1y h ASN 158 Cb 0.20 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.23 2d1y h ASN 158 CO -0.00 0.36 -0.14 0.25 -1.29 0.00 0.00 177.43 176.60 2d1y h LEU 159 N 0.00 0.51 -0.83 0.34 5.85 -0.67 -1.05 115.31 119.46 2d1y h LEU 159 Ca -0.00 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.59 2d1y h LEU 159 Cb 1.04 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.89 2d1y h LEU 159 CO 0.05 0.67 0.54 0.74 -0.34 0.00 0.00 178.44 180.11 2d1y h THR 160 N 0.48 1.19 -0.40 1.05 2.02 -0.82 0.13 112.91 116.56 2d1y h THR 160 Ca 0.09 -0.38 -0.08 0.00 0.77 0.00 0.00 66.41 66.81 2d1y h THR 160 Cb 0.53 -0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.92 2d1y h THR 160 CO 0.03 0.20 -0.05 0.03 0.37 0.00 0.00 175.52 176.10 2d1y h ARG 161 N 1.10 0.74 -0.02 6.66 3.08 -1.30 -1.24 114.38 123.41 2d1y h ARG 161 Ca 0.31 -0.27 0.01 0.00 0.07 0.00 0.00 59.98 60.10 2d1y h ARG 161 Cb -0.10 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 2d1y h ARG 161 CO -0.08 0.86 -0.03 1.03 -1.07 0.00 0.00 179.97 180.68 2d1y h SER 162 N 0.56 -0.10 -0.83 7.04 0.87 -0.64 -1.80 113.55 118.67 2d1y h SER 162 Ca 0.11 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.70 2d1y h SER 162 Cb 0.56 0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.52 2d1y h SER 162 CO 0.03 -0.05 0.55 -0.07 -0.53 0.00 0.00 176.83 176.76 2d1y h LEU 163 N -0.05 0.94 -0.85 2.23 3.38 -0.71 -1.31 115.31 118.95 2d1y h LEU 163 Ca 0.02 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2d1y h LEU 163 Cb 0.08 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 2d1y h LEU 163 CO -0.05 0.68 0.56 0.00 0.09 0.00 0.00 178.44 179.72 2d1y h ALA 164 N 1.31 1.08 -0.23 1.53 0.00 -0.87 0.12 119.26 122.21 2d1y h ALA 164 Ca 0.31 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 2d1y h ALA 164 Cb -0.12 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.34 2d1y h ALA 164 CO -0.07 0.45 -0.18 -0.07 0.00 0.00 0.00 179.25 179.38 2d1y h LEU 165 N 1.12 0.56 -0.44 0.00 3.38 -0.89 -2.70 115.31 116.34 2d1y h LEU 165 Ca 0.32 -0.45 -0.12 0.00 0.09 0.00 0.00 57.88 57.71 2d1y h LEU 165 Cb -0.10 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2d1y h LEU 165 CO -0.08 0.90 -0.57 0.44 0.09 0.00 0.00 178.44 179.21 2d1y h ASP 166 N 0.23 0.00 0.14 -0.43 3.32 -1.00 -3.29 116.42 115.40 2d1y h ASP 166 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2d1y h ASP 166 Cb 0.72 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.27 2d1y h ASP 166 CO 0.05 0.57 -0.57 0.18 -1.72 0.00 0.00 179.24 177.75 2d1y n LEU 167 N -3.44 1.24 -0.26 1.55 4.77 0.40 -4.35 117.00 116.91 2d1y n LEU 167 Ca 0.00 -0.43 0.03 0.00 -0.03 0.00 0.00 56.01 55.58 2d1y n LEU 167 Cb 0.68 -0.08 0.16 0.00 -2.33 0.00 0.00 43.42 41.86 2d1y n LEU 167 CO 0.41 0.25 1.07 0.00 -1.33 0.00 0.00 177.39 177.79 2d1y h ALA 168 N 3.44 1.06 -0.10 -1.18 0.00 -1.54 -0.37 119.26 120.56 2d1y h ALA 168 Ca 0.00 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2d1y h ALA 168 Cb 0.58 