#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d2a n PRO 10 N 0.00 0.00 0.00 3.52 -0.04 -1.26 -5.20 135.00 132.02 2d2a n PRO 10 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2d2a n PRO 10 Cb 0.00 -0.14 0.00 0.00 -0.04 0.00 0.00 33.50 33.32 2d2a n PRO 10 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d2a n GLN 11 N -2.96 0.00 -2.70 0.54 -0.00 -1.26 -4.82 117.38 106.19 2d2a n GLN 11 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.00 56.99 2d2a n GLN 11 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 30.24 30.23 2d2a n GLN 11 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2d2a n ASP 12 N 0.00 -7.06 0.00 2.61 10.43 -1.26 -5.08 116.55 116.19 2d2a n ASP 12 Ca 0.00 1.43 0.00 0.00 2.57 0.00 0.00 54.79 58.79 2d2a n ASP 12 Cb 0.00 -5.33 0.00 0.00 1.84 0.00 0.00 41.12 37.63 2d2a n ASP 12 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 2d2a n PHE 13 N 0.83 0.00 -2.77 1.24 3.01 -1.26 -5.17 117.46 113.35 2d2a n PHE 13 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.41 2d2a n PHE 13 Cb 0.08 0.08 0.00 0.00 -0.01 0.00 0.00 39.48 39.63 2d2a n PHE 13 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2d2a n ALA 14 N 0.00 -1.49 -2.65 4.37 0.00 -1.26 -5.02 120.51 114.46 2d2a n ALA 14 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 2d2a n ALA 14 Cb 0.31 -0.43 -0.01 0.00 0.00 0.00 0.00 19.45 19.32 2d2a n ALA 14 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2d2a s TRP 15 N -0.49 3.22 0.03 0.00 0.52 -1.26 -5.02 118.94 115.94 2d2a s TRP 15 Ca 0.00 -0.15 -0.04 0.00 0.02 0.00 0.00 56.10 55.93 2d2a s TRP 15 Cb 0.00 -1.82 -0.28 0.00 -1.15 0.00 0.00 33.47 30.21 2d2a s TRP 15 CO 0.00 0.17 0.96 -0.56 0.02 0.00 0.00 176.95 177.54 2d2a h GLN 16 N 1.02 0.28 0.00 4.98 3.07 -1.97 -3.49 115.11 119.00 2d2a h GLN 16 Ca -0.48 -0.47 0.00 0.00 0.09 0.00 0.00 58.65 57.79 2d2a h GLN 16 Cb 1.25 0.18 0.00 0.00 0.08 0.00 0.00 27.48 28.98 2d2a h GLN 16 CO 0.56 1.17 0.00 0.41 0.09 0.00 0.00 178.83 181.06 2d2a n GLY 17 N 1.62 0.51 3.30 0.06 0.00 -1.26 -4.96 105.19 104.46 2d2a n GLY 17 Ca -0.14 -2.21 -0.16 0.00 0.00 0.00 0.00 46.02 43.51 2d2a n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d2a s LEU 18 N 0.00 2.41 0.20 0.99 1.43 -1.26 -1.71 118.68 120.74 2d2a s LEU 18 Ca 0.00 -1.10 0.08 0.00 -1.03 0.00 0.00 54.13 52.09 2d2a s LEU 18 Cb 0.00 -0.39 -0.04 0.00 0.03 0.00 0.00 46.19 45.79 2d2a s LEU 18 CO 0.00 -0.37 -0.16 0.42 0.23 0.00 0.00 176.35 176.46 2d2a s THR 19 N -3.29 1.85 -0.09 5.49 -4.23 -1.02 -4.91 115.64 109.43 2d2a s THR 19 Ca 0.22 -2.12 0.03 0.00 -1.18 0.00 0.00 61.69 58.65 2d2a s THR 19 Cb 0.03 -1.99 -0.01 0.00 1.34 0.00 0.00 72.50 71.87 2d2a s THR 19 CO 0.05 -0.47 -0.20 -0.76 -0.54 0.00 0.00 174.62 172.70 2d2a s LEU 20 N -3.08 2.31 0.67 4.79 1.43 -1.26 -0.26 118.68 123.28 2d2a s LEU 20 Ca 0.21 -0.46 -0.14 0.00 -1.03 0.00 0.00 54.13 52.71 2d2a s LEU 20 Cb -0.03 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.72 2d2a s LEU 20 CO 0.08 0.20 1.10 0.42 0.23 0.00 0.00 176.35 178.37 2d2a s THR 21 N 0.14 3.35 0.37 5.49 -4.23 -0.58 -4.78 115.64 115.41 2d2a s THR 21 Ca -0.11 0.60 0.17 0.00 -1.18 0.00 0.00 61.69 61.17 2d2a s THR 21 Cb -0.16 -3.12 0.37 0.00 1.34 0.00 0.00 72.50 70.93 2d2a s THR 21 CO 0.06 -0.42 1.72 -0.65 -0.54 0.00 0.00 174.62 174.79 2d2a h PRO 22 N -0.10 0.38 -0.54 3.99 0.11 -1.98 -0.18 132.00 133.68 2d2a h PRO 22 Ca -0.46 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2d2a h PRO 22 Cb 1.24 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2d2a h PRO 22 CO 0.54 0.25 0.16 0.00 -0.21 0.00 0.00 178.00 178.75 2d2a h ALA 23 N 1.69 0.71 -0.46 -0.75 0.00 -1.90 0.29 119.26 118.83 2d2a h ALA 23 Ca 0.66 