#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dc2 s ILE 10 N 0.00 4.49 -0.05 0.52 2.07 -1.26 -4.47 121.20 122.50 2dc2 s ILE 10 Ca 0.00 1.94 0.05 0.00 -1.41 0.00 0.00 60.65 61.23 2dc2 s ILE 10 Cb 0.00 -4.24 -0.01 0.00 0.13 0.00 0.00 42.46 38.34 2dc2 s ILE 10 CO 0.00 0.24 -0.20 -0.60 -1.91 0.00 0.00 174.94 172.47 2dc2 s ARG 11 N 0.40 2.08 -0.22 3.50 3.52 -1.01 -5.05 118.95 122.17 2dc2 s ARG 11 Ca 0.50 -0.72 -0.09 0.00 -0.13 0.00 0.00 55.73 55.29 2dc2 s ARG 11 Cb -0.24 -1.78 -0.04 0.00 -1.56 0.00 0.00 34.95 31.32 2dc2 s ARG 11 CO 0.30 0.29 0.12 0.15 -0.81 0.00 0.00 175.30 175.35 2dc2 s LYS 12 N -0.03 4.01 0.02 5.12 3.01 -1.26 -2.91 119.74 127.69 2dc2 s LYS 12 Ca -0.04 -0.31 0.05 0.00 -1.01 0.00 0.00 55.97 54.66 2dc2 s LYS 12 Cb -0.12 -3.40 -0.02 0.00 -1.01 0.00 0.00 37.83 33.28 2dc2 s LYS 12 CO 0.03 0.13 -0.15 0.14 0.51 0.00 0.00 175.35 176.00 2dc2 s VAL 13 N 0.82 1.22 -0.11 3.17 -7.23 0.20 -5.02 120.40 113.45 2dc2 s VAL 13 Ca 0.06 -0.87 0.01 0.00 -1.81 0.00 0.00 61.98 59.37 2dc2 s VAL 13 Cb -0.13 -1.06 -0.02 0.00 0.56 0.00 0.00 36.38 35.73 2dc2 s VAL 13 CO 0.02 0.18 -0.14 -1.48 -0.31 0.00 0.00 175.10 173.36 2dc2 s LEU 14 N -0.81 2.66 0.00 1.32 0.05 -1.26 0.52 118.68 121.17 2dc2 s LEU 14 Ca 0.04 -0.32 0.08 0.00 0.05 0.00 0.00 54.13 53.98 2dc2 s LEU 14 Cb -0.07 -1.58 -0.02 0.00 -2.05 0.00 0.00 46.19 42.47 2dc2 s LEU 14 CO 0.01 0.21 -0.25 -0.22 -0.55 0.00 0.00 176.35 175.54 2dc2 s LEU 15 N 0.11 2.09 -0.26 1.48 2.96 0.11 -4.97 118.68 120.20 2dc2 s LEU 15 Ca -0.07 -0.50 -0.06 0.00 -0.22 0.00 0.00 54.13 53.28 2dc2 s LEU 15 Cb -0.15 -1.27 -0.01 0.00 0.50 0.00 0.00 46.19 45.25 2dc2 s LEU 15 CO 0.05 0.29 0.05 -0.22 -1.32 0.00 0.00 176.35 175.20 2dc2 s LEU 16 N -0.82 3.46 0.09 -0.68 0.20 -1.26 -1.40 118.68 118.28 2dc2 s LEU 16 Ca 0.10 -0.40 0.09 0.00 0.69 0.00 0.00 54.13 54.61 2dc2 s LEU 16 Cb -0.10 -1.87 -0.04 0.00 -0.43 0.00 0.00 46.19 43.75 2dc2 s LEU 16 CO 0.00 -0.08 -0.22 -0.75 -0.29 0.00 0.00 176.35 175.01 2dc2 s LYS 17 N 1.55 1.73 0.26 1.98 2.20 -1.20 -4.77 119.74 121.50 2dc2 s LYS 17 Ca 0.05 -1.18 0.10 0.00 -0.36 0.00 0.00 55.97 54.58 2dc2 s LYS 17 Cb -0.16 -2.04 -0.04 0.00 -1.51 0.00 0.00 37.83 34.08 2dc2 s LYS 17 CO 0.02 0.49 -0.04 -1.21 -0.36 0.00 0.00 175.35 174.25 2dc2 s GLU 18 N -1.83 2.18 0.31 4.03 8.01 -1.26 -3.64 118.70 126.51 2dc2 s GLU 18 Ca 0.15 -1.47 0.02 0.00 0.01 0.00 0.00 54.97 53.68 2dc2 s GLU 18 Cb -0.10 -2.10 0.57 0.00 -4.31 0.00 0.00 34.13 28.19 2dc2 s GLU 18 CO 0.07 0.36 1.92 0.22 0.01 0.00 0.00 175.26 177.83 2dc2 h ASP 19 N 2.00 0.86 1.17 -0.19 3.58 -2.00 -1.56 116.42 120.27 2dc2 h ASP 19 Ca -0.44 0.01 -0.17 0.00 0.42 0.00 0.00 57.03 56.85 2dc2 h ASP 19 Cb 1.25 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 42.10 2dc2 h ASP 19 CO 0.60 0.55 -0.81 1.12 -2.88 0.00 0.00 179.24 177.82 2dc2 h HIS 20 N 0.97 0.00 -3.61 