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2d1y h ALA 168 CO 0.00 -0.07 0.08 -1.35 0.00 0.00 0.00 179.25 177.91 2d1y h PRO 169 N 0.59 0.00 -0.27 0.00 0.11 -1.81 0.16 132.00 130.79 2d1y h PRO 169 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2d1y h PRO 169 Cb 0.45 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.56 2d1y h PRO 169 CO -0.30 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.77 2d1y n LEU 170 N -4.44 1.44 -3.52 2.35 4.32 -0.19 -4.89 117.00 112.08 2d1y n LEU 170 Ca -0.01 -0.72 -0.22 0.00 -0.02 0.00 0.00 56.01 55.04 2d1y n LEU 170 Cb 0.19 -0.18 0.08 0.00 -1.62 0.00 0.00 43.42 41.89 2d1y n LEU 170 CO 0.34 0.36 0.22 0.54 -1.22 0.00 0.00 177.39 177.63 2d1y n ARG 171 N 0.28 -7.63 -4.36 3.23 1.74 0.55 -3.98 116.66 106.49 2d1y n ARG 171 Ca 0.09 0.82 -0.33 0.00 -0.77 0.00 0.00 57.85 57.66 2d1y n ARG 171 Cb 0.23 -5.83 -0.16 0.00 -1.02 0.00 0.00 32.46 25.68 2d1y n ARG 171 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2d1y s ILE 172 N -3.32 2.11 0.12 0.55 1.01 -0.96 -2.04 121.20 118.67 2d1y s ILE 172 Ca 0.48 -0.94 -0.10 0.00 0.00 0.00 0.00 60.65 60.09 2d1y s ILE 172 Cb -0.21 -1.87 -0.06 0.00 0.01 0.00 0.00 42.46 40.33 2d1y s ILE 172 CO 0.72 0.54 0.44 -0.13 0.00 0.00 0.00 174.94 176.51 2d1y s ARG 173 N 1.08 3.78 -0.06 2.79 0.52 -0.87 -3.66 118.95 122.52 2d1y s ARG 173 Ca -0.00 0.20 -0.01 0.00 -0.52 0.00 0.00 55.73 55.39 2d1y s ARG 173 Cb -0.14 -2.91 0.03 0.00 0.52 0.00 0.00 34.95 32.45 2d1y s ARG 173 CO -0.08 0.50 0.01 0.08 0.02 0.00 0.00 175.30 175.83 2d1y s VAL 174 N -1.51 0.24 0.26 3.52 1.01 -1.26 -0.62 120.40 122.04 2d1y s VAL 174 Ca 0.37 0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.55 2d1y s VAL 174 Cb -0.13 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 2d1y s VAL 174 CO 0.20 0.22 0.15 0.20 0.00 0.00 0.00 175.10 175.87 2d1y s ASN 175 N 1.85 0.99 0.04 3.32 0.01 -0.71 0.36 114.94 120.80 2d1y s ASN 175 Ca 0.02 -1.48 0.01 0.00 -0.71 0.00 0.00 52.86 50.70 2d1y s ASN 175 Cb -0.12 0.35 -0.03 0.00 0.41 0.00 0.00 41.25 41.86 2d1y s ASN 175 CO -0.04 -0.85 -0.05 0.00 -1.51 0.00 0.00 177.10 174.65 2d1y s ALA 176 N -3.82 0.38 0.07 0.60 0.00 -0.18 -0.55 121.76 118.26 2d1y s ALA 176 Ca 0.38 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.57 2d1y s ALA 176 Cb 0.06 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.29 2d1y s ALA 176 CO 0.16 -0.17 -0.05 0.14 0.00 0.00 0.00 175.76 175.83 2d1y s VAL 177 N -2.10 3.69 -0.55 0.00 -7.23 -0.54 -0.71 120.40 112.96 2d1y s VAL 177 Ca -0.08 -1.00 0.04 0.00 -1.81 0.00 0.00 61.98 59.13 2d1y s VAL 177 Cb -0.05 -2.70 0.15 0.00 0.56 0.00 0.00 36.38 34.33 2d1y s VAL 177 CO -0.03 0.21 0.33 0.00 -0.31 0.00 0.00 175.10 175.30 2d1y s ALA 178 N -1.18 2.99 0.62 1.32 0.00 0.55 -0.74 121.76 125.33 2d1y s ALA 178 Ca 0.21 -3.20 -0.16 0.00 0.00 0.00 0.00 51.96 48.81 2d1y s ALA 178 Cb -0.11 -2.04 -0.02 0.00 0.00 0.00 0.00 23.12 20.95 2d1y s ALA 178 CO 0.13 -2.05 1.12 -2.14 0.00 0.00 0.00 175.76 172.82 2d1y s PRO 179 