#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ey6 s HIS 8 N 0.00 2.04 -0.02 -1.77 5.65 -1.26 -5.11 115.29 114.82 2ey6 s HIS 8 Ca 0.00 -0.39 -0.19 0.00 0.25 0.00 0.00 55.06 54.74 2ey6 s HIS 8 Cb 0.00 -1.29 -0.05 0.00 -1.18 0.00 0.00 32.58 30.06 2ey6 s HIS 8 CO 0.00 0.00 0.53 0.15 -0.65 0.00 0.00 174.74 174.77 2ey6 s LYS 9 N -0.71 4.23 0.07 2.88 1.02 -1.26 -4.21 119.74 121.75 2ey6 s LYS 9 Ca 0.09 0.60 0.07 0.00 0.02 0.00 0.00 55.97 56.75 2ey6 s LYS 9 Cb -0.09 -3.33 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 2ey6 s LYS 9 CO -0.00 0.42 -0.19 -1.21 -0.92 0.00 0.00 175.35 173.45 2ey6 s GLU 10 N -0.30 1.14 0.55 1.68 2.02 0.34 -4.93 118.70 119.21 2ey6 s GLU 10 Ca 0.28 -0.99 -0.19 0.00 0.02 0.00 0.00 54.97 54.10 2ey6 s GLU 10 Cb -0.17 -1.28 -0.05 0.00 0.10 0.00 0.00 34.13 32.72 2ey6 s GLU 10 CO 0.15 0.31 1.10 -1.25 0.02 0.00 0.00 175.26 175.59 2ey6 s PRO 11 N -1.50 3.38 0.18 0.39 0.04 -1.26 -0.12 135.00 136.11 2ey6 s PRO 11 Ca 0.05 1.48 -0.12 0.00 0.04 0.00 0.00 61.00 62.46 2ey6 s PRO 11 Cb -0.09 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2ey6 s PRO 11 CO 0.03 -0.80 0.37 0.00 0.04 0.00 0.00 177.00 176.63 2ey6 s ALA 12 N -1.96 -0.28 -0.05 8.56 0.00 -0.76 -4.66 121.76 122.61 2ey6 s ALA 12 Ca 0.70 -0.70 0.05 0.00 0.00 0.00 0.00 51.96 52.01 2ey6 s ALA 12 Cb -0.21 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.78 2ey6 s ALA 12 CO 0.28 -0.71 -0.20 0.99 0.00 0.00 0.00 175.76 176.12 2ey6 s THR 13 N -3.94 1.67 0.22 0.00 2.01 -0.86 -4.13 115.64 110.60 2ey6 s THR 13 Ca 0.15 -0.86 -0.30 0.00 0.31 0.00 0.00 61.69 61.00 2ey6 s THR 13 Cb 0.02 -1.42 -0.09 0.00 0.01 0.00 0.00 72.50 71.01 2ey6 s THR 13 CO -0.00 0.47 1.36 -0.22 -0.69 0.00 0.00 174.62 175.54 2ey6 s LEU 14 N -0.08 4.41 -0.14 4.42 2.96 -1.26 0.17 118.68 129.15 2ey6 s LEU 14 Ca -0.03 2.51 -0.13 0.00 -0.22 0.00 0.00 54.13 56.26 2ey6 s LEU 14 Cb -0.12 -3.62 -0.06 0.00 0.50 0.00 0.00 46.19 42.90 2ey6 s LEU 14 CO 0.02 -0.59 -0.27 -0.38 -1.32 0.00 0.00 176.35 173.81 2ey6 n ILE 15 N 2.48 1.38 -3.66 6.68 5.41 0.13 -4.78 119.36 126.99 2ey6 n ILE 15 Ca 0.06 0.07 -0.11 0.00 1.00 0.00 0.00 62.75 63.77 2ey6 n ILE 15 Cb 0.42 -2.08 -0.08 0.00 -0.71 0.00 0.00 39.64 37.18 2ey6 n ILE 15 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2ey6 s LYS 16 N -2.63 0.66 0.06 0.38 2.20 -0.77 -5.01 119.74 114.62 2ey6 s LYS 16 Ca -0.25 0.95 -0.30 0.00 -0.36 0.00 0.00 55.97 56.02 2ey6 s LYS 16 Cb 0.05 0.22 -0.05 0.00 -1.51 0.00 0.00 37.83 36.55 2ey6 s LYS 16 CO 0.35 -0.12 1.00 0.00 -0.36 0.00 0.00 175.35 176.22 2ey6 s ALA 17 N 0.90 3.23 -0.21 3.13 0.00 -1.26 -0.53 121.76 127.01 2ey6 s ALA 17 Ca -0.05 0.60 -0.01 0.00 0.00 0.00 0.00 51.96 52.51 2ey6 s ALA 17 Cb -0.05 -3.33 -0.13 0.00 0.00 0.00 0.00 23.12 19.61 2ey6 s ALA 17 CO -0.08 -0.17 -0.20 -0.89 0.00 0.00 0.00 175.76 174.42 2ey6 n ILE 18 N 3.40 1.20 -3.71 0.00 5.41 -0.74 -4.94 119.36 119.97 2ey6 n ILE 18 Ca 0.05 -0.43 -0.08 0.00 1.00 0.00 0.00 62.75 63.29 2ey6 n ILE 18 Cb 0.50 -1.35 0.01 0.00 -0.71 0.00 0.00 39.64 38.09 2ey6 n ILE 18 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2ey6 n ASP 19 N -3.28 -1.71 0.06 4.38 2.03 -0.83 -4.97 116.55 112.23 2ey6 n ASP 19 Ca -0.38 -2.35 0.10 0.00 0.52 0.00 0.00 54.79 52.68 2ey6 n ASP 19 Cb 0.88 2.89 0.55 0.00 -0.72 0.00 0.00 41.12 44.72 2ey6 n ASP 19 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2ey6 h GLY 20 N 1.61 0.31 -1.19 0.27 0.00 -1.83 -3.01 103.07 99.23 2ey6 h GLY 20 Ca -0.26 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 46.96 2ey6 h GLY 20 CO 0.34 0.09 0.00 2.09 0.00 0.00 0.00 176.54 179.05 2ey6 n ASP 21 N -4.48 2.51 -3.78 0.19 3.85 -1.26 -4.80 116.55 108.78 2ey6 n ASP 21 Ca 0.04 -1.75 -0.15 0.00 -0.71 0.00 0.00 54.79 52.22 2ey6 n ASP 21 Cb 0.23 -0.12 -0.16 0.00 -1.35 0.00 0.00 41.12 39.71 2ey6 n ASP 21 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 2ey6 s THR 22 N -1.01 -0.04 0.03 2.12 2.01 -1.14 -1.10 115.64 116.51 2ey6 s THR 22 Ca 0.20 0.20 0.03 0.00 0.31 0.00 0.00 61.69 62.42 2ey6 s THR 22 Cb 0.12 -0.09 -0.02 0.00 0.01 0.00 0.00 72.50 72.52 2ey6 s THR 22 CO 0.16 0.09 -0.09 0.68 -0.69 0.00 0.00 174.62 174.77 2ey6 s VAL 23 N 1.02 0.66 -0.20 3.82 -7.23 -0.59 -1.80 120.40 116.08 2ey6 s VAL 23 Ca -0.09 -0.80 -0.13 0.00 -1.81 0.00 0.00 61.98 59.15 2ey6 s VAL 23 Cb -0.12 -0.64 -0.05 0.00 0.56 0.00 0.00 36.38 36.13 2ey6 s VAL 23 CO -0.03 -0.13 0.25 -0.75 -0.31 0.00 0.00 175.10 174.14 2ey6 s LYS 24 N -1.03 4.16 0.09 4.82 2.20 0.31 -0.33 119.74 129.97 2ey6 s LYS 24 Ca -0.03 -0.05 0.07 0.00 -0.36 0.00 0.00 55.97 55.60 2ey6 s LYS 24 Cb -0.07 -3.49 -0.03 0.00 -1.51 0.00 0.00 37.83 32.73 2ey6 s LYS 24 CO 0.00 0.12 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.43 2ey6 s LEU 25 N 0.87 2.31 -0.30 5.43 1.43 -0.09 -0.69 118.68 127.64 2ey6 s LEU 25 Ca 0.13 -0.68 -0.25 0.00 -1.03 0.00 0.00 54.13 52.29 2ey6 s LEU 25 Cb -0.13 -0.67 0.01 0.00 0.03 0.00 0.00 46.19 45.42 2ey6 s LEU 25 CO 0.04 -0.03 0.89 -0.32 0.23 0.00 0.00 176.35 177.15 2ey6 s MET 26 N -1.99 4.03 -0.08 1.70 -2.45 0.13 -0.86 119.30 119.77 2ey6 s MET 26 Ca 0.04 0.80 0.01 0.00 -1.25 0.00 0.00 55.69 55.29 2ey6 s MET 26 Cb -0.09 -3.72 0.02 0.00 1.25 0.00 0.00 34.83 32.29 2ey6 s MET 26 CO 0.03 -0.72 -0.09 -0.47 1.05 0.00 0.00 175.02 174.82 2ey6 s TYR 27 N 3.15 1.38 -1.66 4.11 5.04 0.91 -2.04 117.35 128.24 2ey6 s TYR 27 Ca 0.37 -0.57 -0.13 0.00 -2.44 0.00 0.00 57.07 54.29 2ey6 s TYR 27 Cb -0.14 -1.09 0.12 0.00 0.35 0.00 0.00 41.96 41.21 2ey6 s TYR 27 CO 0.12 -0.36 0.55 1.63 -1.34 0.00 0.00 175.55 176.15 2ey6 n LYS 28 N 4.31 -2.29 -1.15 4.97 4.76 -1.26 -0.95 118.16 126.55 2ey6 n LYS 28 Ca -0.19 0.28 -0.05 0.00 -2.87 0.00 0.00 58.31 55.48 2ey6 n LYS 28 Cb 0.51 -4.66 -0.02 0.00 -1.84 0.00 0.00 35.03 29.01 2ey6 n LYS 28 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ey6 n GLY 29 N -1.63 0.76 3.08 0.72 0.00 -1.26 -5.02 105.19 101.84 2ey6 n GLY 29 Ca -0.05 -0.45 -0.28 0.00 0.00 0.00 0.00 46.02 45.23 2ey6 n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ey6 s GLN 30 N -2.02 2.23 0.25 1.61 -1.52 -0.12 -5.12 119.66 114.96 2ey6 s GLN 30 Ca 0.00 -0.58 -0.31 0.00 -1.95 0.00 0.00 55.36 52.52 2ey6 s GLN 30 Cb 0.00 -1.83 -0.12 0.00 -0.22 0.00 0.00 33.01 30.84 2ey6 s GLN 30 CO 0.00 0.01 1.58 -0.35 -0.25 0.00 0.00 175.29 176.28 2ey6 n PRO 31 N 3.95 2.50 -3.82 2.91 -0.04 -1.26 -0.06 135.00 139.18 2ey6 n PRO 31 Ca -0.20 0.89 -0.12 0.00 -0.04 0.00 0.00 63.50 64.03 2ey6 n PRO 31 Cb 0.52 -2.66 -0.13 0.00 -0.04 0.00 0.00 33.50 31.19 2ey6 n PRO 31 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2ey6 s MET 32 N 0.05 0.16 -0.02 0.54 -1.94 -0.04 -4.90 119.30 113.15 2ey6 s MET 32 Ca 0.69 0.21 -0.26 0.00 -1.71 0.00 0.00 55.69 54.62 2ey6 s MET 32 Cb -0.55 0.06 -0.04 0.00 2.01 0.00 0.00 34.83 36.30 2ey6 s MET 32 CO 0.44 -0.03 0.81 0.99 -0.01 0.00 0.00 175.02 177.21 2ey6 s THR 33 N 0.17 4.91 -0.05 2.05 2.01 -1.26 -0.91 115.64 122.56 2ey6 s THR 33 Ca -0.01 1.69 0.04 0.00 0.31 0.00 0.00 61.69 63.72 2ey6 s THR 33 Cb -0.02 -4.15 -0.02 0.00 0.01 0.00 0.00 72.50 68.32 2ey6 s THR 33 CO -0.00 0.25 -0.16 -0.36 -0.69 0.00 0.00 174.62 173.65 2ey6 s PHE 34 N 0.65 2.64 -0.19 4.92 0.40 0.55 -0.61 117.98 126.34 2ey6 s PHE 34 Ca 0.42 -0.27 -0.10 0.00 -0.60 0.00 0.00 56.93 56.38 2ey6 s PHE 34 Cb -0.19 -1.63 -0.05 0.00 0.51 0.00 0.00 43.02 41.66 2ey6 s PHE 34 CO 0.22 0.10 0.15 0.50 0.70 0.00 0.00 175.22 176.89 2ey6 s ARG 35 N -0.59 4.16 0.01 0.44 6.06 0.34 -1.54 118.95 127.84 2ey6 s ARG 35 Ca 0.08 -0.17 -0.30 0.00 -2.50 0.00 0.00 55.73 52.84 2ey6 s ARG 35 Cb -0.11 -3.41 -0.06 0.00 0.06 0.00 0.00 34.95 31.43 2ey6 s ARG 35 CO 0.01 0.32 1.49 -0.51 -2.50 0.00 0.00 175.30 174.11 2ey6 s LEU 36 N 0.30 4.33 0.38 -0.88 1.43 -0.26 -2.70 118.68 121.28 2ey6 s LEU 36 Ca 0.09 2.22 -0.27 0.00 -1.03 0.00 0.00 54.13 55.15 2ey6 s LEU 36 Cb -0.11 -3.56 -0.10 0.00 0.03 0.00 0.00 46.19 42.45 2ey6 s LEU 36 CO -0.01 -0.79 1.35 -0.76 0.23 0.00 0.00 176.35 176.38 2ey6 s LEU 37 N 2.61 4.29 0.00 1.79 1.43 -0.35 -3.83 118.68 124.62 2ey6 s LEU 37 Ca 0.67 2.77 0.00 0.00 -1.03 0.00 0.00 54.13 56.54 2ey6 s LEU 37 Cb -0.34 -3.78 0.00 0.00 0.03 0.00 0.00 46.19 42.10 2ey6 s LEU 37 CO 0.28 -0.79 0.00 0.18 0.23 0.00 0.00 176.35 176.25 2ey6 n LEU 38 N 0.36 0.02 -4.19 1.79 4.77 -1.26 -4.92 117.00 113.57 2ey6 n LEU 38 Ca 0.02 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.75 2ey6 n LEU 38 Cb 0.42 -0.30 -0.15 0.00 -2.33 0.00 0.00 43.42 41.06 2ey6 n LEU 38 CO 0.59 -0.02 -0.51 0.68 -1.33 0.00 0.00 177.39 176.80 2ey6 s VAL 39 N -2.92 1.47 -0.34 4.08 -7.23 -1.25 -0.38 120.40 113.83 2ey6 s VAL 39 Ca 0.00 -0.88 -0.12 0.00 -1.81 0.00 0.00 61.98 59.17 2ey6 s VAL 39 Cb 0.00 -1.24 -0.00 0.00 0.56 0.00 0.00 36.38 35.69 2ey6 s VAL 39 CO 0.00 0.35 0.21 -1.81 -0.31 0.00 0.00 175.10 173.53 2ey6 s ASP 40 N -0.62 5.82 -0.12 4.85 1.01 0.61 -4.73 116.67 123.48 2ey6 s ASP 40 Ca 0.07 -0.59 -0.01 0.00 0.71 0.00 0.00 52.55 52.73 2ey6 s ASP 40 Cb -0.07 -2.07 -0.02 0.00 1.01 0.00 0.00 42.92 41.76 2ey6 s ASP 40 CO -0.00 -0.26 -0.10 -0.69 0.21 0.00 0.00 175.17 174.33 2ey6 s VAL 41 N 1.65 3.34 0.25 -1.27 1.01 -1.26 -1.00 120.40 123.12 2ey6 s VAL 41 Ca 0.05 -0.57 -0.31 0.00 0.00 0.00 0.00 61.98 