#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dev s LYS 3 N 0.00 1.04 -0.09 1.61 1.02 -1.26 -5.06 119.74 117.01 2dev s LYS 3 Ca 0.00 0.99 -0.07 0.00 0.02 0.00 0.00 55.97 56.91 2dev s LYS 3 Cb 0.00 -1.77 0.03 0.00 -0.52 0.00 0.00 37.83 35.57 2dev s LYS 3 CO 0.00 -2.44 0.22 0.08 -0.92 0.00 0.00 175.35 172.29 2dev s VAL 4 N -2.82 -0.01 0.37 3.17 1.01 -1.26 -5.09 120.40 115.76 2dev s VAL 4 Ca 0.64 0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.76 2dev s VAL 4 Cb -0.20 -0.32 -0.05 0.00 0.00 0.00 0.00 36.38 35.81 2dev s VAL 4 CO 0.58 0.02 0.07 -0.31 0.00 0.00 0.00 175.10 175.46 2dev s TYR 5 N 0.49 2.57 0.05 5.22 2.02 -1.26 -1.18 117.35 125.27 2dev s TYR 5 Ca -0.03 -0.49 0.03 0.00 -0.37 0.00 0.00 57.07 56.20 2dev s TYR 5 Cb -0.05 -1.65 -0.03 0.00 -0.40 0.00 0.00 41.96 39.83 2dev s TYR 5 CO -0.02 0.39 -0.09 0.21 -1.57 0.00 0.00 175.55 174.46 2dev s LYS 6 N -3.78 0.58 -0.03 -0.62 2.20 -0.63 -4.87 119.74 112.59 2dev s LYS 6 Ca 0.37 -0.81 0.05 0.00 -0.36 0.00 0.00 55.97 55.22 2dev s LYS 6 Cb 0.02 -0.37 -0.01 0.00 -1.51 0.00 0.00 37.83 35.96 2dev s LYS 6 CO 0.20 0.07 -0.19 0.15 -0.36 0.00 0.00 175.35 175.22 2dev s LYS 7 N -1.69 1.78 0.09 4.03 1.02 -1.26 -1.26 119.74 122.45 2dev s LYS 7 Ca -0.08 -0.67 0.09 0.00 0.02 0.00 0.00 55.97 55.33 2dev s LYS 7 Cb -0.09 -1.60 -0.03 0.00 -0.52 0.00 0.00 37.83 35.58 2dev s LYS 7 CO 0.00 0.32 -0.23 0.14 -0.92 0.00 0.00 175.35 174.67 2dev s VAL 8 N -0.17 1.90 -0.25 3.17 -7.23 0.07 -4.92 120.40 112.96 2dev s VAL 8 Ca 0.01 -1.53 -0.08 0.00 -1.81 0.00 0.00 61.98 58.56 2dev s VAL 8 Cb -0.10 -1.69 -0.04 0.00 0.56 0.00 0.00 36.38 35.11 2dev s VAL 8 CO 0.01 0.07 0.10 -0.70 -0.31 0.00 0.00 175.10 174.27 2dev s GLU 9 N -1.76 3.75 0.39 4.82 2.12 -1.26 -0.66 118.70 126.11 2dev s GLU 9 Ca 0.09 -0.43 0.05 0.00 0.36 0.00 0.00 54.97 55.05 2dev s GLU 9 Cb -0.10 -3.41 -0.06 0.00 0.26 0.00 0.00 34.13 30.82 2dev s GLU 9 CO 0.04 -0.16 0.03 -0.51 -0.54 0.00 0.00 175.26 174.13 2dev s LEU 10 N 1.58 2.50 -0.29 2.70 1.43 -0.10 -4.99 118.68 121.51 2dev s LEU 10 Ca 0.06 -1.43 -0.02 0.00 -1.03 0.00 0.00 54.13 51.71 2dev s LEU 10 Cb -0.15 -0.65 0.10 0.00 0.03 0.00 0.00 46.19 45.52 2dev s LEU 10 CO 0.05 -0.59 0.11 -0.69 0.23 0.00 0.00 176.35 175.46 2dev s VAL 11 N -2.96 0.39 0.19 -1.59 1.01 -1.26 -1.35 120.40 114.83 2dev s VAL 11 Ca 0.31 -1.03 -0.27 0.00 0.00 0.00 0.00 61.98 60.98 2dev s VAL 11 Cb 0.08 -1.29 -0.08 0.00 0.00 0.00 0.00 36.38 35.08 2dev s VAL 11 CO 0.15 -0.67 0.85 -0.83 0.00 0.00 0.00 175.10 174.60 2dev s GLY 12 N 1.87 3.00 