N -0.45 2.97 0.00 0.00 0.02 -1.26 -1.60 135.00 134.68 2d1y s PRO 179 Ca 0.21 1.47 0.00 0.00 0.02 0.00 0.00 61.00 62.70 2d1y s PRO 179 Cb -0.16 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.39 2d1y s PRO 179 CO -0.07 -1.13 0.00 0.41 -0.33 0.00 0.00 177.00 175.88 2d1y n GLY 180 N -0.28 1.79 3.62 0.52 0.00 -0.74 -1.74 105.19 108.36 2d1y n GLY 180 Ca 0.11 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.83 2d1y n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d1y s ALA 181 N -3.00 3.14 -0.15 4.61 0.00 -1.26 -4.94 121.76 120.16 2d1y s ALA 181 Ca 0.00 0.41 -0.04 0.00 0.00 0.00 0.00 51.96 52.33 2d1y s ALA 181 Cb 0.00 -3.91 -0.03 0.00 0.00 0.00 0.00 23.12 19.19 2d1y s ALA 181 CO 0.00 -2.17 -0.03 0.42 0.00 0.00 0.00 175.76 173.98 2d1y s ILE 182 N 5.73 3.98 -0.79 0.00 -1.09 -1.26 -1.41 121.20 126.36 2d1y s ILE 182 Ca 0.74 -0.33 -0.21 0.00 -2.23 0.00 0.00 60.65 58.62 2d1y s ILE 182 Cb -0.24 -2.74 -0.15 0.00 -1.58 0.00 0.00 42.46 37.75 2d1y s ILE 182 CO 0.31 0.50 1.94 0.00 -1.23 0.00 0.00 174.94 176.46 2d1y n ALA 183 N 3.37 3.41 -2.27 9.38 0.00 0.14 -4.74 120.51 129.80 2d1y n ALA 183 Ca -0.17 -3.28 -0.24 0.00 0.00 0.00 0.00 53.44 49.74 2d1y n ALA 183 Cb 0.53 -3.61 0.01 0.00 0.00 0.00 0.00 19.45 16.38 2d1y n ALA 183 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2d1y s THR 184 N 4.90 4.05 0.37 0.00 -4.23 -1.26 -4.67 115.64 114.79 2d1y s THR 184 Ca 0.56 -0.29 0.10 0.00 -1.18 0.00 0.00 61.69 60.88 2d1y s THR 184 Cb 0.14 -3.53 0.33 0.00 1.34 0.00 0.00 72.50 70.78 2d1y s THR 184 CO 0.11 -0.43 1.87 -0.33 -0.54 0.00 0.00 174.62 175.30 2d1y h GLU 185 N 0.24 0.63 -0.61 3.99 5.08 -1.98 0.22 114.58 122.16 2d1y h GLU 185 Ca -0.46 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 57.79 2d1y h GLU 185 Cb 1.25 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.33 2d1y h GLU 185 CO 0.59 0.41 0.10 0.00 -1.00 0.00 0.00 179.01 179.11 2d1y h ALA 186 N 1.61 1.02 0.07 3.43 0.00 -1.95 -2.40 119.26 121.04 2d1y h ALA 186 Ca 0.44 -0.25 -0.26 0.00 0.00 0.00 0.00 54.91 54.84 2d1y h ALA 186 Cb 0.76 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.32 2d1y h ALA 186 CO -0.19 0.62 -1.11 0.28 0.00 0.00 0.00 179.25 178.85 2d1y h VAL 187 N 0.93 1.43 0.00 0.00 2.07 -1.31 -2.94 116.25 116.43 2d1y h VAL 187 Ca 0.19 -2.73 -0.04 0.00 0.82 0.00 0.00 66.70 64.94 2d1y h VAL 187 Cb 0.41 2.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.86 2d1y h VAL 187 CO 0.01 0.81 -0.21 -0.07 0.02 0.00 0.00 177.57 178.12 2d1y h LEU 188 N 0.16 0.00 0.10 2.57 3.38 -0.52 -2.80 115.31 118.21 2d1y h LEU 188 Ca -0.12 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.56 2d1y h LEU 188 Cb 1.