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 55.27 2d2a h ALA 23 Cb 1.59 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 2d2a h ALA 23 CO -0.42 0.37 -0.12 0.00 0.00 0.00 0.00 179.25 179.09 2d2a h ALA 24 N 1.03 0.64 -0.32 0.00 0.00 -1.35 -1.33 119.26 117.93 2d2a h ALA 24 Ca 0.17 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.75 2d2a h ALA 24 Cb 0.29 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2d2a h ALA 24 CO -0.00 0.54 0.19 0.00 0.00 0.00 0.00 179.25 179.98 2d2a h ALA 25 N 0.88 0.40 -0.14 0.00 0.00 -0.90 -1.02 119.26 118.47 2d2a h ALA 25 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2d2a h ALA 25 Cb 0.67 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2d2a h ALA 25 CO 0.05 -0.16 0.08 0.82 0.00 0.00 0.00 179.25 180.03 2d2a h ILE 26 N 0.40 1.08 0.00 0.00 1.08 -0.82 0.08 117.51 119.33 2d2a h ILE 26 Ca 0.12 -0.22 -0.06 0.00 -0.39 0.00 0.00 64.86 64.31 2d2a h ILE 26 Cb -0.02 0.98 -0.01 0.00 -3.07 0.00 0.00 36.82 34.71 2d2a h ILE 26 CO -0.05 0.08 -0.29 -0.74 -0.69 0.00 0.00 178.15 176.46 2d2a h HIS 27 N 0.14 0.00 -0.04 1.37 2.76 -0.97 -0.73 115.15 117.67 2d2a h HIS 27 Ca 0.05 0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 58.00 2d2a h HIS 27 Cb 0.06 0.00 0.02 0.00 1.55 0.00 0.00 27.41 29.03 2d2a h HIS 27 CO -0.05 0.29 -0.84 0.82 -1.30 0.00 0.00 177.93 176.85 2d2a h ILE 28 N 0.00 1.32 -0.18 6.26 2.04 -0.55 -2.53 117.51 123.87 2d2a h ILE 28 Ca -0.00 -2.12 0.03 0.00 1.00 0.00 0.00 64.86 63.77 2d2a h ILE 28 Cb 0.58 2.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.99 2d2a h ILE 28 CO 0.04 0.65 0.12 0.03 0.00 0.00 0.00 178.15 178.99 2d2a h ARG 29 N 0.28 0.09 0.08 2.37 3.08 -0.35 -0.96 114.38 118.97 2d2a h ARG 29 Ca -0.09 -0.01 -0.26 0.00 0.07 0.00 0.00 59.98 59.69 2d2a h ARG 29 Cb 1.51 -0.02 0.01 0.00 0.08 0.00 0.00 29.97 31.54 2d2a h ARG 29 CO 0.17 0.06 -1.12 0.93 -1.07 0.00 0.00 179.97 178.94 2d2a h GLU 30 N 0.10 0.34 0.01 0.04 5.08 -1.03 -3.12 114.58 115.99 2d2a h GLU 30 Ca 0.08 -0.47 -0.23 0.00 -1.00 0.00 0.00 59.36 57.74 2d2a h GLU 30 Cb 0.19 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2d2a h GLU 30 CO -0.01 1.18 -0.96 -0.07 -1.00 0.00 0.00 179.01 178.15 2d2a h LEU 31 N 0.14 0.53 -2.01 1.33 3.38 -1.18 -2.82 115.31 114.68 2d2a h LEU 31 Ca -0.12 -0.43 0.15 0.00 0.09 0.00 0.00 57.88 57.58 2d2a h LEU 31 Cb 1.81 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.38 2d2a h LEU 31 CO 0.19 1.23 0.43 0.58 0.09 0.00 0.00 178.44 180.96 2d2a h VAL 32 N 0.22 0.57 0.01 1.22 2.07 -1.19 -2.38 116.25 116.77 2d2a h VAL 32 Ca -0.08 0.00 -0.38 0.00 0.82 0.00 0.00 66.70 67.06 2d2a h VAL 32 Cb 1.60 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.99 2d2a h VAL 32 CO 0.16 0.00 -2.40 0.00 0.02 0.00 0.00 177.57 175.36 2d2a n ALA 33 N -2.53 1.39 0.47 1.67 0.00 -1.13 -2.67 120.51 117.70 2d2a n ALA 33 Ca 0.10 -1.08 0.13 0.00 0.00 0.00 0.00 53.44 52.59 2d2a n ALA 33 Cb 0.65 -0.19 0.44 0.00 0.00 0.00 0.00 19.45 20.34 2d2a n ALA 33 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2d2a h LYS 34 N 0.01 0.00 -3.75 0.00 1.57 -1.53 -3.44 116.57 109.43 2d2a h LYS 34 Ca -0.55 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 57.68 2d2a h LYS 34 Cb 1.97 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 33.89 2d2a h LYS 34 CO -0.05 0.00 -0.77 -1.14 -0.57 0.00 0.00 179.45 176.92 2d2a s GLN 35 N -3.25 0.91 0.61 3.15 0.74 -0.90 -5.09 119.66 115.83 2d2a s GLN 35 Ca 0.07 -0.63 -0.16 0.00 0.05 0.00 0.00 55.36 54.69 2d2a s GLN 35 Cb 0.10 -2.23 -0.03 0.00 1.10 0.00 0.00 33.01 31.96 2d2a s GLN 35 CO 0.52 -0.66 1.08 -1.25 -0.55 0.00 0.00 175.29 174.43 2d2a s PRO 36 N 1.72 3.14 0.00 1.67 0.04 -1.26 -2.10 135.00 138.21 2d2a s PRO 36 Ca -0.01 