0.28 2.07 -2.06 -3.46 115.15 109.35 2dc2 h HIS 20 Ca 0.38 0.00 -0.48 0.00 -2.85 0.00 0.00 60.37 57.42 2dc2 h HIS 20 Cb 0.23 0.00 0.05 0.00 2.57 0.00 0.00 27.41 30.26 2dc2 h HIS 20 CO -0.00 0.81 0.16 -1.21 -3.07 0.00 0.00 177.93 174.62 2dc2 s GLU 21 N -2.83 2.99 0.00 5.12 0.41 -0.59 -5.11 118.70 118.69 2dc2 s GLU 21 Ca 0.02 -0.00 0.00 0.00 -0.41 0.00 0.00 54.97 54.58 2dc2 s GLU 21 Cb 0.09 -2.29 0.00 0.00 -1.78 0.00 0.00 34.13 30.15 2dc2 s GLU 21 CO 0.79 -0.63 0.00 0.41 -0.49 0.00 0.00 175.26 175.34 2dc2 n GLY 22 N -2.53 3.21 0.49 -1.39 0.00 -1.26 -4.48 105.19 99.23 2dc2 n GLY 22 Ca 0.04 -2.12 -0.20 0.00 0.00 0.00 0.00 46.02 43.74 2dc2 n GLY 22 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2dc2 h LEU 23 N 0.00 -1.05 0.00 0.99 6.46 -1.99 -3.45 115.31 116.27 2dc2 h LEU 23 Ca 0.00 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 2dc2 h LEU 23 Cb 0.00 0.27 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 2dc2 h LEU 23 CO 0.00 -0.73 0.00 0.61 -0.62 0.00 0.00 178.44 177.70 2dc2 n GLY 24 N -1.48 0.56 3.21 3.75 0.00 -1.26 -4.73 105.19 105.23 2dc2 n GLY 24 Ca -0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 2dc2 n GLY 24 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2dc2 s ILE 25 N -2.00 0.14 -0.05 -0.61 -5.25 -1.26 -1.10 121.20 111.07 2dc2 s ILE 25 Ca 0.00 -1.37 0.07 0.00 -0.99 0.00 0.00 60.65 58.35 2dc2 s ILE 25 Cb 0.00 -1.52 -0.01 0.00 2.95 0.00 0.00 42.46 43.88 2dc2 s ILE 25 CO 0.00 -0.62 -0.25 -0.55 -1.79 0.00 0.00 174.94 171.73 2dc2 s SER 26 N -2.91 3.12 0.20 4.36 0.15 0.18 -4.87 113.70 113.93 2dc2 s SER 26 Ca 0.09 -0.48 0.11 0.00 0.70 0.00 0.00 55.95 56.37 2dc2 s SER 26 Cb 0.05 -0.69 -0.04 0.00 -1.71 0.00 0.00 66.02 63.63 2dc2 s SER 26 CO -0.08 0.27 -0.24 0.27 1.20 0.00 0.00 173.24 174.67 2dc2 s ILE 27 N -0.32 2.37 0.05 6.45 -4.36 -1.26 -2.06 121.20 122.07 2dc2 s ILE 27 Ca 0.01 -2.04 0.01 0.00 -0.26 0.00 0.00 60.65 58.38 2dc2 s ILE 27 Cb -0.12 -2.14 -0.03 0.00 1.25 0.00 0.00 42.46 41.42 2dc2 s ILE 27 CO 0.02 -0.12 -0.06 0.42 0.24 0.00 0.00 174.94 175.44 2dc2 s THR 28 N -1.69 0.46 -1.08 8.37 -4.23 0.86 -4.87 115.64 113.46 2dc2 s THR 28 Ca 0.21 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.38 2dc2 s THR 28 Cb -0.08 -0.91 0.00 0.00 1.34 0.00 0.00 72.50 72.85 2dc2 s THR 28 CO 0.10 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.20 2dc2 n GLY 29 N 0.97 0.50 3.27 3.99 0.00 -1.26 -1.68 105.19 110.98 2dc2 n GLY 29 Ca -0.19 -2.23 0.03 0.00 0.00 0.00 0.00 46.02 43.63 2dc2 n GLY 29 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dc2 s GLY 30 N 0.00 -0.47 0.45 -0.02 0.00 -1.26 -4.93 107.32 101.10 2dc2 s GLY 30 Ca 0.00 2.63 0.11 0.00 0.00 0.00 0.00 44.72 47.46 2dc2 s GLY 30 CO 0.00 3.48 2.09 1.70 0.00 0.00 0.00 173.10 180.37 2dc2 h LYS 31 N 7.83 0.32 -0.07 2.90 3.11 -1.80 -1.36 116.57 127.51 2dc2 h LYS 31 Ca -0.17 -0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 57.65 2dc2 h LYS 31 Cb 1.15 -0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 32.30 2dc2 h LYS 31 CO 0.06 0.21 0.04 0.93 -2.81 0.00 0.00 179.45 177.88 2dc2 h GLU 32 N 0.33 0.09 0.00 1.90 5.08 -1.87 -1.13 114.58 118.99 2dc2 h GLU 32 Ca 0.10 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.31 2dc2 h GLU 32 Cb -0.01 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2dc2 h GLU 32 CO -0.02 0.07 -0.68 0.45 -1.00 0.00 0.00 179.01 177.83 2dc2 h HIS 33 N 0.10 0.00 0.00 4.33 3.86 -1.67 -3.47 115.15 118.30 2dc2 h HIS 33 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2dc2 h HIS 33 Cb -0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2dc2 h HIS 33 CO 0.00 0.68 0.00 0.41 0.86 0.00 0.00 177.93 179.88 2dc2 n GLY 34 N 0.83 1.85 3.13 2.45 0.00 -0.43 -5.12 105.19 107.90 2dc2 n GLY 34 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2dc2 n GLY 34 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dc2 s VAL 35 N -2.00 0.03 0.70 1.61 -7.23 -1.22 -5.04 120.40 107.25 2dc2 s VAL 35 Ca 0.00 -0.26 -0.13 0.00 -1.81 0.00 0.00 61.98 59.78 2dc2 s VAL 35 Cb 0.00 -0.40 0.02 0.00 0.56 0.00 0.00 36.38 36.56 2dc2 s VAL 35 CO 0.00 -0.14 1.10 -2.16 -0.31 0.00 0.00 175.10 173.59 2dc2 s PRO 36 N -0.50 2.58 0.15 4.82 0.04 -1.26 -3.03 135.00 137.80 2dc2 s PRO 36 Ca -0.06 1.31 -0.25 0.00 0.04 0.00 0.00 61.00 62.03 2dc2 s PRO 36 Cb -0.04 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.50 2dc2 s PRO 36 CO 0.01 -1.41 0.77 0.42 0.04 0.00 0.00 177.00 176.83 2dc2 s ILE 37 N -2.56 4.42 0.16 0.56 -1.09 -1.26 -4.61 121.20 116.81 2dc2 s ILE 37 Ca 0.65 1.69 0.04 0.00 -2.23 0.00 0.00 60.65 60.80 2dc2 s ILE 37 Cb -0.19 -4.13 -0.04 0.00 -1.58 0.00 0.00 42.46 36.51 2dc2 s ILE 37 CO 0.47 0.50 -0.09 -0.76 -1.23 0.00 0.00 174.94 173.83 2dc2 s LEU 38 N -1.00 2.50 -0.21 2.97 1.02 -0.67 -0.53 118.68 122.75 2dc2 s LEU 38 Ca 0.36 -1.03 -0.20 0.00 0.02 0.00 0.00 54.13 53.28 2dc2 s LEU 38 Cb -0.23 -0.35 -0.02 0.00 0.02 0.00 0.00 46.19 45.61 2dc2 s LEU 38 CO 0.26 -0.34 0.61 -0.63 0.02 0.00 0.00 176.35 176.27 2dc2 s ILE 39 N -3.33 5.02 -0.11 -0.59 1.01 0.13 -0.10 121.20 123.24 2dc2 s ILE 39 Ca 0.18 1.14 0.08 0.00 0.00 0.00 0.00 60.65 62.04 2dc2 s ILE 39 Cb 0.03 -3.93 -0.12 0.00 0.01 0.00 0.00 42.46 38.45 2dc2 s ILE 39 CO 0.01 0.10 0.01 -1.20 0.00 0.00 0.00 174.94 173.86 2dc2 n SER 40 N 5.20 2.48 -4.23 3.58 7.64 -0.87 0.19 113.62 127.61 2dc2 n SER 40 Ca -0.02 -0.01 -0.21 0.00 1.01 0.00 0.00 58.87 59.64 2dc2 n SER 40 Cb 0.50 0.61 -0.12 0.00 -1.01 0.00 0.00 64.21 64.18 2dc2 n SER 40 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2dc2 s GLU 41 N -2.26 1.00 -0.14 1.43 2.12 -1.14 -4.70 118.70 115.01 2dc2 s GLU 41 Ca -0.07 -1.03 -0.02 0.00 0.36 0.00 0.00 54.97 54.20 2dc2 s GLU 41 Cb 0.03 -1.13 0.05 0.00 0.26 0.00 