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.53 2d1y h LEU 188 CO 0.19 0.21 -1.50 1.05 0.09 0.00 0.00 178.44 178.48 2d1y h GLU 189 N 0.00 0.22 0.00 1.13 4.11 -1.47 -3.27 114.58 115.29 2d1y h GLU 189 Ca -0.00 -0.37 -0.02 0.00 0.07 0.00 0.00 59.36 59.04 2d1y h GLU 189 Cb 0.46 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 2d1y h GLU 189 CO 0.03 1.07 -0.07 0.00 0.07 0.00 0.00 179.01 180.11 2d1y h ALA 190 N 0.56 1.45 -2.13 1.06 0.00 -1.31 -3.52 119.26 115.37 2d1y h ALA 190 Ca -0.23 -0.07 -0.46 0.00 0.00 0.00 0.00 54.91 54.16 2d1y h ALA 190 Cb 2.00 -0.01 0.12 0.00 0.00 0.00 0.00 17.79 19.89 2d1y h ALA 190 CO 0.16 0.09 0.32 0.42 0.00 0.00 0.00 179.25 180.24 2d1y s ILE 191 N -4.45 2.09 0.00 0.00 1.01 -1.09 -5.11 121.20 113.65 2d1y s ILE 191 Ca -0.04 -0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.46 2d1y s ILE 191 Cb 0.14 -2.94 0.00 0.00 0.01 0.00 0.00 42.46 39.68 2d1y s ILE 191 CO 0.58 0.00 0.00 -1.14 0.00 0.00 0.00 174.94 174.38 2d1y n ARG 199 N -3.31 0.00 -0.22 2.79 3.00 -1.26 -4.98 116.66 112.67 2d1y n ARG 199 Ca 0.12 0.00 0.01 0.00 -0.00 0.00 0.00 57.85 57.98 2d1y n ARG 199 Cb 0.60 0.00 0.25 0.00 0.00 0.00 0.00 32.46 33.31 2d1y n ARG 199 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.63 178.78 2d1y h THR 200 N 0.00 1.17 0.40 5.15 2.02 -2.01 0.74 112.91 120.38 2d1y h THR 200 Ca 0.00 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.82 2d1y h THR 200 Cb 0.00 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.49 2d1y h THR 200 CO 0.00 0.18 -0.19 -0.09 0.37 0.00 0.00 175.52 175.79 2d1y h ARG 201 N 1.00 -0.52 -0.49 6.66 9.65 -2.00 -2.47 114.38 126.22 2d1y h ARG 201 Ca 0.29 0.04 0.05 0.00 -1.10 0.00 0.00 59.98 59.25 2d1y h ARG 201 Cb -0.05 0.12 -0.05 0.00 -1.39 0.00 0.00 29.97 28.60 2d1y h ARG 201 CO -0.07 -0.23 0.23 0.00 2.80 0.00 0.00 179.97 182.70 2d1y h ARG 202 N -0.77 0.44 0.13 0.20 3.08 -1.90 -1.29 114.38 114.27 2d1y h ARG 202 Ca -0.05 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 59.98 2d1y h ARG 202 Cb 0.53 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 2d1y h ARG 202 CO 0.09 0.29 -0.16 -0.44 -1.07 0.00 0.00 179.97 178.68 2d1y h ASP 203 N 0.45 -0.43 -0.77 7.04 5.19 -0.87 0.33 116.42 127.37 2d1y h ASP 203 Ca 0.22 0.04 0.01 0.00 -0.62 0.00 0.00 57.03 56.68 2d1y h ASP 203 Cb 0.16 0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.78 2d1y h ASP 203 CO -0.17 -0.24 0.51 -0.50 -3.12 0.00 0.00 179.24 175.72 2d1y h TRP 204 N -0.33 0.97 -0.52 4.55 -0.00 -1.30 -2.65 115.95 116.67 2d1y h TRP 204 Ca 0.01 0.02 -0.03 0.00 -0.00 0.00 0.00 58.89 58.89 2d1y h TRP 204 Cb 0.33 -0.33 -0.02 0.00 -0.00 0.00 0.00 29.16 29.14 2d1y h TRP 204 CO -0.15 0.61 0.19 0.93 -0.00 0.00 0.00 178.44 180.03 2d1y h GLU 205 N 1.04 0.78 0.00 0.49 5.08 -0.88 -2.56 114.58 118.54 2d1y h GLU 205 Ca 0.28 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2d1y h GLU 205 Cb -0.12 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.01 2d1y h GLU 205 CO -0.06 0.70 0.00 -0.25 -1.00 0.00 0.00 179.01 178.40 2d1y n ASP 206 N -4.52 0.00 0.13 1.42 10.43 0.11 -1.87 116.55 122.25 2d1y n ASP 206 Ca 0.02 -0.70 0.12 0.00 2.57 0.00 0.00 54.79 56.80 2d1y n ASP 206 Cb 0.17 0.00 0.27 0.00 1.84 0.00 0.00 41.12 43.39 2d1y n ASP 206 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 2d1y