0.19 4.51 0.00 -0.79 -4.86 107.32 111.24 2dev s GLY 12 Ca 0.09 0.47 0.09 0.00 0.00 0.00 0.00 44.72 45.37 2dev s GLY 12 CO -0.30 1.02 -0.19 -0.51 0.00 0.00 0.00 173.10 173.12 2dev s THR 13 N -1.11 1.99 -0.09 0.90 -4.23 -1.25 -1.39 115.64 110.45 2dev s THR 13 Ca 0.38 -2.03 -0.30 0.00 -1.18 0.00 0.00 61.69 58.56 2dev s THR 13 Cb -0.24 -1.98 0.11 0.00 1.34 0.00 0.00 72.50 71.74 2dev s THR 13 CO 0.29 -0.32 0.95 -0.55 -0.54 0.00 0.00 174.62 174.44 2dev s SER 14 N -2.85 -0.37 0.00 3.99 0.15 -0.79 -4.52 113.70 109.31 2dev s SER 14 Ca 0.19 0.23 0.20 0.00 0.70 0.00 0.00 55.95 57.27 2dev s SER 14 Cb -0.05 0.34 -0.05 0.00 -1.71 0.00 0.00 66.02 64.54 2dev s SER 14 CO 0.08 -0.47 0.97 -0.62 1.20 0.00 0.00 173.24 174.41 2dev n GLU 15 N 0.29 1.21 -0.01 5.44 1.02 -1.26 0.43 120.64 127.76 2dev n GLU 15 Ca -0.09 -0.74 -0.01 0.00 -0.02 0.00 0.00 57.16 56.29 2dev n GLU 15 Cb 0.59 -1.41 -0.01 0.00 -0.02 0.00 0.00 31.44 30.60 2dev n GLU 15 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2dev h GLU 16 N 1.77 -0.08 0.00 3.49 5.08 -1.95 -3.46 114.58 119.42 2dev h GLU 16 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2dev h GLU 16 Cb 0.64 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.91 2dev h GLU 16 CO 0.00 -0.05 0.00 0.41 -1.00 0.00 0.00 179.01 178.37 2dev n GLY 17 N 1.58 -1.16 0.16 -3.84 0.00 -1.26 -5.01 105.19 95.65 2dev n GLY 17 Ca -0.01 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 44.95 2dev n GLY 17 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dev h LEU 18 N 0.00 -0.27 -0.70 0.99 3.38 -1.95 -1.44 115.31 115.32 2dev h LEU 18 Ca 0.00 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.00 2dev h LEU 18 Cb 0.00 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 2dev h LEU 18 CO 0.00 -0.17 0.42 -0.33 0.09 0.00 0.00 178.44 178.45 2dev h GLU 19 N -0.34 0.79 -0.18 1.13 3.07 -1.99 -2.01 114.58 115.05 2dev h GLU 19 Ca -0.03 -0.05 0.03 0.00 -0.50 0.00 0.00 59.36 58.81 2dev h GLU 19 Cb 0.26 -0.18 -0.03 0.00 -0.84 0.00 0.00 28.75 27.96 2dev h GLU 19 CO 0.05 0.52 0.00 0.00 -1.40 0.00 0.00 179.01 178.19 2dev h ALA 20 N 1.32 0.16 -0.68 3.43 0.00 -1.90 0.02 119.26 121.61 2dev h ALA 20 Ca 0.29 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.31 2dev h ALA 20 Cb 0.08 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2dev h ALA 20 CO -0.14 -0.43 0.45 0.00 0.00 0.00 0.00 179.25 179.13 2dev h ALA 21 N 1.15 1.71 -0.14 0.00 0.00 -0.91 0.24 119.26 121.31 2dev h ALA 21 Ca 0.08 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2dev h ALA 21 