#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d1y n LEU 3 N 0.00 0.56 -1.12 0.99 4.77 -1.20 -2.44 117.00 118.56 2d1y n LEU 3 Ca 0.00 0.75 0.04 0.00 -0.03 0.00 0.00 56.01 56.77 2d1y n LEU 3 Cb 0.00 -0.81 0.07 0.00 -2.33 0.00 0.00 43.42 40.36 2d1y n LEU 3 CO 0.00 -0.91 0.17 0.49 -1.33 0.00 0.00 177.39 175.81 2d1y n PHE 4 N -2.24 0.00 -1.68 -1.77 3.72 -0.78 -4.84 117.46 109.87 2d1y n PHE 4 Ca -0.01 -0.73 -0.49 0.00 -0.05 0.00 0.00 57.45 56.17 2d1y n PHE 4 Cb 0.05 -0.17 -0.05 0.00 -0.94 0.00 0.00 39.48 38.38 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 -0.04 0.81 -0.90 4.37 0.00 -1.02 -1.23 120.51 122.50 2d1y n ALA 5 Ca 0.09 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2d1y n ALA 5 Cb 0.97 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.98 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 4.19 0.50 3.81 0.00 0.00 -0.37 -4.91 105.19 108.40 2d1y n GLY 6 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.52 4.30 -0.21 1.61 -0.14 -0.37 -4.78 119.74 119.64 2d1y s LYS 7 Ca 0.00 0.91 -0.22 0.00 -1.36 0.00 0.00 55.97 55.30 2d1y s LYS 7 Cb 0.00 -2.97 -0.02 0.00 -1.68 0.00 0.00 37.83 33.16 2d1y s LYS 7 CO 0.00 0.44 0.67 0.20 -0.76 0.00 0.00 175.35 175.91 2d1y s GLY 8 N -1.53 1.99 -0.11 -3.33 0.00 -1.26 -0.49 107.32 102.59 2d1y s GLY 8 Ca 0.41 -0.25 0.02 0.00 0.00 0.00 0.00 44.72 44.90 2d1y s GLY 8 CO 0.22 1.42 -0.17 0.14 0.00 0.00 0.00 173.10 174.71 2d1y s VAL 9 N 2.13 1.66 -0.18 1.40 1.01 -0.46 -0.31 120.40 125.64 2d1y s VAL 9 Ca 0.30 -0.74 -0.08 0.00 0.00 0.00 0.00 61.98 61.46 2d1y s VAL 9 Cb -0.16 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 2d1y s VAL 9 CO 0.10 0.47 0.07 -0.76 0.00 0.00 0.00 175.10 174.98 2d1y s LEU 10 N 0.89 3.88 -0.12 3.92 1.02 0.09 -0.87 118.68 127.48 2d1y s LEU 10 Ca -0.08 0.11 -0.00 0.00 0.02 0.00 0.00 54.13 54.17 2d1y s LEU 10 Cb -0.15 -1.98 0.03 0.00 0.02 0.00 0.00 46.19 44.10 2d1y s LEU 10 CO -0.01 0.18 -0.08 -0.69 0.02 0.00 0.00 176.35 175.77 2d1y s VAL 11 N 0.36 1.09 0.24 -1.59 1.01 -0.29 -0.49 120.40 120.72 2d1y s VAL 11 Ca 0.04 -0.37 -0.16 0.00 0.00 0.00 0.00 61.98 61.49 2d1y s VAL 11 Cb -0.12 -1.12 -0.08 0.00 0.00 0.00 0.00 36.38 35.06 2d1y s VAL 11 CO -0.00 0.34 0.67 0.42 0.00 0.00 0.00 175.10 176.53 2d1y s THR 12 N 1.68 4.70 -1.32 3.92 -4.23 -0.79 -2.22 115.64 117.37 2d1y s THR 12 Ca 0.04 1.01 -0.06 0.00 -1.18 0.00 0.00 61.69 61.50 2d1y s THR 12 Cb -0.13 -3.74 0.01 0.00 1.34 0.00 0.00 72.50 69.99 2d1y s THR 12 CO -0.08 0.07 1.08 0.61 -0.54 0.00 0.00 174.62 175.76 2d1y n GLY 13 N 0.34 -0.47 1.01 3.99 0.00 0.49 -2.82 105.19 107.74 2d1y n GLY 13 Ca -0.01 0.19 0.06 0.00 0.00 0.00 0.00 46.02 46.26 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 -1.67 1.59 0.16 -0.02 0.00 -0.89 -4.17 105.19 100.20 2d1y n GLY 14 Ca -0.11 -0.49 -0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 3.49 1.13 -2.45 4.61 0.00 -1.88 -3.23 119.26 120.92 2d1y h ALA 15 Ca 0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 2d1y h ALA 15 Cb 0.92 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2d1y h ALA 15 CO 0.13 0.64 0.04 2.89 0.00 0.00 0.00 179.25 182.95 2d1y n ARG 16 N -3.94 0.27 0.00 0.00 1.85 -1.26 -4.59 116.66 108.99 2d1y n ARG 16 Ca -0.02 -0.63 0.00 0.00 -1.00 0.00 0.00 57.85 56.20 2d1y n ARG 16 Cb 0.52 0.73 0.00 0.00 -1.05 0.00 0.00 32.46 32.67 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 -0.15 2.33 0.32 2.89 0.00 -1.26 -1.79 105.19 107.54 2d1y n GLY 17 Ca -0.02 -0.25 -0.05 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.85 -0.61 2.04 -1.91 -2.35 117.51 115.07 2d1y h ILE 18 Ca 0.00 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.24 2d1y h ILE 18 Cb 0.00 0.22 -0.05 0.00 -0.74 0.00 0.00 36.82 36.26 2d1y h ILE 18 CO 0.00 0.28 0.55 1.23 0.00 0.00 0.00 178.15 180.21 2d1y h GLY 19 N 1.11 1.22 1.03 5.37 0.00 -1.68 0.87 103.07 110.99 2d1y h GLY 19 Ca 0.27 -0.43 -0.08 0.00 0.00 0.00 0.00 47.33 47.10 2d1y h GLY 19 CO -0.04 0.38 0.01 -0.09 0.00 0.00 0.00 176.54 176.81 2d1y h ARG 20 N 1.09 0.93 -0.82 4.80 2.43 -1.12 -0.62 114.38 121.08 2d1y h ARG 20 Ca 0.33 -0.29 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2d1y h ARG 20 Cb -0.04 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.39 2d1y h ARG 20 CO -0.10 0.94 0.36 0.00 -1.51 0.00 0.00 179.97 179.66 2d1y h ALA 21 N 0.96 1.06 -0.22 2.80 0.00 -0.85 -1.48 119.26 121.52 2d1y h ALA 21 Ca 0.15 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2d1y h ALA 21 Cb 0.51 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2d1y h ALA 21 CO 0.02 0.65 0.05 0.82 0.00 0.00 0.00 179.25 180.80 2d1y h ILE 22 N 1.18 1.21 -0.82 0.00 2.04 -0.54 -0.35 117.51 120.23 2d1y h ILE 22 Ca 0.28 -0.67 0.05 0.00 1.00 0.00 0.00 64.86 65.51 2d1y h ILE 22 Cb 0.17 1.24 -0.06 0.00 -0.74 0.00 0.00 36.82 37.43 2d1y h ILE 22 CO -0.03 0.21 0.51 0.00 0.00 0.00 0.00 178.15 178.84 2d1y h ALA 23 N 0.87 1.10 -0.30 1.87 0.00 -0.85 -1.12 119.26 120.83 2d1y h ALA 23 Ca 0.07 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 2d1y h ALA 23 Cb 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2d1y h ALA 23 CO 0.00 0.28 -0.44 1.96 0.00 0.00 0.00 179.25 181.06 2d1y h GLN 24 N 0.96 0.75 -0.32 0.00 4.20 -1.13 -2.12 115.11 117.45 2d1y h GLN 24 Ca 0.34 -0.41 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 2d1y h GLN 24 Cb 0.10 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2d1y h GLN 24 CO -0.15 1.04 0.16 0.00 -0.67 0.00 0.00 178.83 179.21 2d1y h ALA 25 N 0.90 0.41 -0.66 3.87 0.00 -0.47 -0.45 119.26 122.87 2d1y h ALA 25 Ca 0.04 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2d1y h ALA 25 Cb 1.00 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2d1y h ALA 25 CO 0.09 -0.04 0.19 0.74 0.00 0.00 0.00 179.25 180.23 2d1y h PHE 26 N 0.39 1.06 -0.53 0.00 0.04 -1.18 -2.40 116.94 114.31 2d1y h PHE 26 Ca 0.11 -0.10 -0.08 0.00 2.80 0.00 0.00 57.97 60.70 2d1y h PHE 26 Cb 0.10 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 37.92 2d1y h PHE 26 CO -0.02 0.85 0.02 0.00 -0.60 0.00 0.00 178.31 178.56 2d1y h ALA 27 N 1.22 1.04 0.00 2.45 0.00 -1.07 -1.60 119.26 121.31 2d1y h ALA 27 Ca 0.21 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2d1y h ALA 27 Cb 0.31 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2d1y h ALA 27 CO -0.00 0.60 -0.08 -0.09 0.00 0.00 0.00 179.25 179.67 2d1y h ARG 28 N 0.82 0.00 -0.62 0.00 2.43 -0.67 -1.50 114.38 114.83 2d1y h ARG 28 Ca 0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2d1y h ARG 28 Cb 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2d1y h ARG 28 CO 0.02 0.08 0.00 0.39 -1.51 0.00 0.00 179.97 178.95 2d1y n GLU 29 N -3.41 3.06 -0.57 0.20 -0.58 -0.70 -4.85 120.64 113.79 2d1y n GLU 29 Ca -0.01 -2.30 0.00 0.00 -0.42 0.00 0.00 57.16 54.43 2d1y n GLU 29 Cb 0.24 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.40 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 1.09 0.75 3.84 0.62 0.00 -0.57 -1.87 105.19 109.05 2d1y n GLY 30 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.57 2.93 -0.43 4.61 0.00 -0.69 -1.24 121.76 124.37 2d1y s ALA 31 Ca 0.00 0.10 -0.16 0.00 0.00 0.00 0.00 51.96 51.89 2d1y s ALA 31 Cb 0.00 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 20.01 2d1y s ALA 31 CO 0.00 -0.73 0.39 -0.51 0.00 0.00 0.00 175.76 174.91 2d1y s LEU 32 N -4.89 5.08 -0.14 0.00 1.43 0.36 -4.49 118.68 116.02 2d1y s LEU 32 Ca 0.58 -0.87 -0.08 0.00 -1.03 0.00 0.00 54.13 52.72 2d1y s LEU 32 Cb -0.12 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.78 2d1y s LEU 32 CO 0.46 -0.56 0.15 -0.69 0.23 0.00 0.00 176.35 175.94 2d1y s VAL 33 N 1.93 5.45 -0.14 -1.59 1.01 -1.26 -1.36 120.40 124.44 2d1y s VAL 33 Ca 0.08 0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.31 2d1y s VAL 33 Cb -0.19 -3.44 0.02 0.00 0.00 0.00 0.00 36.38 32.77 2d1y s VAL 33 CO 0.11 0.55 -0.14 0.00 0.00 0.00 0.00 175.10 175.62 2d1y s ALA 34 N -0.54 1.84 0.19 5.51 0.00 -0.05 -0.34 121.76 128.38 2d1y s ALA 34 Ca 0.13 -0.89 0.09 0.00 0.00 0.00 0.00 51.96 51.29 2d1y s ALA 34 Cb -0.12 -1.03 -0.04 0.00 0.00 0.00 0.00 23.12 21.93 2d1y s ALA 34 CO 0.02 -0.34 -0.18 -0.48 0.00 0.00 0.00 175.76 174.79 2d1y s LEU 35 N 1.42 2.48 0.13 0.00 2.34 -0.21 -1.14 118.68 123.71 2d1y s LEU 35 Ca 0.03 -0.92 0.03 0.00 0.06 0.00 0.00 54.13 53.34 2d1y s LEU 35 Cb -0.13 -0.83 -0.04 0.00 -0.56 0.00 0.00 46.19 44.62 2d1y s LEU 35 CO -0.10 -0.06 -0.08 0.00 -1.06 0.00 0.00 176.35 175.06 2d1y s ASP 37 N -3.11 -0.15 0.20 0.00 -1.08 -0.99 -0.38 116.67 111.15 2d1y s ASP 37 Ca 0.15 -0.00 0.11 0.00 -0.52 0.00 0.00 52.55 52.28 2d1y s ASP 37 Cb 0.04 0.17 -0.04 0.00 -1.46 0.00 0.00 42.92 41.62 2d1y s ASP 37 CO -0.02 -0.27 1.38 -0.07 0.52 0.00 0.00 175.17 176.71 2d1y h LEU 38 N 2.00 0.00 -9.28 -1.34 3.38 -1.89 -1.85 115.31 106.33 2d1y h LEU 38 Ca -0.11 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.31 2d1y h LEU 38 Cb 1.17 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 2d1y h LEU 38 CO 0.24 0.78 0.59 -0.13 0.09 0.00 0.00 178.44 180.00 2d1y s ARG 39 N -2.89 4.41 0.61 1.13 0.52 -1.26 -4.87 118.95 116.60 2d1y s ARG 39 Ca 0.02 1.45 0.40 0.00 -0.52 0.00 0.00 55.73 57.09 2d1y s ARG 39 Cb 0.09 -3.54 2.10 0.00 0.52 0.00 0.00 34.95 34.12 2d1y s ARG 39 CO 0.78 -0.33 2.23 -1.00 0.02 0.00 0.00 175.30 177.00 2d1y h PRO 40 N 7.16 0.00 0.00 3.54 0.13 -2.01 -2.17 132.00 138.65 2d1y h PRO 40 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2d1y h PRO 40 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2d1y h PRO 40 CO 0.86 0.00 0.00 1.49 -0.23 0.00 0.00 178.00 180.12 2d1y h GLU 41 N 0.00 0.00 -0.22 0.86 4.81 -1.92 -1.74 114.58 116.37 2d1y h GLU 41 Ca 0.00 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2d1y h GLU 41 Cb 0.10 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 2d1y h GLU 41 CO 0.00 0.00 0.17 0.78 -0.73 0.00 0.00 179.01 179.23 2d1y h GLY 42 N 0.17 0.00 0.71 1.92 0.00 -1.64 -1.99 103.07 102.24 2d1y h GLY 42 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.36 2d1y h GLY 42 CO 0.00 0.00 0.07 1.70 0.00 0.00 0.00 176.54 178.31 2d1y h LYS 43 N 0.00 0.17 -0.74 4.80 3.64 -1.57 -2.04 116.57 120.83 2d1y h LYS 43 Ca 0.10 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2d1y h LYS 43 Cb 0.44 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.18 2d1y h LYS 43 CO -0.00 0.11 0.46 0.93 -2.27 0.00 0.00 179.45 178.68 2d1y h GLU 44 N 0.18 0.99 -0.39 1.90 3.07 -1.57 -1.42 114.58 117.33 2d1y h GLU 44 Ca 0.12 -0.08 0.04 0.00 -0.50 0.00 0.00 59.36 58.95 2d1y h GLU 44 Cb 0.12 -0.21 -0.04 0.00 -0.84 0.00 0.00 28.75 27.77 2d1y h GLU 44 CO -0.15 0.69 0.15 0.28 -1.40 0.00 0.00 179.01 178.58 2d1y h VAL 45 N 1.01 0.90 -0.58 3.13 2.07 -1.36 -1.17 116.25 120.25 2d1y h VAL 45 Ca 0.27 -0.11 -0.08 0.00 0.82 0.00 0.00 66.70 67.59 2d1y h VAL 45 Cb -0.06 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 2d1y h VAL 45 CO -0.05 0.06 0.03 0.00 0.02 0.00 0.00 177.57 177.62 2d1y h ALA 46 N 1.24 0.96 -0.47 1.67 0.00 -1.07 -2.70 119.26 118.90 2d1y h ALA 46 Ca 0.18 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2d1y h ALA 46 Cb 0.14 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2d1y h ALA 46 CO -0.17 0.64 0.25 0.93 0.00 0.00 0.00 179.25 180.89 2d1y h GLU 47 N 0.90 0.67 -0.11 0.00 5.08 -0.76 0.72 114.58 121.08 2d1y h GLU 47 Ca 0.17 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 2d1y h GLU 47 Cb 0.49 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2d1y h GLU 47 CO 0.02 0.54 -0.07 0.00 -1.00 0.00 0.00 179.01 178.51 2d1y h ALA 48 N 1.09 1.68 -0.45 3.43 0.00 -1.07 -2.46 119.26 121.49 2d1y h ALA 48 Ca 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2d1y h ALA 48 Cb 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2d1y h ALA 48 CO -0.02 0.24 0.00 0.44 0.00 0.00 0.00 179.25 179.90 2d1y n ILE 49 N -4.37 1.84 -2.00 0.00 -5.35 -1.00 -4.94 119.36 103.54 2d1y n ILE 49 Ca -0.01 -1.38 -0.16 0.00 -0.27 0.00 0.00 62.75 60.92 2d1y n ILE 49 Cb 0.20 0.07 -0.04 0.00 -1.74 0.00 0.00 39.64 38.13 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 0.42 0.43 0.00 3.28 0.00 0.07 -4.87 105.19 104.51 2d1y n GLY 50 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.64 1.51 3.44 -0.02 0.00 0.23 -4.85 105.19 104.86 2d1y n GLY 51 Ca -0.18 -2.05 -0.31 0.00 0.00 0.00 0.00 46.02 43.48 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 -2.28 2.55 -0.03 4.61 0.00 0.54 -4.47 121.76 122.68 2d1y s ALA 52 Ca 0.00 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.88 2d1y s ALA 52 Cb 0.00 -0.75 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 2d1y s ALA 52 CO 0.00 0.56 -0.23 0.12 0.00 0.00 0.00 175.76 176.21 2d1y s PHE 53 N -0.85 2.12 -0.09 0.00 5.36 -1.26 -1.04 117.98 122.22 2d1y s PHE 53 Ca 0.13 -0.46 -0.01 0.00 -0.96 0.00 0.00 56.93 55.63 2d1y s PHE 53 Cb -0.10 -1.38 0.03 0.00 -0.34 0.00 0.00 43.02 41.23 2d1y s PHE 53 CO 0.03 -0.08 -0.04 -0.06 -1.46 0.00 0.00 175.22 173.61 2d1y s PHE 54 N -0.42 1.10 -0.48 10.12 0.08 -0.30 -4.97 117.98 123.11 2d1y s PHE 54 Ca 0.06 -0.47 -0.29 0.00 0.12 0.00 0.00 56.93 56.35 2d1y s PHE 54 Cb -0.10 -1.02 0.03 0.00 -0.57 0.00 0.00 43.02 41.36 2d1y s PHE 54 CO 0.00 -0.41 1.13 -1.14 -0.10 0.00 0.00 175.22 174.70 2d1y s GLN 55 N 1.76 3.71 -0.02 0.44 0.74 -1.26 -2.35 119.66 122.68 2d1y s GLN 55 Ca 0.04 0.54 0.01 0.00 0.05 0.00 0.00 55.36 56.00 2d1y s GLN 55 Cb -0.13 -3.91 0.01 0.00 1.10 0.00 0.00 33.01 30.08 2d1y s GLN 55 CO -0.06 -1.38 -0.04 0.08 -0.55 0.00 0.00 175.29 173.34 2d1y s VAL 56 N 4.43 0.42 -0.68 1.34 1.01 -0.70 -4.92 120.40 121.30 2d1y s VAL 56 Ca 0.47 -0.15 -0.19 0.00 0.00 0.00 0.00 61.98 62.11 2d1y s VAL 56 Cb -0.07 -0.40 0.12 0.00 0.00 0.00 0.00 36.38 36.02 2d1y s VAL 56 CO 0.32 0.15 0.80 -0.62 0.00 0.00 0.00 175.10 175.75 2d1y s ASP 57 N 0.34 6.31 0.00 3.32 -1.08 -1.26 -3.55 116.67 120.75 2d1y s ASP 57 Ca -0.04 -1.61 0.05 0.00 -0.52 0.00 0.00 52.55 50.43 2d1y s ASP 57 Cb -0.07 -2.32 0.23 0.00 -1.46 0.00 0.00 42.92 39.30 2d1y s ASP 57 CO -0.00 -1.09 1.00 0.18 0.52 0.00 0.00 175.17 175.78 2d1y n LEU 58 N 6.27 0.00 0.17 -1.34 4.77 -1.26 -1.58 117.00 124.03 2d1y n LEU 58 Ca -0.01 0.30 0.04 0.00 -0.03 0.00 0.00 56.01 56.31 2d1y n LEU 58 Cb 0.44 -0.30 0.25 0.00 -2.33 0.00 0.00 43.42 41.47 2d1y n LEU 58 CO 0.55 -0.26 0.61 -0.08 -1.33 0.00 0.00 177.39 176.88 2d1y h GLU 59 N 0.00 0.00 -5.37 3.23 4.81 -1.91 -3.43 114.58 111.91 2d1y h GLU 59 Ca 0.00 0.00 -0.62 0.00 -0.13 0.00 0.00 59.36 58.61 2d1y h GLU 59 Cb 0.05 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 29.30 2d1y h GLU 59 CO 0.00 0.44 -0.01 0.34 -0.73 0.00 0.00 179.01 179.05 2d1y s ASP 60 N -6.47 6.45 0.48 1.04 -1.08 -0.61 -4.90 116.67 111.57 2d1y s ASP 60 Ca 0.01 0.54 0.16 0.00 -0.52 0.00 0.00 52.55 52.74 2d1y s ASP 60 Cb 0.10 -2.28 1.15 0.00 -1.46 0.00 0.00 42.92 40.43 2d1y s ASP 60 CO 0.71 -0.28 2.05 1.05 0.52 0.00 0.00 175.17 179.21 2d1y h GLU 61 N 7.97 0.22 -0.28 4.34 4.11 -1.86 -1.12 114.58 127.95 2d1y h GLU 61 Ca -0.29 -0.01 -0.13 0.00 0.07 0.00 0.00 59.36 58.99 2d1y h GLU 61 Cb 1.14 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 2d1y h GLU 61 CO 0.72 0.15 -0.37 0.00 0.07 0.00 0.00 179.01 179.58 2d1y h ARG 62 N 0.23 0.64 -0.16 1.06 3.08 -1.93 -2.29 114.38 115.01 2d1y h ARG 62 Ca 0.16 -0.31 -0.13 0.00 0.07 0.00 0.00 59.98 59.77 2d1y h ARG 62 Cb 0.36 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 2d1y h ARG 62 CO -0.03 0.91 -0.46 0.93 -1.07 0.00 0.00 179.97 180.25 2d1y h GLU 63 N 0.53 0.40 -0.45 0.04 4.39 -1.50 -1.67 114.58 116.32 2d1y h GLU 63 Ca 0.05 -0.22 -0.12 0.00 0.34 0.00 0.00 59.36 59.42 2d1y h GLU 63 Cb 0.88 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.53 2d1y h GLU 63 CO 0.08 0.78 -0.19 0.00 -1.16 0.00 0.00 179.01 178.52 2d1y h ARG 64 N 0.32 0.89 -0.25 2.33 3.08 -1.18 -1.10 114.38 118.47 2d1y h ARG 64 Ca 0.02 -0.35 -0.03 0.00 0.07 0.00 0.00 59.98 59.69 2d1y h ARG 64 Cb 0.94 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.94 2d1y h ARG 64 CO 0.08 1.00 0.06 0.28 -1.07 0.00 0.00 179.97 180.31 2d1y h VAL 65 N 0.78 1.22 -0.46 2.04 2.07 -1.22 -2.86 116.25 117.81 2d1y h VAL 65 Ca 0.11 -0.71 0.03 0.00 0.82 0.00 0.00 66.70 66.95 2d1y h VAL 65 Cb 0.72 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 2d1y h VAL 65 CO 0.06 0.23 0.26 -0.09 0.02 0.00 0.00 177.57 178.05 2d1y h ARG 66 N 0.23 0.51 -0.28 1.57 2.43 -1.11 -2.07 114.38 115.67 2d1y h ARG 66 Ca 0.08 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.26 2d1y h ARG 66 Cb 0.29 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.68 2d1y h ARG 66 CO 0.00 0.34 0.01 0.35 -1.51 0.00 0.00 179.97 179.16 2d1y h PHE 67 N 0.52 0.01 -0.62 2.20 3.57 -1.10 0.03 116.94 121.56 2d1y h PHE 67 Ca 0.19 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 2d1y h PHE 67 Cb 0.04 