#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 5.23 -0.13 0.52 1.01 -1.26 -3.90 121.20 122.67 2dc2 s ILE 10 Ca 0.00 0.51 0.02 0.00 0.00 0.00 0.00 60.65 61.18 2dc2 s ILE 10 Cb 0.00 -3.58 0.01 0.00 0.01 0.00 0.00 42.46 38.90 2dc2 s ILE 10 CO 0.00 0.54 -0.19 -0.60 0.00 0.00 0.00 174.94 174.70 2dc2 s ARG 11 N -1.22 2.63 -0.40 2.79 3.52 -0.44 -5.03 118.95 120.81 2dc2 s ARG 11 Ca 0.22 -0.71 -0.17 0.00 -0.13 0.00 0.00 55.73 54.94 2dc2 s ARG 11 Cb -0.14 -2.18 0.01 0.00 -1.56 0.00 0.00 34.95 31.08 2dc2 s ARG 11 CO 0.11 -0.05 0.42 0.15 -0.81 0.00 0.00 175.30 175.12 2dc2 s LYS 12 N 0.93 3.23 -0.02 5.12 3.01 -1.26 -2.87 119.74 127.88 2dc2 s LYS 12 Ca -0.06 -0.66 0.03 0.00 -1.01 0.00 0.00 55.97 54.27 2dc2 s LYS 12 Cb -0.15 -3.92 -0.00 0.00 -1.01 0.00 0.00 37.83 32.75 2dc2 s LYS 12 CO -0.02 -0.76 -0.10 0.08 0.51 0.00 0.00 175.35 175.06 2dc2 s VAL 13 N 2.11 0.81 -0.05 3.17 1.01 -0.66 -5.04 120.40 121.75 2dc2 s VAL 13 Ca 0.12 -0.41 -0.08 0.00 0.00 0.00 0.00 61.98 61.61 2dc2 s VAL 13 Cb -0.17 -0.70 -0.05 0.00 0.00 0.00 0.00 36.38 35.47 2dc2 s VAL 13 CO 0.13 0.24 0.23 -1.48 0.00 0.00 0.00 175.10 174.23 2dc2 s LEU 14 N -0.04 4.40 -0.02 3.92 2.34 -1.26 -1.07 118.68 126.94 2dc2 s LEU 14 Ca 0.01 0.59 0.07 0.00 0.06 0.00 0.00 54.13 54.86 2dc2 s LEU 14 Cb -0.06 -2.38 -0.02 0.00 -0.56 0.00 0.00 46.19 43.17 2dc2 s LEU 14 CO 0.00 0.34 -0.24 -0.22 -1.06 0.00 0.00 176.35 175.17 2dc2 s LEU 15 N -1.30 2.05 -0.19 1.48 2.96 0.85 -4.93 118.68 119.60 2dc2 s LEU 15 Ca 0.21 -0.44 -0.05 0.00 -0.22 0.00 0.00 54.13 53.63 2dc2 s LEU 15 Cb -0.13 -1.24 -0.03 0.00 0.50 0.00 0.00 46.19 45.28 2dc2 s LEU 15 CO 0.10 0.29 0.00 -0.22 -1.32 0.00 0.00 176.35 175.21 2dc2 s LEU 16 N -0.53 3.37 -0.15 -0.68 0.20 -1.26 -2.02 118.68 117.62 2dc2 s LEU 16 Ca 0.08 -0.12 0.00 0.00 0.69 0.00 0.00 54.13 54.78 2dc2 s LEU 16 Cb -0.10 -1.84 -0.00 0.00 -0.43 0.00 0.00 46.19 43.82 2dc2 s LEU 16 CO -0.01 0.11 -0.15 -0.75 -0.29 0.00 0.00 176.35 175.26 2dc2 s LYS 17 N 0.71 3.23 0.18 1.98 2.20 -1.24 -4.85 119.74 121.95 2dc2 s LYS 17 Ca 0.00 -0.75 0.06 0.00 -0.36 0.00 0.00 55.97 54.93 2dc2 s LYS 17 Cb -0.14 -2.60 -0.04 0.00 -1.51 0.00 0.00 37.83 33.54 2dc2 s LYS 17 CO 0.02 0.06 0.07 -1.21 -0.36 0.00 0.00 175.35 173.94 2dc2 s GLU 18 N 0.70 2.65 0.29 4.03 2.02 -1.26 -4.21 118.70 122.92 2dc2 s GLU 18 Ca -0.07 -1.03 0.00 0.00 0.02 0.00 0.00 54.97 53.89 2dc2 s GLU 18 Cb -0.16 -2.48 0.50 0.00 0.10 0.00 0.00 34.13 32.10 2dc2 s GLU 18 CO 0.02 0.46 1.90 -0.44 0.02 0.00 0.00 175.26 177.21 2dc2 h ASP 19 N 2.42 0.94 1.17 -0.19 3.32 -2.00 -1.67 116.42 120.40 2dc2 h ASP 19 Ca -0.47 0.01 -0.15 0.00 0.02 0.00 0.00 57.03 56.43 2dc2 h ASP 19 Cb 1.21 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 2dc2 h ASP 19 CO 