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.32 2d2a s PRO 36 Cb -0.18 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2d2a s PRO 36 CO -0.09 -0.97 0.00 0.41 0.04 0.00 0.00 177.00 176.39 2d2a n GLY 37 N -0.74 0.98 3.65 0.56 0.00 -1.26 -4.98 105.19 103.41 2d2a n GLY 37 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 2d2a n GLY 37 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2d2a s MET 38 N 0.00 4.13 0.03 1.61 0.00 -0.89 -4.49 119.30 119.69 2d2a s MET 38 Ca 0.00 1.72 0.21 0.00 0.00 0.00 0.00 55.69 57.62 2d2a s MET 38 Cb 0.00 -3.86 -0.20 0.00 0.00 0.00 0.00 34.83 30.78 2d2a s MET 38 CO 0.00 -0.85 0.65 1.33 0.00 0.00 0.00 175.02 176.15 2d2a n VAL 39 N 5.61 0.58 -2.20 10.11 0.24 -0.40 -4.83 118.33 127.45 2d2a n VAL 39 Ca 0.15 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 2d2a n VAL 39 Cb 0.45 -0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.52 2d2a n VAL 39 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2d2a n GLY 40 N 1.33 -1.53 3.68 7.63 0.00 -1.19 -4.47 105.19 110.63 2d2a n GLY 40 Ca -0.08 -1.05 -0.23 0.00 0.00 0.00 0.00 46.02 44.67 2d2a n GLY 40 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2d2a s VAL 41 N -2.64 3.50 -0.08 1.61 -7.23 -0.96 -0.91 120.40 113.69 2d2a s VAL 41 Ca 0.00 -1.83 -0.00 0.00 -1.81 0.00 0.00 61.98 58.34 2d2a s VAL 41 Cb 0.00 -2.93 0.03 0.00 0.56 0.00 0.00 36.38 34.04 2d2a s VAL 41 CO 0.00 -0.35 -0.04 -0.60 -0.31 0.00 0.00 175.10 173.81 2d2a s ARG 42 N -3.72 1.01 -0.27 4.82 3.52 0.24 -0.79 118.95 123.77 2d2a s ARG 42 Ca 0.32 -0.08 -0.22 0.00 -0.13 0.00 0.00 55.73 55.63 2d2a s ARG 42 Cb -0.06 -1.18 -0.01 0.00 -1.56 0.00 0.00 34.95 32.14 2d2a s ARG 42 CO 0.21 -0.24 0.70 -0.51 -0.81 0.00 0.00 175.30 174.65 2d2a s LEU 43 N 1.65 4.09 0.49 -0.88 1.43 -0.83 -1.00 118.68 123.63 2d2a s LEU 43 Ca 0.01 0.71 0.06 0.00 -1.03 0.00 0.00 54.13 53.88 2d2a s LEU 43 Cb -0.13 -2.96 0.01 0.00 0.03 0.00 0.00 46.19 43.14 2d2a s LEU 43 CO -0.05 -0.47 0.35 -0.83 0.23 0.00 0.00 176.35 175.58 2d2a s GLY 44 N 1.51 2.34 0.01 -3.19 0.00 -0.34 -4.04 107.32 103.61 2d2a s GLY 44 Ca 0.29 -1.52 0.04 0.00 0.00 0.00 0.00 44.72 43.53 2d2a s GLY 44 CO 0.10 -1.89 -0.13 -1.34 0.00 0.00 0.00 173.10 169.83 2d2a s VAL 45 N -2.68 1.05 0.10 1.40 -7.23 -1.26 -1.82 120.40 109.96 2d2a s VAL 45 Ca 0.37 -0.74 0.10 0.00 -1.81 0.00 0.00 61.98 59.90 2d2a s VAL 45 Cb -0.01 -0.91 -0.04 0.00 0.56 0.00 0.00 36.38 35.98 2d2a s VAL 45 CO 0.22 0.16 -0.23 -0.54 -0.31 0.00 0.00 175.10 174.41 2d2a s LYS 46 N -0.66 1.67 0.24 4.82 1.02 -0.58 -4.92 119.74 121.33 2d2a s LYS 46 Ca 0.03 -1.21 -0.30 0.00 0.02 0.00 0.00 55.97 54.51 2d2a s LYS 46 Cb -0.06 -2.02 -0.09 0.00 -0.52 0.00 0.00 37.83 35.14 2d2a s LYS 46 CO 0.00 0.48 1.26 -0.65 -0.92 0.00 0.00 175.35 175.52 2d2a s GLN 47 N -1.89 4.43 0.13 1.68 1.11 -1.26 -1.91 119.66 121.95 2d2a s GLN 47 Ca 0.15 2.03 -0.02 0.00 0.01 0.00 0.00 55.36 57.53 2d2a s GLN 47 Cb -0.10 -3.17 0.01 0.00 -1.01 0.00 0.00 33.01 28.73 2d2a s GLN 47 CO 0.07 -0.14 0.21 0.25 0.01 0.00 0.00 175.29 175.68 2d2a n THR 48 N 1.96 0.00 -1.45 -0.19 -2.24 -1.12 -4.83 114.28 106.41 2d2a n THR 48 Ca 0.03 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2d2a n THR 48 Cb 0.43 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 2d2a n THR 48 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2d2a n GLY 49 N -0.21 2.90 0.00 3.38 0.00 -1.26 -2.26 105.19 107.73 2d2a n GLY 49 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2d2a n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d2a n ALA 51 N -3.00 5.65 -0.46 0.00 0.00 -1.26 -4.99 120.51 116.45 2d2a n ALA 51 Ca 0.00 -2.89 -0.30 0.00 0.00 0.00 0.00 53.44 50.25 2d2a n ALA 51 Cb 0.00 -1.51 0.28 0.00 