61.15 2ey6 s VAL 41 Cb -0.18 -2.41 -0.13 0.00 0.00 0.00 0.00 36.38 33.67 2ey6 s VAL 41 CO 0.08 0.53 1.46 -2.65 0.00 0.00 0.00 175.10 174.52 2ey6 n PRO 42 N 3.29 2.19 -3.98 2.72 -0.02 -1.26 -4.85 135.00 133.09 2ey6 n PRO 42 Ca -0.18 0.78 -0.26 0.00 -2.02 0.00 0.00 63.50 61.82 2ey6 n PRO 42 Cb 0.53 -2.47 -0.04 0.00 -0.02 0.00 0.00 33.50 31.50 2ey6 n PRO 42 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2ey6 s GLU 43 N -0.39 3.30 -0.00 -0.52 2.02 -1.26 -4.36 118.70 117.48 2ey6 s GLU 43 Ca 0.67 -0.68 0.22 0.00 0.02 0.00 0.00 54.97 55.21 2ey6 s GLU 43 Cb -0.61 -2.88 -0.23 0.00 0.10 0.00 0.00 34.13 30.51 2ey6 s GLU 43 CO 0.49 0.51 0.73 0.25 0.02 0.00 0.00 175.26 177.26 2ey6 n THR 44 N -0.53 0.05 0.00 3.63 -2.24 -1.26 -0.32 114.28 113.60 2ey6 n THR 44 Ca -0.07 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 2ey6 n THR 44 Cb 0.54 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 2ey6 n THR 44 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2ey6 n LYS 45 N -1.97 0.00 -1.54 -0.78 4.01 -1.24 -3.90 118.16 112.75 2ey6 n LYS 45 Ca -0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2ey6 n LYS 45 Cb 0.47 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.99 2ey6 n LYS 45 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 2ey6 n HIS 46 N 0.00 -4.22 -0.11 2.13 -0.00 -1.26 -3.62 115.22 108.14 2ey6 n HIS 46 Ca 0.00 2.27 -0.22 0.00 0.46 0.00 0.00 57.72 60.23 2ey6 n HIS 46 Cb 0.00 -3.49 -0.12 0.00 -0.12 0.00 0.00 29.99 26.26 2ey6 n HIS 46 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2ey6 n PRO 47 N -1.91 0.65 -1.47 1.57 -0.04 -1.26 -2.57 135.00 129.97 2ey6 n PRO 47 Ca 0.00 0.22 -0.40 0.00 -0.04 0.00 0.00 63.50 63.28 2ey6 n PRO 47 Cb 0.28 -1.55 -0.02 0.00 -0.04 0.00 0.00 33.50 32.17 2ey6 n PRO 47 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2ey6 n LYS 48 N -3.60 2.88 0.00 0.54 4.76 -1.26 -3.22 118.16 118.25 2ey6 n LYS 48 Ca -0.46 -2.31 0.00 0.00 -2.87 0.00 0.00 58.31 52.68 2ey6 n LYS 48 Cb 0.96 -3.04 0.00 0.00 -1.84 0.00 0.00 35.03 31.10 2ey6 n LYS 48 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2ey6 n LYS 49 N 5.34 0.00 0.00 1.97 4.81 -1.26 -5.07 118.16 123.95 2ey6 n LYS 49 Ca 0.59 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 2ey6 n LYS 49 Cb 0.33 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.38 2ey6 n LYS 49 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ey6 n GLY 50 N 0.00 1.60 3.60 3.14 0.00 -1.06 -4.64 105.19 107.82 2ey6 n GLY 50 Ca 0.00 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 2ey6 n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ey6 s VAL 51 N 0.00 4.76 0.51 1.61 1.01 -1.25 -3.67 120.40 123.36 2ey6 s VAL 51 Ca 0.00 1.01 -0.04 0.00 0.00 0.00 0.00 61.98 62.95 2ey6 s VAL 51 Cb 0.00 -4.18 -0.01 0.00 0.00 0.00 0.00 36.38 32.18 2ey6 s VAL 51 CO 0.00 -0.35 0.80 -1.61 0.00 0.00 0.00 175.10 173.94 2ey6 s GLU 52 N 3.04 3.24 0.28 2.72 2.02 0.56 -4.99 118.70 125.57 2ey6 s GLU 52 Ca 0.32 -0.00 -0.30 0.00 0.02 0.00 0.00 54.97 55.00 2ey6 s GLU 52 Cb -0.14 -2.38 -0.11 0.00 0.10 0.00 0.00 34.13 31.60 2ey6 s GLU 52 CO 0.15 -0.38 1.59 0.21 0.02 0.00 0.00 175.26 176.85 2ey6 s LYS 53 N -4.79 4.14 0.00 1.61 2.20 -1.26 -1.41 119.74 120.23 2ey6 s LYS 53 Ca 0.50 2.55 0.00 0.00 -0.36 0.00 0.00 55.97 58.65 2ey6 s LYS 53 Cb -0.10 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 2ey6 s LYS 53 CO 0.44 -0.62 0.00 0.66 -0.36 0.00 0.00 175.35 175.46 2ey6 n TYR 54 N 2.39 0.00 0.29 4.03 4.01 -1.26 -4.83 117.16 121.79 2ey6 n TYR 54 Ca 0.09 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.66 2ey6 n TYR 54 Cb 0.38 -0.46 -0.08 0.00 -0.31 0.00 0.00 39.34 38.86 2ey6 n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2ey6 h GLY 55 N 0.00 -0.79 0.90 2.72 0.00 -1.44 0.11 103.07 104.58 2ey6 h GLY 55 Ca 0.00 0.31 0.05 0.00 0.00 0.00 0.00 47.33 47.69 2ey6 h GLY 55 CO 0.00 -0.29 0.61 -2.55 0.00 0.00 0.00 176.54 174.31 2ey6 h PRO 56 N -0.75 1.08 -0.54 4.80 0.11 -1.86 -0.36 132.00 134.49 2ey6 h PRO 56 Ca -0.06 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 65.92 2ey6 h PRO 56 Cb 0.60 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.44 2ey6 h PRO 56 CO 0.08 0.72 0.09 0.93 -0.21 0.00 0.00 178.00 179.61 2ey6 h GLU 57 N 1.12 0.89 -0.27 1.05 3.07 -1.92 0.51 114.58 119.02 2ey6 h GLU 57 Ca 0.38 -0.24 -0.15 0.00 -0.50 0.00 0.00 59.36 58.86 2ey6 h GLU 57 Cb 0.10 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2ey6 h GLU 57 CO -0.13 0.86 -0.42 0.00 -1.40 0.00 0.00 179.01 177.92 2ey6 h ALA 58 N 0.99 0.75 -0.40 3.43 0.00 -0.32 -2.12 119.26 121.58 2ey6 h ALA 58 Ca 0.16 