0.61 0.60 -0.73 1.12 -1.72 0.00 0.00 179.24 179.11 2dc2 h HIS 20 N 1.06 0.00 -5.62 4.55 2.07 -2.05 -3.46 115.15 111.70 2dc2 h HIS 20 Ca 0.40 0.00 -0.41 0.00 -2.85 0.00 0.00 60.37 57.52 2dc2 h HIS 20 Cb 0.20 0.00 0.05 0.00 2.57 0.00 0.00 27.41 30.23 2dc2 h HIS 20 CO -0.00 0.73 0.04 0.39 -3.07 0.00 0.00 177.93 176.02 2dc2 n GLU 21 N -3.34 0.25 0.00 5.12 1.02 -0.63 -5.14 120.64 117.93 2dc2 n GLU 21 Ca 0.01 -2.48 0.00 0.00 -0.02 0.00 0.00 57.16 54.67 2dc2 n GLU 21 Cb 0.81 -0.43 0.00 0.00 -0.02 0.00 0.00 31.44 31.80 2dc2 n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dc2 n GLY 22 N -1.40 5.42 0.24 0.62 0.00 -1.26 -4.50 105.19 104.32 2dc2 n GLY 22 Ca 0.14 -1.20 -0.12 0.00 0.00 0.00 0.00 46.02 44.84 2dc2 n GLY 22 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dc2 h LEU 23 N 0.00 -0.45 0.00 0.99 -0.00 -1.96 -3.44 115.31 110.45 2dc2 h LEU 23 Ca 0.00 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.76 2dc2 h LEU 23 Cb 0.00 0.12 0.00 0.00 -0.00 0.00 0.00 40.66 40.78 2dc2 h LEU 23 CO 0.00 -0.03 0.00 0.61 -0.00 0.00 0.00 178.44 179.02 2dc2 n GLY 24 N -0.06 1.65 3.03 0.83 0.00 -1.26 -4.46 105.19 104.92 2dc2 n GLY 24 Ca -0.09 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.43 0.15 -0.13 -0.61 -5.25 -1.26 -1.14 121.20 110.53 2dc2 s ILE 25 Ca 0.00 -1.27 -0.05 0.00 -0.99 0.00 0.00 60.65 58.34 2dc2 s ILE 25 Cb 0.00 -0.78 -0.04 0.00 2.95 0.00 0.00 42.46 44.60 2dc2 s ILE 25 CO 0.00 -0.70 0.06 -0.44 -1.79 0.00 0.00 174.94 172.07 2dc2 s SER 26 N -2.05 5.71 0.12 4.36 0.01 -0.23 -4.96 113.70 116.66 2dc2 s SER 26 Ca -0.07 0.22 0.11 0.00 1.31 0.00 0.00 55.95 57.52 2dc2 s SER 26 Cb -0.03 -1.81 -0.04 0.00 0.21 0.00 0.00 66.02 64.35 2dc2 s SER 26 CO -0.05 0.32 -0.26 0.27 0.41 0.00 0.00 173.24 173.93 2dc2 s ILE 27 N -0.53 2.31 0.03 1.44 -4.36 -1.26 -2.01 121.20 116.81 2dc2 s ILE 27 Ca 0.10 -1.72 0.02 0.00 -0.26 0.00 0.00 60.65 58.80 2dc2 s ILE 27 Cb -0.12 -2.02 -0.02 0.00 1.25 0.00 0.00 42.46 41.55 2dc2 s ILE 27 CO 0.02 0.11 -0.07 0.28 0.24 0.00 0.00 174.94 175.51 2dc2 s THR 28 N -1.05 0.52 -5.00 8.37 -1.32 0.31 -4.94 115.64 112.52 2dc2 s THR 28 Ca 0.14 -0.82 0.00 0.00 -1.21 0.00 0.00 61.69 59.80 2dc2 s THR 28 Cb -0.10 -0.54 0.00 0.00 -1.51 0.00 0.00 72.50 70.35 2dc2 s THR 28 CO 0.06 -0.23 0.00 0.61 -2.21 0.00 0.00 174.62 172.86 2dc2 n GLY 29 N 1.91 0.05 0.00 6.08 0.00 -1.26 -0.98 105.19 110.99 2dc2 n GLY 29 Ca -0.20 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 2.29 0.31 -0.02 0.00 -1.09 -4.86 105.19 101.81 2dc2 n GLY 30 Ca 0.00 0.31 0.05 0.00 0.00 0.00 0.00 46.02 46.38 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 0.49 -0.27 1.61 3.11 -1.76 -1.66 116.57 118.09 2dc2 h LYS 31 Ca 0.00 -0.03 0.08 0.00 -2.81 0.00 0.00 60.65 57.89 2dc2 