0.00 0.00 0.00 19.45 18.22 2d2a n ALA 51 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2d2a s GLY 52 N -1.30 1.44 -0.30 0.00 0.00 -0.96 -4.96 107.32 101.25 2d2a s GLY 52 Ca 0.56 -0.79 -0.18 0.00 0.00 0.00 0.00 44.72 44.31 2d2a s GLY 52 CO 0.07 0.19 1.23 -1.36 0.00 0.00 0.00 173.10 173.24 2d2a s PHE 53 N -2.37 -0.17 0.09 1.90 0.08 -1.25 -2.78 117.98 113.48 2d2a s PHE 53 Ca 0.69 0.30 0.10 0.00 0.12 0.00 0.00 56.93 58.14 2d2a s PHE 53 Cb -0.14 0.10 -0.04 0.00 -0.57 0.00 0.00 43.02 42.38 2d2a s PHE 53 CO 0.58 -0.08 -0.26 0.20 -0.10 0.00 0.00 175.22 175.56 2d2a s GLY 54 N 1.83 1.51 0.45 4.36 0.00 -0.80 -4.91 107.32 109.76 2d2a s GLY 54 Ca -0.02 -1.37 -0.20 0.00 0.00 0.00 0.00 44.72 43.12 2d2a s GLY 54 CO -0.15 -1.31 0.97 -0.19 0.00 0.00 0.00 173.10 172.43 2d2a s TYR 55 N -0.96 3.25 -0.27 1.90 2.02 -1.26 -1.53 117.35 120.50 2d2a s TYR 55 Ca 0.13 1.59 -0.01 0.00 -0.37 0.00 0.00 57.07 58.41 2d2a s TYR 55 Cb -0.10 -2.90 0.13 0.00 -0.40 0.00 0.00 41.96 38.69 2d2a s TYR 55 CO 0.05 -0.30 0.30 0.08 -1.57 0.00 0.00 175.55 174.10 2d2a s VAL 56 N -2.18 -0.43 -0.17 0.71 1.01 -0.76 -4.87 120.40 113.72 2d2a s VAL 56 Ca 0.63 -0.37 -0.18 0.00 0.00 0.00 0.00 61.98 62.07 2d2a s VAL 56 Cb -0.11 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 2d2a s VAL 56 CO 0.16 -0.37 0.47 -0.22 0.00 0.00 0.00 175.10 175.14 2d2a s LEU 57 N 2.39 4.20 0.04 3.92 0.20 -1.26 -1.20 118.68 126.96 2d2a s LEU 57 Ca 0.09 0.68 0.02 0.00 0.69 0.00 0.00 54.13 55.61 2d2a s LEU 57 Cb -0.14 -2.64 -0.02 0.00 -0.43 0.00 0.00 46.19 42.95 2d2a s LEU 57 CO -0.27 -0.08 -0.07 -0.62 -0.29 0.00 0.00 176.35 175.01 2d2a s ASP 58 N 0.92 0.75 0.34 3.68 -1.08 -0.17 -4.92 116.67 116.18 2d2a s ASP 58 Ca 0.23 -0.51 -0.29 0.00 -0.52 0.00 0.00 52.55 51.46 2d2a s ASP 58 Cb -0.15 0.04 -0.11 0.00 -1.46 0.00 0.00 42.92 41.24 2d2a s ASP 58 CO 0.09 -0.20 1.50 -0.55 0.52 0.00 0.00 175.17 176.53 2d2a s SER 59 N -1.46 6.41 0.06 -0.34 0.15 -1.26 0.80 113.70 118.06 2d2a s SER 59 Ca -0.10 2.97 0.05 0.00 0.70 0.00 0.00 55.95 59.57 2d2a s SER 59 Cb -0.09 -2.65 -0.03 0.00 -1.71 0.00 0.00 66.02 61.53 2d2a s SER 59 CO 0.00 -0.85 -0.15 0.54 1.20 0.00 0.00 173.24 173.99 2d2a s VAL 60 N -0.71 1.16 -0.04 4.45 0.11 -0.09 -4.77 120.40 120.51 2d2a s VAL 60 Ca 0.56 -1.24 0.01 0.00 -2.93 0.00 0.00 61.98 58.38 2d2a s VAL 60 Cb -0.46 -1.09 -0.03 0.00 -1.53 0.00 0.00 36.38 33.27 2d2a s VAL 60 CO 0.56 -0.14 -0.03 -1.20 -3.33 0.00 0.00 175.10 170.96 2d2a n SER 61 N 1.44 3.71 -3.90 3.54 7.64 -1.26 -1.27 113.62 123.52 2d2a n SER 61 Ca -0.20 -0.02 -0.30 0.00 1.01 0.00 0.00 58.87 59.36 2d2a n SER 61 Cb 0.54 -0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.60 2d2a n SER 61 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2d2a s GLU 62 N -2.09 1.47 0.30 1.43 -6.30 -1.26 -4.53 118.70 107.72 2d2a s GLU 62 Ca -0.05 -2.00 -0.30 0.00 -2.50 0.00 0.00 54.97 50.12 2d2a s GLU 62 Cb 0.01 -2.88 -0.12 0.00 0.00 0.00 0.00 34.13 31.14 2d2a s GLU 62 CO 0.11 -1.04 1.43 -2.30 0.02 0.00 0.00 175.26 173.47 2d2a n PRO 63 N 3.87 2.30 -1.62 4.30 -0.01 -1.26 -5.01 135.00 137.57 2d2a n PRO 63 Ca 0.04 0.81 -0.36 0.00 -0.01 0.00 0.00 63.50 63.98 2d2a n PRO 63 Cb 0.38 -2.49 0.08 0.00 -0.01 0.00 0.00 33.50 31.46 2d2a n PRO 63 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 175.50 172.02 2d2a n ASP 64 N 1.53 1.87 -0.02 2.55 2.03 -1.26 -4.93 116.55 118.32 2d2a n ASP 64 Ca 0.07 0.79 -0.13 0.00 0.52 0.00 0.00 54.79 56.05 2d2a n ASP 64 Cb 0.35 -1.55 -0.07 0.00 -0.72 0.00 0.00 41.12 39.13 2d2a n ASP 64 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 2d2a h LYS 65 N 0.29 -0.48 0.00 -0.67 2.10 -2.04 -1.55 116.57 114.23 2d2a h LYS 65 Ca -0.50 0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 