#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 2.92 -0.01 1.61 -2.85 -1.26 -5.06 119.74 115.10 2dev s LYS 3 Ca 0.00 1.23 0.01 0.00 -1.00 0.00 0.00 55.97 56.21 2dev s LYS 3 Cb 0.00 -1.98 -0.00 0.00 -2.06 0.00 0.00 37.83 33.79 2dev s LYS 3 CO 0.00 -1.13 -0.04 0.08 0.10 0.00 0.00 175.35 174.35 2dev s VAL 4 N -2.57 0.37 0.31 1.79 1.01 -1.26 -5.09 120.40 114.96 2dev s VAL 4 Ca 0.64 -0.19 0.11 0.00 0.00 0.00 0.00 61.98 62.54 2dev s VAL 4 Cb -0.17 -0.32 -0.06 0.00 0.00 0.00 0.00 36.38 35.83 2dev s VAL 4 CO 0.44 0.11 -0.14 -0.31 0.00 0.00 0.00 175.10 175.19 2dev s TYR 5 N -0.04 2.36 0.08 5.22 2.02 -1.26 -1.11 117.35 124.62 2dev s TYR 5 Ca 0.01 -0.40 0.07 0.00 -0.37 0.00 0.00 57.07 56.39 2dev s TYR 5 Cb -0.03 -1.17 -0.03 0.00 -0.40 0.00 0.00 41.96 40.34 2dev s TYR 5 CO -0.00 0.66 -0.19 0.21 -1.57 0.00 0.00 175.55 174.65 2dev s LYS 6 N -3.56 1.10 -0.08 -0.62 2.20 -0.38 -4.88 119.74 113.52 2dev s LYS 6 Ca 0.31 -1.05 0.04 0.00 -0.36 0.00 0.00 55.97 54.91 2dev s LYS 6 Cb -0.02 -1.27 -0.00 0.00 -1.51 0.00 0.00 37.83 35.02 2dev s LYS 6 CO 0.16 0.30 -0.21 0.15 -0.36 0.00 0.00 175.35 175.39 2dev s LYS 7 N -1.68 2.57 0.15 4.03 1.02 -1.26 -1.30 119.74 123.26 2dev s LYS 7 Ca 0.05 -0.78 0.10 0.00 0.02 0.00 0.00 55.97 55.37 2dev s LYS 7 Cb -0.10 -2.03 -0.04 0.00 -0.52 0.00 0.00 37.83 35.14 2dev s LYS 7 CO 0.03 0.21 -0.22 0.14 -0.92 0.00 0.00 175.35 174.58 2dev s VAL 8 N 0.25 2.52 -0.21 3.17 -7.23 -0.61 -4.92 120.40 113.37 2dev s VAL 8 Ca -0.13 -1.75 -0.07 0.00 -1.81 0.00 0.00 61.98 58.21 2dev s VAL 8 Cb -0.16 -2.16 -0.04 0.00 0.56 0.00 0.00 36.38 34.58 2dev s VAL 8 CO 0.06 0.02 0.06 -0.70 -0.31 0.00 0.00 175.10 174.24 2dev s GLU 9 N -2.30 3.83 0.32 4.82 2.12 -1.26 -0.67 118.70 125.56 2dev s GLU 9 Ca 0.18 -0.41 0.06 0.00 0.36 0.00 0.00 54.97 55.16 2dev s GLU 9 Cb -0.10 -3.25 -0.06 0.00 0.26 0.00 0.00 34.13 30.98 2dev s GLU 9 CO 0.09 0.08 -0.02 -0.51 -0.54 0.00 0.00 175.26 174.36 2dev s LEU 10 N 0.88 2.50 -0.28 2.70 1.43 0.40 -4.97 118.68 121.34 2dev s LEU 10 Ca 0.04 -1.27 -0.02 0.00 -1.03 0.00 0.00 54.13 51.85 2dev s LEU 10 Cb -0.14 -0.65 0.09 0.00 0.03 0.00 0.00 46.19 45.52 2dev s LEU 10 CO 0.03 -0.42 0.08 -0.69 0.23 0.00 0.00 176.35 175.58 2dev s VAL 11 N -3.00 0.69 0.03 -1.59 1.01 -1.26 -0.73 120.40 115.55 2dev s VAL 11 Ca 0.33 -1.11 -0.21 0.00 0.00 0.00 0.00 61.98 60.98 2dev s VAL 11 Cb 0.06 -1.43 -0.06 0.00 0.00 0.00 0.00 36.38 34.95 2dev s VAL 11 CO 0.14 -0.56 0.61 -0.83 0.00 0.00 0.00 175.10 174.47 2dev s