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 2d1y h PHE 67 CO -0.08 -0.03 0.07 0.28 -2.23 0.00 0.00 178.31 176.32 2d1y h VAL 68 N 0.10 1.26 0.62 1.41 2.07 -1.34 -0.08 116.25 120.29 2d1y h VAL 68 Ca 0.13 -1.06 -0.03 0.00 0.82 0.00 0.00 66.70 66.57 2d1y h VAL 68 Cb 0.16 0.73 0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2d1y h VAL 68 CO -0.21 0.39 -0.30 -0.33 0.02 0.00 0.00 177.57 177.14 2d1y h GLU 69 N 0.95 -0.81 -0.52 1.57 5.08 -1.01 0.12 114.58 119.96 2d1y h GLU 69 Ca 0.18 0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 2d1y h GLU 69 Cb 0.47 0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 2d1y h GLU 69 CO 0.02 -0.51 0.25 0.93 -1.00 0.00 0.00 179.01 178.70 2d1y h GLU 70 N -0.92 0.73 -0.16 2.33 4.39 -0.99 -1.06 114.58 118.89 2d1y h GLU 70 Ca -0.09 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.48 2d1y h GLU 70 Cb 0.67 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2d1y h GLU 70 CO 0.14 0.57 -0.09 0.00 -1.16 0.00 0.00 179.01 178.47 2d1y h ALA 71 N 1.54 0.23 -0.79 3.43 0.00 -0.93 -1.07 119.26 121.67 2d1y h ALA 71 Ca 0.18 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2d1y h ALA 71 Cb 0.08 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2d1y h ALA 71 CO -0.02 0.06 0.52 0.00 0.00 0.00 0.00 179.25 179.81 2d1y h ALA 72 N 0.66 1.01 -0.25 0.00 0.00 -0.64 0.10 119.26 120.15 2d1y h ALA 72 Ca 0.03 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2d1y h ALA 72 Cb 0.58 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2d1y h ALA 72 CO 0.03 0.40 -0.09 -0.92 0.00 0.00 0.00 179.25 178.67 2d1y h TYR 73 N 1.06 0.57 -0.40 0.00 3.20 -1.17 0.14 116.97 120.37 2d1y h TYR 73 Ca 0.29 -0.13 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 2d1y h TYR 73 Cb -0.10 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 2d1y h TYR 73 CO -0.02 0.74 0.19 0.00 -1.64 0.00 0.00 178.16 177.44 2d1y h ALA 74 N 0.75 0.52 0.01 1.82 0.00 -0.84 -3.15 119.26 118.37 2d1y h ALA 74 Ca 0.06 -0.11 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 2d1y h ALA 74 Cb 0.58 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2d1y h ALA 74 CO 0.03 0.08 -1.11 -0.07 0.00 0.00 0.00 179.25 178.19 2d1y h LEU 75 N 0.51 0.04 0.00 0.00 3.38 -0.83 -3.48 115.31 114.93 2d1y h LEU 75 Ca 0.14 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2d1y h LEU 75 Cb 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2d1y h LEU 75 CO -0.02 1.03 0.00 0.61 0.09 0.00 0.00 178.44 180.16 2d1y n GLY 76 N 1.39 0.90 3.57 0.83 0.00 0.48 -4.94 105.19 107.44 2d1y n GLY 76 Ca -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.69 0.54 -0.13 1.61 1.70 -1.19 -4.98 118.95 115.80 2d1y s ARG 77 Ca 0.00 -0.22 -0.01 0.00 -0.47 0.00 0.00 55.73 55.04 2d1y s ARG 77 Cb 0.00 0.24 0.03 0.00 -0.57 0.00 0.00 34.95 34.65 2d1y s ARG 77 CO 0.00 -0.24 -0.04 0.08 -1.08 0.00 0.00 175.30 174.02 2d1y s VAL 78 N -2.71 0.91 -0.07 4.99 1.01 -1.26 -4.21 120.40 119.05 2d1y s VAL 78 Ca 0.08 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 61.73 2d1y s VAL 78 Cb -0.01 -1.05 -0.07 0.00 0.00 0.00 0.00 36.38 35.25 2d1y s VAL 78 CO -0.06 0.21 -0.01 0.47 0.00 0.00 0.00 175.10 175.72 2d1y n ASP 79 N 4.96 3.40 -3.98 3.32 8.00 0.57 -3.83 116.55 128.99 2d1y n ASP 79 Ca -0.11 -0.01 -0.15 0.00 0.71 0.00 0.00 54.79 55.23 2d1y n ASP 79 Cb 0.49 0.40 -0.14 0.00 -0.02 0.00 0.00 41.12 41.85 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 0.42 -0.07 2.53 1.01 -0.67 -1.56 120.40 119.91 2d1y s VAL 80 Ca -0.06 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.50 2d1y s VAL 80 Cb 0.02 -0.40 0.01 0.00 0.00 0.00 0.00 36.38 36.02 2d1y s VAL 80 CO 0.24 -0.03 -0.11 -0.22 0.00 0.00 0.00 175.10 174.98 2d1y s LEU 81 N -0.51 1.59 -0.24 3.92 2.96 -0.78 -0.73 118.68 124.89 2d1y s LEU 81 Ca -0.01 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 53.63 2d1y s LEU 81 Cb -0.04 -0.79 0.05 0.00 0.50 0.00 0.00 46.19 45.91 2d1y s LEU 81 CO -0.00 0.02 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.23 2d1y s VAL 82 N 0.75 2.25 -0.81 1.68 1.01 0.35 -1.04 120.40 124.59 2d1y s VAL 82 Ca -0.13 -1.41 -0.21 0.00 0.00 0.00 0.00 61.98 60.23 2d1y s VAL 82 Cb -0.15 -2.22 0.10 0.00 0.00 0.00 0.00 36.38 34.10 2d1y s VAL 82 CO 0.03 0.12 1.07 0.20 0.00 0.00 0.00 175.10 176.51 2d1y s ASN 83 N 1.17 6.41 -0.13 3.32 0.01 -0.51 -1.89 114.94 123.33 2d1y s ASN 83 Ca -0.05 -1.54 0.08 0.00 -0.71 0.00 0.00 52.86 50.65 2d1y s ASN 83 Cb -0.18 -2.42 -0.14 0.00 0.41 0.00 0.00 41.25 38.93 2d1y s ASN 83 CO -0.07 -1.26 -0.01 -3.20 -1.51 0.00 0.00 177.10 171.06 2d1y n ASN 84 N 7.20 2.20 -4.74 -1.22 2.85 -1.25 -1.05 115.26 119.25 2d1y n ASN 84 Ca 0.12 -0.02 -0.41 0.00 -0.11 0.00 0.00 54.58 54.15 2d1y n ASN 84 Cb 0.47 0.52 0.00 0.00 1.24 0.00 0.00 39.78 42.01 2d1y n ASN 84 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2d1y n ALA 85 N -2.59 1.88 -3.50 5.20 0.00 -1.13 -4.90 120.51 115.47 2d1y n ALA 85 Ca -0.22 0.33 -0.09 0.00 0.00 0.00 0.00 53.44 53.46 2d1y n ALA 85 Cb 0.87 -2.35 -0.02 0.00 0.00 0.00 0.00 19.45 17.95 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 -1.13 -1.82 0.28 0.00 0.00 -1.26 -4.74 121.76 113.09 2d1y s ALA 86 Ca 0.56 1.03 0.03 0.00 0.00 0.00 0.00 51.96 53.58 2d1y s ALA 86 Cb -0.50 0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 2d1y s ALA 86 CO 0.62 -0.66 0.18 0.96 0.00 0.00 0.00 175.76 176.86 2d1y s ILE 87 N -2.98 0.13 0.12 0.00 -4.36 -1.26 -5.05 121.20 107.80 2d1y s ILE 87 Ca 0.04 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.41 2d1y s ILE 87 Cb -0.01 -2.51 -0.04 0.00 1.25 0.00 0.00 42.46 41.16 2d1y s ILE 87 CO -0.08 0.00 0.07 0.00 0.24 0.00 0.00 174.94 175.17 2d1y s ALA 88 N -3.75 0.68 -0.21 2.27 0.00 -1.26 -4.80 121.76 114.68 2d1y s ALA 88 Ca 0.38 -1.34 -0.04 0.00 0.00 0.00 0.00 51.96 50.96 2d1y s ALA 88 Cb 0.05 0.76 0.07 0.00 0.00 0.00 0.00 23.12 24.00 2d1y s ALA 88 CO 0.18 -0.49 0.09 0.00 0.00 0.00 0.00 175.76 175.54 2d1y s ALA 89 N -4.01 0.67 0.41 0.00 0.00 -1.26 -5.02 121.76 112.54 2d1y s ALA 89 Ca 0.20 -0.66 -0.25 0.00 0.00 0.00 0.00 51.96 51.25 2d1y s ALA 89 Cb 0.07 -1.18 -0.11 0.00 0.00 0.00 0.00 23.12 21.90 2d1y s ALA 89 CO -0.01 -1.31 1.07 -2.30 0.00 0.00 0.00 175.76 173.21 2d1y n PRO 90 N 5.19 1.49 0.00 0.00 -0.02 -1.26 -4.52 135.00 135.89 2d1y n PRO 90 Ca -0.07 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2d1y n PRO 90 Cb 0.47 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 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 1.10 3.62 3.94 -1.23 0.00 -0.26 -4.60 105.19 107.75 2d1y n GLY 91 Ca 0.09 -1.61 -0.29 0.00 0.00 0.00 0.00 46.02 44.20 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 3.13 0.64 1.61 1.04 -1.26 -2.19 113.70 116.67 2d1y s SER 92 Ca 0.00 0.16 0.41 0.00 0.48 0.00 0.00 55.95 57.00 2d1y s SER 92 Cb 0.00 -0.20 2.21 0.00 0.10 0.00 0.00 66.02 68.13 2d1y s SER 92 CO 0.00 -2.72 2.31 0.00 0.98 0.00 0.00 173.24 173.82 2d1y h ALA 93 N -1.58 1.11 0.00 5.32 0.00 -1.97 -1.93 119.26 120.21 2d1y h ALA 93 Ca -0.43 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 2d1y h ALA 93 Cb 1.23 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2d1y h ALA 93 CO 0.36 0.01 -0.39 -0.07 0.00 0.00 0.00 179.25 179.15 2d1y h LEU 94 N 0.00 0.00 0.00 0.00 3.38 -2.02 -3.37 115.31 113.30 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 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2d1y h LEU 94 CO 0.00 0.39 -0.30 0.35 0.09 0.00 0.00 178.44 178.98 2d1y n THR 95 N -3.91 0.00 -2.06 0.22 -2.24 -0.88 -5.04 114.28 100.37 2d1y n THR 95 Ca -0.01 -0.25 -0.41 0.00 -2.27 0.00 0.00 64.05 61.10 2d1y n THR 95 Cb 0.44 0.78 -0.02 0.00 -2.10 0.00 0.00 70.33 69.43 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 -1.09 2.69 0.22 2.28 0.11 -0.78 -4.96 120.40 118.87 2d1y s VAL 96 Ca 0.00 0.63 -0.25 0.00 -2.93 0.00 0.00 61.98 59.43 2d1y s VAL 96 Cb 0.00 -3.40 -0.09 0.00 -1.53 0.00 0.00 36.38 31.36 2d1y s VAL 96 CO 0.00 0.12 0.83 -0.13 -3.33 0.00 0.00 175.10 172.59 2d1y s ARG 97 N -1.03 4.56 0.24 1.54 0.52 -1.26 -4.94 118.95 118.58 2d1y s ARG 97 Ca 0.54 1.19 -0.04 0.00 -0.52 0.00 0.00 55.73 56.90 2d1y s ARG 97 Cb -0.41 -3.10 0.42 0.00 0.52 0.00 0.00 34.95 32.38 2d1y s ARG 97 CO 0.48 0.47 1.79 -0.07 0.02 0.00 0.00 175.30 177.99 2d1y h LEU 98 N 3.89 0.57 -0.76 2.53 3.38 -1.99 -0.67 115.31 122.27 2d1y h LEU 98 Ca -0.47 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.55 