0.00 34.13 33.34 2dc2 s GLU 41 CO 0.41 0.26 0.02 0.42 -0.54 0.00 0.00 175.26 175.84 2dc2 s ILE 42 N -1.17 0.45 -0.03 -3.70 1.01 -1.26 0.48 121.20 116.98 2dc2 s ILE 42 Ca 0.03 -0.25 -0.30 0.00 0.00 0.00 0.00 60.65 60.13 2dc2 s ILE 42 Cb -0.10 -0.80 -0.06 0.00 0.01 0.00 0.00 42.46 41.51 2dc2 s ILE 42 CO 0.03 0.00 1.65 -1.00 0.00 0.00 0.00 174.94 175.62 2dc2 s HIS 43 N 1.91 2.05 0.69 3.97 3.76 -0.25 -4.97 115.29 122.45 2dc2 s HIS 43 Ca 0.02 0.22 -0.14 0.00 -0.15 0.00 0.00 55.06 55.01 2dc2 s HIS 43 Cb -0.15 -3.92 0.01 0.00 1.11 0.00 0.00 32.58 29.64 2dc2 s HIS 43 CO -0.07 -3.83 1.10 -1.25 -0.85 0.00 0.00 174.74 169.83 2dc2 s PRO 44 N 3.79 2.69 -1.18 8.40 0.04 -1.26 -3.82 135.00 143.66 2dc2 s PRO 44 Ca 0.73 1.29 -0.05 0.00 0.04 0.00 0.00 61.00 63.02 2dc2 s PRO 44 Cb -0.34 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.26 2dc2 s PRO 44 CO 0.30 -1.32 0.64 0.41 0.04 0.00 0.00 177.00 177.06 2dc2 n GLY 45 N -0.82 -0.25 3.41 0.56 0.00 -1.26 -5.01 105.19 101.81 2dc2 n GLY 45 Ca 0.10 -0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 2dc2 n GLY 45 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dc2 s GLN 46 N -5.65 1.78 0.52 1.61 1.11 -1.25 -5.01 119.66 112.77 2dc2 s GLN 46 Ca 0.31 -2.05 0.31 0.00 0.01 0.00 0.00 55.36 53.94 2dc2 s GLN 46 Cb -0.14 -0.24 1.44 0.00 -1.01 0.00 0.00 33.01 33.06 2dc2 s GLN 46 CO 0.39 -0.51 1.85 -1.35 0.01 0.00 0.00 175.29 175.68 2dc2 h PRO 47 N 2.00 0.07 -0.31 2.91 0.11 -1.86 -0.19 132.00 134.74 2dc2 h PRO 47 Ca -0.32 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.76 2dc2 h PRO 47 Cb 1.26 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2dc2 h PRO 47 CO 0.51 0.04 0.11 0.00 -0.21 0.00 0.00 178.00 178.45 2dc2 h ALA 48 N 1.52 0.40 -0.37 -0.75 0.00 -1.85 -2.42 119.26 115.79 2dc2 h ALA 48 Ca 0.49 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 55.11 2dc2 h ALA 48 Cb 1.83 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 2dc2 h ALA 48 CO -0.05 0.01 -0.38 0.22 0.00 0.00 0.00 179.25 179.06 2dc2 h ASP 49 N 0.34 0.97 -0.81 0.00 1.82 -1.32 -2.48 116.42 114.94 2dc2 h ASP 49 Ca 0.10 -0.47 0.10 0.00 -0.39 0.00 0.00 57.03 56.37 2dc2 h ASP 49 Cb 0.21 -0.27 -0.06 0.00 0.68 0.00 0.00 39.33 39.89 2dc2 h ASP 49 CO -0.01 1.24 0.53 0.03 -1.61 0.00 0.00 179.24 179.42 2dc2 h ARG 50 N 0.72 0.73 0.00 0.28 3.08 -1.22 -1.43 114.38 116.54 2dc2 h ARG 50 Ca 0.06 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 59.89 2dc2 h ARG 50 Cb 0.97 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.83 2dc2 h ARG 50 CO 0.09 0.48 -0.88 0.00 -1.07 0.00 0.00 179.97 178.59 2dc2 n GLY 52 N 1.32 0.71 0.07 0.00 0.00 -0.54 -4.84 105.19 101.90 2dc2 n GLY 52 Ca -0.01 -0.22 -0.07 0.00 0.00 0.00 0.00 46.02 45.72 2dc2 n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dc2 n GLY 53 N -1.11 -0.59 3.56 -0.02 0.00 -1.25 -4.91 105.19 100.86 