GLY 12 N 1.73 2.66 0.22 4.51 0.00 0.18 -4.85 107.32 111.77 2dev s GLY 12 Ca 0.07 0.07 0.11 0.00 0.00 0.00 0.00 44.72 44.97 2dev s GLY 12 CO -0.22 0.72 -0.21 -0.51 0.00 0.00 0.00 173.10 172.88 2dev s THR 13 N -0.46 2.29 -0.21 0.90 -4.23 -1.25 -0.62 115.64 112.07 2dev s THR 13 Ca 0.31 -2.18 -0.29 0.00 -1.18 0.00 0.00 61.69 58.36 2dev s THR 13 Cb -0.19 -2.15 0.14 0.00 1.34 0.00 0.00 72.50 71.64 2dev s THR 13 CO 0.19 -0.28 1.08 -0.55 -0.54 0.00 0.00 174.62 174.52 2dev s SER 14 N -3.04 -0.31 0.00 3.99 0.15 -0.53 -4.49 113.70 109.47 2dev s SER 14 Ca 0.24 0.40 0.25 0.00 0.70 0.00 0.00 55.95 57.54 2dev s SER 14 Cb -0.06 0.34 0.49 0.00 -1.71 0.00 0.00 66.02 65.07 2dev s SER 14 CO 0.11 -0.25 1.40 -0.62 1.20 0.00 0.00 173.24 175.08 2dev n GLU 15 N 0.97 0.80 -0.04 5.44 1.02 -1.26 0.41 120.64 127.99 2dev n GLU 15 Ca -0.09 -0.55 -0.20 0.00 -0.02 0.00 0.00 57.16 56.30 2dev n GLU 15 Cb 0.58 -1.49 -0.13 0.00 -0.02 0.00 0.00 31.44 30.37 2dev n GLU 15 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2dev n GLU 16 N -0.62 0.72 -3.25 3.49 -0.58 -1.26 -4.88 120.64 114.27 2dev n GLU 16 Ca 0.10 0.22 0.00 0.00 -0.42 0.00 0.00 57.16 57.07 2dev n GLU 16 Cb 0.38 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 29.60 2dev n GLU 16 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2dev n GLY 17 N 2.08 -1.38 0.19 0.62 0.00 -1.26 -4.99 105.19 100.45 2dev n GLY 17 Ca -0.36 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.33 -0.64 0.99 3.38 -1.96 -2.20 115.31 114.55 2dev h LEU 18 Ca 0.00 -0.20 0.09 0.00 0.09 0.00 0.00 57.88 57.87 2dev h LEU 18 Cb 0.00 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 2dev h LEU 18 CO 0.00 0.07 0.27 -0.33 0.09 0.00 0.00 178.44 178.53 2dev h GLU 19 N -0.80 0.45 -0.08 1.13 3.07 -1.99 -1.41 114.58 114.96 2dev h GLU 19 Ca -0.04 -0.03 0.03 0.00 -0.50 0.00 0.00 59.36 58.83 2dev h GLU 19 Cb 0.51 -0.10 -0.04 0.00 -0.84 0.00 0.00 28.75 28.28 2dev h GLU 19 CO 0.07 0.30 -0.15 0.00 -1.40 0.00 0.00 179.01 177.82 2dev h ALA 20 N 1.42 -0.12 -0.58 3.43 0.00 -1.93 0.09 119.26 121.57 2dev h ALA 20 Ca 0.32 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.31 2dev h ALA 20 Cb 0.38 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 2dev h ALA 20 CO -0.30 -0.62 0.39 0.00 0.00 0.00 0.00 179.25 178.72 2dev h ALA 21 N 0.79 1.74 -0.29 0.00 0.00 -0.66 0.11 119.26 120.96 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 0.32 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2dev h ALA 21 CO -0.20 