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 2ey6 h ALA 58 Cb 0.41 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2ey6 h ALA 58 CO 0.01 0.66 0.11 1.03 0.00 0.00 0.00 179.25 181.06 2ey6 h SER 59 N 0.54 0.60 -0.20 0.00 0.87 -0.92 -1.30 113.55 113.15 2ey6 h SER 59 Ca 0.04 -0.22 -0.04 0.00 -1.23 0.00 0.00 61.79 60.33 2ey6 h SER 59 Cb 0.96 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.74 2ey6 h SER 59 CO 0.09 0.67 -0.00 0.00 -0.53 0.00 0.00 176.83 177.05 2ey6 h ALA 60 N 0.96 1.43 0.21 6.23 0.00 -0.85 -1.53 119.26 125.70 2ey6 h ALA 60 Ca 0.13 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2ey6 h ALA 60 Cb 0.29 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2ey6 h ALA 60 CO -0.00 0.41 -0.10 0.35 0.00 0.00 0.00 179.25 179.91 2ey6 h PHE 61 N 0.46 -0.26 -0.44 0.00 3.57 -0.96 -0.64 116.94 118.67 2ey6 h PHE 61 Ca 0.10 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.61 2ey6 h PHE 61 Cb 0.30 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.10 2ey6 h PHE 61 CO 0.01 -0.02 0.26 1.15 -2.23 0.00 0.00 178.31 177.48 2ey6 h THR 62 N -0.46 1.05 -0.55 4.41 2.02 -1.20 -1.34 112.91 116.84 2ey6 h THR 62 Ca -0.03 -0.18 0.03 0.00 0.77 0.00 0.00 66.41 67.00 2ey6 h THR 62 Cb 0.35 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 67.19 2ey6 h THR 62 CO 0.05 0.10 0.32 0.50 0.37 0.00 0.00 175.52 176.85 2ey6 h LYS 63 N 0.53 0.61 -0.39 6.66 3.64 -1.18 -1.06 116.57 125.38 2ey6 h LYS 63 Ca 0.18 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.39 2ey6 h LYS 63 Cb 0.01 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 2ey6 h LYS 63 CO -0.08 0.40 -0.27 -0.22 -2.27 0.00 0.00 179.45 177.01 2ey6 h LYS 64 N 0.63 0.83 -0.69 1.90 1.63 -0.94 0.06 116.57 119.99 2ey6 h LYS 64 Ca 0.23 -0.37 -0.08 0.00 -0.85 0.00 0.00 60.65 59.58 2ey6 h LYS 64 Cb 0.05 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.64 2ey6 h LYS 64 CO -0.11 1.00 0.13 1.98 -3.45 0.00 0.00 179.45 178.99 2ey6 h MET 65 N 0.71 1.13 0.00 1.90 4.05 -0.81 -2.74 114.93 119.17 2ey6 h MET 65 Ca 0.09 -0.29 -0.22 0.00 -0.28 0.00 0.00 59.70 58.99 2ey6 h MET 65 Cb 0.81 -0.14 -0.04 0.00 -0.80 0.00 0.00 31.60 31.44 2ey6 h MET 65 CO 0.07 1.02 -1.30 -0.39 0.23 0.00 0.00 176.91 176.53 2ey6 h VAL 66 N 1.05 1.06 0.00 -5.77 -1.51 -0.98 -3.24 116.25 106.86 2ey6 h VAL 66 Ca 0.21 -2.76 -0.09 0.00 -1.23 0.00 0.00 66.70 62.83 2ey6 h VAL 66 Cb 0.43 2.49 -0.01 0.00 -2.13 0.00 0.00 31.29 32.06 2ey6 h VAL 66 CO 0.01 0.61 -0.43 -0.33 -1.23 0.00 0.00 177.57 176.20 2ey6 h GLU 67 N 0.00 0.00 -0.33 5.19 5.08 -0.97 -3.09 114.58 120.46 2ey6 h GLU 67 Ca -0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2ey6 h GLU 67 Cb 1.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.04 2ey6 h GLU 67 CO 0.09 0.43 0.00 0.09 -1.00 0.00 0.00 179.01 178.62 2ey6 n ASN 68 N -3.79 3.04 -4.84 1.42 4.13 -1.04 -4.96 115.26 109.22 2ey6 n ASN 68 Ca -0.01 -1.93 -0.33 0.00 1.68 0.00 0.00 54.58 53.99 2ey6 n ASN 68 Cb 0.49 -0.21 -0.06 0.00 -1.54 0.00 0.00 39.78 38.46 2ey6 n ASN 68 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ey6 s ALA 69 N -1.58 3.27 0.04 5.41 0.00 -1.17 -4.97 121.76 122.77 2ey6 s ALA 69 Ca 0.37 0.13 -0.03 0.00 0.00 0.00 0.00 51.96 52.42 2ey6 s ALA 69 Cb 0.21 -2.85 -0.28 0.00 0.00 0.00 0.00 23.12 20.21 2ey6 s ALA 69 CO 0.30 0.29 1.01 0.87 0.00 0.00 0.00 175.76 178.23 2ey6 h LYS 70 N 2.28 0.25 -4.02 0.00 1.57 -1.93 -3.46 116.57 111.27 2ey6 h LYS 70 Ca -0.48 -0.43 -0.44 0.00 -1.87 0.00 0.00 60.65 57.43 2ey6 h LYS 70 Cb 1.18 0.16 -0.35 0.00 0.08 0.00 0.00 32.23 33.30 2ey6 h LYS 70 CO 0.64 1.15 -0.78 0.15 -0.57 0.00 0.00 179.45 180.05 2ey6 s LYS 71 N -2.64 0.93 -0.11 3.15 1.02 -1.26 -5.02 119.74 115.81 2ey6 s LYS 71 Ca -0.06 -0.10 -0.02 0.00 0.02 0.00 0.00 55.97 55.80 2ey6 s LYS 71 Cb 0.07 -0.99 -0.03 0.00 -0.52 0.00 0.00 37.83 36.36 2ey6 s LYS 71 CO 0.87 -0.14 -0.01 0.42 -0.92 0.00 0.00 175.35 175.57 2ey6 s ILE 72 N 1.19 4.16 0.04 2.17 -1.09 -1.26 -0.56 121.20 125.85 2ey6 s ILE 72 Ca -0.06 -0.29 0.04 0.00 -2.23 0.00 0.00 60.65 58.10 2ey6 s ILE 72 Cb -0.14 -2.77 -0.02 0.00 -1.58 0.00 0.00 42.46 37.95 2ey6 s ILE 72 CO -0.02 0.57 -0.12 -1.61 -1.23 0.00 0.00 174.94 172.54 2ey6 s GLU 73 N -0.46 0.75 0.05 2.79 2.02 -0.54 -1.83 118.70 121.47 2ey6 s GLU 73 Ca 0.08 -0.74 0.05 0.00 0.02 0.00 0.00 54.97 54.38 2ey6 s GLU 73 Cb -0.12 -0.69 -0.04 0.00 0.10 0.00 0.00 34.13 33.38 2ey6 s GLU 73 CO 0.02 0.16 -0.09 0.14 0.02 0.00 0.00 175.26 175.51 2ey6 s VAL 74 N -1.01 3.42 -0.17 2.63 -7.23 0.83 -0.86 120.40 118.01 2ey6 s VAL 74 Ca -0.02 -1.03 -0.03 0.00 -1.81 0.00 0.00 61.98 59.09 2ey6 s