Cb 0.10 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2dev h ALA 21 CO -0.14 0.19 -0.15 0.82 0.00 0.00 0.00 179.25 179.98 2dev h ILE 22 N 0.73 1.35 -0.86 0.00 2.04 -0.59 -2.67 117.51 117.50 2dev h ILE 22 Ca 0.29 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 2dev h ILE 22 Cb 0.22 1.90 -0.04 0.00 -0.74 0.00 0.00 36.82 38.16 2dev h ILE 22 CO -0.09 0.39 0.49 1.56 0.00 0.00 0.00 178.15 180.50 2dev h GLN 23 N -0.03 1.19 -0.64 2.37 1.08 -0.46 -1.34 115.11 117.28 2dev h GLN 23 Ca 0.02 -0.12 0.08 0.00 -1.45 0.00 0.00 58.65 57.18 2dev h GLN 23 Cb 0.68 -0.24 -0.06 0.00 -0.05 0.00 0.00 27.48 27.81 2dev h GLN 23 CO 0.04 0.85 0.31 0.00 -0.95 0.00 0.00 178.83 179.08 2dev h ALA 24 N 1.27 0.86 -0.24 3.87 0.00 -0.91 0.71 119.26 124.82 2dev h ALA 24 Ca 0.31 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 2dev h ALA 24 Cb -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2dev h ALA 24 CO -0.05 -0.08 0.07 0.00 0.00 0.00 0.00 179.25 179.19 2dev h ALA 25 N 1.39 0.31 -0.37 0.00 0.00 -1.08 -2.38 119.26 117.12 2dev h ALA 25 Ca 0.31 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2dev h ALA 25 Cb 0.30 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2dev h ALA 25 CO -0.25 -0.05 0.20 -0.07 0.00 0.00 0.00 179.25 179.09 2dev h LEU 26 N 0.21 0.46 -0.03 0.00 3.38 -0.50 -1.04 115.31 117.80 2dev h LEU 26 Ca 0.08 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2dev h LEU 26 Cb 0.25 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 2dev h LEU 26 CO -0.00 0.42 -0.49 0.00 0.09 0.00 0.00 178.44 178.45 2dev h ALA 27 N 1.07 -0.83 0.00 1.53 0.00 0.54 0.19 119.26 121.76 2dev h ALA 27 Ca 0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2dev h ALA 27 Cb 0.06 0.88 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2dev h ALA 27 CO -0.02 -1.05 -0.03 -0.09 0.00 0.00 0.00 179.25 178.06 2dev h ARG 28 N -0.62 0.00 -0.01 0.00 9.65 -1.25 -1.47 114.38 120.67 2dev h ARG 28 Ca 0.03 0.00 -0.20 0.00 -1.10 0.00 0.00 59.98 58.71 2dev h ARG 28 Cb 0.70 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.27 2dev h ARG 28 CO -0.36 0.03 -0.85 0.00 2.80 0.00 0.00 179.97 181.59 2dev h ALA 29 N 1.97 0.51 0.00 2.80 0.00 0.33 -3.12 119.26 121.75 2dev h ALA 29 Ca -0.00 -0.69 -0.01 0.00 0.00 0.00 0.00 54.91 54.21 2dev h ALA 29 Cb 0.10 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2dev h ALA 29 CO 0.00 0.85 -0.07 -0.09 0.00 0.00 0.00 179.25 179.95 2dev h ARG 30 N 0.17 0.00 0.00 0.00 2.43 0.03 -0.30 114.38 116.71 2dev h ARG 30 Ca -0.05 