2d2a h LYS 65 Cb 1.33 0.11 0.00 0.00 -0.90 0.00 0.00 32.23 32.77 2d2a h LYS 65 CO 0.52 -0.32 0.26 -0.40 -2.00 0.00 0.00 179.45 177.51 2d2a n ASP 66 N -5.43 0.08 -4.85 7.07 5.68 -1.26 -4.88 116.55 112.96 2d2a n ASP 66 Ca -0.04 0.34 -0.32 0.00 -0.50 0.00 0.00 54.79 54.28 2d2a n ASP 66 Cb 0.37 -0.33 -0.01 0.00 -1.14 0.00 0.00 41.12 40.01 2d2a n ASP 66 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 2d2a s ASP 67 N -2.76 6.36 0.12 -1.12 1.01 -0.58 -3.23 116.67 116.46 2d2a s ASP 67 Ca -0.00 1.53 0.04 0.00 0.71 0.00 0.00 52.55 54.84 2d2a s ASP 67 Cb 0.01 -2.50 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 2d2a s ASP 67 CO 0.03 -0.78 0.08 -0.76 0.21 0.00 0.00 175.17 173.96 2d2a s LEU 68 N -4.58 3.71 -0.12 1.23 1.43 -0.88 -4.91 118.68 114.56 2d2a s LEU 68 Ca 0.58 -0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.59 2d2a s LEU 68 Cb -0.11 -2.37 0.01 0.00 0.03 0.00 0.00 46.19 43.75 2d2a s LEU 68 CO 0.41 0.13 -0.22 -0.22 0.23 0.00 0.00 176.35 176.68 2d2a s LEU 69 N -2.69 2.04 -0.21 1.79 2.96 -1.26 -0.19 118.68 121.12 2d2a s LEU 69 Ca 0.29 -0.55 -0.02 0.00 -0.22 0.00 0.00 54.13 53.62 2d2a s LEU 69 Cb -0.11 -1.37 0.06 0.00 0.50 0.00 0.00 46.19 45.28 2d2a s LEU 69 CO 0.22 0.10 0.03 -0.36 -1.32 0.00 0.00 176.35 175.02 2d2a s PHE 70 N 0.63 1.23 -0.26 5.38 0.40 -0.53 -4.98 117.98 119.85 2d2a s PHE 70 Ca -0.12 -1.03 -0.09 0.00 -0.60 0.00 0.00 56.93 55.08 2d2a s PHE 70 Cb -0.16 -1.14 -0.04 0.00 0.51 0.00 0.00 43.02 42.18 2d2a s PHE 70 CO 0.03 -0.65 0.14 -2.00 0.70 0.00 0.00 175.22 173.43 2d2a s GLU 71 N 1.79 3.84 -0.07 0.44 2.12 -1.26 -1.88 118.70 123.68 2d2a s GLU 71 Ca -0.01 -0.38 0.01 0.00 0.36 0.00 0.00 54.97 54.95 2d2a s GLU 71 Cb -0.17 -3.51 0.02 0.00 0.26 0.00 0.00 34.13 30.73 2d2a s GLU 71 CO -0.10 -0.16 -0.06 -1.58 -0.54 0.00 0.00 175.26 172.83 2d2a s HIS 72 N 1.63 1.05 -1.48 5.30 2.46 -1.04 -4.86 115.29 118.35 2d2a s HIS 72 Ca 0.07 -0.39 -0.12 0.00 0.47 0.00 0.00 55.06 55.09 2d2a s HIS 72 Cb -0.15 -0.90 0.08 0.00 -0.13 0.00 0.00 32.58 31.47 2d2a s HIS 72 CO 0.08 -0.30 0.82 -0.25 -2.47 0.00 0.00 174.74 172.61 2d2a n ASP 73 N 4.37 -4.71 0.00 9.88 8.00 -1.26 -1.18 116.55 131.66 2d2a n ASP 73 Ca -0.19 -0.63 0.00 0.00 0.71 0.00 0.00 54.79 54.68 2d2a n ASP 73 Cb 0.51 -3.79 0.00 0.00 -0.02 0.00 0.00 41.12 37.82 2d2a n ASP 73 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2d2a n GLY 74 N -1.54 3.14 3.66 0.44 0.00 -1.26 -5.01 105.19 104.62 2d2a n GLY 74 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2d2a n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d2a s ALA 75 N -1.67 3.65 0.07 4.61 0.00 -0.32 -4.97 121.76 123.13 2d2a s ALA 75 Ca 0.00 0.19 -0.28 0.00 0.00 0.00 0.00 51.96 51.86 2d2a s ALA 75 Cb 0.00 -3.59 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 2d2a s ALA 75 CO 0.00 -1.16 0.89 0.15 0.00 0.00 0.00 175.76 175.64 2d2a s LYS 76 N 3.35 4.61 -0.24 0.00 1.02 -1.26 -2.49 119.74 124.73 2d2a s LYS 76 Ca 0.46 1.31 -0.02 0.00 0.02 0.00 0.00 55.97 57.74 2d2a s LYS 76 Cb -0.16 -3.38 0.07 0.00 -0.52 0.00 0.00 37.83 33.84 2d2a s LYS 76 CO 0.09 0.21 0.04 -1.17 -0.92 0.00 0.00 175.35 173.60 2d2a s LEU 77 N 0.09 1.74 -0.15 3.17 2.96 -0.79 -2.27 118.68 123.43 2d2a s LEU 77 Ca 0.44 -1.12 -0.07 0.00 -0.22 0.00 0.00 54.13 53.16 2d2a s LEU 77 Cb -0.22 -0.78 -0.04 0.00 0.50 0.00 0.00 46.19 45.65 2d2a s LEU 77 CO 0.27 -0.32 0.08 -0.36 -1.32 0.00 0.00 176.35 174.70 2d2a s PHE 78 N 1.70 3.35 -0.10 5.38 0.40 0.03 -1.45 117.98 127.30 2d2a s PHE 78 Ca 0.01 0.25 0.01 0.00 -0.60 0.00 0.00 56.93 56.60 2d2a s PHE 78 Cb -0.17 -2.01 0.02 0.00 0.51 0.00 0.00 43.02 41.37 2d2a s PHE 78 CO -0.13 0.38 -0.10 0.08 0.70 0.00 0.00 175.22 176.15 