#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 4.59 -0.08 0.52 2.07 -1.26 -1.47 121.20 125.57 2dc2 s ILE 10 Ca 0.00 1.90 0.03 0.00 -1.41 0.00 0.00 60.65 61.17 2dc2 s ILE 10 Cb 0.00 -4.22 -0.02 0.00 0.13 0.00 0.00 42.46 38.35 2dc2 s ILE 10 CO 0.00 -0.11 -0.16 -0.60 -1.91 0.00 0.00 174.94 172.16 2dc2 s ARG 11 N 2.88 2.83 -0.29 3.50 3.52 0.15 -4.98 118.95 126.56 2dc2 s ARG 11 Ca 0.48 -0.73 -0.02 0.00 -0.13 0.00 0.00 55.73 55.33 2dc2 s ARG 11 Cb -0.18 -2.44 0.04 0.00 -1.56 0.00 0.00 34.95 30.82 2dc2 s ARG 11 CO 0.12 0.43 -0.01 0.15 -0.81 0.00 0.00 175.30 175.19 2dc2 s LYS 12 N -0.24 2.57 0.01 5.12 3.01 -1.26 -1.99 119.74 126.95 2dc2 s LYS 12 Ca 0.01 -1.17 0.03 0.00 -1.01 0.00 0.00 55.97 53.83 2dc2 s LYS 12 Cb -0.13 -3.15 -0.01 0.00 -1.01 0.00 0.00 37.83 33.52 2dc2 s LYS 12 CO 0.03 -0.56 -0.10 0.08 0.51 0.00 0.00 175.35 175.31 2dc2 s VAL 13 N 1.29 0.76 -0.12 3.17 1.01 -0.69 -5.03 120.40 120.79 2dc2 s VAL 13 Ca -0.03 -0.58 -0.11 0.00 0.00 0.00 0.00 61.98 61.26 2dc2 s VAL 13 Cb -0.19 -0.67 -0.05 0.00 0.00 0.00 0.00 36.38 35.48 2dc2 s VAL 13 CO -0.02 0.09 0.23 -0.76 0.00 0.00 0.00 175.10 174.64 2dc2 s LEU 14 N -0.55 4.33 -0.22 3.92 1.02 -1.26 -0.92 118.68 125.00 2dc2 s LEU 14 Ca 0.01 0.52 -0.05 0.00 0.02 0.00 0.00 54.13 54.63 2dc2 s LEU 14 Cb -0.05 -2.24 -0.02 0.00 0.02 0.00 0.00 46.19 43.89 2dc2 s LEU 14 CO 0.00 0.27 0.01 -0.22 0.02 0.00 0.00 176.35 176.43 2dc2 s LEU 15 N -0.38 3.20 -0.34 1.79 2.96 0.14 -4.94 118.68 121.11 2dc2 s LEU 15 Ca 0.16 -0.26 -0.12 0.00 -0.22 0.00 0.00 54.13 53.69 2dc2 s LEU 15 Cb -0.13 -1.83 -0.01 0.00 0.50 0.00 0.00 46.19 44.72 2dc2 s LEU 15 CO 0.04 0.01 0.22 -0.22 -1.32 0.00 0.00 176.35 175.08 2dc2 s LEU 16 N 1.32 4.45 0.06 -0.68 1.98 -1.26 -2.40 118.68 122.15 2dc2 s LEU 16 Ca 0.04 -0.48 0.06 0.00 -2.89 0.00 0.00 54.13 50.86 2dc2 s LEU 16 Cb -0.15 -2.10 -0.03 0.00 0.66 0.00 0.00 46.19 44.58 2dc2 s LEU 16 CO 0.01 -0.24 -0.17 -0.75 -1.89 0.00 0.00 176.35 173.31 2dc2 s LYS 17 N 1.69 1.08 0.29 1.98 2.36 -1.24 -4.71 119.74 121.19 2dc2 s LYS 17 Ca 0.06 -0.93 0.08 0.00 -2.55 0.00 0.00 55.97 52.62 2dc2 s LYS 17 Cb -0.17 -1.18 -0.04 0.00 -1.05 0.00 0.00 37.83 35.39 2dc2 s LYS 17 CO 0.09 0.29 0.16 -1.21 1.55 0.00 0.00 175.35 176.23 2dc2 s GLU 18 N -1.43 2.64 0.30 4.03 8.01 -1.26 -4.06 118.70 126.94 2dc2 s GLU 18 Ca 0.04 -1.27 0.01 0.00 0.01 0.00 0.00 54.97 53.76 2dc2 s GLU 18 Cb -0.09 -2.38 0.54 0.00 -4.31 0.00 0.00 34.13 27.89 2dc2 s GLU 18 CO 0.02 0.28 1.90 -0.44 0.01 0.00 0.00 175.26 177.03 2dc2 h ASP 19 N 1.55 0.90 1.16 -0.19 5.19 -2.00 -1.62 116.42 121.41 2dc2 h ASP 19 Ca -0.46 0.01 -0.18 0.00 -0.62 0.00 0.00 57.03 55.79 2dc2 h ASP 19 Cb 1.25 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 40.55 2dc2 h ASP 19 CO 0.61 0.56 -0.84 1.12 -3.12 0.00 0.00 179.24 177.56 2dc2 h HIS 20 N 1.02 0.00 -3.88 4.55 2.07 -2.06 -3.46 115.15 113.38 2dc2 h HIS 20 Ca 0.41 0.00 -0.48 0.00 -2.85 0.00 0.00 60.37 57.45 2dc2 h HIS 20 Cb 0.27 0.00 0.07 0.00 2.57 0.00 0.00 27.41 30.31 2dc2 h HIS 20 CO -0.00 0.83 0.24 -1.21 -3.07 0.00 0.00 177.93 174.72 2dc2 s GLU 21 N -2.79 2.78 0.00 5.12 0.41 -0.61 -5.11 118.70 118.50 2dc2 s GLU 21 Ca 0.02 0.07 0.00 0.00 -0.41 0.00 0.00 54.97 54.65 2dc2 s GLU 21 Cb 0.09 -2.19 0.00 0.00 -1.78 0.00 0.00 34.13 30.25 2dc2 s GLU 21 CO 0.80 -0.87 0.00 0.41 -0.49 0.00 0.00 175.26 175.10 2dc2 n GLY 22 N -2.74 3.36 0.27 -1.39 0.00 -1.26 -4.52 105.19 98.90 2dc2 n GLY 22 Ca 0.06 -2.17 -0.13 0.00 0.00 0.00 0.00 46.02 43.77 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 -0.52 0.00 0.99 5.85 -1.99 -3.46 115.31 116.19 2dc2 h LEU 23 Ca 0.00 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.63 2dc2 h LEU 23 Cb 0.00 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.16 2dc2 h LEU 23 CO 0.00 -0.12 0.00 0.61 -0.34 0.00 0.00 178.44 178.59 2dc2 n GLY 24 N -0.23 0.74 3.14 3.75 0.00 -1.26 -4.57 105.19 106.77 2dc2 n GLY 24 Ca -0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.35 0.12 -0.07 -0.61 -4.36 -1.26 0.22 121.20 112.89 2dc2 s ILE 25 Ca 0.00 -1.02 0.03 0.00 -0.26 0.00 0.00 60.65 59.40 2dc2 s ILE 25 Cb 0.00 -0.92 -0.02 0.00 1.25 0.00 0.00 42.46 42.77 2dc2 s ILE 25 CO 0.00 -0.56 -0.13 -0.44 0.24 0.00 0.00 174.94 174.05 2dc2 s SER 26 N -2.13 4.11 0.19 4.36 0.01 0.12 -4.92 113.70 115.44 2dc2 s SER 26 Ca -0.05 -0.20 0.10 0.00 1.31 0.00 0.00 55.95 57.11 2dc2 s SER 26 Cb -0.01 -1.03 -0.04 0.00 0.21 0.00 0.00 66.02 65.15 2dc2 s SER 26 CO -0.04 0.31 -0.13 0.27 0.41 0.00 0.00 173.24 174.06 2dc2 s ILE 27 N -0.54 2.97 0.13 1.44 -4.36 -1.26 -2.20 121.20 117.38 2dc2 s ILE 27 Ca 0.08 -1.78 0.00 0.00 -0.26 0.00 0.00 60.65 58.69 2dc2 s ILE 27 Cb -0.12 -2.47 -0.04 0.00 1.25 0.00 0.00 42.46 41.08 2dc2 s ILE 27 CO 0.02 -0.13 0.01 0.42 0.24 0.00 0.00 174.94 175.49 2dc2 s THR 28 N -1.74 0.40 0.00 8.37 -4.23 0.11 -4.88 115.64 113.67 2dc2 s THR 28 Ca 0.24 -1.92 0.00 0.00 -1.18 0.00 0.00 61.69 58.83 2dc2 s THR 28 Cb -0.08 -1.93 0.00 0.00 1.34 0.00 0.00 72.50 71.83 2dc2 s THR 28 CO 0.14 -0.62 0.00 0.61 -0.54 0.00 0.00 174.62 174.21 2dc2 n GLY 29 N -0.10 -0.14 0.00 3.99 0.00 -1.26 -1.66 105.19 106.02 2dc2 n GLY 29 Ca -0.08 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.15 2dc2 n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dc2 n GLY 30 N 0.00 3.18 0.38 -0.02 0.00 -1.13 -4.85 105.19 102.75 2dc2 n GLY 30 Ca 0.00 -0.06 0.18 0.00 0.00 0.00 0.00 46.02 46.14 2dc2 n GLY 30 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2dc2 h LYS 31 N 0.00 0.15 -0.37 1.61 3.11 -1.46 -0.10 116.57 