h LEU 207 N 0.00 0.00 -9.34 0.64 3.38 -1.32 -3.45 115.31 105.22 2d1y h LEU 207 Ca 0.00 -0.04 -0.66 0.00 0.09 0.00 0.00 57.88 57.27 2d1y h LEU 207 Cb 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.61 2d1y h LEU 207 CO 0.00 0.02 -0.70 -1.00 0.09 0.00 0.00 178.44 176.85 2d1y s HIS 208 N -3.16 2.88 0.44 1.13 3.76 -0.78 -4.11 115.29 115.44 2d1y s HIS 208 Ca 0.08 -0.07 0.13 0.00 -0.15 0.00 0.00 55.06 55.05 2d1y s HIS 208 Cb 0.10 -1.52 0.97 0.00 1.11 0.00 0.00 32.58 33.24 2d1y s HIS 208 CO 0.65 0.44 1.98 0.00 -0.85 0.00 0.00 174.74 176.97 2d1y h ALA 209 N 3.73 1.67 0.00 -1.40 0.00 -0.80 -0.88 119.26 121.58 2d1y h ALA 209 Ca -0.48 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2d1y h ALA 209 Cb 1.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2d1y h ALA 209 CO 0.56 0.24 0.00 1.28 0.00 0.00 0.00 179.25 181.33 2d1y n LEU 210 N -4.32 0.00 -3.97 0.00 4.77 -0.82 -4.91 117.00 107.74 2d1y n LEU 210 Ca -0.02 0.19 -0.28 0.00 -0.03 0.00 0.00 56.01 55.87 2d1y n LEU 210 Cb 0.24 -0.19 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 2d1y n LEU 210 CO 0.37 -0.03 -0.10 0.54 -1.33 0.00 0.00 177.39 176.84 2d1y n ARG 211 N -1.19 -3.88 -3.53 3.23 1.74 -0.34 -4.95 116.66 107.74 2d1y n ARG 211 Ca 0.15 0.46 -0.09 0.00 -0.77 0.00 0.00 57.85 57.60 2d1y n ARG 211 Cb 0.17 -4.92 -0.02 0.00 -1.02 0.00 0.00 32.46 26.67 2d1y n ARG 211 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2d1y s ARG 212 N -6.57 1.15 0.46 5.56 1.70 -1.19 -4.77 118.95 115.29 2d1y s ARG 212 Ca 0.29 -0.48 -0.15 0.00 -0.47 0.00 0.00 55.73 54.92 2d1y s ARG 212 Cb -0.15 0.50 -0.08 0.00 -0.57 0.00 0.00 34.95 34.65 2d1y s ARG 212 CO 0.88 -0.51 0.91 -0.51 -1.08 0.00 0.00 175.30 174.98 2d1y s LEU 213 N -2.69 3.74 0.52 -1.89 1.43 -1.26 -4.81 118.68 113.72 2d1y s LEU 213 Ca 0.05 1.44 -0.07 0.00 -1.03 0.00 0.00 54.13 54.51 2d1y s LEU 213 Cb -0.02 -4.34 -0.04 0.00 0.03 0.00 0.00 46.19 41.83 2d1y s LEU 213 CO -0.08 -0.49 0.86 -0.83 0.23 0.00 0.00 176.35 176.03 2d1y s GLY 214 N -2.98 1.54 0.05 -3.19 0.00 -0.50 -4.78 107.32 97.46 2d1y s GLY 214 Ca 0.57 -0.39 -0.02 0.00 0.00 0.00 0.00 44.72 44.88 2d1y s GLY 214 CO 0.29 -0.19 0.23 0.54 0.00 0.00 0.00 173.10 173.96 2d1y s LYS 215 N -4.87 3.47 0.37 2.90 1.02 -1.26 0.24 119.74 121.62 2d1y s LYS 215 Ca 0.50 -0.33 0.11 0.00 0.02 0.00 0.00 55.97 56.26 2d1y s LYS 215 Cb -0.10 -3.03 0.88 0.00 -0.52 0.00 0.00 37.83 35.06 2d1y s LYS 215 CO 0.47 0.61 1.88 -1.35 -0.92 0.00 0.00 175.35 176.05 2d1y h PRO 216 N 3.32 0.60 -0.19 -1.68 0.11 -1.93 -0.30 132.00 131.92 2d1y h PRO 216 Ca -0.47 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 2d1y h PRO 216 Cb 1.17 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2d1y h PRO 216 CO 0.73 0.39 0.04 0.93 -0.21 0.00 0.00 178.00 179.88 2d1y h GLU 217 N 0.61 0.26 -0.06 1.05 3.07 -1.93 -1.53 114.58 116.05 2d1y h GLU 217 Ca 0.43 -0.03 -0.13 0.00 -0.50 0.00 0.00 59.36 59.13 2d1y h GLU 217 Cb 0.78 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.62 