2dc2 n GLY 53 Ca -0.05 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 2dc2 n GLY 53 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dc2 s LEU 54 N -5.04 3.36 0.23 0.99 2.01 -1.25 -4.95 118.68 114.03 2dc2 s LEU 54 Ca -0.08 0.76 0.10 0.00 0.01 0.00 0.00 54.13 54.92 2dc2 s LEU 54 Cb 0.04 -2.65 -0.04 0.00 0.01 0.00 0.00 46.19 43.55 2dc2 s LEU 54 CO 0.51 -2.49 -0.07 -1.38 1.01 0.00 0.00 176.35 173.94 2dc2 s HIS 55 N 10.01 2.62 0.22 0.29 -3.43 -1.26 -4.88 115.29 118.86 2dc2 s HIS 55 Ca 0.81 -0.23 -0.30 0.00 -0.80 0.00 0.00 55.06 54.54 2dc2 s HIS 55 Cb -0.16 -1.21 -0.09 0.00 -1.43 0.00 0.00 32.58 29.69 2dc2 s HIS 55 CO 0.24 0.58 1.22 0.08 -2.00 0.00 0.00 174.74 174.86 2dc2 s VAL 56 N -2.07 3.39 0.00 -5.38 1.01 -1.26 -3.86 120.40 112.23 2dc2 s VAL 56 Ca 0.28 1.22 0.00 0.00 0.00 0.00 0.00 61.98 63.48 2dc2 s VAL 56 Cb -0.07 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.53 2dc2 s VAL 56 CO 0.17 0.22 0.00 0.61 0.00 0.00 0.00 175.10 176.10 2dc2 n GLY 57 N 1.93 0.60 3.46 4.51 0.00 0.13 -5.00 105.19 110.81 2dc2 n GLY 57 Ca 0.03 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 2dc2 n GLY 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dc2 s ASP 58 N -2.39 4.35 -0.21 1.61 -1.08 -1.16 -3.07 116.67 114.72 2dc2 s ASP 58 Ca 0.00 -0.20 -0.18 0.00 -0.52 0.00 0.00 52.55 51.64 2dc2 s ASP 58 Cb 0.00 -1.51 -0.03 0.00 -1.46 0.00 0.00 42.92 39.92 2dc2 s ASP 58 CO 0.00 0.22 0.51 0.00 0.52 0.00 0.00 175.17 176.42 2dc2 s ALA 59 N 0.04 3.55 0.11 3.66 0.00 -0.99 0.21 121.76 128.34 2dc2 s ALA 59 Ca -0.03 -0.43 -0.30 0.00 0.00 0.00 0.00 51.96 51.20 2dc2 s ALA 59 Cb -0.14 -2.81 -0.06 0.00 0.00 0.00 0.00 23.12 20.10 2dc2 s ALA 59 CO 0.04 -0.47 1.14 0.42 0.00 0.00 0.00 175.76 176.89 2dc2 s ILE 60 N 1.70 4.03 0.02 0.00 1.01 0.31 -2.67 121.20 125.59 2dc2 s ILE 60 Ca 0.23 1.57 -0.00 0.00 0.00 0.00 0.00 60.65 62.45 2dc2 s ILE 60 Cb -0.15 -4.00 -0.00 0.00 0.01 0.00 0.00 42.46 38.31 2dc2 s ILE 60 CO 0.09 0.19 -0.01 0.18 0.00 0.00 0.00 174.94 175.39 2dc2 n LEU 61 N 3.26 0.28 -4.02 2.97 4.77 -0.85 -4.60 117.00 118.81 2dc2 n LEU 61 Ca 0.06 0.04 -0.14 0.00 -0.03 0.00 0.00 56.01 55.93 2dc2 n LEU 61 Cb 0.47 -0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 41.30 2dc2 n LEU 61 CO 0.55 -0.55 -0.40 0.00 -1.33 0.00 0.00 177.39 175.65 2dc2 s ALA 62 N -2.11 0.52 -0.24 -1.18 0.00 -1.10 -2.89 121.76 114.77 2dc2 s ALA 62 Ca -0.01 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.41 2dc2 s ALA 62 Cb 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.12 2dc2 s ALA 62 CO 0.01 0.04 -0.09 0.08 0.00 0.00 0.00 175.76 175.80 2dc2 s VAL 63 N -0.83 2.63 -1.46 0.00 1.01 0.85 -1.50 120.40 121.10 2dc2 s VAL 63 Ca -0.05 -1.08 -0.11 0.00 0.00 0.00 0.00 61.98 60.75 2dc2 s VAL 63 Cb -0.07 -2.32 0.06 0.00 0.00 0.00 0.00 36.38 34.05 2dc2 s VAL 63 CO 0.00 0.24 0.81 -3.20 0.00 