2d2a s VAL 79 N -0.19 1.11 0.12 -0.44 1.01 0.73 -1.96 120.40 120.78 2d2a s VAL 79 Ca 0.09 -0.39 -0.31 0.00 0.00 0.00 0.00 61.98 61.36 2d2a s VAL 79 Cb -0.12 -1.08 -0.10 0.00 0.00 0.00 0.00 36.38 35.08 2d2a s VAL 79 CO 0.01 0.37 1.84 -2.16 0.00 0.00 0.00 175.10 175.16 2d2a s PRO 80 N 1.26 4.14 0.25 2.72 0.04 -1.26 -2.07 135.00 140.07 2d2a s PRO 80 Ca -0.03 2.60 0.03 0.00 0.04 0.00 0.00 61.00 63.64 2d2a s PRO 80 Cb -0.14 -3.64 0.64 0.00 0.04 0.00 0.00 34.50 31.40 2d2a s PRO 80 CO -0.03 -0.85 1.22 1.28 0.04 0.00 0.00 177.00 178.65 2d2a n LEU 81 N 5.83 -0.06 0.00 -3.56 4.77 -1.20 -0.43 117.00 122.36 2d2a n LEU 81 Ca 0.18 1.32 0.00 0.00 -0.03 0.00 0.00 56.01 57.48 2d2a n LEU 81 Cb 0.38 -0.50 0.03 0.00 -2.33 0.00 0.00 43.42 41.00 2d2a n LEU 81 CO 0.66 -1.35 0.18 0.00 -1.33 0.00 0.00 177.39 175.54 2d2a n GLN 82 N -5.07 0.05 -0.01 3.23 1.13 -1.26 -2.15 117.38 113.30 2d2a n GLN 82 Ca 0.19 0.00 0.04 0.00 -1.94 0.00 0.00 57.00 55.30 2d2a n GLN 82 Cb 0.64 -1.28 -0.07 0.00 0.11 0.00 0.00 30.24 29.63 2d2a n GLN 82 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2d2a n ALA 83 N -0.78 2.32 0.01 -1.58 0.00 0.43 -4.84 120.51 116.07 2d2a n ALA 83 Ca 0.01 -0.24 -0.10 0.00 0.00 0.00 0.00 53.44 53.11 2d2a n ALA 83 Cb 0.00 -0.30 -0.05 0.00 0.00 0.00 0.00 19.45 19.11 2d2a n ALA 83 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2d2a h MET 84 N 0.00 -0.06 -0.47 0.00 2.86 -1.42 -2.26 114.93 113.57 2d2a h MET 84 Ca -0.01 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 2d2a h MET 84 Cb 0.47 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.09 2d2a h MET 84 CO 0.00 -0.04 -0.28 -0.35 1.06 0.00 0.00 176.91 177.30 2d2a n PRO 85 N -5.18 -0.21 0.28 -0.22 -0.04 -1.26 0.80 135.00 129.17 2d2a n PRO 85 Ca -0.05 0.95 0.17 0.00 -0.04 0.00 0.00 63.50 64.53 2d2a n PRO 85 Cb 0.11 -1.40 0.72 0.00 -0.04 0.00 0.00 33.50 32.89 2d2a n PRO 85 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2d2a h PHE 86 N 0.00 0.00 0.00 0.54 -1.00 -1.76 -3.37 116.94 111.35 2d2a h PHE 86 Ca 0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.85 2d2a h PHE 86 Cb 0.19 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.75 2d2a h PHE 86 CO -0.71 0.02 -0.31 0.44 -1.61 0.00 0.00 178.31 176.14 2d2a n ILE 87 N -3.13 0.00 -1.69 -0.55 -5.35 -0.55 -5.07 119.36 103.01 2d2a n ILE 87 Ca 0.00 0.00 -0.37 0.00 -0.27 0.00 0.00 62.75 62.11 2d2a n ILE 87 Cb 0.29 0.62 0.06 0.00 -1.74 0.00 0.00 39.64 38.87 2d2a n ILE 87 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2d2a n ASP 88 N 0.00 1.64 0.00 7.28 4.64 0.24 -1.30 116.55 129.06 2d2a n ASP 88 Ca 0.00 0.83 0.00 0.00 -1.38 0.00 0.00 54.79 54.24 2d2a n ASP 88 Cb 0.63 -1.50 0.00 0.00 -1.04 0.00 0.00 41.12 39.21 2d2a n ASP 88 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2d2a n GLY 89 N 1.05 0.86 3.62 0.27 0.00 -0.69 -4.65 105.19 105.64 2d2a n GLY 89 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 2d2a n GLY 89 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2d2a n THR 90 N -1.92 2.07 -4.31 2.61 -1.04 -0.42 -4.64 114.28 106.63 2d2a n THR 90 Ca 0.00 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.05 61.17 2d2a n THR 90 Cb 0.00 -1.15 -0.11 0.00 -1.82 0.00 0.00 70.33 67.25 2d2a n THR 90 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2d2a s GLU 91 N -1.71 3.49 -0.20 -2.82 2.12 -0.65 -2.43 118.70 116.49 2d2a s GLU 91 Ca 0.59 -0.44 -0.11 0.00 0.36 0.00 0.00 54.97 55.36 2d2a s GLU 91 Cb -0.64 -2.93 -0.05 0.00 0.26 0.00 0.00 34.13 30.77 2d2a s GLU 91 CO 0.60 0.41 0.17 0.08 -0.54 0.00 0.00 175.26 175.99 2d2a s VAL 92 N -0.08 5.38 0.37 3.70 1.01 0.64 -2.21 120.40 129.21 2d2a s VAL 92 Ca 0.04 0.27 0.04 0.00 0.00 0.00 0.00 61.98 62.32 2d2a s VAL 92 