119.51 2dc2 h LYS 31 Ca 0.00 -0.01 0.08 0.00 -2.81 0.00 0.00 60.65 57.91 2dc2 h LYS 31 Cb 0.00 -0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.18 2dc2 h LYS 31 CO 0.00 0.10 0.25 1.05 -2.81 0.00 0.00 179.45 178.04 2dc2 h GLU 32 N 0.15 0.14 0.00 1.90 4.11 -1.86 -0.07 114.58 118.95 2dc2 h GLU 32 Ca 0.29 -0.01 -0.03 0.00 0.07 0.00 0.00 59.36 59.68 2dc2 h GLU 32 Cb 0.94 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 2dc2 h GLU 32 CO -0.04 0.09 -0.57 0.45 0.07 0.00 0.00 179.01 179.01 2dc2 h HIS 33 N 0.15 0.00 0.00 2.06 3.86 -1.39 -3.48 115.15 116.35 2dc2 h HIS 33 Ca 0.17 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.38 2dc2 h HIS 33 Cb 0.48 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.95 2dc2 h HIS 33 CO -0.00 0.14 0.00 0.41 0.86 0.00 0.00 177.93 179.34 2dc2 n GLY 34 N 1.18 1.73 3.14 2.45 0.00 -0.04 -5.09 105.19 108.55 2dc2 n GLY 34 Ca 0.01 0.00 -0.13 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 -0.00 0.84 1.61 -7.23 -1.19 -5.00 120.40 107.43 2dc2 s VAL 35 Ca 0.00 0.00 -0.12 0.00 -1.81 0.00 0.00 61.98 60.05 2dc2 s VAL 35 Cb 0.00 -0.36 0.10 0.00 0.56 0.00 0.00 36.38 36.68 2dc2 s VAL 35 CO 0.00 0.00 1.18 -2.84 -0.31 0.00 0.00 175.10 173.13 2dc2 s PRO 36 N 0.17 1.47 -0.11 4.82 0.02 -1.26 -1.49 135.00 138.62 2dc2 s PRO 36 Ca -0.00 1.67 -0.27 0.00 0.02 0.00 0.00 61.00 62.42 2dc2 s PRO 36 Cb -0.02 -1.77 -0.02 0.00 0.02 0.00 0.00 34.50 32.71 2dc2 s PRO 36 CO 0.00 -2.32 0.89 0.42 -0.33 0.00 0.00 177.00 175.65 2dc2 s ILE 37 N -2.34 4.87 0.28 2.83 1.09 -1.26 -4.18 121.20 122.50 2dc2 s ILE 37 Ca 0.71 1.80 0.09 0.00 -1.10 0.00 0.00 60.65 62.14 2dc2 s ILE 37 Cb -0.26 -4.20 -0.06 0.00 -1.06 0.00 0.00 42.46 36.88 2dc2 s ILE 37 CO 0.53 0.07 -0.13 -0.76 -0.10 0.00 0.00 174.94 174.55 2dc2 s LEU 38 N 1.74 2.60 -0.20 2.97 1.02 -0.66 -0.70 118.68 125.45 2dc2 s LEU 38 Ca 0.43 -1.11 -0.16 0.00 0.02 0.00 0.00 54.13 53.31 2dc2 s LEU 38 Cb -0.18 -0.89 -0.04 0.00 0.02 0.00 0.00 46.19 45.11 2dc2 s LEU 38 CO 0.17 -0.16 0.39 -0.63 0.02 0.00 0.00 176.35 176.15 2dc2 s ILE 39 N -2.74 5.20 -0.12 -0.59 1.01 0.13 0.05 121.20 124.14 2dc2 s ILE 39 Ca 0.29 0.70 0.06 0.00 0.00 0.00 0.00 60.65 61.70 2dc2 s ILE 39 Cb -0.00 -3.73 -0.11 0.00 0.01 0.00 0.00 42.46 38.63 2dc2 s ILE 39 CO 0.13 0.26 -0.04 -1.20 0.00 0.00 0.00 174.94 174.10 2dc2 n SER 40 N 4.40 2.66 -4.30 3.58 7.64 -0.93 0.10 113.62 126.76 2dc2 n SER 40 Ca -0.08 -0.03 -0.27 0.00 1.01 0.00 0.00 58.87 59.49 2dc2 n SER 40 Cb 0.51 0.31 -0.14 0.00 -1.01 0.00 0.00 64.21 63.89 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 1.41 -0.17 1.43 2.12 -1.15 -4.71 118.70 115.38 2dc2 s GLU 41 Ca -0.11 -1.09 -0.02 0.00 0.36 0.00 0.00 54.97 54.10 2dc2 s GLU 41 Cb 0.04 -1.64 0.05 0.00 0.26 0.00 0.00 34.13 32.84 2dc2 s