0.00 0.00 175.10 172.95 2dc2 n ASN 64 N 4.63 -4.99 0.00 3.32 2.85 0.13 -0.50 115.26 120.70 2dc2 n ASN 64 Ca -0.17 -0.56 0.00 0.00 -0.11 0.00 0.00 54.58 53.74 2dc2 n ASN 64 Cb 0.47 -4.01 0.00 0.00 1.24 0.00 0.00 39.78 37.48 2dc2 n ASN 64 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2dc2 n GLY 65 N -1.57 2.55 3.75 8.20 0.00 -1.26 -4.98 105.19 111.88 2dc2 n GLY 65 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2dc2 n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dc2 s VAL 66 N -2.22 4.72 0.22 1.61 1.01 0.34 -5.04 120.40 121.04 2dc2 s VAL 66 Ca 0.00 1.58 -0.30 0.00 0.00 0.00 0.00 61.98 63.26 2dc2 s VAL 66 Cb 0.00 -4.09 -0.08 0.00 0.00 0.00 0.00 36.38 32.21 2dc2 s VAL 66 CO 0.00 0.39 1.03 0.21 0.00 0.00 0.00 175.10 176.73 2dc2 s ASN 67 N -0.19 7.42 0.00 3.32 2.47 -1.26 -0.10 114.94 126.60 2dc2 s ASN 67 Ca 0.37 2.06 0.04 0.00 0.42 0.00 0.00 52.86 55.75 2dc2 s ASN 67 Cb -0.20 -2.61 0.02 0.00 -1.45 0.00 0.00 41.25 37.01 2dc2 s ASN 67 CO 0.22 -0.06 0.55 -0.11 -3.72 0.00 0.00 177.10 173.99 2dc2 n LEU 68 N 1.81 1.15 0.16 3.21 7.94 -1.14 -4.63 117.00 125.50 2dc2 n LEU 68 Ca 0.00 -0.90 0.01 0.00 -1.11 0.00 0.00 56.01 54.00 2dc2 n LEU 68 Cb 0.46 0.00 0.27 0.00 0.53 0.00 0.00 43.42 44.69 2dc2 n LEU 68 CO 0.52 0.25 0.63 -0.09 -1.11 0.00 0.00 177.39 177.59 2dc2 h ARG 69 N 0.72 0.03 -0.69 1.96 2.43 -1.92 -2.81 114.38 114.11 2dc2 h ARG 69 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2dc2 h ARG 69 Cb 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 2dc2 h ARG 69 CO 0.00 0.49 0.00 -0.25 -1.51 0.00 0.00 179.97 178.70 2dc2 n ASP 70 N -3.98 3.98 -4.72 -3.80 8.00 -1.26 -4.95 116.55 109.82 2dc2 n ASP 70 Ca -0.02 -2.11 -0.23 0.00 0.71 0.00 0.00 54.79 53.14 2dc2 n ASP 70 Cb 0.49 -0.50 -0.06 0.00 -0.02 0.00 0.00 41.12 41.03 2dc2 n ASP 70 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2dc2 s THR 71 N -1.26 3.87 0.53 -3.53 2.01 -1.06 -5.13 115.64 111.06 2dc2 s THR 71 Ca 0.48 -1.64 -0.06 0.00 0.31 0.00 0.00 61.69 60.78 2dc2 s THR 71 Cb 0.26 -3.06 -0.02 0.00 0.01 0.00 0.00 72.50 69.69 2dc2 s THR 71 CO 0.30 -0.32 0.85 -0.54 -0.69 0.00 0.00 174.62 174.21 2dc2 s LYS 72 N -3.61 3.38 0.14 4.92 3.01 -1.26 -4.64 119.74 121.67 2dc2 s LYS 72 Ca 0.31 0.21 -0.21 0.00 -1.01 0.00 0.00 55.97 55.28 2dc2 s LYS 72 Cb -0.07 -2.31 -0.00 0.00 -1.01 0.00 0.00 37.83 34.43 2dc2 s LYS 72 CO 0.22 -0.38 1.67 1.25 0.51 0.00 0.00 175.35 178.62 2dc2 h HIS 73 N 0.05 -0.32 -0.58 3.18 -0.00 -1.93 0.63 115.15 116.18 2dc2 h HIS 73 Ca -0.46 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 59.86 2dc2 h HIS 73 Cb 1.22 0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 28.77 2dc2 h HIS 73 CO 0.56 -0.19 0.09 -0.22 -0.00 0.00 0.00 177.93 178.17 2dc2 h LYS 74 N -0.13 0.97 -0.53 5.26 3.64 -1.97 -2.80 116.57 121.02 2dc2 h LYS 74 Ca 0.11 -0.26 -0.06 0.00 -1.27 0.00 0.00 