Cb -0.13 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 2d2a s VAL 92 CO 0.02 0.41 0.06 -0.62 0.00 0.00 0.00 175.10 174.96 2d2a s ASP 93 N 0.54 2.88 -0.11 3.32 2.15 -0.70 -1.53 116.67 123.22 2d2a s ASP 93 Ca 0.10 -1.46 -0.05 0.00 0.43 0.00 0.00 52.55 51.56 2d2a s ASP 93 Cb -0.12 0.04 0.05 0.00 -0.30 0.00 0.00 42.92 42.59 2d2a s ASP 93 CO 0.01 -0.67 0.25 0.12 -0.17 0.00 0.00 175.17 174.70 2d2a s PHE 94 N -3.14 -0.34 -0.13 -5.34 5.36 -1.26 -1.49 117.98 111.64 2d2a s PHE 94 Ca 0.31 0.81 0.03 0.00 -0.96 0.00 0.00 56.93 57.11 2d2a s PHE 94 Cb 0.07 0.04 0.01 0.00 -0.34 0.00 0.00 43.02 42.80 2d2a s PHE 94 CO 0.14 -0.25 -0.22 0.54 -1.46 0.00 0.00 175.22 173.98 2d2a s VAL 95 N 1.36 2.14 -0.13 3.12 0.11 -0.73 -4.58 120.40 121.69 2d2a s VAL 95 Ca -0.08 -0.96 0.01 0.00 -2.93 0.00 0.00 61.98 58.01 2d2a s VAL 95 Cb -0.10 -1.85 0.02 0.00 -1.53 0.00 0.00 36.38 32.92 2d2a s VAL 95 CO -0.09 0.55 -0.15 -0.60 -3.33 0.00 0.00 175.10 171.48 2d2a s ARG 96 N 0.66 2.35 -0.21 1.54 3.52 -1.26 -1.89 118.95 123.66 2d2a s ARG 96 Ca -0.10 -0.59 -0.10 0.00 -0.13 0.00 0.00 55.73 54.81 2d2a s ARG 96 Cb -0.16 -2.07 0.08 0.00 -1.56 0.00 0.00 34.95 31.24 2d2a s ARG 96 CO 0.02 -0.15 0.49 -2.00 -0.81 0.00 0.00 175.30 172.84 2d2a s GLU 97 N 1.24 0.44 0.00 5.12 2.56 -0.80 -5.05 118.70 122.21 2d2a s GLU 97 Ca -0.00 1.01 0.00 0.00 0.00 0.00 0.00 54.97 55.98 2d2a s GLU 97 Cb -0.14 0.21 0.00 0.00 2.00 0.00 0.00 34.13 36.20 2d2a s GLU 97 CO -0.07 -0.19 0.00 0.41 -0.56 0.00 0.00 175.26 174.85 2d2a n GLY 98 N 4.76 1.37 0.08 -1.50 0.00 -1.26 -2.07 105.19 106.57 2d2a n GLY 98 Ca -0.17 0.50 0.11 0.00 0.00 0.00 0.00 46.02 46.47 2d2a n GLY 98 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2d2a n LEU 99 N 0.00 0.62 -4.60 0.99 0.00 -1.26 -4.82 117.00 107.93 2d2a n LEU 99 Ca 0.00 0.21 -0.43 0.00 0.00 0.00 0.00 56.01 55.79 2d2a n LEU 99 Cb 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 43.42 43.34 2d2a n LEU 99 CO 0.00 -0.11 1.67 0.21 0.00 0.00 0.00 177.39 179.15 2d2a s ASN 100 N -4.95 5.67 -0.17 1.96 2.47 -0.88 -4.36 114.94 114.68 2d2a s ASN 100 Ca -0.02 1.48 0.01 0.00 0.42 0.00 0.00 52.86 54.75 2d2a s ASN 100 Cb 0.11 -2.52 0.02 0.00 -1.45 0.00 0.00 41.25 37.41 2d2a s ASN 100 CO 0.82 -1.86 -0.17 -1.10 -3.72 0.00 0.00 177.10 171.06 2d2a s GLN 101 N 6.03 2.68 -0.06 0.43 -0.21 -0.48 -1.90 119.66 126.16 2d2a s GLN 101 Ca 0.88 -0.72 -0.15 0.00 0.02 0.00 0.00 55.36 55.39 2d2a s GLN 101 Cb -0.26 -2.37 0.03 0.00 1.00 0.00 0.00 33.01 31.41 2d2a s GLN 101 CO 0.34 -0.23 0.34 -1.50 -2.12 0.00 0.00 175.29 172.12 2d2a s ILE 102 N 1.37 0.04 -0.18 1.08 2.07 -0.79 -2.82 121.20 121.96 2d2a s ILE 102 Ca 0.05 -0.30 -0.21 0.00 -1.41 0.00 0.00 60.65 58.78 2d2a s ILE 102 Cb -0.13 -0.59 -0.03 0.00 0.13 0.00 0.00 42.46 41.84 2d2a s ILE 102 CO -0.12 -0.16 0.64 -0.36 -1.91 0.00 0.00 174.94 173.02 2d2a s PHE 103 N -0.82 3.40 0.13 3.50 0.40 -1.26 -1.77 117.98 121.56 2d2a s PHE 103 Ca -0.09 0.96 0.08 0.00 -0.60 0.00 0.00 56.93 57.28 2d2a s PHE 103 Cb -0.04 -2.80 -0.04 0.00 0.51 0.00 0.00 43.02 40.65 2d2a s PHE 103 CO 0.03 -0.15 -0.10 0.15 0.70 0.00 0.00 175.22 175.85 2d2a s LYS 104 N 1.79 2.07 -0.12 0.44 -0.14 -0.55 -4.98 119.74 118.25 2d2a s LYS 104 Ca 0.30 -1.12 0.01 0.00 -1.36 0.00 0.00 55.97 53.80 2d2a s LYS 104 Cb -0.16 -2.24 0.02 0.00 -1.68 0.00 0.00 37.83 33.77 2d2a s LYS 104 CO 0.11 0.48 -0.13 -0.06 -0.76 0.00 0.00 175.35 174.99 2d2a s PHE 105 N -1.37 1.89 -0.43 3.18 0.40 -1.26 -1.73 117.98 118.67 2d2a s PHE 105 Ca 0.22 -0.94 -0.05 0.00 -0.60 0.00 0.00 56.93 55.56 2d2a s PHE 105 Cb -0.10 -1.41 0.11 0.00 0.51 0.00 0.00 43.02 42.13 2d2a s PHE 105 CO 0.14 -0.52 0.25 -1.58 0.70 0.00 0.00 175.22 174.21 2d2a s HIS 106 N 1.24 