0.18 -0.04 0.82 0.00 0.00 0.00 179.25 180.01 2dev h ILE 22 N 0.64 1.27 -0.69 0.00 2.04 -0.28 -2.75 117.51 117.74 2dev h ILE 22 Ca 0.24 -1.03 -0.04 0.00 1.00 0.00 0.00 64.86 65.03 2dev h ILE 22 Cb 0.15 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 2dev h ILE 22 CO -0.07 0.33 0.28 1.56 0.00 0.00 0.00 178.15 180.25 2dev h GLN 23 N 0.30 1.02 -0.92 2.37 1.08 0.20 -1.47 115.11 117.69 2dev h GLN 23 Ca 0.08 -0.17 -0.01 0.00 -1.45 0.00 0.00 58.65 57.10 2dev h GLN 23 Cb 0.50 -0.17 -0.04 0.00 -0.05 0.00 0.00 27.48 27.71 2dev h GLN 23 CO 0.02 0.83 0.55 0.00 -0.95 0.00 0.00 178.83 179.28 2dev h ALA 24 N 1.31 1.17 -0.39 3.87 0.00 -0.70 0.44 119.26 124.96 2dev h ALA 24 Ca 0.23 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 2dev h ALA 24 Cb 0.19 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2dev h ALA 24 CO -0.02 0.64 -0.38 0.00 0.00 0.00 0.00 179.25 179.49 2dev h ALA 25 N 1.30 0.60 -0.37 0.00 0.00 -1.14 -2.38 119.26 117.26 2dev h ALA 25 Ca 0.33 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 2dev h ALA 25 Cb -0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2dev h ALA 25 CO -0.06 0.68 -0.21 -0.07 0.00 0.00 0.00 179.25 179.58 2dev h LEU 26 N 0.76 0.82 0.01 0.00 3.38 -0.84 -1.72 115.31 117.72 2dev h LEU 26 Ca 0.06 -0.42 0.03 0.00 0.09 0.00 0.00 57.88 57.65 2dev h LEU 26 Cb 0.97 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 2dev h LEU 26 CO 0.09 1.06 -0.29 0.00 0.09 0.00 0.00 178.44 179.39 2dev h ALA 27 N 0.79 -0.42 0.00 1.53 0.00 -0.09 -1.54 119.26 119.52 2dev h ALA 27 Ca 0.08 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2dev h ALA 27 Cb 0.77 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2dev h ALA 27 CO 0.06 -0.80 -0.19 -0.09 0.00 0.00 0.00 179.25 178.22 2dev h ARG 28 N -0.45 0.00 -0.17 0.00 9.65 -1.41 -2.78 114.38 119.23 2dev h ARG 28 Ca 0.06 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.78 2dev h ARG 28 Cb 0.53 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.10 2dev h ARG 28 CO -0.24 0.19 -0.56 0.00 2.80 0.00 0.00 179.97 182.16 2dev h ALA 29 N 1.81 0.71 -0.10 2.80 0.00 -0.66 -3.05 119.26 120.77 2dev h ALA 29 Ca -0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 2dev h ALA 29 Cb 0.46 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2dev h ALA 29 CO 0.02 0.69 -0.02 -0.09 0.00 0.00 0.00 179.25 179.86 2dev h ARG 30 N 0.39 0.13 0.00 0.00 2.43 -1.01 0.97 114.38 117.30 2dev h ARG 30 Ca 0.00 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 