GLU 41 CO 0.38 0.41 0.02 0.42 -0.54 0.00 0.00 175.26 175.94 2dc2 s ILE 42 N -0.93 0.55 0.09 -3.70 1.09 -1.26 0.11 121.20 117.15 2dc2 s ILE 42 Ca 0.09 -0.45 -0.31 0.00 -1.10 0.00 0.00 60.65 58.89 2dc2 s ILE 42 Cb -0.10 -0.97 -0.07 0.00 -1.06 0.00 0.00 42.46 40.27 2dc2 s ILE 42 CO 0.03 -0.10 1.30 -1.00 -0.10 0.00 0.00 174.94 175.07 2dc2 s HIS 43 N 1.86 3.33 0.61 3.97 3.76 0.13 -4.97 115.29 123.98 2dc2 s HIS 43 Ca 0.00 1.12 -0.15 0.00 -0.15 0.00 0.00 55.06 55.88 2dc2 s HIS 43 Cb -0.16 -3.55 -0.03 0.00 1.11 0.00 0.00 32.58 29.95 2dc2 s HIS 43 CO -0.07 -1.85 1.06 -1.25 -0.85 0.00 0.00 174.74 171.78 2dc2 s PRO 44 N 1.11 3.24 -0.36 8.40 0.04 -1.26 -4.08 135.00 142.09 2dc2 s PRO 44 Ca 0.62 1.15 -0.01 0.00 0.04 0.00 0.00 61.00 62.81 2dc2 s PRO 44 Cb -0.33 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.19 2dc2 s PRO 44 CO 0.30 -0.87 0.09 0.41 0.04 0.00 0.00 177.00 176.97 2dc2 n GLY 45 N -1.18 0.33 3.31 0.56 0.00 -1.26 -5.04 105.19 101.91 2dc2 n GLY 45 Ca 0.08 -0.62 -0.18 0.00 0.00 0.00 0.00 46.02 45.30 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 -4.58 1.56 0.49 1.61 -0.21 -1.26 -5.03 119.66 112.25 2dc2 s GLN 46 Ca 0.04 -1.89 0.27 0.00 0.02 0.00 0.00 55.36 53.81 2dc2 s GLN 46 Cb -0.02 0.01 1.34 0.00 1.00 0.00 0.00 33.01 35.34 2dc2 s GLN 46 CO 0.05 -0.47 1.85 -1.35 -2.12 0.00 0.00 175.29 173.26 2dc2 h PRO 47 N 2.26 0.15 -0.37 2.91 0.11 -1.84 -0.60 132.00 134.62 2dc2 h PRO 47 Ca -0.33 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.77 2dc2 h PRO 47 Cb 1.25 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2dc2 h PRO 47 CO 0.50 0.10 0.22 0.00 -0.21 0.00 0.00 178.00 178.61 2dc2 h ALA 48 N 1.56 0.48 -0.25 -0.75 0.00 -1.88 -1.34 119.26 117.08 2dc2 h ALA 48 Ca 0.48 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.24 2dc2 h ALA 48 Cb 1.62 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 2dc2 h ALA 48 CO -0.09 -0.02 -0.22 0.22 0.00 0.00 0.00 179.25 179.14 2dc2 h ASP 49 N 0.49 0.63 -0.38 0.00 1.82 -1.39 -2.76 116.42 114.83 2dc2 h ASP 49 Ca 0.13 -0.46 0.04 0.00 -0.39 0.00 0.00 57.03 56.35 2dc2 h ASP 49 Cb 0.01 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 39.83 2dc2 h ASP 49 CO -0.02 0.96 0.25 0.03 -1.61 0.00 0.00 179.24 178.85 2dc2 h ARG 50 N 0.30 0.34 0.00 0.28 2.47 -1.27 -1.38 114.38 115.12 2dc2 h ARG 50 Ca 0.04 -0.02 -0.14 0.00 -1.26 0.00 0.00 59.98 58.60 2dc2 h ARG 50 Cb 0.77 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.99 2dc2 h ARG 50 CO 0.06 0.22 -0.68 0.00 0.56 0.00 0.00 179.97 180.13 2dc2 n GLY 52 N 0.90 1.14 0.02 0.00 0.00 -0.52 -4.83 105.19 101.90 2dc2 n GLY 52 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.13 -0.21 3.55 -0.02 0.00 -1.25 -4.94 105.19 101.19 2dc2 n GLY 53 Ca -0.10 