2d1y h LEU 98 Cb 1.20 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.88 2d1y h LEU 98 CO 0.66 0.31 0.41 -0.65 0.09 0.00 0.00 178.44 179.26 2d1y h PRO 99 N 0.69 1.06 -0.29 1.13 0.11 -1.99 0.08 132.00 132.78 2d1y h PRO 99 Ca 0.40 -0.13 -0.13 0.00 0.11 0.00 0.00 66.00 66.26 2d1y h PRO 99 Cb 0.44 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 2d1y h PRO 99 CO -0.28 0.79 -0.34 0.93 -0.21 0.00 0.00 178.00 178.88 2d1y h GLU 100 N 1.05 0.64 -0.19 1.05 4.39 -1.81 -1.28 114.58 118.43 2d1y h GLU 100 Ca 0.27 -0.30 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 2d1y h GLU 100 Cb 0.04 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 2d1y h GLU 100 CO -0.04 0.90 0.08 2.35 -1.16 0.00 0.00 179.01 181.13 2d1y h TRP 101 N 0.54 0.29 -0.38 4.33 2.91 -0.78 -1.97 115.95 120.89 2d1y h TRP 101 Ca 0.06 -0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.01 2d1y h TRP 101 Cb 0.85 -0.09 -0.02 0.00 -0.51 0.00 0.00 29.16 29.39 2d1y h TRP 101 CO 0.04 0.33 0.06 0.00 -1.03 0.00 0.00 178.44 177.84 2d1y h ARG 102 N 0.16 0.57 -0.70 2.65 3.08 -0.84 -1.89 114.38 117.41 2d1y h ARG 102 Ca 0.06 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.93 2d1y h ARG 102 Cb 0.16 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 2d1y h ARG 102 CO -0.01 0.55 0.14 -0.09 -1.07 0.00 0.00 179.97 179.50 2d1y h ARG 103 N 0.55 1.14 -0.58 0.04 2.43 -0.95 -0.22 114.38 116.79 2d1y h ARG 103 Ca 0.12 -0.29 -0.09 0.00 -0.81 0.00 0.00 59.98 58.91 2d1y h ARG 103 Cb 0.27 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 2d1y h ARG 103 CO 0.00 1.02 -0.00 0.28 -1.51 0.00 0.00 179.97 179.76 2d1y h VAL 104 N 1.07 1.27 -0.59 0.20 2.07 -0.83 -1.46 116.25 117.98 2d1y h VAL 104 Ca 0.22 -1.15 -0.08 0.00 0.82 0.00 0.00 66.70 66.51 2d1y h VAL 104 Cb 0.41 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2d1y h VAL 104 CO 0.01 0.41 0.06 -0.07 0.02 0.00 0.00 177.57 178.00 2d1y h LEU 105 N 0.93 0.94 -0.16 2.57 3.38 -1.03 0.29 115.31 122.22 2d1y h LEU 105 Ca 0.16 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2d1y h LEU 105 Cb 0.56 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2d1y h LEU 105 CO 0.03 0.96 0.06 -0.08 0.09 0.00 0.00 178.44 179.50 2d1y h GLU 106 N 0.91 0.24 -0.03 1.13 4.57 -0.76 -0.44 114.58 120.20 2d1y h GLU 106 Ca 0.18 -0.05 -0.21 0.00 -1.18 0.00 0.00 59.36 58.10 2d1y h GLU 106 Cb 0.45 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.02 2d1y h GLU 106 CO 0.02 0.35 -0.78 0.28 -1.18 0.00 0.00 179.01 177.69 2d1y h VAL 107 N 0.09 1.34 0.00 0.32 2.07 -1.19 0.18 116.25 119.06 2d1y h VAL 107 Ca 0.05 -2.09 -0.10 0.00 0.82 0.00 0.00 66.70 65.38 2d1y h VAL 107 Cb 0.20 2.38 -0.02 0.00 -1.52 0.00 0.00 31.29 32.34 2d1y h VAL 107 CO -0.00 0.63 -0.75 0.78 0.02 0.00 0.00 177.57 178.26 2d1y h ASN 108 N 0.20 0.00 0.00 0.57 4.21 -1.00 -3.38 115.58 116.19 2d1y h ASN 108 Ca -0.09 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.42 2d1y h ASN 108 Cb 1.45 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.65 2d1y h ASN 108 CO 0.16 0.43 -0.79 -0.11 -1.29 0.00 0.00 177.43 175.82 2d1y n LEU 109 N -3.07 0.02 -0.14 1.61 7.94 -0.30 -4.65 117.00 118.41 2d1y n LEU 109 Ca -0.01 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.77 2d1y n LEU 109 Cb 0.73 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.67 2d1y n LEU 109 CO 0.41 -0.10 0.66 0.74 -1.11 0.00 0.00 177.39 177.99 2d1y h THR 110 N 0.00 1.28 -0.16 1.96 2.02 -1.14 -2.75 112.91 114.12 2d1y h THR 110 Ca 0.00 -1.35 0.00 0.00 0.77 0.00 0.00 66.41 65.83 2d1y h THR 110 Cb 0.79 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 2d1y h THR 110 CO 0.00 0.46 0.11 0.00 0.37 0.00 0.00 175.52 176.45 2d1y h ALA 111 N 0.84 0.21 -0.32 6.16 0.00 -0.80 -0.98 119.26 124.35 2d1y h ALA 111 Ca 0.10 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2d1y h ALA 111 Cb 0.77 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2d1y h ALA 111 CO 0.06 -0.30 0.08 -1.35 0.00 0.00 0.00 179.25 177.74 2d1y h PRO 112 N 0.21 0.46 0.24 0.00 0.11 -1.76 0.75 132.00 132.01 2d1y h PRO 112 Ca 0.06 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 2d1y h PRO 112 Cb -0.01 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.02 2d1y h PRO 112 CO -0.01 0.42 -0.11 1.98 -0.21 0.00 0.00 178.00 180.06 2d1y h MET 113 N 0.45 -0.31 -0.01 1.05 -1.53 -1.14 -1.49 114.93 111.95 2d1y h MET 113 Ca 0.11 0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.39 2d1y h MET 113 Cb 0.16 0.07 -0.00 0.00 -0.55 0.00 0.00 31.60 31.28 2d1y h MET 113 CO -0.01 -0.05 0.01 1.25 0.14 0.00 0.00 176.91 178.25 2d1y h HIS 114 N -0.55 0.02 -0.51 1.39 6.17 -0.93 -2.31 115.15 118.42 2d1y h HIS 114 Ca -0.03 0.00 -0.01 0.00 0.71 0.00 0.00 60.37 61.04 2d1y h HIS 114 Cb 0.40 -0.01 -0.03 0.00 2.52 0.00 0.00 27.41 30.30 2d1y h HIS 114 CO 0.00 0.04 0.27 -0.07 0.71 0.00 0.00 177.93 178.88 2d1y h LEU 115 N -0.01 0.63 -0.56 0.26 3.38 -0.90 -1.25 115.31 116.87 2d1y h LEU 115 Ca 0.00 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2d1y h LEU 115 Cb 0.02 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2d1y h LEU 115 CO -0.00 0.52 0.14 0.28 0.09 0.00 0.00 178.44 179.47 2d1y h SER 116 N 0.71 0.84 -0.37 -0.43 0.02 -0.97 0.11 113.55 113.47 2d1y h SER 116 Ca 0.18 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 60.87 2d1y h SER 116 Cb 0.04 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 2d1y h SER 116 CO -0.03 0.85 0.09 0.00 -1.14 0.00 0.00 176.83 176.60 2d1y h ALA 117 N 1.02 0.48 -0.40 3.77 0.00 -0.86 0.89 119.26 124.16 2d1y h ALA 117 Ca 0.17 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2d1y h ALA 117 Cb 0.34 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2d1y h ALA 117 CO 0.00 0.16 0.16 -0.07 0.00 0.00 0.00 179.25 179.49 2d1y h LEU 118 N 0.44 0.56 -0.60 0.00 3.38 -1.03 -2.67 115.31 115.39 2d1y h LEU 118 Ca 0.12 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 2d1y h LEU 118 Cb 0.30 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2d1y h LEU 118 CO 0.00 0.58 -0.17 0.00 0.09 0.00 0.00 178.44 178.94 2d1y h ALA 119 N 1.00 0.80 -0.94 1.53 0.00 -0.69 -3.06 119.26 117.90 2d1y h ALA 119 Ca 0.13 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.73 2d1y h ALA 119 Cb 0.20 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 2d1y h ALA 119 CO -0.01 0.66 0.60 0.00 0.00 0.00 0.00 179.25 180.50 2d1y h ALA 120 N 0.98 1.29 0.00 0.00 0.00 -0.64 -0.10 119.26 120.79 2d1y h ALA 120 Ca 0.12 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2d1y h ALA 120 Cb 0.72 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2d1y h ALA 120 CO 0.06 0.40 -0.12 0.00 0.00 0.00 0.00 179.25 179.58 2d1y h ARG 121 N 1.11 0.00 0.12 0.00 3.08 -1.37 -1.19 114.38 116.13 2d1y h ARG 121 Ca 0.40 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 60.16 2d1y h ARG 121 Cb 0.13 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 2d1y h ARG 121 CO -0.16 0.12 -1.38 0.93 -1.07 0.00 0.00 179.97 178.41 2d1y h GLU 122 N 0.00 0.25 -0.13 0.04 4.39 -1.25 -3.28 114.58 114.61 2d1y h GLU 122 Ca -0.00 -0.43 -0.05 0.00 0.34 0.00 0.00 59.36 59.22 2d1y h GLU 122 Cb 0.22 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 2d1y h GLU 122 CO 0.02 1.16 -0.13 0.52 -1.16 0.00 0.00 179.01 179.41 2d1y h MET 123 N 0.07 0.20 -0.57 2.33 2.86 -0.39 -2.15 114.93 117.28 2d1y h MET 123 Ca -0.19 -0.04 0.10 0.00 -2.06 0.00 0.00 59.70 57.51 2d1y h MET 123 Cb 1.99 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 33.59 2d1y h MET 123 CO 0.18 0.33 0.39 -0.09 1.06 0.00 0.00 176.91 178.78 2d1y h ARG 124 N 0.19 0.35 0.00 1.72 2.43 -1.30 -0.30 114.38 117.46 2d1y h ARG 124 Ca 0.04 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 2d1y h ARG 124 Cb 0.35 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2d1y h ARG 124 CO 0.02 0.23 -0.16 0.87 -1.51 0.00 0.00 179.97 179.42 2d1y h LYS 125 N 0.36 0.00 -0.23 0.20 1.57 -1.53 -2.90 116.57 114.04 2d1y h LYS 125 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2d1y h LYS 125 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2d1y h LYS 125 CO -0.07 0.16 0.00 1.33 -0.57 0.00 0.00 179.45 180.30 2d1y n VAL 126 N -3.56 2.14 -0.84 0.50 0.24 -0.28 -4.97 118.33 111.56 2d1y n VAL 126 Ca -0.01 -1.87 0.00 0.00 -2.04 0.00 0.00 64.34 60.42 2d1y n VAL 126 Cb 0.31 -0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.48 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 -0.57 0.54 0.00 7.63 0.00 -1.01 -4.92 105.19 106.85 2d1y n GLY 127 Ca 0.20 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.84 0.44 0.00 -0.02 0.00 -0.28 -4.75 105.19 97.74 2d1y n GLY 128 Ca 0.00 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 43.80 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 -0.60 3.17 -0.02 0.00 -0.89 -4.70 105.19 102.15 2d1y n GLY 129 Ca 0.00 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.57 -0.04 4.61 0.00 -0.60 -1.84 121.76 122.32 2d1y s ALA 130 Ca 0.00 0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.16 2d1y s ALA 130 Cb 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 23.12 23.16 2d1y s ALA 130 CO 0.00 -0.22 -0.14 0.42 0.00 0.00 0.00 175.76 175.81 2d1y s ILE 131 N -1.21 1.19 -0.11 0.00 1.01 0.04 -1.86 121.20 120.26 2d1y s ILE 131 Ca -0.13 -0.58 0.01 0.00 0.00 0.00 0.00 60.65 59.95 2d1y s ILE 131 Cb -0.06 -1.03 0.02 0.00 0.01 0.00 0.00 42.46 41.39 2d1y s ILE 131 CO 0.03 0.35 -0.13 -0.69 0.00 0.00 0.00 174.94 174.50 2d1y s VAL 132 N 0.10 1.37 -0.18 2.92 1.01 -0.20 -1.80 120.40 123.62 2d1y s VAL 132 Ca -0.04 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 2d1y s VAL 132 Cb -0.10 -1.29 -0.05 0.00 0.00 0.00 0.00 36.38 34.94 2d1y s VAL 132 CO 0.02 0.42 0.14 0.20 0.00 0.00 0.00 175.10 175.87 2d1y s ASN 133 N 1.20 6.27 -0.59 3.32 0.01 0.34 -1.42 114.94 124.06 2d1y s ASN 133 Ca -0.03 0.31 -0.20 0.00 -0.71 0.00 0.00 52.86 52.22 2d1y s ASN 133 Cb -0.14 -2.09 0.08 0.00 0.41 0.00 0.00 41.25 39.51 2d1y s ASN 133 CO -0.04 0.25 0.78 -0.69 -1.51 0.00 0.00 177.10 175.89 2d1y s VAL 134 N -0.04 4.65 0.00 1.60 1.01 -0.22 -1.52 120.40 125.88 2d1y s VAL 134 Ca 0.10 -0.62 0.00 0.00 0.00 0.00 0.00 61.98 61.46 2d1y s VAL 134 Cb -0.11 -4.51 0.00 0.00 0.00 0.00 0.00 36.38 31.75 2d1y s VAL 134 CO -0.00 -1.16 0.00 0.00 0.00 0.00 0.00 175.10 173.94 2d1y n ALA 135 N 6.78 0.00 -3.61 5.51 0.00 0.09 -4.85 120.51 124.43 2d1y n ALA 135 Ca -0.06 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.34 2d1y n ALA 135 Cb 0.44 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.87 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 -0.10 0.58 0.00 0.15 -1.25 -4.46 113.70 107.62 2d1y s SER 136 Ca 0.00 -0.02 0.36 0.00 0.70 0.00 0.00 55.95 56.99 2d1y s SER 136 Cb 0.00 0.12 1.75 0.00 -1.71 0.00 0.00 66.02 66.19 2d1y s SER 136 CO 0.00 -0.20 2.14 -0.37 1.20 0.00 0.00 173.24 176.01 2d1y h VAL 137 N 2.00 0.17 0.00 4.45 -1.51 -1.56 -0.40 116.25 119.39 2d1y h VAL 137 Ca -0.11 -0.35 0.00 0.00 -1.23 0.00 0.00 66.70 65.01 2d1y h VAL 137 Cb 1.16 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 31.62 2d1y h VAL 137 CO 0.23 0.04 0.00 0.00 -1.23 0.00 0.00 177.57 176.61 2d1y n GLN 138 N -3.25 0.95 -0.00 5.19 6.02 -1.26 -1.28 117.38 123.75 2d1y n GLN 138 Ca -0.01 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.03 2d1y n GLN 138 Cb 0.21 -1.13 -0.07 0.00 1.02 0.00 0.00 30.24 30.27 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 0.34 -0.22 0.02 1.08 0.00 -0.16 -4.37 105.19 101.88 2d1y n GLY 139 Ca 0.00 -0.31 0.04 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.47 0.00 -4.20 0.99 4.77 -0.60 -3.87 117.00 112.62 2d1y n LEU 140 Ca 0.01 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.85 2d1y n LEU 140 Cb 0.22 0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.30 2d1y n LEU 140 CO 0.23 0.08 -0.16 -0.36 -1.33 0.00 0.00 177.39 175.86 2d1y s PHE 141 N -2.82 1.25 0.43 -1.77 0.08 -0.40 -5.13 117.98 109.61 2d1y s PHE 141 Ca -0.05 -1.40 0.04 0.00 0.12 0.00 0.00 56.93 55.64 2d1y s PHE 141 Cb 0.08 -0.52 -0.05 0.00 -0.57 0.00 0.00 43.02 41.95 2d1y s PHE 141 CO 0.58 -0.75 0.03 0.00 -0.10 0.00 0.00 175.22 174.97 2d1y s ALA 142 N -3.92 3.32 0.11 5.36 0.00 -1.26 -4.25 121.76 121.12 2d1y s ALA 142 Ca 0.38 -1.56 -0.02 0.00 0.00 0.00 0.00 51.96 50.76 2d1y s ALA 142 Cb 0.05 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 2d1y s ALA 142 CO 0.16 -0.14 0.04 -1.83 0.00 0.00 0.00 175.76 174.00 2d1y s GLU 143 N -3.79 0.84 0.56 0.00 -1.05 -1.26 -5.05 118.70 108.95 2d1y s GLU 143 Ca 0.25 -1.34 -0.18 0.00 -0.15 0.00 0.00 54.97 53.54 2d1y s GLU 143 Cb 0.06 0.24 -0.05 0.00 -0.44 0.00 0.00 34.13 33.95 2d1y s GLU 143 CO 0.13 -0.22 1.10 -0.65 0.95 0.00 0.00 175.26 176.57 2d1y s GLN 144 N -4.00 3.30 -1.57 -4.83 -0.21 -1.26 -3.90 119.66 107.20 2d1y s GLN 144 Ca 0.18 1.49 -0.15 0.00 0.02 0.00 0.00 55.36 56.90 2d1y s GLN 144 Cb 0.07 -2.01 0.10 0.00 1.00 0.00 0.00 33.01 32.17 2d1y s GLN 144 CO -0.02 -0.86 0.96 0.39 -2.12 0.00 0.00 175.29 173.63 2d1y n GLU 145 N -1.55 -5.16 -2.75 2.91 -0.58 -1.26 -4.87 120.64 107.37 2d1y n GLU 145 Ca 0.11 0.56 -0.02 0.00 -0.42 0.00 0.00 57.16 57.39 2d1y n GLU 145 Cb 0.52 -5.43 0.08 0.00 -0.57 0.00 0.00 31.44 26.04 2d1y n GLU 145 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2d1y n ASN 146 N -2.80 0.20 -0.03 1.62 5.15 -1.19 -1.10 115.26 117.10 2d1y n ASN 146 Ca 0.05 -2.18 -0.08 0.00 -0.60 0.00 0.00 54.58 51.77 2d1y n ASN 146 Cb 0.52 0.05 -0.02 0.00 -0.53 0.00 0.00 39.78 39.80 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 2.00 -0.08 -0.44 5.20 0.00 -1.70 -0.85 119.26 123.39 2d1y h ALA 147 Ca -0.26 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.75 2d1y h ALA 147 Cb 1.28 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 19.45 2d1y h ALA 147 CO 0.05 -0.63 0.23 0.00 0.00 0.00 0.00 179.25 178.90 2d1y h ALA 148 N 0.86 0.55 -0.34 0.00 0.00 -1.79 0.57 119.26 119.11 2d1y h ALA 148 Ca 0.13 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2d1y h ALA 148 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2d1y h ALA 148 CO -0.33 -0.11 0.11 -0.92 0.00 0.00 0.00 179.25 178.00 2d1y h TYR 149 N 0.46 0.54 -0.58 0.00 3.20 -1.80 -0.57 116.97 118.23 2d1y h TYR 149 Ca 0.19 -0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.90 2d1y h TYR 149 Cb 0.07 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.17 2d1y h TYR 149 CO -0.09 0.52 -0.07 -0.91 -1.64 0.00 0.00 178.16 175.97 2d1y h ASN 150 N 0.40 1.05 -0.27 -2.11 -0.26 -0.81 -0.90 115.58 112.67 2d1y h ASN 150 Ca 0.11 -0.33 -0.06 0.00 -0.56 0.00 0.00 56.30 55.46 2d1y h ASN 150 Cb 0.23 -0.29 -0.01 0.00 -1.06 0.00 0.00 38.32 37.20 2d1y h ASN 150 CO -0.01 1.14 -0.06 0.00 -1.06 0.00 0.00 177.43 177.44 2d1y h ALA 151 N 0.95 0.37 -0.54 -0.83 0.00 -0.79 -1.39 119.26 117.03 2d1y h ALA 151 Ca 0.15 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 2d1y h ALA 151 Cb 0.64 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2d1y h ALA 151 CO 0.04 0.18 -0.05 0.66 0.00 0.00 0.00 179.25 180.08 2d1y h SER 152 N 0.27 0.98 0.47 0.00 4.64 -1.03 -1.24 113.55 117.65 2d1y h SER 152 Ca 0.07 -0.33 -0.12 0.00 -0.47 0.00 0.00 61.79 60.94 2d1y h SER 152 Cb 0.54 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 2d1y h SER 152 CO 0.03 1.08 -0.55 0.11 -0.87 0.00 0.00 176.83 176.62 2d1y h LYS 153 N 0.87 0.09 -0.56 4.77 1.79 -1.18 -0.44 116.57 121.90 2d1y h LYS 153 Ca 0.15 -0.06 -0.08 0.00 -2.18 0.00 0.00 60.65 58.48 2d1y h LYS 153 Cb 0.60 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.24 2d1y h LYS 153 CO 0.04 0.62 0.03 0.78 -1.08 0.00 0.00 179.45 179.84 2d1y h GLY 154 N 1.57 1.05 1.34 3.86 0.00 -1.01 -1.56 103.07 108.33 2d1y h GLY 154 Ca -0.00 -0.75 -0.09 0.00 0.00 0.00 0.00 47.33 46.49 2d1y h GLY 154 CO 0.08 0.70 -0.07 -1.33 0.00 0.00 0.00 176.54 175.91 2d1y h GLY 155 N 0.86 0.85 1.52 4.60 0.00 -0.89 -2.67 103.07 107.36 2d1y h GLY 155 Ca 0.16 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 46.83 2d1y h GLY 155 CO 0.02 0.57 0.04 -2.00 0.00 0.00 0.00 176.54 175.18 2d1y h LEU 156 N 0.72 0.56 -0.13 3.11 5.85 -0.65 0.62 115.31 125.40 2d1y h LEU 156 Ca 0.13 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2d1y h LEU 156 Cb 0.55 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2d1y h LEU 156 CO 0.03 0.60 0.06 0.58 -0.34 0.00 0.00 178.44 179.37 2d1y h VAL 157 N 0.58 1.14 0.00 1.05 2.07 -0.95 -0.94 116.25 119.19 2d1y h VAL 157 Ca 0.13 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 67.17 2d1y h VAL 157 Cb 0.31 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 2d1y h VAL 157 CO 0.01 0.13 -0.30 -1.13 0.02 0.00 0.00 177.57 176.29 2d1y h ASN 158 N 0.06 0.00 -0.03 0.57 -1.24 -1.32 -2.69 115.58 110.93 2d1y h ASN 158 Ca 0.04 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 56.97 2d1y h ASN 158 Cb 0.15 