VAL 74 Cb -0.08 -2.53 0.05 0.00 0.56 0.00 0.00 36.38 34.38 2ey6 s VAL 74 CO 0.01 0.27 0.03 -0.70 -0.31 0.00 0.00 175.10 174.40 2ey6 s GLU 75 N -1.74 0.66 0.60 4.82 2.12 -0.04 -0.50 118.70 124.60 2ey6 s GLU 75 Ca 0.19 -0.33 -0.13 0.00 0.36 0.00 0.00 54.97 55.05 2ey6 s GLU 75 Cb -0.11 -1.93 -0.04 0.00 0.26 0.00 0.00 34.13 32.31 2ey6 s GLU 75 CO 0.10 -0.58 1.03 -0.06 -0.54 0.00 0.00 175.26 175.20 2ey6 s PHE 76 N 1.88 3.37 0.00 5.30 0.40 -1.26 -0.77 117.98 126.90 2ey6 s PHE 76 Ca 0.00 1.41 0.00 0.00 -0.60 0.00 0.00 56.93 57.74 2ey6 s PHE 76 Cb -0.16 -2.82 0.00 0.00 0.51 0.00 0.00 43.02 40.55 2ey6 s PHE 76 CO -0.08 -0.76 0.00 -3.47 0.70 0.00 0.00 175.22 171.61 2ey6 n ASP 77 N -2.34 0.00 0.17 1.36 -0.08 -1.26 -4.71 116.55 109.69 2ey6 n ASP 77 Ca 0.07 -0.68 0.12 0.00 -1.51 0.00 0.00 54.79 52.79 2ey6 n ASP 77 Cb 0.54 0.00 0.27 0.00 2.34 0.00 0.00 41.12 44.27 2ey6 n ASP 77 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2ey6 h LYS 78 N 0.00 0.00 0.00 -0.67 1.57 -1.97 -3.47 116.57 112.03 2ey6 h LYS 78 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2ey6 h LYS 78 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2ey6 h LYS 78 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 2ey6 n GLY 79 N 1.19 2.44 3.65 3.86 0.00 -1.26 -4.98 105.19 110.10 2ey6 n GLY 79 Ca 0.05 -1.81 -0.45 0.00 0.00 0.00 0.00 46.02 43.81 2ey6 n GLY 79 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ey6 n GLN 80 N 0.00 1.84 0.00 1.61 3.00 -1.26 -4.93 117.38 117.64 2ey6 n GLN 80 Ca 0.00 0.65 0.09 0.00 -0.01 0.00 0.00 57.00 57.74 2ey6 n GLN 80 Cb 0.00 -2.23 -0.01 0.00 0.00 0.00 0.00 30.24 28.00 2ey6 n GLN 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 2ey6 n ARG 81 N 1.53 1.43 -4.04 -1.09 1.74 -1.26 -4.81 116.66 110.15 2ey6 n ARG 81 Ca 0.10 -0.86 -0.11 0.00 -0.77 0.00 0.00 57.85 56.22 2ey6 n ARG 81 Cb 0.31 -1.38 -0.11 0.00 -1.02 0.00 0.00 32.46 30.27 2ey6 n ARG 81 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2ey6 s THR 82 N -2.21 0.35 0.05 0.55 -4.23 -1.26 -0.46 115.64 108.43 2ey6 s THR 82 Ca 0.15 -1.17 0.01 0.00 -1.18 0.00 0.00 61.69 59.50 2ey6 s THR 82 Cb 0.15 -0.67 0.01 0.00 1.34 0.00 0.00 72.50 73.33 2ey6 s THR 82 CO 0.50 -0.54 0.07 -0.90 -0.54 0.00 0.00 174.62 173.21 2ey6 n ASP 83 N 1.23 0.15 0.05 3.99 5.68 -0.27 -4.88 116.55 122.49 2ey6 n ASP 83 Ca -0.21 -1.11 0.12 0.00 -0.50 0.00 0.00 54.79 53.08 2ey6 n ASP 83 Cb 0.56 -0.04 0.48 0.00 -1.14 0.00 0.00 41.12 40.98 2ey6 n ASP 83 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2ey6 n LYS 84 N -1.12 0.10 -0.17 0.11 2.85 -1.26 -1.91 118.16 116.76 2ey6 n LYS 84 Ca 0.01 0.18 0.10 0.00 -1.05 0.00 0.00 58.31 57.55 2ey6 n LYS 84 Cb 0.05 -1.64 0.28 0.00 -0.65 0.00 0.00 35.03 33.07 2ey6 n LYS 84 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2ey6 n TYR 85 N -1.81 0.44 -0.61 5.58 4.02 -1.26 -4.93 117.16 118.59 2ey6 n TYR 85 Ca 0.05 -0.22 0.00 0.00 -0.01 0.00 0.00 57.90 57.72 2ey6 n TYR 85 Cb 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.63 2ey6 n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2ey6 n GLY 86 N 1.28 0.75 3.79 2.72 0.00 -0.80 -5.04 105.19 107.88 2ey6 n GLY 86 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2ey6 n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ey6 s ARG 87 N -0.39 4.52 0.46 1.61 0.52 -1.26 -4.79 118.95 119.62 2ey6 s ARG 87 Ca 0.00 1.16 -0.24 0.00 -0.52 0.00 0.00 55.73 56.13 2ey6 s ARG 87 Cb 0.00 -3.03 -0.07 0.00 0.52 0.00 0.00 34.95 32.37 2ey6 s ARG 87 CO 0.00 0.44 1.33 0.20 0.02 0.00 0.00 175.30 177.29 2ey6 s GLY 88 N -1.42 2.89 -0.36 -3.53 0.00 0.22 -1.12 107.32 104.00 2ey6 s GLY 88 Ca 0.42 1.28 -0.07 0.00 0.00 0.00 0.00 44.72 46.36 2ey6 s GLY 88 CO 0.25 1.84 0.14 1.08 0.00 0.00 0.00 173.10 176.41 2ey6 s LEU 89 N -2.89 4.55 0.22 0.66 1.43 0.39 -0.50 118.68 122.54 2ey6 s LEU 89 Ca 0.63 -1.29 -0.12 0.00 -1.03 0.00 0.00 54.13 52.32 2ey6 s LEU 89 Cb -0.39 -1.88 -0.00 0.00 0.03 0.00 0.00 46.19 43.94 2ey6 s LEU 89 CO 0.49 -0.39 0.42 0.00 0.23 0.00 0.00 176.35 177.10 2ey6 s ALA 90 N 1.38 -0.18 -0.06 4.21 0.00 -1.10 -4.38 121.76 121.63 2ey6 s ALA 90 Ca -0.00 -0.85 -0.18 0.00 0.00 0.00 0.00 51.96 50.92 2ey6 s ALA 90 Cb -0.20 1.02 -0.05 0.00 0.00 0.00 0.00 23.12 23.88 2ey6 s ALA 90 CO 0.02 -0.79 0.51 0.71 0.00 0.00 0.00 175.76 176.21 2ey6 s TYR 91 N -4.00 3.60 -0.11 0.00 2.02 0.05 -1.21 117.35 117.71 2ey6 s TYR 91 Ca 0.21 1.01 0.02 0.00 -0.37 0.00 0.00 57.07 57.94 2ey6 s TYR 91 Cb 0.01 -2.53 -0.01 0.00 -0.40 0.00 0.00 41.96 39.02 2ey6 s TYR 91 CO 0.06 0.30 -0.17 0.42 -1.57 0.00 0.00 175.55 174.59 2ey6 s ILE 92 N 0.08 2.70 -0.07 