h LYS 31 Cb 0.00 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.11 2dc2 h LYS 31 CO 0.00 0.32 0.20 0.93 -2.81 0.00 0.00 179.45 178.09 2dc2 h GLU 32 N 0.50 0.00 0.00 1.90 5.08 -1.90 -0.64 114.58 119.53 2dc2 h GLU 32 Ca 0.14 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.29 2dc2 h GLU 32 Cb -0.04 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 2dc2 h GLU 32 CO -0.03 0.00 -1.14 0.45 -1.00 0.00 0.00 179.01 177.29 2dc2 h HIS 33 N 0.00 0.00 0.00 4.33 3.86 -1.70 -3.48 115.15 118.17 2dc2 h HIS 33 Ca 0.13 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 2dc2 h HIS 33 Cb 0.52 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.99 2dc2 h HIS 33 CO 0.00 0.91 0.00 0.41 0.86 0.00 0.00 177.93 180.11 2dc2 n GLY 34 N 1.39 1.76 2.98 2.45 0.00 -0.25 -5.12 105.19 108.41 2dc2 n GLY 34 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.04 0.74 1.61 -7.23 -1.20 -5.04 120.40 107.26 2dc2 s VAL 35 Ca 0.00 0.14 -0.15 0.00 -1.81 0.00 0.00 61.98 60.16 2dc2 s VAL 35 Cb 0.00 -0.28 0.05 0.00 0.56 0.00 0.00 36.38 36.71 2dc2 s VAL 35 CO 0.00 0.06 1.23 -2.84 -0.31 0.00 0.00 175.10 173.23 2dc2 s PRO 36 N 0.99 2.02 0.02 4.82 0.02 -1.26 -2.69 135.00 138.92 2dc2 s PRO 36 Ca -0.07 1.83 -0.27 0.00 0.02 0.00 0.00 61.00 62.50 2dc2 s PRO 36 Cb -0.09 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.57 2dc2 s PRO 36 CO -0.05 -1.94 0.87 0.42 -0.33 0.00 0.00 177.00 175.96 2dc2 s ILE 37 N -1.92 4.80 0.18 2.83 1.09 -1.26 -4.52 121.20 122.40 2dc2 s ILE 37 Ca 0.76 1.83 0.07 0.00 -1.10 0.00 0.00 60.65 62.21 2dc2 s ILE 37 Cb -0.31 -4.21 -0.05 0.00 -1.06 0.00 0.00 42.46 36.83 2dc2 s ILE 37 CO 0.46 0.26 -0.14 -1.48 -0.10 0.00 0.00 174.94 173.94 2dc2 s LEU 38 N 0.50 2.53 -0.03 2.97 2.34 -0.16 -1.21 118.68 125.62 2dc2 s LEU 38 Ca 0.45 -0.98 -0.27 0.00 0.06 0.00 0.00 54.13 53.38 2dc2 s LEU 38 Cb -0.21 -0.63 -0.03 0.00 -0.56 0.00 0.00 46.19 44.76 2dc2 s LEU 38 CO 0.25 -0.18 0.85 -0.63 -1.06 0.00 0.00 176.35 175.59 2dc2 s ILE 39 N -2.86 4.95 -0.00 1.48 1.01 0.14 -0.53 121.20 125.39 2dc2 s ILE 39 Ca 0.20 1.78 0.00 0.00 0.00 0.00 0.00 60.65 62.63 2dc2 s ILE 39 Cb -0.01 -4.19 -0.00 0.00 0.01 0.00 0.00 42.46 38.26 2dc2 s ILE 39 CO 0.06 0.20 -0.00 -1.20 0.00 0.00 0.00 174.94 173.99 2dc2 n SER 40 N 3.85 3.59 -4.75 3.58 7.64 -0.85 0.24 113.62 126.92 2dc2 n SER 40 Ca 0.03 -0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.57 2dc2 n SER 40 Cb 0.51 -0.01 -0.08 0.00 -1.01 0.00 0.00 64.21 63.63 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 -2.01 3.00 -0.20 1.43 2.12 -1.13 -4.67 118.70 117.24 2dc2 s GLU 41 Ca -0.01 -0.50 -0.01 0.00 0.36 0.00 0.00 54.97 54.82 2dc2 s GLU 41 Cb 0.00 -2.82 0.05 0.00 0.26 0.00 0.00 34.13 31.63 2dc2 s GLU 41 CO 0.01 0.65 -0.03 0.42 -0.54 