2d1y h GLU 217 CO -0.19 0.26 -0.55 0.93 -1.40 0.00 0.00 179.01 178.06 2d1y h GLU 218 N 0.26 0.18 -0.13 2.33 5.08 -1.44 -1.63 114.58 119.23 2d1y h GLU 218 Ca 0.07 -0.11 -0.17 0.00 -1.00 0.00 0.00 59.36 58.14 2d1y h GLU 218 Cb 0.12 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.39 2d1y h GLU 218 CO -0.00 0.69 -0.60 0.28 -1.00 0.00 0.00 179.01 178.37 2d1y h VAL 219 N 0.14 1.33 -0.94 3.13 2.07 -1.33 -3.19 116.25 117.46 2d1y h VAL 219 Ca -0.00 -1.87 0.09 0.00 0.82 0.00 0.00 66.70 65.74 2d1y h VAL 219 Cb 1.02 2.09 -0.07 0.00 -1.52 0.00 0.00 31.29 32.81 2d1y h VAL 219 CO 0.08 0.58 0.58 0.00 0.02 0.00 0.00 177.57 178.83 2d1y h ALA 220 N 0.51 1.34 -0.85 1.67 0.00 -1.07 -1.52 119.26 119.33 2d1y h ALA 220 Ca -0.04 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2d1y h ALA 220 Cb 1.24 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 2d1y h ALA 220 CO 0.13 0.28 0.51 0.93 0.00 0.00 0.00 179.25 181.10 2d1y h GLU 221 N 1.00 1.16 -0.49 0.00 4.39 -1.30 0.20 114.58 119.54 2d1y h GLU 221 Ca 0.43 -0.10 -0.12 0.00 0.34 0.00 0.00 59.36 59.91 2d1y h GLU 221 Cb 0.30 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 2d1y h GLU 221 CO -0.21 0.81 -0.18 0.00 -1.16 0.00 0.00 179.01 178.27 2d1y h ALA 222 N 1.39 0.76 -0.55 3.43 0.00 -1.30 -1.99 119.26 120.99 2d1y h ALA 222 Ca 0.31 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2d1y h ALA 222 Cb -0.05 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2d1y h ALA 222 CO -0.06 0.67 0.22 0.28 0.00 0.00 0.00 179.25 180.36 2d1y h VAL 223 N 0.85 1.22 -0.41 0.00 2.07 -0.74 -1.68 116.25 117.56 2d1y h VAL 223 Ca 0.12 -0.68 0.02 0.00 0.82 0.00 0.00 66.70 66.98 2d1y h VAL 223 Cb 0.74 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 2d1y h VAL 223 CO 0.06 0.26 0.22 -0.07 0.02 0.00 0.00 177.57 178.06 2d1y h LEU 224 N 0.74 0.35 -0.04 2.57 3.38 -0.79 -1.55 115.31 119.98 2d1y h LEU 224 Ca 0.18 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.18 2d1y h LEU 224 Cb 0.19 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2d1y h LEU 224 CO -0.02 0.25 -0.04 0.15 0.09 0.00 0.00 178.44 178.87 2d1y h PHE 225 N 0.45 -0.10 0.00 1.13 3.57 -1.04 -1.59 116.94 119.36 2d1y h PHE 225 Ca 0.17 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 2d1y h PHE 225 Cb 0.04 0.05 -0.00 0.00 2.79 0.00 0.00 35.95 38.82 2d1y h PHE 225 CO -0.08 -0.07 -0.15 -0.07 -2.23 0.00 0.00 178.31 175.71 2d1y h LEU 226 N -0.06 0.00 0.00 0.59 3.38 -1.11 -1.99 115.31 116.13 2d1y h LEU 226 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2d1y h LEU 226 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2d1y h LEU 226 CO -0.07 0.15 -0.41 0.00 0.09 0.00 0.00 178.44 178.19 2d1y n ALA 227 N -2.33 3.29 -2.12 1.53 0.00 -0.60 -4.83 120.51 115.45 2d1y n ALA 227 Ca -0.02 -0.30 -0.23 0.00 0.00 0.00 0.00 53.44 52.89 2d1y n ALA 227 Cb 0.25 -1.19 0.03 0.00 0.00 0.00 0.00 19.45 18.55 2d1y n ALA 227 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2d1y s SER 228 N -3.07 