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.04 2dev h ARG 30 Cb 1.47 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.00 2dev h ARG 30 CO 0.14 0.07 -0.38 0.87 -1.51 0.00 0.00 179.97 179.16 2dev h LYS 31 N 0.00 0.00 0.00 0.20 1.57 -1.54 -3.34 116.57 113.46 2dev h LYS 31 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2dev h LYS 31 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2dev h LYS 31 CO 0.01 0.38 0.00 0.25 -0.57 0.00 0.00 179.45 179.52 2dev n THR 32 N -4.06 0.00 -5.08 -0.16 -2.24 -1.04 -5.05 114.28 96.64 2dev n THR 32 Ca -0.02 -0.38 -0.31 0.00 -2.27 0.00 0.00 64.05 61.08 2dev n THR 32 Cb 0.42 1.08 -0.15 0.00 -2.10 0.00 0.00 70.33 69.57 2dev n THR 32 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dev s LEU 33 N -1.02 2.18 0.06 3.22 1.43 -0.15 -5.13 118.68 119.27 2dev s LEU 33 Ca 0.00 -0.49 0.05 0.00 -1.03 0.00 0.00 54.13 52.65 2dev s LEU 33 Cb 0.00 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.83 2dev s LEU 33 CO 0.00 0.29 -0.05 -0.13 0.23 0.00 0.00 176.35 176.70 2dev s ARG 34 N -0.91 2.46 -0.82 1.70 0.52 -1.26 -4.54 118.95 116.09 2dev s ARG 34 Ca 0.11 -0.83 -0.05 0.00 -0.52 0.00 0.00 55.73 54.45 2dev s ARG 34 Cb -0.10 -2.48 0.01 0.00 0.52 0.00 0.00 34.95 32.90 2dev s ARG 34 CO 0.01 0.56 0.71 0.72 0.02 0.00 0.00 175.30 177.32 2dev n HIS 35 N 1.01 -1.72 -1.72 -0.53 8.25 -1.26 -4.35 115.22 114.90 2dev n HIS 35 Ca -0.13 0.62 -0.42 0.00 -0.26 0.00 0.00 57.72 57.53 2dev n HIS 35 Cb 0.52 -3.54 -0.03 0.00 1.12 0.00 0.00 29.99 28.06 2dev n HIS 35 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2dev n LEU 36 N -3.22 4.05 -0.01 2.41 4.77 -1.26 -1.92 117.00 121.81 2dev n LEU 36 Ca -0.02 1.07 -0.03 0.00 -0.03 0.00 0.00 56.01 57.00 2dev n LEU 36 Cb 0.55 -1.58 -0.01 0.00 -2.33 0.00 0.00 43.42 40.05 2dev n LEU 36 CO 0.40 0.19 -0.20 -0.67 -1.33 0.00 0.00 177.39 175.77 2dev n ASP 37 N 3.80 0.96 -4.15 -1.43 -0.08 -0.46 -4.93 116.55 110.26 2dev n ASP 37 Ca 0.15 0.15 -0.11 0.00 -1.51 0.00 0.00 54.79 53.47 2dev n ASP 37 Cb 0.35 -0.42 -0.09 0.00 2.34 0.00 0.00 41.12 43.30 2dev n ASP 37 CO 0.00 0.00 0.00 -1.66 0.12 0.00 0.00 177.20 175.66 2dev s TRP 38 N -1.91 0.97 0.07 -0.67 -2.14 -1.13 -5.01 118.94 109.12 2dev s TRP 38 Ca -0.09 -1.22 0.00 0.00 2.66 0.00 0.00 56.10 57.45 2dev s TRP 38 Cb 0.01 -0.39 -0.04 0.00 -3.10 0.00 0.00 33.47 29.96 2dev s TRP 38 CO 0.13 -0.72 -0.05 -0.59 -2.66 0.00 0.00 176.95 173.06 2dev s PHE 39 N -4.12 0.67 -0.04 1.66 -0.12 -1.26 -0.27 117.98 114.50 2dev s PHE 39 Ca 0.35 -0.98 0.01 0.00 -0.05 0.00 0.00 56.93 56.25 2dev