2.71 -1.09 -1.26 -0.86 121.20 123.40 2ey6 s ILE 92 Ca 0.27 -0.80 0.02 0.00 -2.23 0.00 0.00 60.65 57.91 2ey6 s ILE 92 Cb -0.16 -2.09 -0.02 0.00 -1.58 0.00 0.00 42.46 38.60 2ey6 s ILE 92 CO 0.13 0.55 -0.13 -0.31 -1.23 0.00 0.00 174.94 173.95 2ey6 s TYR 93 N 0.18 2.77 -0.23 3.97 2.02 -0.04 -0.07 117.35 125.95 2ey6 s TYR 93 Ca -0.10 -0.26 0.01 0.00 -0.37 0.00 0.00 57.07 56.35 2ey6 s TYR 93 Cb -0.16 -1.70 0.04 0.00 -0.40 0.00 0.00 41.96 39.74 2ey6 s TYR 93 CO 0.06 0.10 -0.13 0.00 -1.57 0.00 0.00 175.55 174.01 2ey6 s ALA 94 N -0.44 2.52 -1.47 3.71 0.00 -0.15 -1.47 121.76 124.46 2ey6 s ALA 94 Ca 0.06 -1.48 -0.04 0.00 0.00 0.00 0.00 51.96 50.49 2ey6 s ALA 94 Cb -0.12 -1.47 0.03 0.00 0.00 0.00 0.00 23.12 21.56 2ey6 s ALA 94 CO 0.02 -0.78 0.47 -0.25 0.00 0.00 0.00 175.76 175.21 2ey6 n ASP 95 N 4.57 -0.87 0.00 0.00 10.43 0.27 -1.36 116.55 129.59 2ey6 n ASP 95 Ca -0.17 -1.02 0.00 0.00 2.57 0.00 0.00 54.79 56.17 2ey6 n ASP 95 Cb 0.46 -2.93 0.00 0.00 1.84 0.00 0.00 41.12 40.49 2ey6 n ASP 95 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2ey6 n GLY 96 N -1.91 2.33 3.57 0.44 0.00 -1.26 -5.00 105.19 103.36 2ey6 n GLY 96 Ca -0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 2ey6 n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ey6 s LYS 97 N -0.16 3.90 -0.03 1.61 1.02 -0.46 -5.03 119.74 120.58 2ey6 s LYS 97 Ca 0.00 -0.36 -0.30 0.00 0.02 0.00 0.00 55.97 55.33 2ey6 s LYS 97 Cb 0.00 -3.42 -0.05 0.00 -0.52 0.00 0.00 37.83 33.84 2ey6 s LYS 97 CO 0.00 -0.01 1.42 1.41 -0.92 0.00 0.00 175.35 177.25 2ey6 s MET 98 N 1.20 4.26 0.21 1.68 -2.45 -1.26 -0.98 119.30 121.96 2ey6 s MET 98 Ca 0.06 1.95 -0.07 0.00 -1.25 0.00 0.00 55.69 56.38 2ey6 s MET 98 Cb -0.14 -3.66 0.15 0.00 1.25 0.00 0.00 34.83 32.44 2ey6 s MET 98 CO 0.05 -0.63 1.73 0.28 1.05 0.00 0.00 175.02 177.49 2ey6 h VAL 99 N 5.09 1.26 -0.91 10.11 2.07 -0.84 -1.21 116.25 131.82 2ey6 h VAL 99 Ca -0.37 -0.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.18 2ey6 h VAL 99 Cb 1.17 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 2ey6 h VAL 99 CO 0.92 0.37 0.56 0.78 0.02 0.00 0.00 177.57 180.22 2ey6 h ASN 100 N 1.04 1.08 -0.29 0.57 4.21 -1.91 -2.03 115.58 118.26 2ey6 h ASN 100 Ca 0.21 -0.06 -0.15 0.00 1.21 0.00 0.00 56.30 57.51 2ey6 h ASN 100 Cb 0.38 -0.27 -0.00 0.00 -1.12 0.00 0.00 38.32 37.31 2ey6 h ASN 100 CO 0.00 0.82 -0.41 -0.08 -1.29 0.00 0.00 177.43 176.47 2ey6 h GLU 101 N 1.25 0.79 -0.94 0.81 4.22 -1.87 -2.96 114.58 115.87 2ey6 h GLU 101 Ca 0.33 -0.46 0.04 0.00 0.08 0.00 0.00 59.36 59.34 2ey6 h GLU 101 Cb -0.07 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.16 2ey6 h GLU 101 CO -0.06 1.09 0.61 0.00 -2.18 0.00 0.00 179.01 178.47 2ey6 h ALA 102 N 0.68 1.24 -0.64 2.92 0.00 -0.88 0.12 119.26 122.71 2ey6 h ALA 102 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ey6 h ALA 102 Cb 1.01 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2ey6 h ALA 102 CO 0.10 0.48 0.42 -0.07 0.00 0.00 0.00 179.25 180.17 2ey6 h LEU 103 N 1.18 0.75 -0.34 0.00 3.38 -1.36 -2.55 115.31 116.37 2ey6 h LEU 103 Ca 0.38 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.24 2ey6 h LEU 103 Cb 0.01 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2ey6 h LEU 103 CO -0.12 0.56 -0.07 0.58 0.09 0.00 0.00 178.44 179.47 2ey6 h VAL 104 N 0.87 1.28 -0.29 1.22 2.07 -1.16 -0.60 116.25 119.64 2ey6 h VAL 104 Ca 0.23 -1.12 0.04 0.00 0.82 0.00 0.00 66.70 66.68 2ey6 h VAL 104 Cb -0.08 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2ey6 h VAL 104 CO -0.05 0.37 0.20 -0.09 0.02 0.00 0.00 177.57 178.01 2ey6 h ARG 105 N 0.43 0.19 -0.18 1.57 9.65 -0.73 -2.09 114.38 123.22 2ey6 h ARG 105 Ca 0.09 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.95 2ey6 h ARG 105 Cb 0.57 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.11 2ey6 h ARG 105 CO 0.03 0.13 0.00 1.04 2.80 0.00 0.00 179.97 183.97 2ey6 n GLN 106 N -4.49 1.68 -2.11 0.20 1.13 -0.97 -4.43 117.38 108.41 2ey6 n GLN 106 Ca 0.03 -1.03 -0.10 0.00 -1.94 0.00 0.00 57.00 53.95 2ey6 n GLN 106 Cb 0.22 -1.37 -0.01 0.00 0.11 0.00 0.00 30.24 29.19 2ey6 n GLN 106 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ey6 n GLY 107 N 1.09 0.06 0.44 1.08 0.00 -0.79 -4.41 105.19 102.67 2ey6 n GLY 107 Ca 0.15 -0.46 0.06 0.00 0.00 0.00 0.00 46.02 45.77 2ey6 n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ey6 n LEU 108 N -1.47 2.83 -3.55 0.99 4.77 -0.25 -1.02 117.00 119.29 2ey6 n LEU 108 Ca -0.12 -2.44 -0.11 0.00 -0.03 0.00 0.00 56.01 53.31 2ey6 n LEU 108 Cb 0.57 -0.29 -0.05 0.00 -2.33 0.00 0.00 43.42 41.33 2ey6 n LEU 108 CO 0.15 0.66 0.71 0.00 -1.33 