0.00 0.00 175.26 175.77 2dc2 s ILE 42 N -1.13 1.11 -0.10 -3.70 -1.09 -1.26 -1.07 121.20 113.97 2dc2 s ILE 42 Ca 0.21 -0.85 -0.25 0.00 -2.23 0.00 0.00 60.65 57.53 2dc2 s ILE 42 Cb -0.12 -1.42 -0.03 0.00 -1.58 0.00 0.00 42.46 39.31 2dc2 s ILE 42 CO 0.11 -0.06 0.79 -1.00 -1.23 0.00 0.00 174.94 173.55 2dc2 s HIS 43 N 1.60 3.53 0.69 3.97 3.76 -0.29 -5.01 115.29 123.54 2dc2 s HIS 43 Ca -0.02 1.31 -0.13 0.00 -0.15 0.00 0.00 55.06 56.07 2dc2 s HIS 43 Cb -0.17 -2.93 0.01 0.00 1.11 0.00 0.00 32.58 30.60 2dc2 s HIS 43 CO -0.07 -0.05 1.08 -1.25 -0.85 0.00 0.00 174.74 173.60 2dc2 s PRO 44 N 1.33 2.76 -0.37 8.40 0.04 -1.26 -4.16 135.00 141.73 2dc2 s PRO 44 Ca 0.40 1.17 -0.02 0.00 0.04 0.00 0.00 61.00 62.59 2dc2 s PRO 44 Cb -0.18 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.41 2dc2 s PRO 44 CO 0.17 -1.26 0.23 0.41 0.04 0.00 0.00 177.00 176.60 2dc2 n GLY 45 N -1.21 0.47 3.34 0.56 0.00 -1.26 -5.06 105.19 102.03 2dc2 n GLY 45 Ca 0.09 -0.50 -0.11 0.00 0.00 0.00 0.00 46.02 45.50 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 -5.08 1.34 0.51 1.61 1.11 -1.26 -5.04 119.66 112.85 2dc2 s GLN 46 Ca 0.11 -1.51 0.28 0.00 0.01 0.00 0.00 55.36 54.25 2dc2 s GLN 46 Cb -0.05 0.34 1.39 0.00 -1.01 0.00 0.00 33.01 33.68 2dc2 s GLN 46 CO 0.14 -0.49 1.88 -1.35 0.01 0.00 0.00 175.29 175.48 2dc2 h PRO 47 N 2.48 0.09 -0.45 2.91 0.11 -1.89 -1.28 132.00 133.98 2dc2 h PRO 47 Ca -0.32 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.82 2dc2 h PRO 47 Cb 1.25 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.30 2dc2 h PRO 47 CO 0.47 0.06 0.21 0.00 -0.21 0.00 0.00 178.00 178.53 2dc2 h ALA 48 N 1.57 0.56 -0.34 -0.75 0.00 -1.87 0.33 119.26 118.75 2dc2 h ALA 48 Ca 0.44 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.27 2dc2 h ALA 48 Cb 1.60 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 2dc2 h ALA 48 CO -0.05 -0.15 -0.21 -0.44 0.00 0.00 0.00 179.25 178.40 2dc2 h ASP 49 N 0.43 0.77 0.20 0.00 5.19 -1.51 -2.96 116.42 118.53 2dc2 h ASP 49 Ca 0.20 -0.43 -0.05 0.00 -0.62 0.00 0.00 57.03 56.13 2dc2 h ASP 49 Cb 0.12 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.41 2dc2 h ASP 49 CO -0.15 1.03 -0.23 0.03 -3.12 0.00 0.00 179.24 176.80 2dc2 h ARG 50 N 0.51 0.06 0.00 3.56 2.47 -1.21 -2.47 114.38 117.30 2dc2 h ARG 50 Ca 0.07 -0.02 -0.09 0.00 -1.26 0.00 0.00 59.98 58.68 2dc2 h ARG 50 Cb 0.76 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.06 2dc2 h ARG 50 CO 0.06 0.29 -0.44 0.00 0.56 0.00 0.00 179.97 180.44 2dc2 n GLY 52 N 0.00 1.39 0.34 0.00 0.00 -0.93 -4.54 105.19 101.44 2dc2 n GLY 52 Ca -0.01 -0.02 0.18 0.00 0.00 0.00 0.00 46.02 46.17 2dc2 n GLY 52 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2dc2 h GLY 53 N 0.00 0.00 -7.44 -0.02 0.00 -1.90 -3.39 103.07 90.32 2dc2 h GLY 53 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.98 2dc2 h GLY 53 CO 0.00 0.00 1.05 -2.27 0.00 0.00 0.00 176.54 175.32 2dc2 s LEU 54 N -6.92 3.21 0.24 3.11 1.98 -1.26 -4.93 118.68 114.12 2dc2 s LEU 54 Ca -0.04 0.31 0.11 0.00 -2.89 0.00 0.00 54.13 51.62 2dc2 s LEU 54 Cb 0.13 -2.53 -0.05 0.00 0.66 0.00 0.00 46.19 44.41 2dc2 s LEU 54 CO 0.46 -2.91 -0.20 -1.38 -1.89 0.00 0.00 176.35 170.43 2dc2 s HIS 55 N 11.39 2.33 0.22 5.38 -3.43 -1.26 -4.84 115.29 125.08 2dc2 s HIS 55 Ca 0.82 -0.33 -0.30 0.00 -0.80 0.00 0.00 55.06 54.45 2dc2 s HIS 55 Cb -0.13 -1.08 -0.09 0.00 -1.43 0.00 0.00 32.58 29.85 2dc2 s HIS 55 CO 0.16 0.62 1.35 0.14 -2.00 0.00 0.00 174.74 175.00 2dc2 s VAL 56 N -2.12 3.03 0.00 -5.38 -7.23 -1.26 -3.79 120.40 103.64 2dc2 s VAL 56 Ca 0.26 0.86 0.00 0.00 -1.81 0.00 0.00 61.98 61.29 2dc2 s VAL 56 Cb -0.06 -3.55 0.00 0.00 0.56 0.00 0.00 36.38 33.33 2dc2 s VAL 56 CO 0.13 0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.67 2dc2 n GLY 57 N 2.23 0.73 3.33 2.32 0.00 0.14 -4.95 105.19 108.99 2dc2 n GLY 57 Ca 0.06 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 2dc2 n GLY 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dc2 s ASP 58 N -2.19 4.28 -0.22 1.61 1.01 -1.14 -2.75 116.67 117.27 2dc2 s ASP 58 Ca 0.00 -0.36 -0.19 0.00 0.71 0.00 0.00 52.55 52.71 2dc2 s ASP 58 Cb 0.00 -1.72 -0.03 0.00 1.01 0.00 0.00 42.92 42.18 2dc2 s ASP 58 CO 0.00 0.03 0.55 0.00 0.21 0.00 0.00 175.17 175.95 2dc2 s ALA 59 N 1.19 3.56 0.15 5.23 0.00 -0.90 0.28 121.76 131.28 2dc2 s ALA 59 Ca 0.02 -0.44 -0.31 0.00 0.00 0.00 0.00 51.96 51.24 2dc2 s ALA 59 Cb -0.14 -2.88 -0.08 0.00 0.00 0.00 0.00 23.12 20.01 2dc2 s ALA 59 CO -0.02 -0.57 1.34 0.42 0.00 0.00 0.00 175.76 176.93 2dc2 s ILE 60 N 1.94 3.29 -0.03 0.00 1.01 -0.35 -2.39 121.20 124.68 2dc2 s ILE 60 Ca 0.24 0.99 -0.04 0.00 0.00 0.00 0.00 60.65 61.84 2dc2 s ILE 60 Cb -0.16 -3.63 -0.02 0.00 0.01 0.00 0.00 42.46 38.66 2dc2 s ILE 60 CO 0.09 0.11 -0.09 0.18 0.00 0.00 0.00 174.94 175.24 2dc2 n LEU 61 N 3.29 0.88 -3.74 2.97 4.77 0.55 -4.65 117.00 121.08 2dc2 n LEU 61 Ca 0.09 0.13 -0.14 0.00 -0.03 0.00 0.00 56.01 56.06 2dc2 n LEU 61 Cb 0.43 -0.32 -0.09 0.00 -2.33 0.00 0.00 43.42 41.11 2dc2 n LEU 61 CO 0.58 -0.21 0.07 0.00 -1.33 0.00 0.00 177.39 176.50 2dc2 s ALA 62 N -2.18 -0.92 -0.14 -1.18 0.00 -1.15 -3.07 121.76 113.12 2dc2 s ALA 62 Ca -0.09 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.58 2dc2 s ALA 62 Cb 0.03 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.95 2dc2 s ALA 62 CO 0.12 -0.24 -0.13 0.08 0.00 0.00 0.00 175.76 175.59 2dc2 s VAL 63 N -0.70 1.45 -1.50 0.00 1.01 0.44 -1.10 120.40 120.00 2dc2 s VAL 63 Ca -0.08 -0.56 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 