s PHE 39 Cb 0.05 -0.44 0.02 0.00 -0.63 0.00 0.00 43.02 42.03 2dev s PHE 39 CO 0.11 -0.27 -0.02 -1.21 -0.05 0.00 0.00 175.22 173.78 2dev s GLU 40 N -3.77 0.60 -0.12 1.99 2.02 0.20 -4.95 118.70 114.67 2dev s GLU 40 Ca 0.08 -0.01 -0.28 0.00 0.02 0.00 0.00 54.97 54.78 2dev s GLU 40 Cb 0.06 -0.72 -0.01 0.00 0.10 0.00 0.00 34.13 33.56 2dev s GLU 40 CO -0.07 -0.12 0.95 0.08 0.02 0.00 0.00 175.26 176.11 2dev s VAL 41 N 1.07 4.82 -0.26 2.63 1.01 -1.26 -0.67 120.40 127.74 2dev s VAL 41 Ca -0.09 1.91 -0.07 0.00 0.00 0.00 0.00 61.98 63.72 2dev s VAL 41 Cb -0.14 -4.25 -0.15 0.00 0.00 0.00 0.00 36.38 31.84 2dev s VAL 41 CO -0.01 0.02 -0.24 0.29 0.00 0.00 0.00 175.10 175.16 2dev n LYS 42 N 5.02 0.62 -3.91 2.72 4.01 0.73 -4.97 118.16 122.38 2dev n LYS 42 Ca 0.07 0.23 -0.09 0.00 -0.51 0.00 0.00 58.31 58.02 2dev n LYS 42 Cb 0.49 -1.53 -0.08 0.00 -0.51 0.00 0.00 35.03 33.40 2dev n LYS 42 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 2dev s GLU 43 N -2.51 0.75 -0.07 1.97 2.02 -0.90 -4.99 118.70 114.98 2dev s GLU 43 Ca -0.36 -0.96 -0.01 0.00 0.02 0.00 0.00 54.97 53.66 2dev s GLU 43 Cb 0.12 0.30 0.03 0.00 0.10 0.00 0.00 34.13 34.67 2dev s GLU 43 CO 0.56 -0.21 -0.01 0.42 0.02 0.00 0.00 175.26 176.03 2dev s ILE 44 N -3.62 0.42 0.02 -1.63 1.01 -1.26 -0.97 121.20 115.16 2dev s ILE 44 Ca 0.03 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.75 2dev s ILE 44 Cb 0.04 -0.55 -0.00 0.00 0.01 0.00 0.00 42.46 41.96 2dev s ILE 44 CO -0.09 0.26 0.02 -2.11 0.00 0.00 0.00 174.94 173.02 2dev n ARG 45 N 4.94 0.04 0.00 2.79 1.85 0.97 -5.00 116.66 122.25 2dev n ARG 45 Ca -0.11 -0.19 0.00 0.00 -1.00 0.00 0.00 57.85 56.56 2dev n ARG 45 Cb 0.50 0.17 0.00 0.00 -1.05 0.00 0.00 32.46 32.08 2dev n ARG 45 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2dev n GLY 46 N -0.04 0.22 3.82 2.89 0.00 -1.26 -0.04 105.19 110.77 2dev n GLY 46 Ca 0.00 -0.94 -0.27 0.00 0.00 0.00 0.00 46.02 44.82 2dev n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dev s THR 47 N -2.00 4.61 -0.16 2.61 -4.23 -0.54 -4.97 115.64 110.97 2dev s THR 47 Ca 0.00 -0.98 -0.03 0.00 -1.18 0.00 0.00 61.69 59.50 2dev s THR 47 Cb 0.00 -3.34 -0.02 0.00 1.34 0.00 0.00 72.50 70.48 2dev s THR 47 CO 0.00 -0.07 -0.07 -0.63 -0.54 0.00 0.00 174.62 173.31 2dev s ILE 48 N -1.70 3.54 0.27 2.99 1.01 -1.26 -0.65 121.20 125.40 2dev s ILE 48 Ca 0.31 -0.48 0.01 0.00 0.00 0.00 0.00 60.65 60.50 2dev s ILE 48 Cb -0.10 -2.54 0.01 0.00 0.01 0.00 0.00 42.46 39.84 2dev s ILE 48 CO 0.24 0.49 0.11 0.61 0.00 0.00 0.00 174.94 176.39 2dev n