0.00 0.00 177.39 177.57 2ey6 s ALA 109 N -1.78 -1.89 0.19 -1.18 0.00 -1.21 -4.36 121.76 111.54 2ey6 s ALA 109 Ca 0.24 1.44 0.08 0.00 0.00 0.00 0.00 51.96 53.71 2ey6 s ALA 109 Cb 0.17 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 2ey6 s ALA 109 CO 0.08 -0.39 -0.00 0.15 0.00 0.00 0.00 175.76 175.59 2ey6 s LYS 110 N -1.51 2.37 0.21 0.00 1.02 -0.17 -4.47 119.74 117.20 2ey6 s LYS 110 Ca -0.02 -1.17 -0.30 0.00 0.02 0.00 0.00 55.97 54.50 2ey6 s LYS 110 Cb -0.00 -2.32 -0.09 0.00 -0.52 0.00 0.00 37.83 34.89 2ey6 s LYS 110 CO 0.01 0.44 1.40 0.08 -0.92 0.00 0.00 175.35 176.36 2ey6 s VAL 111 N -1.83 2.90 0.88 3.17 1.01 -1.26 -0.29 120.40 124.98 2ey6 s VAL 111 Ca 0.28 0.73 -0.12 0.00 0.00 0.00 0.00 61.98 62.87 2ey6 s VAL 111 Cb -0.09 -3.46 0.17 0.00 0.00 0.00 0.00 36.38 32.99 2ey6 s VAL 111 CO 0.19 0.10 1.22 0.00 0.00 0.00 0.00 175.10 176.61 2ey6 s ALA 112 N 0.23 2.64 0.17 5.51 0.00 0.49 -4.68 121.76 126.12 2ey6 s ALA 112 Ca 0.60 -1.25 -0.32 0.00 0.00 0.00 0.00 51.96 50.99 2ey6 s ALA 112 Cb -0.40 -2.61 -0.11 0.00 0.00 0.00 0.00 23.12 20.00 2ey6 s ALA 112 CO 0.39 -2.10 1.71 -0.47 0.00 0.00 0.00 175.76 175.30 2ey6 s TYR 113 N -3.67 2.72 -0.15 0.00 5.04 -1.26 -4.93 117.35 115.11 2ey6 s TYR 113 Ca 0.71 0.32 -0.06 0.00 -2.44 0.00 0.00 57.07 55.59 2ey6 s TYR 113 Cb -0.05 -4.09 -0.04 0.00 0.35 0.00 0.00 41.96 38.13 2ey6 s TYR 113 CO 0.50 -4.22 0.07 0.08 -1.34 0.00 0.00 175.55 170.65 2ey6 s VAL 114 N 1.65 4.88 -0.28 3.14 1.01 -1.26 -4.98 120.40 124.56 2ey6 s VAL 114 Ca 0.75 -0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.67 2ey6 s VAL 114 Cb -0.47 -3.15 0.02 0.00 0.00 0.00 0.00 36.38 32.78 2ey6 s VAL 114 CO 0.33 0.53 0.02 -0.31 0.00 0.00 0.00 175.10 175.67 2ey6 s TYR 115 N -0.26 3.13 0.42 5.22 1.51 -1.26 -5.08 117.35 121.03 2ey6 s TYR 115 Ca 0.08 -1.27 -0.24 0.00 -1.01 0.00 0.00 57.07 54.63 2ey6 s TYR 115 Cb -0.12 -2.17 -0.08 0.00 -0.11 0.00 0.00 41.96 39.48 2ey6 s TYR 115 CO 0.01 -0.66 1.15 0.15 -1.11 0.00 0.00 175.55 175.10 2ey6 s LYS 116 N 1.41 3.96 -0.35 -0.62 1.02 -1.26 -0.83 119.74 123.08 2ey6 s LYS 116 Ca 0.01 1.76 0.08 0.00 0.02 0.00 0.00 55.97 57.85 2ey6 s LYS 116 Cb -0.17 -2.55 0.72 0.00 -0.52 0.00 0.00 37.83 35.31 2ey6 s LYS 116 CO -0.00 -0.38 1.82 -0.35 -0.92 0.00 0.00 175.35 175.52 2ey6 n PRO 117 N -0.16 3.36 -2.15 -1.68 -0.04 -1.26 -5.02 135.00 128.06 2ey6 n PRO 117 Ca 0.06 -3.00 -0.42 0.00 -0.04 0.00 0.00 63.50 60.09 2ey6 n PRO 117 Cb 0.48 -2.20 0.00 0.00 -0.04 0.00 0.00 33.50 31.74 2ey6 n PRO 117 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2ey6 n ASN 118 N -0.36 4.66 -0.83 3.54 3.02 -0.01 -4.28 115.26 121.02 2ey6 n ASN 118 Ca 0.45 -3.01 0.00 0.00 -0.03 0.00 0.00 54.58 51.99 2ey6 n ASN 118 Cb 1.45 -1.55 -0.00 0.00 -0.61 0.00 0.00 39.78 39.06 2ey6 n ASN 118 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2ey6 n ASN 119 N 4.80 0.17 -0.14 6.41 6.94 -1.26 -4.51 115.26 127.67 2ey6 n ASN 119 Ca 0.44 -1.83 -0.04 0.00 -0.02 0.00 0.00 54.58 53.13 2ey6 n ASN 119 Cb 0.38 -0.14 0.04 0.00 -2.36 0.00 0.00 39.78 37.70 2ey6 n ASN 119 CO 0.00 0.00 0.00 0.74 -1.03 0.00 0.00 177.26 176.97 2ey6 h THR 120 N 6.45 0.87 -0.49 5.53 2.02 -1.98 -2.20 112.91 123.12 2ey6 h THR 120 Ca -0.12 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 66.94 2ey6 h THR 120 Cb 1.47 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 2ey6 h THR 120 CO -0.00 0.06 0.00 1.41 0.37 0.00 0.00 175.52 177.36 2ey6 n HIS 121 N -5.00 1.68 -0.11 3.16 8.25 -1.26 -4.63 115.22 117.30 2ey6 n HIS 121 Ca 0.04 -0.59 -0.06 0.00 -0.26 0.00 0.00 57.72 56.84 2ey6 n HIS 121 Cb 0.16 -0.42 0.02 0.00 1.12 0.00 0.00 29.99 30.88 2ey6 n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2ey6 h GLU 122 N 3.34 0.33 -0.48 -0.41 4.81 -1.77 -2.09 114.58 118.31 2ey6 h GLU 122 Ca 0.00 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.08 2ey6 h GLU 122 Cb 1.68 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.97 2ey6 h GLU 122 CO 0.39 0.22 -0.20 0.37 -0.73 0.00 0.00 179.01 179.06 2ey6 h GLN 123 N 0.34 0.99 -0.32 1.92 5.75 -1.82 -1.57 115.11 120.41 2ey6 h GLN 123 Ca 0.17 -0.42 0.06 0.00 -0.15 0.00 0.00 58.65 58.31 2ey6 h GLN 123 Cb 0.11 -0.04 -0.05 0.00 1.07 0.00 0.00 27.48 28.57 2ey6 h GLN 123 CO -0.14 1.09 -0.01 1.25 -2.65 0.00 0.00 178.83 178.37 2ey6 h HIS 124 N 0.84 -0.03 -0.58 3.99 2.76 -1.86 0.42 115.15 120.68 2ey6 h HIS 124 Ca 0.11 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.22 2ey6 h HIS 124 Cb 0.77 0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.77 2ey6 h HIS 124 CO 0.05 -0.06 0.03 -0.07 -1.30 0.00 0.00 177.93 176.58 2ey6 h LEU 125 