2dev h ARG 30 Cb 1.10 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 2dev h ARG 30 CO 0.10 0.17 -0.24 0.87 -1.51 0.00 0.00 179.97 179.36 2dev h LYS 31 N 0.13 0.00 0.00 0.20 1.57 -1.55 -3.34 116.57 113.59 2dev h LYS 31 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 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 0.00 0.24 0.00 0.25 -0.57 0.00 0.00 179.45 179.37 2dev n THR 32 N -3.76 0.00 -4.89 -0.16 -2.24 -1.05 -5.05 114.28 97.13 2dev n THR 32 Ca -0.01 -0.29 -0.33 0.00 -2.27 0.00 0.00 64.05 61.15 2dev n THR 32 Cb 0.34 1.11 -0.13 0.00 -2.10 0.00 0.00 70.33 69.55 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 -0.87 2.71 0.06 3.22 1.43 0.31 -5.13 118.68 120.42 2dev s LEU 33 Ca 0.00 -0.21 0.05 0.00 -1.03 0.00 0.00 54.13 52.93 2dev s LEU 33 Cb 0.00 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.63 2dev s LEU 33 CO 0.00 0.34 -0.04 -0.13 0.23 0.00 0.00 176.35 176.75 2dev s ARG 34 N -0.77 2.47 -0.72 1.70 0.52 -1.26 -4.55 118.95 116.33 2dev s ARG 34 Ca 0.12 -0.83 -0.03 0.00 -0.52 0.00 0.00 55.73 54.46 2dev s ARG 34 Cb -0.11 -2.49 0.00 0.00 0.52 0.00 0.00 34.95 32.88 2dev s ARG 34 CO 0.01 0.56 0.44 0.72 0.02 0.00 0.00 175.30 177.04 2dev n HIS 35 N 0.94 -1.19 -1.75 -0.53 8.25 -1.26 -4.38 115.22 115.30 2dev n HIS 35 Ca -0.13 0.38 -0.42 0.00 -0.26 0.00 0.00 57.72 57.29 2dev n HIS 35 Cb 0.52 -2.86 -0.03 0.00 1.12 0.00 0.00 29.99 28.74 2dev n HIS 35 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2dev s LEU 36 N -3.82 4.40 -0.10 2.41 1.43 -1.26 -2.27 118.68 119.46 2dev s LEU 36 Ca 0.22 2.70 -0.11 0.00 -1.03 0.00 0.00 54.13 55.91 2dev s LEU 36 Cb -0.10 -3.56 -0.05 0.00 0.03 0.00 0.00 46.19 42.52 2dev s LEU 36 CO 0.27 -0.99 -0.22 0.47 0.23 0.00 0.00 176.35 176.11 2dev n ASP 37 N 5.90 1.53 -4.07 2.29 8.00 0.11 -4.97 116.55 125.35 2dev n ASP 37 Ca 0.18 0.25 -0.13 0.00 0.71 0.00 0.00 54.79 55.80 2dev n ASP 37 Cb 0.39 -0.57 -0.09 0.00 -0.02 0.00 0.00 41.12 40.82 2dev n ASP 37 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 2dev s TRP 38 N -2.51 1.15 0.09 1.24 -2.14 -1.03 -5.00 118.94 110.73 2dev s TRP 38 Ca -0.20 -1.35 0.01 0.00 2.66 0.00 0.00 56.10 57.22 2dev s TRP 38 Cb 0.04 -0.50 -0.04 0.00 -3.10 0.00 0.00 33.47 29.87 2dev s TRP 38 CO 0.28 -0.71 -0.04 -0.59 -2.66 0.00 0.00 176.95 173.23 2dev s PHE 39 N -4.04 0.80 -0.02 1.66 -0.12 -1.26 0.32 117.98 115.31 2dev s PHE 39 Ca 0.37 -1.01 -0.00 0.00 -0.05 0.00 0.00 56.93 56.25 2dev s PHE 39 Cb 0.06 -0.49 0.03 0.00 -0.63 0.00 