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 -4.31 3.24 0.23 0.99 2.01 -1.25 -4.94 118.68 114.65 2dc2 s LEU 54 Ca -0.02 0.41 0.10 0.00 0.01 0.00 0.00 54.13 54.63 2dc2 s LEU 54 Cb 0.01 -2.53 -0.04 0.00 0.01 0.00 0.00 46.19 43.64 2dc2 s LEU 54 CO 0.17 -2.87 -0.11 -1.38 1.01 0.00 0.00 176.35 173.18 2dc2 s HIS 55 N 11.34 2.54 0.17 0.29 -3.43 -1.26 -4.89 115.29 120.05 2dc2 s HIS 55 Ca 0.83 -0.26 -0.31 0.00 -0.80 0.00 0.00 55.06 54.52 2dc2 s HIS 55 Cb -0.13 -1.18 -0.09 0.00 -1.43 0.00 0.00 32.58 29.74 2dc2 s HIS 55 CO 0.17 0.59 1.47 0.08 -2.00 0.00 0.00 174.74 175.05 2dc2 s VAL 56 N -2.05 2.88 0.00 -5.38 1.01 -1.26 -3.73 120.40 111.87 2dc2 s VAL 56 Ca 0.27 0.66 0.00 0.00 0.00 0.00 0.00 61.98 62.91 2dc2 s VAL 56 Cb -0.07 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.89 2dc2 s VAL 56 CO 0.16 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.94 2dc2 n GLY 57 N 3.24 0.81 3.29 4.51 0.00 0.11 -4.95 105.19 112.20 2dc2 n GLY 57 Ca 0.11 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.05 4.29 -0.22 1.61 -1.08 -1.17 -2.40 116.67 115.66 2dc2 s ASP 58 Ca 0.00 -0.47 -0.18 0.00 -0.52 0.00 0.00 52.55 51.38 2dc2 s ASP 58 Cb 0.00 -1.73 -0.03 0.00 -1.46 0.00 0.00 42.92 39.70 2dc2 s ASP 58 CO 0.00 -0.04 0.51 0.00 0.52 0.00 0.00 175.17 176.16 2dc2 s ALA 59 N 1.46 3.56 0.24 3.66 0.00 -1.11 0.17 121.76 129.74 2dc2 s ALA 59 Ca 0.05 -0.47 -0.30 0.00 0.00 0.00 0.00 51.96 51.25 2dc2 s ALA 59 Cb -0.15 -2.82 -0.09 0.00 0.00 0.00 0.00 23.12 20.06 2dc2 s ALA 59 CO -0.04 -0.52 1.17 0.42 0.00 0.00 0.00 175.76 176.80 2dc2 s ILE 60 N 1.81 3.42 0.04 0.00 1.01 0.13 -2.29 121.20 125.32 2dc2 s ILE 60 Ca 0.23 1.31 0.00 0.00 0.00 0.00 0.00 60.65 62.19 2dc2 s ILE 60 Cb -0.15 -3.84 0.00 0.00 0.01 0.00 0.00 42.46 38.48 2dc2 s ILE 60 CO 0.09 0.26 0.00 0.18 0.00 0.00 0.00 174.94 175.48 2dc2 n LEU 61 N 1.77 0.21 -4.00 2.97 4.77 -0.03 -4.60 117.00 118.09 2dc2 n LEU 61 Ca 0.02 0.07 -0.14 0.00 -0.03 0.00 0.00 56.01 55.92 2dc2 n LEU 61 Cb 0.44 -0.04 -0.13 0.00 -2.33 0.00 0.00 43.42 41.37 2dc2 n LEU 61 CO 0.55 -0.31 -0.40 0.00 -1.33 0.00 0.00 177.39 175.91 2dc2 s ALA 62 N -2.00 0.45 -0.14 -1.18 0.00 -1.14 -0.14 121.76 117.60 2dc2 s ALA 62 Ca 0.00 -0.50 -0.01 0.00 0.00 0.00 0.00 51.96 51.45 2dc2 s ALA 62 Cb 0.00 -0.01 0.04 0.00 0.00 0.00 0.00 23.12 23.15 2dc2 s ALA 62 CO 0.00 0.02 -0.04 0.08 0.00 0.00 0.00 175.76 175.82 2dc2 s VAL 63 N -0.82 0.89 -1.56 0.00 1.01 0.11 -1.29 120.40 118.74 2dc2 s VAL 63 Ca -0.05 -0.44 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 2dc2 s VAL 63 Cb -0.06 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.24 2dc2 s VAL 63 CO 0.00 0.15 0.53 -3.20 0.00 0.00 0.00 175.10 172.58 2dc2 n ASN 64 N 4.96 -5.89 0.00 3.32 2.85 0.13 -1.24 115.26 119.40 2dc2 n ASN 64 Ca -0.11 -0.26 0.00 