60.65 59.17 2dc2 h LYS 74 Cb 0.29 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 2dc2 h LYS 74 CO -0.27 0.92 0.09 0.93 -2.27 0.00 0.00 179.45 178.86 2dc2 h GLU 75 N 0.87 0.84 -0.06 1.90 5.08 -1.80 -2.52 114.58 118.89 2dc2 h GLU 75 Ca 0.18 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2dc2 h GLU 75 Cb 0.43 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2dc2 h GLU 75 CO 0.01 0.78 -0.13 0.00 -1.00 0.00 0.00 179.01 178.68 2dc2 h ALA 76 N 1.30 1.66 -0.68 3.43 0.00 0.51 -2.38 119.26 123.10 2dc2 h ALA 76 Ca 0.17 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2dc2 h ALA 76 Cb 0.35 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2dc2 h ALA 76 CO 0.01 0.25 0.36 0.28 0.00 0.00 0.00 179.25 180.14 2dc2 h VAL 77 N 0.09 1.22 -0.64 0.00 2.07 -1.21 -1.83 116.25 115.96 2dc2 h VAL 77 Ca 0.02 -0.57 -0.06 0.00 0.82 0.00 0.00 66.70 66.91 2dc2 h VAL 77 Cb 0.29 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 2dc2 h VAL 77 CO 0.02 0.25 0.17 0.74 0.02 0.00 0.00 177.57 178.76 2dc2 h THR 78 N 0.94 1.25 -0.49 2.57 2.02 -1.46 -2.64 112.91 115.10 2dc2 h THR 78 Ca 0.24 -0.90 0.04 0.00 0.77 0.00 0.00 66.41 66.55 2dc2 h THR 78 Cb 0.07 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 2dc2 h THR 78 CO -0.04 0.34 0.27 0.40 0.37 0.00 0.00 175.52 176.86 2dc2 h ILE 79 N 0.94 0.99 -0.92 3.11 1.08 -1.13 -1.45 117.51 120.13 2dc2 h ILE 79 Ca 0.20 -0.18 0.03 0.00 -0.39 0.00 0.00 64.86 64.52 2dc2 h ILE 79 Cb 0.34 0.42 -0.05 0.00 -3.07 0.00 0.00 36.82 34.46 2dc2 h ILE 79 CO -0.00 0.10 0.61 0.25 -0.69 0.00 0.00 178.15 178.41 2dc2 h LEU 80 N 0.52 1.02 -0.37 1.44 6.46 -1.15 -1.25 115.31 121.99 2dc2 h LEU 80 Ca 0.21 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 2dc2 h LEU 80 Cb 0.09 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 39.78 2dc2 h LEU 80 CO -0.13 0.72 0.00 -1.20 -0.62 0.00 0.00 178.44 177.21 2dc2 n SER 81 N -4.48 0.58 0.17 1.25 7.64 -0.83 -3.05 113.62 114.91 2dc2 n SER 81 Ca 0.11 0.61 0.01 0.00 1.01 0.00 0.00 58.87 60.62 2dc2 n SER 81 Cb 0.06 -0.74 0.30 0.00 -1.01 0.00 0.00 64.21 62.82 2dc2 n SER 81 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2dc2 h GLN 82 N 0.00 0.00 -6.65 1.43 1.08 -0.18 -3.43 115.11 107.35 2dc2 h GLN 82 Ca 0.00 0.00 -0.51 0.00 -1.45 0.00 0.00 58.65 56.69 2dc2 h GLN 82 Cb 0.47 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.90 2dc2 h GLN 82 CO 0.00 0.45 0.45 -0.65 -0.95 0.00 0.00 178.83 178.13 2dc2 s GLN 83 N -3.97 4.63 0.05 1.46 1.11 -1.17 -5.05 119.66 116.71 2dc2 s GLN 83 Ca -0.02 1.66 0.05 0.00 0.01 0.00 0.00 55.36 57.06 2dc2 s GLN 83 Cb 0.14 -3.29 -0.02 0.00 -1.01 0.00 0.00 33.01 28.82 2dc2 s GLN 83 CO 0.73 0.13 -0.14 1.03 0.01 0.00 0.00 175.29 177.06 2dc2 s ARG 84 N -0.39 0.87 2.16 2.91 0.52 -1.26 -4.96 118.95 118.80 2dc2 s ARG 84 Ca 0.48 -0.80 0.00 0.00 -0.52 0.00 0.00 55.73 54.90 2dc2 