0.00 43.02 41.99 2dev s PHE 39 CO 0.14 -0.27 0.04 -1.21 -0.05 0.00 0.00 175.22 173.87 2dev s GLU 40 N -3.89 -0.02 -0.15 1.99 2.02 0.05 -4.95 118.70 113.74 2dev s GLU 40 Ca 0.12 0.19 -0.23 0.00 0.02 0.00 0.00 54.97 55.08 2dev s GLU 40 Cb 0.06 -0.22 -0.03 0.00 0.10 0.00 0.00 34.13 34.05 2dev s GLU 40 CO -0.05 -0.16 0.71 0.08 0.02 0.00 0.00 175.26 175.86 2dev s VAL 41 N 0.99 4.99 -0.25 2.63 1.01 -1.26 -0.25 120.40 128.26 2dev s VAL 41 Ca -0.08 1.40 -0.06 0.00 0.00 0.00 0.00 61.98 63.23 2dev s VAL 41 Cb -0.12 -4.03 -0.16 0.00 0.00 0.00 0.00 36.38 32.07 2dev s VAL 41 CO -0.03 0.13 -0.21 0.29 0.00 0.00 0.00 175.10 175.28 2dev n LYS 42 N 4.68 0.63 -4.01 2.72 4.01 -0.02 -4.96 118.16 121.21 2dev n LYS 42 Ca 0.00 0.23 -0.08 0.00 -0.51 0.00 0.00 58.31 57.95 2dev n LYS 42 Cb 0.50 -1.53 -0.10 0.00 -0.51 0.00 0.00 35.03 33.38 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 0.53 -0.16 1.97 2.02 -1.07 -5.00 118.70 114.47 2dev s GLU 43 Ca -0.35 -0.93 -0.01 0.00 0.02 0.00 0.00 54.97 53.70 2dev s GLU 43 Cb 0.11 0.19 0.04 0.00 0.10 0.00 0.00 34.13 34.57 2dev s GLU 43 CO 0.57 -0.11 -0.03 0.42 0.02 0.00 0.00 175.26 176.14 2dev s ILE 44 N -2.90 0.89 0.00 -1.63 1.01 -1.26 -1.01 121.20 116.31 2dev s ILE 44 Ca -0.03 -0.53 0.00 0.00 0.00 0.00 0.00 60.65 60.09 2dev s ILE 44 Cb 0.01 -1.15 0.00 0.00 0.01 0.00 0.00 42.46 41.33 2dev s ILE 44 CO -0.06 0.06 0.00 -2.11 0.00 0.00 0.00 174.94 172.83 2dev n ARG 45 N 4.94 0.30 0.00 2.79 1.85 -0.06 -5.00 116.66 121.49 2dev n ARG 45 Ca -0.11 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.74 2dev n ARG 45 Cb 0.48 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.89 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 0.57 1.08 3.97 2.89 0.00 -1.26 -0.79 105.19 111.64 2dev n GLY 46 Ca 0.00 -0.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 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 4.79 -0.02 2.61 -4.23 -0.68 -4.97 115.64 111.14 2dev s THR 47 Ca 0.00 -0.82 0.07 0.00 -1.18 0.00 0.00 61.69 59.76 2dev s THR 47 Cb 0.00 -3.71 -0.02 0.00 1.34 0.00 0.00 72.50 70.12 2dev s THR 47 CO 0.00 -0.34 -0.24 -0.63 -0.54 0.00 0.00 174.62 172.87 2dev s ILE 48 N -2.16 1.93 0.00 2.99 1.01 -1.26 -1.35 121.20 122.36 2dev s ILE 48 Ca 0.40 -1.04 0.00 0.00 0.00 0.00 0.00 60.65 60.00 2dev s ILE 48 Cb -0.09 -1.61 0.00 0.00 0.01 0.00 0.00 42.46 40.77 2dev s ILE 48 CO 0.32 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.42 2dev n GLY 49 N 2.51 4.48 0.31 6.18 0.00 0.27 -4.73 105.19 