0.00 -0.11 0.00 0.00 54.58 54.10 2dc2 n ASN 64 Cb 0.48 -4.78 0.00 0.00 1.24 0.00 0.00 39.78 36.72 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 -1.44 2.65 3.76 8.20 0.00 -1.26 -4.95 105.19 112.15 2dc2 n GLY 65 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.11 4.89 0.12 1.61 1.01 -0.37 -5.04 120.40 120.52 2dc2 s VAL 66 Ca 0.00 1.31 -0.31 0.00 0.00 0.00 0.00 61.98 62.98 2dc2 s VAL 66 Cb 0.00 -3.96 -0.07 0.00 0.00 0.00 0.00 36.38 32.34 2dc2 s VAL 66 CO 0.00 0.40 1.29 0.21 0.00 0.00 0.00 175.10 177.00 2dc2 s ASN 67 N -0.11 6.95 0.00 3.32 3.84 -1.26 0.03 114.94 127.71 2dc2 s ASN 67 Ca 0.32 2.23 0.03 0.00 0.21 0.00 0.00 52.86 55.65 2dc2 s ASN 67 Cb -0.18 -2.59 0.03 0.00 -0.55 0.00 0.00 41.25 37.96 2dc2 s ASN 67 CO 0.18 -0.53 0.67 -0.11 -2.79 0.00 0.00 177.10 174.52 2dc2 n LEU 68 N 3.49 1.41 0.17 3.21 7.94 0.80 -4.65 117.00 129.38 2dc2 n LEU 68 Ca 0.09 -1.16 0.03 0.00 -1.11 0.00 0.00 56.01 53.86 2dc2 n LEU 68 Cb 0.44 -0.01 0.29 0.00 0.53 0.00 0.00 43.42 44.67 2dc2 n LEU 68 CO 0.57 0.33 0.62 0.08 -1.11 0.00 0.00 177.39 177.88 2dc2 h ARG 69 N 0.58 0.00 -0.60 1.96 0.11 -1.77 -3.05 114.38 111.62 2dc2 h ARG 69 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2dc2 h ARG 69 Cb 0.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.27 2dc2 h ARG 69 CO 0.00 0.46 0.00 -3.47 0.10 0.00 0.00 179.97 177.06 2dc2 n ASP 70 N -3.72 3.67 -4.76 0.08 -0.08 -1.26 -4.92 116.55 105.56 2dc2 n ASP 70 Ca -0.01 -1.99 -0.32 0.00 -1.51 0.00 0.00 54.79 50.96 2dc2 n ASP 70 Cb 0.53 -0.39 -0.07 0.00 2.34 0.00 0.00 41.12 43.52 2dc2 n ASP 70 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 2dc2 s THR 71 N -1.21 4.57 0.77 5.18 -4.23 -1.15 -5.09 115.64 114.47 2dc2 s THR 71 Ca 0.45 -0.54 -0.11 0.00 -1.18 0.00 0.00 61.69 60.31 2dc2 s THR 71 Cb 0.24 -3.11 0.05 0.00 1.34 0.00 0.00 72.50 71.02 2dc2 s THR 71 CO 0.32 0.29 1.08 -0.54 -0.54 0.00 0.00 174.62 175.24 2dc2 s LYS 72 N -1.88 2.30 0.14 3.99 -0.14 -1.26 -4.35 119.74 118.53 2dc2 s LYS 72 Ca 0.24 1.00 -0.19 0.00 -1.36 0.00 0.00 55.97 55.66 2dc2 s LYS 72 Cb -0.12 -1.91 0.02 0.00 -1.68 0.00 0.00 37.83 34.14 2dc2 s LYS 72 CO 0.15 -1.57 1.68 1.25 -0.76 0.00 0.00 175.35 176.11 2dc2 h HIS 73 N -1.07 -0.23 -0.71 3.18 2.76 -1.89 0.49 115.15 117.69 2dc2 h HIS 73 Ca -0.45 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 57.76 2dc2 h HIS 73 Cb 1.24 0.14 -0.04 0.00 1.55 0.00 0.00 27.41 30.30 2dc2 h HIS 73 CO 0.56 -0.16 0.47 0.87 -1.30 0.00 0.00 177.93 178.37 2dc2 h LYS 74 N -0.05 0.92 -0.42 5.26 1.79 -1.95 -1.90 116.57 120.22 2dc2 h LYS 74 Ca 0.13 -0.06 -0.11 0.00 -2.18 0.00 0.00 60.65 58.44 2dc2 h LYS 74 Cb 0.25 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 2dc2 h LYS 74 CO -0.30 0.61 -0.17 0.93 -1.08 0.00 0.00 179.45 179.44 