2dc2 s VAL 63 Cb -0.04 -1.38 0.02 0.00 0.00 0.00 0.00 36.38 34.98 2dc2 s VAL 63 CO 0.03 0.44 0.51 -3.20 0.00 0.00 0.00 175.10 172.88 2dc2 n ASN 64 N 4.75 -5.54 0.00 3.32 2.85 0.14 -0.85 115.26 119.94 2dc2 n ASN 64 Ca -0.16 -0.26 0.00 0.00 -0.11 0.00 0.00 54.58 54.05 2dc2 n ASN 64 Cb 0.50 -4.51 0.00 0.00 1.24 0.00 0.00 39.78 37.01 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 -1.38 2.33 3.77 8.20 0.00 -1.26 -4.94 105.19 111.92 2dc2 n GLY 65 Ca -0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.61 4.84 0.07 1.61 1.01 -0.03 -5.05 120.40 120.23 2dc2 s VAL 66 Ca 0.00 1.27 -0.27 0.00 0.00 0.00 0.00 61.98 62.98 2dc2 s VAL 66 Cb 0.00 -3.94 -0.06 0.00 0.00 0.00 0.00 36.38 32.38 2dc2 s VAL 66 CO 0.00 0.45 0.86 0.21 0.00 0.00 0.00 175.10 176.62 2dc2 s ASN 67 N -0.44 7.34 -0.00 3.32 2.47 -1.26 -0.42 114.94 125.95 2dc2 s ASN 67 Ca 0.31 1.61 0.12 0.00 0.42 0.00 0.00 52.86 55.32 2dc2 s ASN 67 Cb -0.19 -2.52 -0.15 0.00 -1.45 0.00 0.00 41.25 36.94 2dc2 s ASN 67 CO 0.18 -0.03 0.46 0.18 -3.72 0.00 0.00 177.10 174.17 2dc2 n LEU 68 N 2.84 0.44 0.26 3.21 4.32 -1.18 -4.53 117.00 122.36 2dc2 n LEU 68 Ca -0.00 -0.38 0.09 0.00 -0.02 0.00 0.00 56.01 55.69 2dc2 n LEU 68 Cb 0.50 0.00 0.65 0.00 -1.62 0.00 0.00 43.42 42.95 2dc2 n LEU 68 CO 0.49 0.11 1.03 -0.09 -1.22 0.00 0.00 177.39 177.71 2dc2 h ARG 69 N 0.00 0.00 -0.57 3.23 2.43 -1.88 -1.15 114.38 116.44 2dc2 h ARG 69 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2dc2 h ARG 69 Cb 0.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2dc2 h ARG 69 CO 0.00 0.05 0.00 -0.40 -1.51 0.00 0.00 179.97 178.11 2dc2 n ASP 70 N -4.34 3.24 -4.48 -3.80 5.75 -1.26 -4.92 116.55 106.74 2dc2 n ASP 70 Ca -0.03 -1.99 -0.25 0.00 -0.01 0.00 0.00 54.79 52.52 2dc2 n ASP 70 Cb 0.14 -0.38 -0.10 0.00 -1.03 0.00 0.00 41.12 39.74 2dc2 n ASP 70 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2dc2 s THR 71 N -1.24 2.57 0.56 2.12 -4.23 -0.44 -5.13 115.64 109.85 2dc2 s THR 71 Ca 0.40 -2.21 -0.08 0.00 -1.18 0.00 0.00 61.69 58.63 2dc2 s THR 71 Cb 0.21 -2.31 -0.03 0.00 1.34 0.00 0.00 72.50 71.71 2dc2 s THR 71 CO 0.28 -0.29 0.91 -0.54 -0.54 0.00 0.00 174.62 174.44 2dc2 s LYS 72 N -3.23 3.42 0.15 3.99 3.01 -1.26 -4.38 119.74 121.43 2dc2 s LYS 72 Ca 0.27 0.38 -0.19 0.00 -1.01 0.00 0.00 55.97 55.42 2dc2 s LYS 72 Cb -0.06 -2.23 0.03 0.00 -1.01 0.00 0.00 37.83 34.56 2dc2 s LYS 72 CO 0.14 -0.47 1.68 1.25 0.51 0.00 0.00 175.35 178.46 2dc2 h HIS 73 N -0.09 -0.23 -0.85 3.18 -0.00 -1.93 0.37 115.15 115.59 2dc2 h HIS 73 Ca -0.46 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 59.96 2dc2 h HIS 73 Cb 1.21 0.15 -0.04 0.00 -0.00 0.00 0.00 27.41 28.72 2dc2 h HIS 73 CO 0.59 -0.16 0.56 1.57 -0.00 0.00 0.00 177.93 180.49 2dc2 