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 2d1y h ASN 158 CO -0.00 0.30 -0.23 0.25 -1.29 0.00 0.00 177.43 176.46 2d1y h LEU 159 N 0.00 0.42 -1.01 0.34 5.85 -0.65 -1.38 115.31 118.89 2d1y h LEU 159 Ca -0.00 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 2d1y h LEU 159 Cb 1.05 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 2d1y h LEU 159 CO 0.04 0.66 0.55 0.74 -0.34 0.00 0.00 178.44 180.09 2d1y h THR 160 N 0.38 1.25 -0.39 1.05 2.02 -0.83 0.16 112.91 116.56 2d1y h THR 160 Ca 0.06 -0.54 -0.12 0.00 0.77 0.00 0.00 66.41 66.59 2d1y h THR 160 Cb 0.61 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 2d1y h THR 160 CO 0.04 0.26 -0.21 0.03 0.37 0.00 0.00 175.52 176.01 2d1y h ARG 161 N 1.25 0.83 -0.05 6.66 3.08 -1.34 -1.66 114.38 123.15 2d1y h ARG 161 Ca 0.33 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2d1y h ARG 161 Cb -0.06 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 2d1y h ARG 161 CO -0.06 1.01 0.03 1.03 -1.07 0.00 0.00 179.97 180.90 2d1y h SER 162 N 0.63 0.06 -0.83 7.04 0.87 -0.61 -2.14 113.55 118.57 2d1y h SER 162 Ca 0.08 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 2d1y h SER 162 Cb 0.77 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.68 2d1y h SER 162 CO 0.06 0.07 0.46 -0.07 -0.53 0.00 0.00 176.83 176.82 2d1y h LEU 163 N 0.05 1.03 -0.78 2.23 3.38 -0.68 -1.40 115.31 119.14 2d1y h LEU 163 Ca 0.02 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.91 2d1y h LEU 163 Cb 0.02 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 2d1y h LEU 163 CO -0.00 0.83 0.52 0.00 0.09 0.00 0.00 178.44 179.87 2d1y h ALA 164 N 1.34 0.99 -0.13 1.53 0.00 -0.99 0.44 119.26 122.44 2d1y h ALA 164 Ca 0.29 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 2d1y h ALA 164 Cb 0.02 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 2d1y h ALA 164 CO -0.05 0.40 -0.13 -0.07 0.00 0.00 0.00 179.25 179.40 2d1y h LEU 165 N 1.06 0.34 -0.68 0.00 3.38 -0.94 -2.64 115.31 115.83 2d1y h LEU 165 Ca 0.29 -0.48 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 2d1y h LEU 165 Cb -0.12 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2d1y h LEU 165 CO -0.06 0.75 -0.36 0.44 0.09 0.00 0.00 178.44 179.30 2d1y h ASP 166 N -0.06 0.00 0.07 -0.43 3.32 -1.13 -3.25 116.42 114.94 2d1y h ASP 166 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2d1y h ASP 166 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2d1y h ASP 166 CO 0.03 0.36 -0.66 0.18 -1.72 0.00 0.00 179.24 177.44 2d1y n LEU 167 N -3.38 1.36 -0.33 1.55 4.77 0.13 -4.28 117.00 116.82 2d1y n LEU 167 Ca 0.01 -0.52 0.05 0.00 -0.03 0.00 0.00 56.01 55.52 2d1y n LEU 167 Cb 0.56 -0.04 0.21 0.00 -2.33 0.00 0.00 43.42 41.81 2d1y n LEU 167 CO 0.37 0.28 1.18 0.00 -1.33 0.00 0.00 177.39 177.89 2d1y h ALA 168 N 3.43 1.35 -0.01 -1.18 0.00 -1.50 0.18 119.26 121.53 2d1y h ALA 168 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2d1y h ALA 168 Cb 0.60 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2d1y h ALA 168 CO 0.00 0.14 0.02 -1.35 0.00 0.00 0.00 179.25 178.06 2d1y h PRO 169 N 0.87 0.00 -0.38 0.00 0.11 -1.79 0.58 132.00 131.39 2d1y h PRO 169 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 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 -0.27 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.80 2d1y n LEU 170 N -3.95 2.35 -3.23 2.35 4.32 0.01 -4.92 117.00 113.94 2d1y n LEU 170 Ca -0.03 -1.12 -0.21 0.00 -0.02 0.00 0.00 56.01 54.63 2d1y n LEU 170 Cb 0.10 -0.25 0.07 0.00 -1.62 0.00 0.00 43.42 41.72 2d1y n LEU 170 CO 0.28 0.56 0.21 0.54 -1.22 0.00 0.00 177.39 177.77 2d1y n ARG 171 N 0.77 -6.99 -4.41 3.23 1.74 0.20 -3.93 116.66 107.28 2d1y n ARG 171 Ca 0.16 0.74 -0.33 0.00 -0.77 0.00 0.00 57.85 57.65 2d1y n ARG 171 Cb 0.39 -5.50 -0.16 0.00 -1.02 0.00 0.00 32.46 26.17 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 -3.28 2.35 0.13 0.55 1.01 -0.95 -2.09 121.20 118.92 2d1y s ILE 172 Ca 0.51 -0.87 -0.10 0.00 0.00 0.00 0.00 60.65 60.20 2d1y s ILE 172 Cb -0.23 -1.98 -0.06 0.00 0.01 0.00 0.00 42.46 40.20 2d1y s ILE 172 CO 0.63 0.53 0.46 -0.13 0.00 0.00 0.00 174.94 176.43 2d1y s ARG 173 N 1.01 3.79 -0.06 2.79 0.52 -0.77 -3.74 118.95 122.50 2d1y s ARG 173 Ca -0.02 0.22 -0.01 0.00 -0.52 0.00 0.00 55.73 55.41 2d1y s ARG 173 Cb -0.15 -2.89 0.03 0.00 0.52 0.00 0.00 34.95 32.46 2d1y s ARG 173 CO -0.05 0.48 0.00 0.08 0.02 0.00 0.00 175.30 175.83 2d1y s VAL 174 N -1.53 0.32 0.26 3.52 1.01 -1.26 -0.78 120.40 121.94 2d1y s VAL 174 Ca 0.38 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.49 2d1y s VAL 174 Cb -0.13 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 2d1y s VAL 174 CO 0.20 0.23 0.16 0.20 0.00 0.00 0.00 175.10 175.89 2d1y s ASN 175 N 1.67 0.88 0.02 3.32 0.01 -0.74 0.67 114.94 120.77 2d1y s ASN 175 Ca 0.00 -1.50 -0.01 0.00 -0.71 0.00 0.00 52.86 50.65 2d1y s ASN 175 Cb -0.13 0.39 -0.02 0.00 0.41 0.00 0.00 41.25 41.90 2d1y s ASN 175 CO -0.04 -0.88 -0.02 0.00 -1.51 0.00 0.00 177.10 174.65 2d1y s ALA 176 N -3.85 0.16 0.08 0.60 0.00 -0.36 -0.50 121.76 117.88 2d1y s ALA 176 Ca 0.38 -0.67 0.05 0.00 0.00 0.00 0.00 51.96 51.72 2d1y s ALA 176 Cb 0.06 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.31 2d1y s ALA 176 CO 0.16 -0.20 -0.02 0.14 0.00 0.00 0.00 175.76 175.85 2d1y s VAL 177 N -1.87 3.93 -0.54 0.00 -7.23 -0.58 -0.45 120.40 113.67 2d1y s VAL 177 Ca -0.12 -0.97 0.04 0.00 -1.81 0.00 0.00 61.98 59.12 2d1y s VAL 177 Cb -0.07 -2.85 0.15 0.00 0.56 0.00 0.00 36.38 34.18 2d1y s VAL 177 CO -0.02 0.16 0.35 0.00 -0.31 0.00 0.00 175.10 175.28 2d1y s ALA 178 N -1.26 2.80 0.57 1.32 0.00 0.66 -0.73 121.76 125.12 2d1y s ALA 178 Ca 0.24 -3.12 -0.19 0.00 0.00 0.00 0.00 51.96 48.90 2d1y s ALA 178 Cb -0.12 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 20.98 2d1y s ALA 178 CO 0.16 -2.05 1.14 -2.14 0.00 0.00 0.00 175.76 172.87 2d1y s PRO 179 N -0.44 3.18 0.00 0.00 0.02 -1.26 -1.61 135.00 134.90 2d1y s PRO 179 Ca 0.23 1.62 0.00 0.00 0.02 0.00 0.00 61.00 62.87 2d1y s PRO 179 Cb -0.13 -1.98 0.00 0.00 0.02 0.00 0.00 34.50 32.41 2d1y s PRO 179 CO -0.09 -0.99 0.00 0.41 -0.33 0.00 0.00 177.00 176.00 2d1y n GLY 180 N 0.12 1.28 3.65 0.52 0.00 -0.64 -2.07 105.19 108.05 2d1y n GLY 180 Ca 0.12 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.89 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 -3.03 3.51 -0.09 4.61 0.00 -1.26 -4.94 121.76 120.56 2d1y s ALA 181 Ca 0.00 0.61 0.02 0.00 0.00 0.00 0.00 51.96 52.59 2d1y s ALA 181 Cb 0.00 -3.75 -0.02 0.00 0.00 0.00 0.00 23.12 19.35 2d1y s ALA 181 CO 0.00 -1.53 -0.13 0.42 0.00 0.00 0.00 175.76 174.51 2d1y s ILE 182 N 4.28 3.10 -0.91 0.00 -1.09 -1.26 -0.90 121.20 124.42 2d1y s ILE 182 Ca 0.67 -0.68 -0.20 0.00 -2.23 0.00 0.00 60.65 58.21 2d1y s ILE 182 Cb -0.26 -2.26 -0.12 0.00 -1.58 0.00 0.00 42.46 38.24 2d1y s ILE 182 CO 0.25 0.56 1.99 0.00 -1.23 0.00 0.00 174.94 176.51 2d1y n ALA 183 N 2.88 3.79 -2.02 9.38 0.00 0.44 -4.59 120.51 130.39 2d1y n ALA 183 Ca -0.18 -3.40 -0.18 0.00 0.00 0.00 0.00 53.44 49.68 2d1y n ALA 183 Cb 0.52 -3.61 0.02 0.00 0.00 0.00 0.00 19.45 16.39 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 4.61 2.80 0.24 0.00 -4.23 -1.26 -4.66 115.64 113.14 2d1y s THR 184 Ca 0.55 -1.00 -0.06 0.00 -1.18 0.00 0.00 61.69 60.00 2d1y s THR 184 Cb 0.14 -2.81 0.20 0.00 1.34 0.00 0.00 72.50 71.37 2d1y s THR 184 CO 0.07 0.00 1.80 -0.33 -0.54 0.00 0.00 174.62 175.63 2d1y h GLU 185 N 0.54 0.72 -0.66 3.99 3.07 -1.95 -0.43 114.58 119.85 2d1y h GLU 185 Ca -0.38 -0.04 0.01 0.00 -0.50 0.00 0.00 59.36 58.45 2d1y h GLU 185 Cb 1.28 -0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 28.99 2d1y h GLU 185 CO 0.44 0.47 0.43 0.00 -1.40 0.00 0.00 179.01 178.96 2d1y h ALA 186 N 1.43 0.85 -0.15 3.43 0.00 -1.94 -0.73 119.26 122.15 2d1y h ALA 186 Ca 0.37 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 55.03 2d1y h ALA 186 Cb 0.33 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.88 2d1y h ALA 186 CO -0.24 0.24 -0.74 0.28 0.00 0.00 0.00 179.25 178.78 2d1y h VAL 187 N 0.87 1.30 -0.11 0.00 2.07 -1.65 -1.92 116.25 116.81 2d1y h VAL 187 Ca 0.25 -1.98 -0.05 0.00 0.82 0.00 0.00 66.70 65.74 2d1y h VAL 187 Cb -0.07 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 2d1y h VAL 187 CO -0.07 0.62 -0.16 -0.07 0.02 0.00 0.00 177.57 177.91 2d1y h LEU 188 N 0.50 0.17 -0.04 2.57 3.38 -0.90 -0.95 115.31 120.03 2d1y h LEU 188 Ca -0.04 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 2d1y h LEU 188 Cb 1.36 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 2d1y h LEU 188 CO 0.15 0.35 -0.05 -0.08 0.09 0.00 0.00 178.44 178.90 2d1y h GLU 189 N 0.17 0.11 -1.00 1.13 4.81 -1.01 -0.52 114.58 118.28 2d1y h GLU 189 Ca 0.03 -0.06 0.09 0.00 -0.13 0.00 0.00 59.36 59.29 2d1y h GLU 189 Cb 0.39 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.70 2d1y h GLU 189 CO 0.02 0.58 0.64 0.00 -0.73 0.00 0.00 179.01 179.53 2d1y h ALA 190 N 0.53 1.47 -0.06 2.92 0.00 -0.96 -0.54 119.26 122.63 2d1y h ALA 190 Ca 0.01 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2d1y h ALA 190 Cb 0.57 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2d1y h ALA 190 CO 0.01 0.33 -0.12 0.82 0.00 0.00 0.00 179.25 180.29 2d1y h ILE 191 N 1.08 1.43 0.00 0.00 2.04 -1.15 -3.17 117.51 117.74 2d1y h ILE 191 Ca 0.46 -1.45 -0.03 0.00 1.00 0.00 0.00 64.86 64.85 2d1y h ILE 191 Cb 0.33 2.25 -0.00 0.00 -0.74 0.00 0.00 36.82 38.65 2d1y h ILE 191 CO -0.21 0.40 -0.12 0.00 0.00 0.00 0.00 178.15 178.22 2d1y h ALA 192 N 0.47 1.62 -0.08 1.87 0.00 -0.65 -2.54 119.26 119.94 2d1y h ALA 192 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2d1y h ALA 192 Cb 0.71 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2d1y h ALA 192 CO 0.03 0.15 0.00 1.28 0.00 0.00 0.00 179.25 180.71 2d1y n LEU 193 N -4.13 1.99 -4.84 0.00 4.77 -0.25 -4.78 117.00 109.76 2d1y n LEU 193 Ca -0.02 -0.72 -0.32 0.00 -0.03 0.00 0.00 56.01 54.92 2d1y n LEU 193 Cb 0.20 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.24 2d1y n LEU 193 CO 0.33 0.36 0.70 -0.94 -1.33 0.00 0.00 177.39 176.51 2d1y s SER 194 N -1.87 6.24 0.28 -1.43 1.04 -0.96 -4.95 113.70 112.04 2d1y s SER 194 Ca 0.35 1.60 0.02 0.00 0.48 0.00 0.00 55.95 58.39 2d1y s SER 194 Cb 0.20 -2.50 0.65 0.00 0.10 0.00 0.00 66.02 64.47 2d1y s SER 194 CO 0.31 -0.86 1.71 -0.65 0.98 0.00 0.00 173.24 174.74 2d1y h PRO 195 N 0.40 0.43 -2.82 4.02 0.11 -1.91 -3.24 132.00 129.00 2d1y h PRO 195 Ca -0.46 -0.03 -0.61 0.00 0.11 0.00 0.00 66.00 65.02 2d1y h PRO 195 Cb 1.20 -0.10 -0.40 0.00 0.11 0.00 0.00 31.00 31.80 2d1y h PRO 195 CO 0.60 0.29 -0.73 0.34 -0.21 0.00 0.00 178.00 178.29 2d1y s ASP 196 N -5.25 3.52 0.25 -2.05 -1.08 -1.26 -5.00 116.67 105.81 2d1y s ASP 196 Ca -0.12 -3.50 -0.04 0.00 -0.52 0.00 0.00 52.55 48.37 2d1y s ASP 196 Cb 0.24 -1.17 0.49 0.00 -1.46 0.00 0.00 42.92 41.03 2d1y s ASP 196 CO 0.78 -0.13 1.69 -0.65 0.52 0.00 0.00 175.17 177.38 2d1y h PRO 197 N 5.56 0.29 -0.20 4.34 0.11 -1.73 -0.19 132.00 140.18 2d1y h PRO 197 Ca 0.18 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.28 2d1y h PRO 197 Cb 0.82 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.85 2d1y h PRO 197 CO 0.58 0.19 0.13 1.49 -0.21 0.00 0.00 178.00 180.18 2d1y h GLU 198 N 0.30 0.25 -0.26 1.05 4.81 -1.94 -0.24 114.58 118.57 2d1y h GLU 198 Ca 0.43 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.63 2d1y h GLU 198 Cb 0.74 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 2d1y h GLU 198 CO -0.50 0.17 0.10 -0.09 -0.73 0.00 0.00 179.01 177.95 2d1y h ARG 199 N 0.26 0.38 -0.39 1.92 9.65 -1.83 -2.34 114.38 122.03 2d1y h ARG 199 Ca 0.08 -0.07 0.05 0.00 -1.10 0.00 0.00 59.98 58.94 2d1y h ARG 199 Cb -0.02 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 28.46 2d1y h ARG 199 CO -0.03 0.42 0.13 1.15 2.80 0.00 0.00 179.97 184.44 2d1y h THR 200 N 0.26 0.87 -0.37 0.20 2.02 -0.79 -0.28 112.91 114.82 2d1y h THR 200 Ca 0.08 -0.10 0.05 0.00 0.77 0.00 0.00 66.41 67.22 2d1y h THR 200 Cb 0.18 0.56 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 2d1y h THR 200 CO -0.01 0.05 0.10 -0.09 0.37 0.00 0.00 175.52 175.95 2d1y h ARG 201 N 0.28 0.24 -0.61 6.66 9.65 -0.94 -0.16 114.38 129.50 2d1y h ARG 201 Ca 0.18 -0.01 0.03 0.00 -1.10 0.00 0.00 59.98 59.08 2d1y h ARG 201 Cb 0.17 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.66 2d1y h ARG 201 CO -0.19 0.16 0.36 0.00 2.80 0.00 0.00 179.97 183.10 2d1y h ARG 202 N 0.24 0.69 -0.50 0.20 3.08 -0.83 -1.08 114.38 116.18 2d1y h ARG 202 Ca 0.17 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 2d1y h ARG 202 Cb 0.18 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 2d1y h ARG 202 CO -0.20 0.45 0.13 -0.44 -1.07 0.00 0.00 179.97 178.84 2d1y h ASP 203 N 0.71 0.76 -0.62 7.04 3.32 -0.55 -1.89 116.42 125.18 2d1y h ASP 203 Ca 0.25 -0.23 -0.08 0.00 0.02 0.00 0.00 57.03 57.00 2d1y h ASP 203 Cb 0.06 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 2d1y h ASP 203 CO -0.12 0.79 0.10 -0.50 -1.72 0.00 0.00 179.24 177.79 2d1y h TRP 204 N 0.69 1.11 -0.60 4.55 4.06 -0.82 -2.85 115.95 122.10 2d1y h TRP 204 Ca 0.16 -0.16 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 2d1y h TRP 204 Cb 0.32 -0.30 -0.03 0.00 -1.00 0.00 0.00 29.16 28.15 2d1y h TRP 204 CO 0.02 0.94 0.34 0.93 -3.56 0.00 0.00 178.44 177.12 2d1y h GLU 205 N 0.95 0.82 0.00 0.49 5.08 -1.05 -2.36 114.58 118.51 2d1y h GLU 205 Ca 0.19 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2d1y h GLU 205 Cb 0.44 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2d1y h GLU 205 CO 0.01 0.61 0.00 -0.25 -1.00 0.00 0.00 179.01 178.39 2d1y n ASP 206 N -4.59 0.00 0.09 1.42 8.00 -0.72 -1.97 116.55 118.77 2d1y n ASP 206 Ca 0.04 -0.36 0.13 0.00 0.71 0.00 0.00 54.79 55.31 2d1y n ASP 206 Cb 0.07 -0.08 0.45 0.00 -0.02 0.00 0.00 41.12 41.54 2d1y n ASP 206 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2d1y n LEU 207 N -1.08 0.66 -4.66 0.64 4.77 -0.89 -4.77 117.00 111.67 2d1y n LEU 207 Ca 0.11 0.58 -0.32 0.00 -0.03 0.00 0.00 56.01 56.35 2d1y n LEU 207 Cb 0.08 -0.39 -0.09 0.00 -2.33 0.00 0.00 43.42 40.69 2d1y n LEU 207 CO 0.10 -0.21 -0.34 -1.00 -1.33 0.00 0.00 177.39 174.61 2d1y s HIS 208 N -3.12 3.00 0.43 -1.77 3.76 -0.83 -4.19 115.29 112.58 2d1y s HIS 208 Ca 0.10 0.01 0.13 0.00 -0.15 0.00 0.00 55.06 55.15 2d1y s HIS 208 Cb 0.13 -1.61 0.94 0.00 1.11 0.00 0.00 32.58 33.15 2d1y s HIS 208 CO 0.55 0.45 1.97 0.00 -0.85 0.00 0.00 174.74 176.86 2d1y h ALA 209 N 4.06 1.65 0.00 -1.40 0.00 -1.07 -0.82 119.26 121.69 2d1y h ALA 209 Ca -0.48 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2d1y h ALA 209 Cb 1.17 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2d1y h ALA 209 CO 0.57 0.26 0.00 1.28 0.00 0.00 0.00 179.25 181.36 2d1y n LEU 210 N -4.31 0.00 -3.93 0.00 4.77 -0.91 -4.92 117.00 107.70 2d1y n LEU 210 Ca -0.02 0.16 -0.27 0.00 -0.03 0.00 0.00 56.01 55.85 2d1y n LEU 210 Cb 0.25 -0.16 -0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2d1y n LEU 210 CO 0.37 -0.01 -0.11 0.54 -1.33 0.00 0.00 177.39 176.85 2d1y n ARG 211 N -1.16 -4.00 -3.56 3.23 1.74 -0.31 -4.96 116.66 107.64 2d1y n ARG 211 Ca 0.18 0.48 -0.09 0.00 -0.77 0.00 0.00 57.85 57.65 2d1y n ARG 211 Cb 0.17 -4.91 -0.02 0.00 -1.02 0.00 0.00 32.46 26.68 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 -6.49 1.21 0.49 5.56 1.70 -1.16 -4.76 118.95 115.50 2d1y s ARG 212 Ca 0.21 -0.52 -0.12 0.00 -0.47 0.00 0.00 55.73 54.83 2d1y s ARG 212 Cb -0.11 0.50 -0.06 0.00 -0.57 0.00 0.00 34.95 34.71 2d1y s ARG 212 CO 0.87 -0.54 0.90 -0.51 -1.08 0.00 0.00 175.30 174.94 2d1y s LEU 213 N -2.72 3.63 0.73 -1.89 1.43 -1.26 -4.79 118.68 113.80 2d1y s LEU 213 Ca 0.05 1.33 -0.10 0.00 -1.03 0.00 0.00 54.13 54.38 2d1y s LEU 213 Cb -0.02 -4.26 0.05 0.00 0.03 0.00 0.00 46.19 41.98 2d1y s LEU 213 CO -0.07 -0.56 1.08 -0.83 0.23 0.00 0.00 176.35 176.20 2d1y s GLY 214 N -3.38 1.62 0.02 -3.19 0.00 -0.08 -4.80 107.32 97.51 2d1y s GLY 214 Ca 0.54 -0.62 0.02 0.00 0.00 0.00 0.00 44.72 44.67 2d1y s GLY 214 CO 0.36 -0.21 -0.01 0.54 0.00 0.00 0.00 173.10 173.78 2d1y s LYS 215 N -5.36 2.70 0.34 2.90 1.02 -1.26 -0.42 119.74 119.65 2d1y s LYS 215 Ca 0.59 -0.67 0.08 0.00 0.02 0.00 0.00 55.97 55.99 2d1y s LYS 215 Cb -0.11 -2.62 0.79 0.00 -0.52 0.00 0.00 37.83 35.38 2d1y s LYS 215 CO 0.48 0.60 1.83 -1.35 -0.92 0.00 0.00 175.35 175.99 2d1y h PRO 216 N 4.18 0.70 -0.22 -1.68 0.11 -1.92 0.29 132.00 133.46 2d1y h PRO 216 Ca -0.49 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 2d1y h PRO 216 Cb 1.17 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2d1y h PRO 216 CO 0.57 0.46 0.10 0.93 -0.21 0.00 0.00 178.00 179.86 2d1y h GLU 217 N 0.72 0.30 -0.17 1.05 3.07 -1.93 -1.32 114.58 116.30 2d1y h GLU 217 Ca 0.51 -0.03 -0.12 0.00 -0.50 0.00 0.00 59.36 59.22 2d1y h GLU 217 Cb 0.84 