GLY 49 N 3.71 3.35 0.35 6.18 0.00 0.31 -4.78 105.19 114.32 2dev n GLY 49 Ca -0.18 -2.26 0.04 0.00 0.00 0.00 0.00 46.02 43.62 2dev n GLY 49 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2dev h GLU 50 N 0.00 0.85 -0.40 1.61 4.81 -1.99 -1.88 114.58 117.58 2dev h GLU 50 Ca -0.20 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 2dev h GLU 50 Cb 0.66 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2dev h GLU 50 CO 0.32 0.56 0.00 0.00 -0.73 0.00 0.00 179.01 179.16 2dev n ALA 51 N -2.43 2.44 0.00 2.92 0.00 -1.26 -5.04 120.51 117.15 2dev n ALA 51 Ca 0.10 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.80 2dev n ALA 51 Cb 0.16 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2dev n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dev n GLY 52 N 1.21 0.57 3.67 0.00 0.00 -0.71 -4.98 105.19 104.95 2dev n GLY 52 Ca 0.15 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 2dev n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dev s VAL 53 N 0.00 3.33 -0.15 1.61 1.01 -1.26 0.12 120.40 125.05 2dev s VAL 53 Ca 0.00 0.50 -0.14 0.00 0.00 0.00 0.00 61.98 62.33 2dev s VAL 53 Cb 0.00 -3.32 -0.11 0.00 0.00 0.00 0.00 36.38 32.95 2dev s VAL 53 CO 0.00 -0.03 0.17 0.50 0.00 0.00 0.00 175.10 175.74 2dev h LYS 54 N 9.51 0.00 -3.70 2.72 3.64 -1.19 -3.44 116.57 124.11 2dev h LYS 54 Ca -0.42 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 58.65 2dev h LYS 54 Cb 1.20 0.00 -0.32 0.00 -0.41 0.00 0.00 32.23 32.69 2dev h LYS 54 CO 0.95 0.48 -0.74 -2.00 -2.27 0.00 0.00 179.45 175.87 2dev s GLU 55 N -2.10 0.13 -0.04 1.90 2.12 -1.22 -4.46 118.70 115.03 2dev s GLU 55 Ca -0.16 0.08 -0.18 0.00 0.36 0.00 0.00 54.97 55.07 2dev s GLU 55 Cb 0.01 -0.30 -0.05 0.00 0.26 0.00 0.00 34.13 34.06 2dev s GLU 55 CO 0.36 -0.10 0.50 0.71 -0.54 0.00 0.00 175.26 176.19 2dev s TYR 56 N 0.74 3.64 -0.15 5.30 2.02 0.17 -1.46 117.35 127.61 2dev s TYR 56 Ca -0.07 1.03 0.00 0.00 -0.37 0.00 0.00 57.07 57.67 2dev s TYR 56 Cb -0.10 -2.49 0.02 0.00 -0.40 0.00 0.00 41.96 38.99 2dev s TYR 56 CO -0.02 0.38 -0.13 -0.65 -1.57 0.00 0.00 175.55 173.56 2dev s GLN 57 N -0.20 2.23 -0.27 -0.62 -0.21 0.94 -1.88 119.66 119.63 2dev s GLN 57 Ca 0.27 -0.54 -0.03 0.00 0.02 0.00 0.00 55.36 55.08 2dev s GLN 57 Cb -0.17 -2.08 0.03 0.00 1.00 0.00 0.00 33.01 31.80 2dev s GLN 57 CO 0.14 -0.25 -0.01 0.08 -2.12 0.00 0.00 175.29 173.13 2dev s VAL 58 N 1.50 3.12 -0.13 1.09 1.01 -0.49 -0.02 120.40 126.49 2dev s VAL 58 Ca 0.05 -1.08 -0.26 0.00 0.00 0.00 0.00 61.98 60.69 2dev s VAL 58 Cb -0.13 