h LYS 74 N -0.05 1.11 -0.47 5.26 2.10 -1.96 -1.95 116.57 120.60 2dc2 h LYS 74 Ca 0.14 -0.07 -0.11 0.00 -2.00 0.00 0.00 60.65 58.61 2dc2 h LYS 74 Cb 0.26 -0.25 -0.02 0.00 -0.90 0.00 0.00 32.23 31.32 2dc2 h LYS 74 CO -0.31 0.73 -0.15 0.93 -2.00 0.00 0.00 179.45 178.65 2dc2 h GLU 75 N 1.14 0.91 -0.41 0.07 5.08 -1.72 -2.95 114.58 116.69 2dc2 h GLU 75 Ca 0.32 -0.34 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 2dc2 h GLU 75 Cb -0.10 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 2dc2 h GLU 75 CO -0.08 0.99 0.07 0.00 -1.00 0.00 0.00 179.01 178.99 2dc2 h ALA 76 N 1.02 1.36 -0.85 3.43 0.00 0.24 -2.25 119.26 122.22 2dc2 h ALA 76 Ca 0.12 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2dc2 h ALA 76 Cb 0.68 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2dc2 h ALA 76 CO 0.05 0.45 0.45 0.28 0.00 0.00 0.00 179.25 180.48 2dc2 h VAL 77 N 0.60 1.25 -0.33 0.00 2.07 -1.20 -0.33 116.25 118.32 2dc2 h VAL 77 Ca 0.14 -0.66 -0.06 0.00 0.82 0.00 0.00 66.70 66.94 2dc2 h VAL 77 Cb 0.27 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 2dc2 h VAL 77 CO 0.00 0.29 -0.03 0.74 0.02 0.00 0.00 177.57 178.59 2dc2 h THR 78 N 1.19 1.27 -0.61 2.57 2.02 -1.41 -2.07 112.91 115.88 2dc2 h THR 78 Ca 0.30 -1.04 -0.02 0.00 0.77 0.00 0.00 66.41 66.42 2dc2 h THR 78 Cb 0.06 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 2dc2 h THR 78 CO -0.04 0.34 0.31 0.40 0.37 0.00 0.00 175.52 176.90 2dc2 h ILE 79 N 0.41 1.21 -0.56 3.11 2.04 -1.11 -2.36 117.51 120.24 2dc2 h ILE 79 Ca 0.09 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 2dc2 h ILE 79 Cb 0.51 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 2dc2 h ILE 79 CO 0.02 0.23 0.23 -0.07 0.00 0.00 0.00 178.15 178.56 2dc2 h LEU 80 N 0.83 0.73 -1.23 1.44 3.38 -0.99 -2.09 115.31 117.39 2dc2 h LEU 80 Ca 0.21 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 2dc2 h LEU 80 Cb 0.09 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2dc2 h LEU 80 CO -0.03 0.66 -0.19 -1.28 0.09 0.00 0.00 178.44 177.69 2dc2 h SER 81 N 0.80 0.29 0.28 -0.43 0.87 -0.89 -2.51 113.55 111.96 2dc2 h SER 81 Ca 0.19 -0.07 -0.05 0.00 -1.23 0.00 0.00 61.79 60.63 2dc2 h SER 81 Cb 0.15 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 2dc2 h SER 81 CO -0.02 0.50 -0.22 1.56 -0.53 0.00 0.00 176.83 178.12 2dc2 h GLN 82 N 0.28 0.00 -6.13 2.24 1.08 -0.89 -3.42 115.11 108.27 2dc2 h GLN 82 Ca 0.05 0.00 -0.57 0.00 -1.45 0.00 0.00 58.65 56.68 2dc2 h GLN 82 Cb 0.49 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.92 2dc2 h GLN 82 CO 0.03 0.22 1.38 -0.65 -0.95 0.00 0.00 178.83 178.86 2dc2 s GLN 83 N -4.41 3.44 0.09 1.46 -1.52 -0.95 -4.97 119.66 112.79 2dc2 s GLN 83 Ca -0.03 2.06 0.06 0.00 -1.95 0.00 0.00 55.36 55.51 2dc2 s GLN 83 