5.50 0.28 0.00 1.04 -0.63 -4.75 113.70 112.06 2d1y s SER 228 Ca 0.11 0.30 0.24 0.00 0.48 0.00 0.00 55.95 57.08 2d1y s SER 228 Cb 0.18 -1.31 1.02 0.00 0.10 0.00 0.00 66.02 66.01 2d1y s SER 228 CO 0.67 -1.01 1.72 -0.62 0.98 0.00 0.00 173.24 174.97 2d1y n GLU 229 N -2.36 0.20 0.28 4.02 1.02 -1.26 -1.84 120.64 120.70 2d1y n GLU 229 Ca 0.05 0.46 0.17 0.00 -0.02 0.00 0.00 57.16 57.81 2d1y n GLU 229 Cb 0.59 -1.90 0.80 0.00 -0.02 0.00 0.00 31.44 30.91 2d1y n GLU 229 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2d1y h LYS 230 N 0.00 0.00 -0.80 3.49 1.79 -1.94 -1.94 116.57 117.17 2d1y h LYS 230 Ca 0.00 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 58.01 2d1y h LYS 230 Cb 0.32 0.00 -0.26 0.00 -1.58 0.00 0.00 32.23 30.72 2d1y h LYS 230 CO 0.00 0.05 0.40 0.00 -1.08 0.00 0.00 179.45 178.83 2d1y n ALA 231 N -2.15 5.37 0.18 3.86 0.00 -0.76 -4.75 120.51 122.26 2d1y n ALA 231 Ca -0.01 -3.14 0.18 0.00 0.00 0.00 0.00 53.44 50.47 2d1y n ALA 231 Cb 0.24 -1.25 0.81 0.00 0.00 0.00 0.00 19.45 19.26 2d1y n ALA 231 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2d1y h SER 232 N 1.26 0.00 -0.34 0.00 4.64 -1.50 -0.75 113.55 116.87 2d1y h SER 232 Ca 0.50 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.74 2d1y h SER 232 Cb 2.07 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 64.11 2d1y h SER 232 CO 0.98 0.00 0.01 0.33 -0.87 0.00 0.00 176.83 177.29 2d1y n PHE 233 N -3.68 1.13 -4.03 4.77 7.35 -1.26 -4.92 117.46 116.82 2d1y n PHE 233 Ca 0.03 -1.14 -0.34 0.00 -0.76 0.00 0.00 57.45 55.24 2d1y n PHE 233 Cb 0.42 -0.41 -0.15 0.00 0.35 0.00 0.00 39.48 39.69 2d1y n PHE 233 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 2d1y s ILE 234 N -2.98 2.52 -0.09 -2.13 1.01 -0.29 -5.09 121.20 114.15 2d1y s ILE 234 Ca 0.44 -0.99 -0.21 0.00 0.00 0.00 0.00 60.65 59.89 2d1y s ILE 234 Cb 0.37 -2.20 0.05 0.00 0.01 0.00 0.00 42.46 40.68 2d1y s ILE 234 CO 0.06 0.34 0.50 0.28 0.00 0.00 0.00 174.94 176.12 2d1y s THR 235 N 1.30 0.02 -0.09 2.92 -1.32 -1.26 -4.71 115.64 112.51 2d1y s THR 235 Ca 0.02 -0.16 0.00 0.00 -1.21 0.00 0.00 61.69 60.34 2d1y s THR 235 Cb -0.15 -0.77 0.00 0.00 -1.51 0.00 0.00 72.50 70.07 2d1y s THR 235 CO -0.08 -0.09 0.00 0.61 -2.21 0.00 0.00 174.62 172.85 2d1y n GLY 236 N 1.74 0.44 3.88 6.08 0.00 0.16 -4.96 105.19 112.52 2d1y n GLY 236 Ca -0.18 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 2d1y n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d1y s ALA 237 N -1.81 3.69 -0.29 4.61 0.00 -1.26 -4.68 121.76 122.03 2d1y s ALA 237 Ca 0.00 -0.41 -0.00 0.00 0.00 0.00 0.00 51.96 51.55 2d1y s ALA 237 Cb 0.00 -2.28 0.05 0.00 0.00 0.00 0.00 23.12 20.90 2d1y s ALA 237 CO 0.00 0.59 -0.04 0.42 0.00 0.00 0.00 175.76 176.73 2d1y s ILE 238 N -1.65 2.69 -0.34 0.00 -1.09 -1.26 -1.01 121.20 118.53 2d1y s ILE 238 Ca 0.42 -1.48 -0.11 0.00 -2.23 0.00 0.00 60.65 57.25 2d1y s ILE 238 Cb -0.12 -2.56 0.00 0.00 -1.58 0.00 0.00 42.46 38.20 2d1y s ILE 238 CO 0.22 -0.08 0.19 -0.22 -1.23 0.00 