114.21 2dev n GLY 49 Ca -0.16 -1.95 0.01 0.00 0.00 0.00 0.00 46.02 43.92 2dev n GLY 49 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dev h GLU 50 N 0.00 0.73 -0.21 1.61 5.08 -2.00 -2.32 114.58 117.46 2dev h GLU 50 Ca 0.00 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2dev h GLU 50 Cb 0.00 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.10 2dev h GLU 50 CO 0.00 0.55 0.00 0.00 -1.00 0.00 0.00 179.01 178.56 2dev n ALA 51 N -2.46 2.50 0.00 3.43 0.00 -1.26 -5.02 120.51 117.70 2dev n ALA 51 Ca 0.04 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.99 2dev n ALA 51 Cb 0.11 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.50 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 1.04 0.60 3.66 0.00 0.00 -0.88 -4.97 105.19 104.65 2dev n GLY 52 Ca 0.13 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 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 3.02 -0.11 1.61 1.01 -1.26 0.97 120.40 125.64 2dev s VAL 53 Ca 0.00 0.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.01 2dev s VAL 53 Cb 0.00 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 2dev s VAL 53 CO 0.00 -0.01 -0.11 0.50 0.00 0.00 0.00 175.10 175.49 2dev h LYS 54 N 10.32 0.00 -4.94 2.72 3.64 -1.50 -3.44 116.57 123.36 2dev h LYS 54 Ca -0.48 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.34 2dev h LYS 54 Cb 1.23 0.00 -0.32 0.00 -0.41 0.00 0.00 32.23 32.73 2dev h LYS 54 CO 0.94 0.00 -0.83 -1.21 -2.27 0.00 0.00 179.45 176.08 2dev s GLU 55 N -1.90 1.91 -0.04 1.90 2.02 -1.24 -4.43 118.70 116.92 2dev s GLU 55 Ca -0.09 -0.55 -0.17 0.00 0.02 0.00 0.00 54.97 54.18 2dev s GLU 55 Cb 0.01 -1.58 -0.05 0.00 0.10 0.00 0.00 34.13 32.61 2dev s GLU 55 CO 0.13 0.13 0.47 0.71 0.02 0.00 0.00 175.26 176.72 2dev s TYR 56 N 0.37 3.64 -0.15 1.61 2.02 0.17 -1.69 117.35 123.32 2dev s TYR 56 Ca -0.11 1.00 0.01 0.00 -0.37 0.00 0.00 57.07 57.60 2dev s TYR 56 Cb -0.14 -2.45 0.02 0.00 -0.40 0.00 0.00 41.96 38.98 2dev s TYR 56 CO 0.04 0.41 -0.17 -0.65 -1.57 0.00 0.00 175.55 173.61 2dev s GLN 57 N -0.29 2.60 -0.20 -0.62 -0.21 0.03 -1.45 119.66 119.52 2dev s GLN 57 Ca 0.26 -0.68 -0.02 0.00 0.02 0.00 0.00 55.36 54.94 2dev s GLN 57 Cb -0.16 -2.27 0.00 0.00 1.00 0.00 0.00 33.01 31.58 2dev s GLN 57 CO 0.13 -0.18 -0.10 0.08 -2.12 0.00 0.00 175.29 173.10 2dev s VAL 58 N 1.29 2.88 -0.14 1.09 1.01 0.21 -0.88 120.40 125.87 2dev s VAL 58 Ca 0.02 -0.66 -0.16 0.00 0.00 0.00 0.00 61.98 61.18 2dev s VAL 58 Cb -0.13 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 