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.67 2d1y h GLU 217 CO -0.28 0.24 -0.42 0.93 -1.40 0.00 0.00 179.01 178.09 2d1y h GLU 218 N 0.31 0.39 -0.12 2.33 5.08 -1.34 -1.43 114.58 119.81 2d1y h GLU 218 Ca 0.08 -0.20 -0.22 0.00 -1.00 0.00 0.00 59.36 58.02 2d1y h GLU 218 Cb 0.04 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.30 2d1y h GLU 218 CO -0.01 0.74 -0.81 0.28 -1.00 0.00 0.00 179.01 178.21 2d1y h VAL 219 N 0.32 1.30 -0.99 3.13 2.07 -1.30 -3.19 116.25 117.59 2d1y h VAL 219 Ca 0.03 -2.05 0.05 0.00 0.82 0.00 0.00 66.70 65.54 2d1y h VAL 219 Cb 0.87 2.07 -0.06 0.00 -1.52 0.00 0.00 31.29 32.65 2d1y h VAL 219 CO 0.07 0.64 0.64 0.00 0.02 0.00 0.00 177.57 178.95 2d1y h ALA 220 N 0.60 1.33 -0.56 1.67 0.00 -0.92 -1.74 119.26 119.64 2d1y h ALA 220 Ca -0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2d1y h ALA 220 Cb 1.44 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 2d1y h ALA 220 CO 0.16 0.50 0.26 0.93 0.00 0.00 0.00 179.25 181.11 2d1y h GLU 221 N 1.22 0.78 -0.39 0.00 4.39 -1.26 -0.36 114.58 118.96 2d1y h GLU 221 Ca 0.40 -0.10 -0.13 0.00 0.34 0.00 0.00 59.36 59.88 2d1y h GLU 221 Cb 0.05 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 2d1y h GLU 221 CO -0.14 0.61 -0.26 0.00 -1.16 0.00 0.00 179.01 178.06 2d1y h ALA 222 N 1.51 0.56 -0.41 3.43 0.00 -1.35 -1.79 119.26 121.21 2d1y h ALA 222 Ca 0.19 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2d1y h ALA 222 Cb 0.09 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2d1y h ALA 222 CO -0.03 0.57 0.13 0.28 0.00 0.00 0.00 179.25 180.21 2d1y h VAL 223 N 0.68 1.22 -0.54 0.00 2.07 -0.97 -1.57 116.25 117.15 2d1y h VAL 223 Ca 0.08 -0.71 0.02 0.00 0.82 0.00 0.00 66.70 66.91 2d1y h VAL 223 Cb 0.84 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 2d1y h VAL 223 CO 0.07 0.25 0.33 0.25 0.02 0.00 0.00 177.57 178.49 2d1y h LEU 224 N 0.52 0.53 0.07 2.57 5.85 -0.99 -0.70 115.31 123.17 2d1y h LEU 224 Ca 0.13 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 2d1y h LEU 224 Cb 0.25 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.17 2d1y h LEU 224 CO -0.00 0.37 -0.03 0.15 -0.34 0.00 0.00 178.44 178.59 2d1y h PHE 225 N 0.65 -0.09 0.00 1.25 3.57 -1.09 -1.45 116.94 119.78 2d1y h PHE 225 Ca 0.21 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 2d1y h PHE 225 Cb 0.01 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.78 2d1y h PHE 225 CO -0.06 -0.05 -0.13 -0.07 -2.23 0.00 0.00 178.31 175.76 2d1y h LEU 226 N -0.10 0.00 0.00 0.59 3.38 -1.02 -2.08 115.31 116.09 2d1y h LEU 226 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2d1y h LEU 226 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2d1y h LEU 226 CO 0.02 0.13 -0.49 0.00 0.09 0.00 0.00 178.44 178.19 2d1y n ALA 227 N -2.31 3.07 -2.11 1.53 0.00 -0.29 -4.82 120.51 115.58 2d1y n ALA 227 Ca -0.02 -0.26 -0.25 0.00 0.00 0.00 0.00 53.44 52.91 2d1y n ALA 227 Cb 0.24 -1.20 0.03 0.00 0.00 0.00 0.00 19.45 18.53 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 -3.66 5.49 0.04 0.00 1.04 -0.58 -4.75 113.70 111.29 2d1y s SER 228 Ca 0.09 0.46 0.16 0.00 0.48 0.00 0.00 55.95 57.14 2d1y s SER 228 Cb 0.15 -1.45 0.69 0.00 0.10 0.00 0.00 66.02 65.52 2d1y s SER 228 CO 0.69 -1.06 1.51 -0.62 0.98 0.00 0.00 173.24 174.74 2d1y n GLU 229 N -2.47 0.03 0.27 4.02 -0.58 -1.26 -1.82 120.64 118.84 2d1y n GLU 229 Ca 0.05 0.28 0.16 0.00 -0.42 0.00 0.00 57.16 57.22 2d1y n GLU 229 Cb 0.58 -1.56 0.71 0.00 -0.57 0.00 0.00 31.44 30.60 2d1y n GLU 229 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2d1y h LYS 230 N 0.00 0.00 -0.82 3.49 1.57 -1.94 -2.22 116.57 116.65 2d1y h LYS 230 Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 2d1y h LYS 230 Cb 0.27 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 32.32 2d1y h LYS 230 CO 0.00 0.05 0.40 0.00 -0.57 0.00 0.00 179.45 179.33 2d1y n ALA 231 N -2.13 5.47 0.31 3.86 0.00 -0.76 -4.74 120.51 122.52 2d1y n ALA 231 Ca -0.00 -3.22 0.19 0.00 0.00 0.00 0.00 53.44 50.41 2d1y n ALA 231 Cb 0.30 -1.27 1.05 0.00 0.00 0.00 0.00 19.45 19.53 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 1.41 0.00 -0.28 0.00 4.64 -1.55 -1.13 113.55 116.64 2d1y h SER 232 Ca 0.51 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.80 2d1y h SER 232 Cb 1.85 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.93 2d1y h SER 232 CO 1.05 0.00 0.00 0.33 -0.87 0.00 0.00 176.83 177.34 2d1y n PHE 233 N -3.35 1.01 -3.96 4.77 7.35 -1.26 -4.92 117.46 117.09 2d1y n PHE 233 Ca -0.02 -0.95 -0.34 0.00 -0.76 0.00 0.00 57.45 55.37 2d1y n PHE 233 Cb 0.14 -0.34 -0.14 0.00 0.35 0.00 0.00 39.48 39.49 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 -2.87 2.91 -0.12 -2.13 1.01 -0.43 -5.09 121.20 114.49 2d1y s ILE 234 Ca 0.43 -0.87 -0.20 0.00 0.00 0.00 0.00 60.65 60.01 2d1y s ILE 234 Cb 0.35 -2.41 0.05 0.00 0.01 0.00 0.00 42.46 40.46 2d1y s ILE 234 CO 0.08 0.30 0.50 0.28 0.00 0.00 0.00 174.94 176.10 2d1y s THR 235 N 1.36 0.01 -0.12 2.92 -1.32 -1.26 -4.71 115.64 112.52 2d1y s THR 235 Ca 0.02 -0.11 0.00 0.00 -1.21 0.00 0.00 61.69 60.39 2d1y s THR 235 Cb -0.16 -0.75 0.00 0.00 -1.51 0.00 0.00 72.50 70.08 2d1y s THR 235 CO -0.05 -0.06 0.00 0.61 -2.21 0.00 0.00 174.62 172.91 2d1y n GLY 236 N 2.05 0.49 3.89 6.08 0.00 0.21 -4.95 105.19 112.96 2d1y n GLY 236 Ca -0.17 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.91 3.73 -0.30 4.61 0.00 -1.26 -4.70 121.76 121.93 2d1y s ALA 237 Ca 0.00 -0.48 0.01 0.00 0.00 0.00 0.00 51.96 51.49 2d1y s ALA 237 Cb 0.00 -2.21 0.07 0.00 0.00 0.00 0.00 23.12 20.98 2d1y s ALA 237 CO 0.00 0.63 -0.01 0.42 0.00 0.00 0.00 175.76 176.79 2d1y s ILE 238 N -1.69 2.52 -0.37 0.00 -1.09 -1.26 -1.23 121.20 118.08 2d1y s ILE 238 Ca 0.42 -1.77 -0.14 0.00 -2.23 0.00 0.00 60.65 56.93 2d1y s ILE 238 Cb -0.12 -2.58 0.00 0.00 -1.58 0.00 0.00 42.46 38.18 2d1y s ILE 238 CO 0.24 -0.24 0.30 -0.22 -1.23 0.00 0.00 174.94 173.78 2d1y s LEU 239 N 1.10 4.76 0.22 2.97 2.96 0.41 -4.91 118.68 126.19 2d1y s LEU 239 Ca -0.02 -0.60 -0.30 0.00 -0.22 0.00 0.00 54.13 52.99 2d1y s LEU 239 Cb -0.20 -2.20 -0.09 0.00 0.50 0.00 0.00 46.19 44.21 2d1y s LEU 239 CO -0.05 -0.36 1.19 -2.84 -1.32 0.00 0.00 176.35 172.97 2d1y s PRO 240 N 1.78 4.51 -0.56 0.98 0.02 -1.26 -0.24 135.00 140.24 2d1y s PRO 240 Ca 0.07 1.89 0.06 0.00 0.02 0.00 0.00 61.00 63.04 2d1y s PRO 240 Cb -0.18 -3.21 0.22 0.00 0.02 0.00 0.00 34.50 31.35 2d1y s PRO 240 CO 0.11 -0.03 0.57 0.28 -0.33 0.00 0.00 177.00 177.60 2d1y n VAL 241 N 2.07 0.89 -1.69 3.83 0.31 -0.63 -4.83 118.33 118.27 2d1y n VAL 241 Ca 0.03 -4.57 0.05 0.00 -0.01 0.00 0.00 64.34 59.84 2d1y n VAL 241 Cb 0.44 -2.02 0.08 0.00 -0.91 0.00 0.00 33.84 31.44 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 1.53 1.23 -2.15 4.52 5.68 -1.26 -1.62 116.55 124.47 2d1y n ASP 242 Ca 0.26 -2.67 -0.14 0.00 -0.50 0.00 0.00 54.79 51.74 2d1y n ASP 242 Cb 0.44 -0.34 -0.02 0.00 -1.14 0.00 0.00 41.12 40.05 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 -0.59 -0.00 1.08 6.12 0.00 -1.26 -1.26 105.19 109.28 2d1y n GLY 243 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.68 0.70 0.33 -0.02 0.00 -1.26 -0.62 105.19 103.64 2d1y n GLY 244 Ca -0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 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 4.10 -0.26 0.00 1.61 1.85 -1.34 -1.69 114.93 119.19 2d1y h MET 245 Ca 0.00 0.02 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 2d1y h MET 245 Cb 0.00 0.06 0.00 0.00 0.43 0.00 0.00 31.60 32.09 2d1y h MET 245 CO 0.00 -0.17 0.00 0.25 -0.40 0.00 0.00 176.91 176.59 2d1y n THR 246 N -5.41 0.00 0.72 -0.77 -2.24 -1.26 -2.98 114.28 102.34 2d1y n THR 246 Ca 0.00 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 2d1y n THR 246 Cb 0.33 -0.13 0.16 0.00 -2.10 0.00 0.00 70.33 68.59 2d1y n THR 246 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d1y n ALA 247 N -0.58 3.26 -3.49 6.98 0.00 -0.64 -4.97 120.51 121.08 2d1y n ALA 247 Ca 0.03 -0.32 -0.11 0.00 0.00 0.00 0.00 53.44 53.05 2d1y n ALA 247 Cb 0.02 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 18.33 2d1y n ALA 247 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2d1y s SER 248 N -3.73 -0.46 0.00 0.00 0.15 -1.16 -5.18 113.70 103.33 2d1y s SER 248 Ca 0.07 0.12 0.25 0.00 0.70 0.00 0.00 55.95 57.09 2d1y s SER 248 Cb 0.15 0.46 0.36 0.00 -1.71 0.00 0.00 66.02 65.28 2d1y s SER 248 CO 0.73 -0.70 1.35 0.49 1.20 0.00 0.00 173.24 176.32