3.53 -0.19 0.36 2.46 -0.94 -4.99 115.29 116.76 2d2a s HIS 106 Ca -0.02 -2.23 -0.22 0.00 0.47 0.00 0.00 55.06 53.06 2d2a s HIS 106 Cb -0.14 -3.31 -0.02 0.00 -0.13 0.00 0.00 32.58 28.98 2d2a s HIS 106 CO -0.05 -0.98 0.68 1.21 -2.47 0.00 0.00 174.74 173.13 2d2a s ASN 107 N 2.10 6.76 0.46 9.88 3.84 -1.26 -1.64 114.94 135.08 2d2a s ASN 107 Ca 0.07 0.93 0.31 0.00 0.21 0.00 0.00 52.86 54.38 2d2a s ASN 107 Cb -0.24 -2.38 1.60 0.00 -0.55 0.00 0.00 41.25 39.69 2d2a s ASN 107 CO -0.03 -0.30 1.95 1.55 -2.79 0.00 0.00 177.10 177.48 2d2a h PRO 108 N 7.43 0.00 0.00 0.43 0.13 -1.82 -2.38 132.00 135.78 2d2a h PRO 108 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2d2a h PRO 108 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2d2a h PRO 108 CO 0.79 0.00 -1.16 1.63 -0.23 0.00 0.00 178.00 179.03 2d2a n LYS 109 N -2.64 0.11 0.02 0.86 5.02 -1.26 -4.49 118.16 115.78 2d2a n LYS 109 Ca -0.01 -0.03 -0.12 0.00 -2.02 0.00 0.00 58.31 56.12 2d2a n LYS 109 Cb 0.11 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.48 2d2a n LYS 109 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2d2a h ALA 110 N 2.83 0.50 -1.19 7.82 0.00 -1.85 -3.50 119.26 123.87 2d2a h ALA 110 Ca 0.00 -1.24 0.07 0.00 0.00 0.00 0.00 54.91 53.74 2d2a h ALA 110 Cb 0.58 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 2d2a h ALA 110 CO 0.00 1.35 -0.14 1.04 0.00 0.00 0.00 179.25 181.50 2d2a n GLN 111 N -3.28 -0.54 -1.67 0.00 6.02 -1.26 -4.52 117.38 112.13 2d2a n GLN 111 Ca -0.15 0.39 -0.13 0.00 -0.01 0.00 0.00 57.00 57.11 2d2a n GLN 111 Cb 1.03 -0.95 -0.04 0.00 1.02 0.00 0.00 30.24 31.29 2d2a n GLN 111 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2d2a n ASN 112 N -4.17 -3.57 -4.47 1.08 2.04 -1.26 -4.89 115.26 100.02 2d2a n ASN 112 Ca -0.00 0.28 -0.45 0.00 -0.44 0.00 0.00 54.58 53.97 2d2a n ASN 112 Cb 0.53 -3.25 -0.01 0.00 -2.53 0.00 0.00 39.78 34.52 2d2a n ASN 112 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 2d2a n GLU 113 N -2.12 0.58 -1.60 -3.83 1.02 -1.26 -4.77 120.64 108.66 2d2a n GLU 113 Ca -0.14 0.21 -0.46 0.00 -0.02 0.00 0.00 57.16 56.75 2d2a n GLU 113 Cb 0.48 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.47 2d2a n GLU 113 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2d2a n GLY 115 N 1.56 -1.02 3.56 0.00 0.00 -1.26 -4.94 105.19 103.09 2d2a n GLY 115 Ca 0.11 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 2d2a n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d2a n GLY 117 N 6.61 4.05 1.24 0.00 0.00 -1.26 -4.36 105.19 111.47 2d2a n GLY 117 Ca 0.35 -1.62 0.08 0.00 0.00 0.00 0.00 46.02 44.84 2d2a n GLY 117 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2d2a n GLU 118 N 2.13 3.43 -4.19 1.61 1.02 -1.26 -4.90 120.64 118.48 2d2a n GLU 118 Ca 0.56 -2.72 -0.16 0.00 -0.02 0.00 0.00 57.16 54.82 2d2a n GLU 118 Cb 0.55 -1.77 -0.13 0.00 -0.02 0.00 0.00 31.44 30.07 2d2a n GLU 118 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2d2a s SER 119 N -1.17 1.05 -0.17 1.62 0.01 -1.26 -5.15 113.70 108.64 2d2a s SER 119 Ca 0.43 -0.39 -0.04 0.00 1.31 0.00 0.00 55.95 57.26 2d2a s SER 119 Cb 0.29 -0.04 0.06 0.00 0.21 0.00 0.00 66.02 66.54 2d2a s SER 119 CO 0.19 -0.05 0.08 0.12 0.41 0.00 0.00 173.24 173.98 2d2a s PHE 120 N -0.84 0.40 0.36 2.43 5.36 -1.26 -5.16 117.98 119.26 2d2a s PHE 120 Ca -0.03 -0.44 -0.23 0.00 -0.96 0.00 0.00 56.93 55.27 2d2a s PHE 120 Cb -0.07 -0.77 -0.10 0.00 -0.34 0.00 0.00 43.02 41.74 2d2a s PHE 120 CO 0.00 -0.53 0.92 0.20 -1.46 0.00 0.00 175.22 174.36 2d2a s GLY 121 N 2.07 2.62 0.00 13.12 0.00 -1.26 -5.00 107.32 118.87 2d2a s GLY 121 Ca 0.01 0.44 0.00 0.00 0.00 0.00 0.00 44.72 45.17 2d2a s GLY 121 CO -0.09 0.80 0.00 3.33 0.00 0.00 0.00 173.10 177.15