2dev s VAL 58 CO -0.09 0.47 0.38 -0.69 0.00 0.00 0.00 175.10 175.17 2dev s VAL 59 N 1.39 5.24 0.14 2.92 1.01 -0.18 -0.65 120.40 130.28 2dev s VAL 59 Ca 0.05 0.75 -0.12 0.00 0.00 0.00 0.00 61.98 62.66 2dev s VAL 59 Cb -0.14 -3.72 0.01 0.00 0.00 0.00 0.00 36.38 32.53 2dev s VAL 59 CO -0.07 0.36 0.32 -1.48 0.00 0.00 0.00 175.10 174.24 2dev s LEU 60 N 0.50 0.83 -0.11 3.92 2.34 0.10 -0.84 118.68 125.41 2dev s LEU 60 Ca 0.21 -0.62 -0.03 0.00 0.06 0.00 0.00 54.13 53.75 2dev s LEU 60 Cb -0.14 1.44 -0.03 0.00 -0.56 0.00 0.00 46.19 46.90 2dev s LEU 60 CO 0.07 -0.86 0.00 -1.61 -1.06 0.00 0.00 176.35 172.89 2dev s GLU 61 N -3.89 3.22 -0.18 1.48 2.02 0.65 -0.45 118.70 121.55 2dev s GLU 61 Ca 0.09 -0.42 -0.01 0.00 0.02 0.00 0.00 54.97 54.65 2dev s GLU 61 Cb 0.03 -2.87 0.00 0.00 0.10 0.00 0.00 34.13 31.39 2dev s GLU 61 CO -0.06 0.58 -0.12 0.08 0.02 0.00 0.00 175.26 175.75 2dev s VAL 62 N -0.53 2.80 -0.15 2.63 1.01 0.16 -0.77 120.40 125.54 2dev s VAL 62 Ca 0.09 -0.70 -0.08 0.00 0.00 0.00 0.00 61.98 61.29 2dev s VAL 62 Cb -0.12 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 2dev s VAL 62 CO 0.02 0.49 0.12 -0.83 0.00 0.00 0.00 175.10 174.90 2dev s GLY 63 N 1.14 2.06 0.00 4.51 0.00 0.15 -1.57 107.32 113.62 2dev s GLY 63 Ca 0.01 -0.68 -0.05 0.00 0.00 0.00 0.00 44.72 44.00 2dev s GLY 63 CO -0.04 -0.15 0.08 -0.11 0.00 0.00 0.00 173.10 172.88 2dev s PHE 64 N -0.33 0.09 0.24 1.90 -0.12 -0.42 -0.71 117.98 118.63 2dev s PHE 64 Ca 0.11 -0.21 -0.30 0.00 -0.05 0.00 0.00 56.93 56.48 2dev s PHE 64 Cb -0.12 -0.08 -0.09 0.00 -0.63 0.00 0.00 43.02 42.10 2dev s PHE 64 CO 0.01 -0.23 1.06 0.50 -0.05 0.00 0.00 175.22 176.52 2dev s ARG 65 N -1.24 4.67 0.13 1.99 3.52 -0.96 -1.24 118.95 125.81 2dev s ARG 65 Ca -0.13 1.71 -0.11 0.00 -0.13 0.00 0.00 55.73 57.07 2dev s ARG 65 Cb -0.08 -3.24 -0.06 0.00 -1.56 0.00 0.00 34.95 30.02 2dev s ARG 65 CO 0.01 0.24 0.47 -0.51 -0.81 0.00 0.00 175.30 174.69 2dev s LEU 66 N -1.07 4.31 0.39 -0.88 1.43 -0.27 -4.73 118.68 117.87 2dev s LEU 66 Ca 0.45 0.89 -0.06 0.00 -1.03 0.00 0.00 54.13 54.38 2dev s LEU 66 Cb -0.30 -3.22 -0.05 0.00 0.03 0.00 0.00 46.19 42.66 2dev s LEU 66 CO 0.37 0.10 0.69 -1.61 0.23 0.00 0.00 176.35 176.14 2dev s GLU 67 N -2.13 3.64 0.00 1.70 2.02 -1.26 -4.65 118.70 118.01 2dev s GLU 67 Ca 0.38 0.18 0.23 0.00 0.02 0.00 0.00 54.97 55.78 2dev s GLU 67 Cb -0.14 -2.48 0.19 0.00 0.10 0.00 0.00 34.13 31.80 2dev s GLU 67 CO 0.19 -0.00 1.24 0.39 0.02 0.00 0.00 175.26 177.10