2dc2 h GLU 75 N 0.95 0.80 -0.10 3.15 5.08 -1.73 -2.83 114.58 119.89 2dc2 h GLU 75 Ca 0.27 -0.30 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 2dc2 h GLU 75 Cb -0.08 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 2dc2 h GLU 75 CO -0.07 0.91 -0.13 0.00 -1.00 0.00 0.00 179.01 178.72 2dc2 h ALA 76 N 1.10 1.59 -0.82 3.43 0.00 0.51 -2.48 119.26 122.59 2dc2 h ALA 76 Ca 0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2dc2 h ALA 76 Cb 0.67 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 2dc2 h ALA 76 CO 0.05 0.30 0.43 0.28 0.00 0.00 0.00 179.25 180.31 2dc2 h VAL 77 N 0.15 1.25 -0.61 0.00 2.07 -1.10 -2.07 116.25 115.94 2dc2 h VAL 77 Ca 0.03 -0.64 -0.09 0.00 0.82 0.00 0.00 66.70 66.83 2dc2 h VAL 77 Cb 0.34 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 2dc2 h VAL 77 CO 0.02 0.28 0.05 0.74 0.02 0.00 0.00 177.57 178.68 2dc2 h THR 78 N 1.15 1.26 -0.69 2.57 2.02 -1.47 -2.63 112.91 115.12 2dc2 h THR 78 Ca 0.29 -1.08 0.04 0.00 0.77 0.00 0.00 66.41 66.42 2dc2 h THR 78 Cb 0.06 0.76 -0.05 0.00 -1.74 0.00 0.00 68.15 67.18 2dc2 h THR 78 CO -0.04 0.40 0.42 0.40 0.37 0.00 0.00 175.52 177.06 2dc2 h ILE 79 N 0.95 1.06 -0.59 3.11 1.08 -1.16 -0.47 117.51 121.49 2dc2 h ILE 79 Ca 0.18 -0.28 -0.00 0.00 -0.39 0.00 0.00 64.86 64.37 2dc2 h ILE 79 Cb 0.50 0.18 -0.03 0.00 -3.07 0.00 0.00 36.82 34.40 2dc2 h ILE 79 CO 0.02 0.15 0.37 -0.07 -0.69 0.00 0.00 178.15 177.93 2dc2 h LEU 80 N 0.81 0.70 -1.30 1.44 3.38 -1.19 -2.12 115.31 117.03 2dc2 h LEU 80 Ca 0.28 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 2dc2 h LEU 80 Cb 0.07 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2dc2 h LEU 80 CO -0.13 0.54 -0.24 -1.28 0.09 0.00 0.00 178.44 177.42 2dc2 h SER 81 N 0.80 0.16 0.30 -0.43 0.87 -1.04 -2.45 113.55 111.77 2dc2 h SER 81 Ca 0.21 -0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.69 2dc2 h SER 81 Cb -0.05 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2dc2 h SER 81 CO -0.04 0.42 -0.21 1.56 -0.53 0.00 0.00 176.83 178.02 2dc2 h GLN 82 N 0.16 0.00 -6.78 2.24 1.08 -0.42 -3.43 115.11 107.95 2dc2 h GLN 82 Ca 0.03 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.70 2dc2 h GLN 82 Cb 0.52 0.00 0.07 0.00 -0.05 0.00 0.00 27.48 28.02 2dc2 h GLN 82 CO 0.04 0.21 0.83 -0.65 -0.95 0.00 0.00 178.83 178.31 2dc2 s GLN 83 N -4.37 4.19 0.02 1.46 -1.52 -0.93 -5.02 119.66 113.49 2dc2 s GLN 83 Ca -0.03 2.46 0.03 0.00 -1.95 0.00 0.00 55.36 55.86 2dc2 s GLN 83 Cb 0.14 -3.06 -0.01 0.00 -0.22 0.00 0.00 33.01 29.86 2dc2 s GLN 83 CO 0.67 -0.54 -0.09 -0.98 -0.25 0.00 0.00 175.29 174.11 2dc2 s ARG 84 N -0.49 0.62 3.94 2.91 1.04 -1.26 -5.04 118.95 120.67 2dc2 s ARG 84 Ca 0.61 -0.50 0.00 0.00 -1.04 0.00 0.00 55.73 54.80 2dc2 s ARG 84 Cb -0.45 -0.54 0.00 0.00 -2.04 