0.00 174.94 173.81 2d1y s LEU 239 N 1.20 4.40 0.30 2.97 2.96 0.11 -4.92 118.68 125.71 2d1y s LEU 239 Ca -0.06 -0.69 -0.29 0.00 -0.22 0.00 0.00 54.13 52.87 2d1y s LEU 239 Cb -0.20 -2.03 -0.10 0.00 0.50 0.00 0.00 46.19 44.36 2d1y s LEU 239 CO -0.03 -0.28 1.15 -2.84 -1.32 0.00 0.00 176.35 173.04 2d1y s PRO 240 N 1.61 4.51 -0.50 0.98 0.02 -1.26 -0.33 135.00 140.02 2d1y s PRO 240 Ca 0.04 1.90 0.06 0.00 0.02 0.00 0.00 61.00 63.02 2d1y s PRO 240 Cb -0.18 -3.10 0.23 0.00 0.02 0.00 0.00 34.50 31.46 2d1y s PRO 240 CO 0.07 0.07 0.55 0.28 -0.33 0.00 0.00 177.00 177.64 2d1y n VAL 241 N 0.97 0.35 -1.62 3.83 0.31 -0.63 -4.82 118.33 116.73 2d1y n VAL 241 Ca -0.00 -4.35 0.05 0.00 -0.01 0.00 0.00 64.34 60.02 2d1y n VAL 241 Cb 0.44 -1.97 0.07 0.00 -0.91 0.00 0.00 33.84 31.47 2d1y n VAL 241 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2d1y n ASP 242 N 1.56 1.17 -1.96 4.52 5.68 -1.26 -1.80 116.55 124.46 2d1y n ASP 242 Ca 0.25 -2.58 -0.17 0.00 -0.50 0.00 0.00 54.79 51.79 2d1y n ASP 242 Cb 0.47 -0.32 -0.04 0.00 -1.14 0.00 0.00 41.12 40.08 2d1y n ASP 242 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2d1y n GLY 243 N -0.64 0.54 1.00 6.12 0.00 -1.26 -1.35 105.19 109.59 2d1y n GLY 243 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2d1y n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d1y n GLY 244 N -0.62 0.76 0.18 -0.02 0.00 -1.26 -0.28 105.19 103.96 2d1y n GLY 244 Ca -0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 2d1y n GLY 244 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2d1y h MET 245 N 2.72 -0.13 0.00 1.61 1.85 -1.37 -2.06 114.93 117.55 2d1y h MET 245 Ca 0.00 0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.10 2d1y h MET 245 Cb 0.00 0.03 0.00 0.00 0.43 0.00 0.00 31.60 32.06 2d1y h MET 245 CO 0.00 -0.09 0.00 0.25 -0.40 0.00 0.00 176.91 176.67 2d1y n THR 246 N -5.29 0.00 0.34 -0.77 -2.24 -1.26 -3.06 114.28 102.00 2d1y n THR 246 Ca -0.02 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.88 2d1y n THR 246 Cb 0.21 -0.27 0.10 0.00 -2.10 0.00 0.00 70.33 68.26 2d1y n THR 246 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d1y h ALA 247 N 3.08 0.59 -2.50 6.98 0.00 -1.77 -3.48 119.26 122.17 2d1y h ALA 247 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2d1y h ALA 247 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 17.63 2d1y h ALA 247 CO 0.00 0.00 -0.01 0.45 0.00 0.00 0.00 179.25 179.69 2d1y s SER 248 N -4.91 -0.39 -0.02 0.00 0.15 -1.17 -5.05 113.70 102.30 2d1y s SER 248 Ca 0.03 0.13 0.17 0.00 0.70 0.00 0.00 55.95 56.98 2d1y s SER 248 Cb 0.11 0.47 -0.26 0.00 -1.71 0.00 0.00 66.02 64.63 2d1y s SER 248 CO 0.74 -0.70 0.41 0.49 1.20 0.00 0.00 173.24 175.38 2d1y n PHE 249 N 0.45 0.00 1.57 3.44 3.72 -1.26 -4.92 117.46 120.45 2d1y n PHE 249 Ca -0.18 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.36 2d1y n PHE 249 Cb 0.60 -0.35 0.58 0.00 -0.94 0.00 0.00 39.48 39.37 2d1y n PHE 249 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71