N 0.08 0.95 -1.26 0.26 3.38 -1.23 -2.35 115.31 115.14 2ey6 h LEU 125 Ca 0.15 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 2ey6 h LEU 125 Cb 0.21 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2ey6 h LEU 125 CO -0.26 0.99 -0.21 0.03 0.09 0.00 0.00 178.44 179.07 2ey6 h ARG 126 N 0.91 0.24 -0.30 1.13 3.08 -0.96 0.36 114.38 118.84 2ey6 h ARG 126 Ca 0.17 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 2ey6 h ARG 126 Cb 0.49 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2ey6 h ARG 126 CO 0.02 0.45 0.11 0.87 -1.07 0.00 0.00 179.97 180.35 2ey6 h LYS 127 N 0.22 0.44 -0.24 0.04 6.56 -0.77 -1.23 116.57 121.59 2ey6 h LYS 127 Ca 0.04 -0.08 -0.10 0.00 -1.06 0.00 0.00 60.65 59.44 2ey6 h LYS 127 Cb 0.51 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 32.08 2ey6 h LYS 127 CO 0.03 0.47 -0.30 0.77 -2.06 0.00 0.00 179.45 178.36 2ey6 h SER 128 N 0.33 0.49 0.04 0.86 0.02 -0.81 -2.84 113.55 111.64 2ey6 h SER 128 Ca 0.10 -0.18 -0.08 0.00 -0.84 0.00 0.00 61.79 60.78 2ey6 h SER 128 Cb 0.19 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 2ey6 h SER 128 CO -0.01 0.77 -0.25 -0.08 -1.14 0.00 0.00 176.83 176.13 2ey6 h GLU 129 N 0.42 0.35 -0.45 3.45 4.81 -0.13 -1.25 114.58 121.77 2ey6 h GLU 129 Ca 0.05 -0.12 -0.11 0.00 -0.13 0.00 0.00 59.36 59.05 2ey6 h GLU 129 Cb 0.73 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 2ey6 h GLU 129 CO 0.06 0.58 -0.17 0.00 -0.73 0.00 0.00 179.01 178.74 2ey6 h ALA 130 N 1.43 0.85 -0.34 2.92 0.00 -1.00 -1.80 119.26 121.32 2ey6 h ALA 130 Ca 0.05 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 2ey6 h ALA 130 Cb 0.61 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2ey6 h ALA 130 CO 0.04 0.64 0.01 0.37 0.00 0.00 0.00 179.25 180.31 2ey6 h GLN 131 N 0.77 0.60 0.00 0.00 5.75 -1.30 -1.21 115.11 119.71 2ey6 h GLN 131 Ca 0.11 -0.19 -0.02 0.00 -0.15 0.00 0.00 58.65 58.41 2ey6 h GLN 131 Cb 0.70 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 29.19 2ey6 h GLN 131 CO 0.05 0.71 -0.10 0.00 -2.65 0.00 0.00 178.83 176.85 2ey6 h ALA 132 N 0.86 1.80 0.10 3.38 0.00 -1.02 0.68 119.26 125.06 2ey6 h ALA 132 Ca 0.10 -0.09 -0.26 0.00 0.00 0.00 0.00 54.91 54.66 2ey6 h ALA 132 Cb 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2ey6 h ALA 132 CO 0.02 0.12 -1.16 -0.22 0.00 0.00 0.00 179.25 178.00 2ey6 h LYS 133 N 0.00 0.30 -0.84 0.00 3.64 -1.07 -1.21 116.57 117.39 2ey6 h LYS 133 Ca -0.00 -0.45 -0.00 0.00 -1.27 0.00 0.00 60.65 58.92 2ey6 h LYS 133 Cb 0.17 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.11 2ey6 h LYS 133 CO 0.01 1.19 0.51 -0.22 -2.27 0.00 0.00 179.45 178.67 2ey6 h LYS 134 N 0.11 1.14 -0.00 1.90 3.64 -0.73 -1.22 116.57 121.41 2ey6 h LYS 134 Ca -0.12 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2ey6 h LYS 134 Cb 1.87 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 33.45 2ey6 h LYS 134 CO 0.19 0.80 -0.06 0.39 -2.27 0.00 0.00 179.45 178.50 2ey6 n GLU 135 N -4.37 0.78 -3.78 1.90 1.02 0.19 -4.94 120.64 111.43 2ey6 n GLU 135 Ca 0.09 -0.21 -0.23 0.00 -0.02 0.00 0.00 57.16 56.79 2ey6 n GLU 135 Cb 0.06 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.01 2ey6 n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2ey6 n LYS 136 N -0.93 -4.63 -3.33 3.49 5.02 -0.46 -4.96 118.16 112.36 2ey6 n LYS 136 Ca 0.16 0.57 -0.38 0.00 -2.02 0.00 0.00 58.31 56.64 2ey6 n LYS 136 Cb 0.25 -5.08 -0.06 0.00 -0.02 0.00 0.00 35.03 30.12 2ey6 n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2ey6 s LEU 137 N -6.81 4.40 0.00 -0.35 1.43 -0.82 -3.54 118.68 113.01 2ey6 s LEU 137 Ca 0.08 1.01 0.00 0.00 -1.03 0.00 0.00 54.13 54.20 2ey6 s LEU 137 Cb -0.04 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 43.42 2ey6 s LEU 137 CO 0.83 0.15 0.00 0.59 0.23 0.00 0.00 176.35 178.15 2ey6 n ASN 138 N 2.64 0.00 0.05 2.29 3.02 -1.26 -0.99 115.26 121.00 2ey6 n ASN 138 Ca -0.09 0.00 0.19 0.00 -0.03 0.00 0.00 54.58 54.65 2ey6 n ASN 138 Cb 0.51 0.00 0.70 0.00 -0.61 0.00 0.00 39.78 40.39 2ey6 n ASN 138 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2ey6 h ILE 139 N 0.00 0.70 -0.21 2.41 1.08 -1.39 -1.44 117.51 118.67 2ey6 h ILE 139 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2ey6 h ILE 139 Cb 0.00 0.76 0.00 0.00 -3.07 0.00 0.00 36.82 34.51 2ey6 h ILE 139 CO 0.00 0.00 0.00 0.79 -0.69 0.00 0.00 178.15 178.25 2ey6 n TRP 140 N -4.28 0.27 1.59 1.37 7.02 -0.16 -5.14 117.44 118.10 2ey6 n TRP 140 Ca 0.08 -0.13 0.14 0.00 -1.02 0.00 0.00 57.50 56.57 2ey6 n TRP 140 Cb 0.54 0.00 0.60 0.00 -2.42 0.00 0.00 31.31 30.03 2ey6 n TRP 140 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54