0.00 0.00 34.95 31.92 2dc2 s ARG 84 CO 0.46 0.13 0.00 0.41 -0.04 0.00 0.00 175.30 176.27 2dc2 n GLY 85 N 2.26 0.84 3.64 3.88 0.00 -1.26 -4.43 105.19 110.12 2dc2 n GLY 85 Ca -0.17 0.58 -0.43 0.00 0.00 0.00 0.00 46.02 46.00 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 4.12 -0.15 1.61 2.12 -1.26 -3.64 118.70 121.49 2dc2 s GLU 86 Ca 0.00 1.03 0.02 0.00 0.36 0.00 0.00 54.97 56.37 2dc2 s GLU 86 Cb 0.00 -3.69 0.01 0.00 0.26 0.00 0.00 34.13 30.71 2dc2 s GLU 86 CO 0.00 -0.71 -0.20 0.42 -0.54 0.00 0.00 175.26 174.23 2dc2 s ILE 87 N 3.24 2.17 -0.25 -3.70 1.01 -1.01 -5.02 121.20 117.64 2dc2 s ILE 87 Ca 0.40 -0.93 -0.17 0.00 0.00 0.00 0.00 60.65 59.96 2dc2 s ILE 87 Cb -0.14 -1.89 -0.03 0.00 0.01 0.00 0.00 42.46 40.41 2dc2 s ILE 87 CO 0.11 0.54 0.45 -1.61 0.00 0.00 0.00 174.94 174.43 2dc2 s GLU 88 N 0.94 4.08 -0.14 2.79 2.02 -1.26 0.24 118.70 127.38 2dc2 s GLU 88 Ca -0.04 0.23 -0.01 0.00 0.02 0.00 0.00 54.97 55.17 2dc2 s GLU 88 Cb -0.15 -3.62 -0.02 0.00 0.10 0.00 0.00 34.13 30.44 2dc2 s GLU 88 CO -0.04 -0.25 -0.11 -0.06 0.02 0.00 0.00 175.26 174.81 2dc2 s PHE 89 N 1.99 2.86 -0.21 1.61 0.40 -0.10 0.21 117.98 124.74 2dc2 s PHE 89 Ca 0.19 -0.59 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 2dc2 s PHE 89 Cb -0.15 -1.87 0.04 0.00 0.51 0.00 0.00 43.02 41.54 2dc2 s PHE 89 CO 0.09 -0.19 -0.13 -1.21 0.70 0.00 0.00 175.22 174.48 2dc2 s GLU 90 N 0.39 2.36 0.22 0.44 0.41 -0.41 -1.70 118.70 120.40 2dc2 s GLU 90 Ca -0.09 -0.96 -0.00 0.00 -0.41 0.00 0.00 54.97 53.51 2dc2 s GLU 90 Cb -0.16 -2.57 -0.04 0.00 -1.78 0.00 0.00 34.13 29.59 2dc2 s GLU 90 CO 0.05 -0.39 0.14 0.14 -0.49 0.00 0.00 175.26 174.70 2dc2 s VAL 91 N 1.29 0.08 -0.04 2.63 -7.23 -0.84 -0.85 120.40 115.44 2dc2 s VAL 91 Ca -0.01 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.18 2dc2 s VAL 91 Cb -0.16 -2.52 0.01 0.00 0.56 0.00 0.00 36.38 34.27 2dc2 s VAL 91 CO -0.09 0.00 -0.10 0.68 -0.31 0.00 0.00 175.10 175.29 2dc2 s VAL 92 N -4.05 0.87 -0.21 1.32 -7.23 -0.97 0.32 120.40 110.46 2dc2 s VAL 92 Ca 0.39 -0.38 -0.29 0.00 -1.81 0.00 0.00 61.98 59.89 2dc2 s VAL 92 Cb 0.07 -0.79 -0.03 0.00 0.56 0.00 0.00 36.38 36.19 2dc2 s VAL 92 CO 0.13 0.28 1.56 -0.47 -0.31 0.00 0.00 175.10 176.29 2dc2 s TYR 93 N 0.40 2.21 -0.12 2.82 6.14 -0.54 -2.74 117.35 125.51 2dc2 s TYR 93 Ca -0.07 0.57 0.01 0.00 0.64 0.00 0.00 57.07 58.22 2dc2 s TYR 93 Cb -0.11 -3.93 0.02 0.00 0.42 0.00 0.00 41.96 38.35 2dc2 s TYR 93 CO 0.01 -2.82 -0.12 0.54 0.64 0.00 0.00 175.55 173.80 2dc2 s VAL 94 N 4.86 1.35 -2.39 3.14 0.11 -1.01 -3.69 120.40 122.78 2dc2 s VAL 94 Ca 0.69 -0.52 0.29 0.00 -2.93 0.00 0.00 61.98 59.50 2dc2 s VAL 94 Cb -0.25 -1.28 0.63 0.00 -1.53 0.00 0.00 36.38 33.95 2dc2 s VAL 94 CO 0.27 0.42 1.85 0.00 -3.33 0.00 0.00 175.10 174.31