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 2dev s VAL 58 CO -0.10 0.08 0.84 -0.69 0.00 0.00 0.00 175.10 175.22 2dev s VAL 59 N 1.34 4.90 0.05 2.92 1.01 -0.15 -1.89 120.40 128.58 2dev s VAL 59 Ca -0.01 1.68 -0.05 0.00 0.00 0.00 0.00 61.98 63.60 2dev s VAL 59 Cb -0.18 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.03 2dev s VAL 59 CO -0.02 0.07 0.09 -1.48 0.00 0.00 0.00 175.10 173.76 2dev s LEU 60 N 1.80 1.88 -0.12 3.92 2.34 -0.46 -0.19 118.68 127.85 2dev s LEU 60 Ca 0.40 -0.68 -0.04 0.00 0.06 0.00 0.00 54.13 53.88 2dev s LEU 60 Cb -0.17 0.61 -0.03 0.00 -0.56 0.00 0.00 46.19 46.03 2dev s LEU 60 CO 0.15 -0.58 0.02 -1.61 -1.06 0.00 0.00 176.35 173.27 2dev s GLU 61 N -3.23 3.35 -0.17 1.48 2.02 0.15 -0.93 118.70 121.38 2dev s GLU 61 Ca 0.00 -0.39 -0.02 0.00 0.02 0.00 0.00 54.97 54.58 2dev s GLU 61 Cb 0.03 -2.93 -0.01 0.00 0.10 0.00 0.00 34.13 31.31 2dev s GLU 61 CO -0.07 0.54 -0.08 0.08 0.02 0.00 0.00 175.26 175.74 2dev s VAL 62 N -0.41 3.33 -0.01 2.63 1.01 0.17 -0.63 120.40 126.49 2dev s VAL 62 Ca 0.08 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2dev s VAL 62 Cb -0.12 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 2dev s VAL 62 CO 0.02 0.48 0.03 -0.83 0.00 0.00 0.00 175.10 174.80 2dev s GLY 63 N 0.73 1.92 0.00 4.51 0.00 0.63 -0.75 107.32 114.37 2dev s GLY 63 Ca -0.04 -0.91 -0.12 0.00 0.00 0.00 0.00 44.72 43.66 2dev s GLY 63 CO 0.02 -0.77 0.24 -0.11 0.00 0.00 0.00 173.10 172.49 2dev s PHE 64 N -1.10 -0.08 0.27 1.90 -0.12 -0.39 -1.35 117.98 117.10 2dev s PHE 64 Ca 0.20 0.05 -0.30 0.00 -0.05 0.00 0.00 56.93 56.84 2dev s PHE 64 Cb -0.12 0.04 -0.09 0.00 -0.63 0.00 0.00 43.02 42.22 2dev s PHE 64 CO 0.11 -0.38 1.06 0.50 -0.05 0.00 0.00 175.22 176.46 2dev s ARG 65 N -1.62 4.70 0.08 1.99 3.52 -0.81 -1.60 118.95 125.21 2dev s ARG 65 Ca -0.12 1.72 -0.04 0.00 -0.13 0.00 0.00 55.73 57.16 2dev s ARG 65 Cb -0.05 -3.22 -0.05 0.00 -1.56 0.00 0.00 34.95 30.08 2dev s ARG 65 CO 0.02 0.29 0.29 -0.51 -0.81 0.00 0.00 175.30 174.59 2dev s LEU 66 N -1.35 4.33 0.03 -0.88 1.43 -0.32 -4.72 118.68 117.19 2dev s LEU 66 Ca 0.44 0.49 -0.27 0.00 -1.03 0.00 0.00 54.13 53.75 2dev s LEU 66 Cb -0.30 -3.01 -0.05 0.00 0.03 0.00 0.00 46.19 42.86 2dev s LEU 66 CO 0.38 0.15 0.87 -1.83 0.23 0.00 0.00 176.35 176.15 2dev s GLU 67 N -2.33 4.56 0.00 1.70 4.04 -1.26 -4.64 118.70 120.77 2dev s GLU 67 Ca 0.35 1.24 0.00 0.00 0.04 0.00 0.00 54.97 56.60 2dev s GLU 67 Cb -0.13 -3.41 0.00 0.00 0.02 0.00 0.00 34.13 30.61 2dev s GLU 67 CO 0.23 0.13 0.44 0.39 -1.84 0.00 0.00 175.26 174.61