s ARG 84 Cb -0.28 -0.87 0.00 0.00 0.52 0.00 0.00 34.95 34.32 2dc2 s ARG 84 CO 0.34 0.21 0.00 0.41 0.02 0.00 0.00 175.30 176.28 2dc2 n GLY 85 N 1.74 0.88 3.55 -3.53 0.00 -1.24 -4.55 105.19 102.03 2dc2 n GLY 85 Ca -0.19 0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 2dc2 n GLY 85 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dc2 s GLU 86 N 0.00 3.58 -0.16 1.61 2.12 -1.26 -3.22 118.70 121.37 2dc2 s GLU 86 Ca 0.00 -0.35 -0.01 0.00 0.36 0.00 0.00 54.97 54.97 2dc2 s GLU 86 Cb 0.00 -3.81 -0.01 0.00 0.26 0.00 0.00 34.13 30.58 2dc2 s GLU 86 CO 0.00 -0.56 -0.12 0.42 -0.54 0.00 0.00 175.26 174.46 2dc2 s ILE 87 N 2.11 2.98 -0.15 -3.70 1.01 -0.49 -5.02 121.20 117.94 2dc2 s ILE 87 Ca 0.14 -0.67 -0.09 0.00 0.00 0.00 0.00 60.65 60.03 2dc2 s ILE 87 Cb -0.16 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 39.99 2dc2 s ILE 87 CO 0.12 0.50 0.14 -0.70 0.00 0.00 0.00 174.94 175.01 2dc2 s GLU 88 N 0.75 3.78 -0.03 2.79 2.12 -1.26 0.03 118.70 126.88 2dc2 s GLU 88 Ca -0.05 -0.15 0.04 0.00 0.36 0.00 0.00 54.97 55.16 2dc2 s GLU 88 Cb -0.15 -3.29 -0.00 0.00 0.26 0.00 0.00 34.13 30.94 2dc2 s GLU 88 CO 0.01 0.56 -0.14 -0.06 -0.54 0.00 0.00 175.26 175.10 2dc2 s PHE 89 N -0.41 1.38 -0.19 5.30 0.40 0.19 0.22 117.98 124.87 2dc2 s PHE 89 Ca 0.12 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 56.09 2dc2 s PHE 89 Cb -0.12 -0.94 0.04 0.00 0.51 0.00 0.00 43.02 42.51 2dc2 s PHE 89 CO 0.02 -0.13 -0.12 -2.00 0.70 0.00 0.00 175.22 173.69 2dc2 s GLU 90 N 0.07 2.17 0.25 0.44 2.12 -0.56 -0.63 118.70 122.57 2dc2 s GLU 90 Ca -0.03 -0.83 -0.04 0.00 0.36 0.00 0.00 54.97 54.43 2dc2 s GLU 90 Cb -0.10 -2.42 -0.02 0.00 0.26 0.00 0.00 34.13 31.85 2dc2 s GLU 90 CO 0.01 -0.39 0.31 0.14 -0.54 0.00 0.00 175.26 174.79 2dc2 s VAL 91 N 1.38 0.00 -0.02 3.70 -7.23 -1.15 -2.00 120.40 115.07 2dc2 s VAL 91 Ca -0.00 -1.76 -0.02 0.00 -1.81 0.00 0.00 61.98 58.39 2dc2 s VAL 91 Cb -0.16 -2.44 0.01 0.00 0.56 0.00 0.00 36.38 34.36 2dc2 s VAL 91 CO -0.09 0.00 0.06 0.54 -0.31 0.00 0.00 175.10 175.30 2dc2 s VAL 92 N -3.85 -0.02 0.01 1.32 0.11 -1.09 -2.40 120.40 114.49 2dc2 s VAL 92 Ca 0.33 0.06 -0.30 0.00 -2.93 0.00 0.00 61.98 59.14 2dc2 s VAL 92 Cb 0.03 -0.10 -0.07 0.00 -1.53 0.00 0.00 36.38 34.71 2dc2 s VAL 92 CO 0.14 0.02 1.66 -0.47 -3.33 0.00 0.00 175.10 173.13 2dc2 s TYR 93 N 0.35 2.18 -0.23 1.54 6.14 -1.26 -2.34 117.35 123.72 2dc2 s TYR 93 Ca -0.03 0.24 -0.06 0.00 0.64 0.00 0.00 57.07 57.87 2dc2 s TYR 93 Cb -0.04 -3.94 -0.02 0.00 0.42 0.00 0.00 41.96 38.37 2dc2 s TYR 93 CO -0.01 -3.89 0.03 0.14 0.64 0.00 0.00 175.55 172.45 2dc2 s VAL 94 N 3.34 3.97 0.00 3.14 -7.23 -1.18 -4.96 120.40 117.48 2dc2 s VAL 94 Ca 0.74 -0.29 0.00 0.00 -1.81 0.00 0.00 61.98 60.62 2dc2 s VAL 94 Cb -0.37 -2.84 0.00 0.00 0.56 0.00 0.00 36.38 33.74 2dc2 s VAL 94 CO 0.31 0.38 0.00 0.00 -0.31 0.00 0.00 175.10 175.48