Cb 0.15 -4.28 -0.04 0.00 -0.22 0.00 0.00 33.01 28.62 2dc2 s GLN 83 CO 0.68 -1.75 -0.09 -0.98 -0.25 0.00 0.00 175.29 172.90 2dc2 s ARG 84 N 5.70 2.21 4.60 2.91 1.70 -1.26 -4.88 118.95 129.93 2dc2 s ARG 84 Ca 0.93 -0.97 0.00 0.00 -0.47 0.00 0.00 55.73 55.22 2dc2 s ARG 84 Cb -0.33 -2.34 0.00 0.00 -0.57 0.00 0.00 34.95 31.71 2dc2 s ARG 84 CO 0.36 0.52 0.00 0.41 -1.08 0.00 0.00 175.30 175.51 2dc2 n GLY 85 N 0.86 0.77 3.69 3.88 0.00 -1.26 -4.56 105.19 108.57 2dc2 n GLY 85 Ca -0.14 0.48 -0.40 0.00 0.00 0.00 0.00 46.02 45.97 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 4.29 -0.08 1.61 2.12 -1.26 -3.72 118.70 121.66 2dc2 s GLU 86 Ca 0.00 0.65 0.03 0.00 0.36 0.00 0.00 54.97 56.00 2dc2 s GLU 86 Cb 0.00 -3.52 0.01 0.00 0.26 0.00 0.00 34.13 30.88 2dc2 s GLU 86 CO 0.00 -0.08 -0.16 0.42 -0.54 0.00 0.00 175.26 174.90 2dc2 s ILE 87 N 1.37 1.42 -0.07 -3.70 1.01 -0.85 -5.03 121.20 115.35 2dc2 s ILE 87 Ca 0.30 -0.64 -0.15 0.00 0.00 0.00 0.00 60.65 60.17 2dc2 s ILE 87 Cb -0.16 -1.27 -0.05 0.00 0.01 0.00 0.00 42.46 40.99 2dc2 s ILE 87 CO 0.12 0.42 0.39 -0.70 0.00 0.00 0.00 174.94 175.17 2dc2 s GLU 88 N 0.64 4.07 -0.06 2.79 2.56 -1.26 -0.11 118.70 127.33 2dc2 s GLU 88 Ca -0.14 0.33 0.02 0.00 0.00 0.00 0.00 54.97 55.18 2dc2 s GLU 88 Cb -0.16 -3.31 0.02 0.00 2.00 0.00 0.00 34.13 32.67 2dc2 s GLU 88 CO 0.04 0.47 -0.09 -0.06 -0.56 0.00 0.00 175.26 175.06 2dc2 s PHE 89 N -0.34 1.23 -0.20 5.30 0.40 -0.23 0.28 117.98 124.42 2dc2 s PHE 89 Ca 0.22 -0.44 0.01 0.00 -0.60 0.00 0.00 56.93 56.13 2dc2 s PHE 89 Cb -0.15 -0.95 0.04 0.00 0.51 0.00 0.00 43.02 42.47 2dc2 s PHE 89 CO 0.10 -0.26 -0.13 -1.21 0.70 0.00 0.00 175.22 174.42 2dc2 s GLU 90 N 0.80 2.37 0.23 0.44 2.02 -0.25 -1.65 118.70 122.66 2dc2 s GLU 90 Ca -0.12 -0.94 0.01 0.00 0.02 0.00 0.00 54.97 53.93 2dc2 s GLU 90 Cb -0.15 -2.55 -0.04 0.00 0.10 0.00 0.00 34.13 31.49 2dc2 s GLU 90 CO 0.02 -0.39 0.15 0.14 0.02 0.00 0.00 175.26 175.20 2dc2 s VAL 91 N 1.30 0.11 0.01 2.63 -7.23 -1.14 -0.33 120.40 115.75 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 34.25 2dc2 s VAL 91 CO -0.09 0.00 -0.08 0.68 -0.31 0.00 0.00 175.10 175.30 2dc2 s VAL 92 N -3.97 0.59 -0.16 1.32 -7.23 -1.00 -1.33 120.40 108.62 2dc2 s VAL 92 Ca 0.39 -0.56 -0.29 0.00 -1.81 0.00 0.00 61.98 59.70 2dc2 s VAL 92 Cb 0.06 -0.54 -0.00 0.00 0.56 0.00 0.00 36.38 36.46 2dc2 s VAL 92 CO 0.15 -0.00 1.02 -0.47 -0.31 0.00 0.00 175.10 175.49 2dc2 s TYR 93 N -0.54 3.43 -0.07 2.82 6.14 -1.25 -2.12 117.35 125.75 2dc2 s TYR 93 Ca -0.01 1.54 0.05 0.00 0.64 0.00 0.00 57.07 59.29 2dc2 s TYR 93 Cb -0.05 -3.23 -0.01 0.00 0.42 0.00 0.00 41.96 39.10 2dc2 s TYR 93 CO 0.00 -0.35 -0.24 0.14 0.64 0.00 0.00 175.55 175.74 2dc2 s VAL 94 N 2.56 2.09 0.00 3.14 -7.23 -1.11 -4.90 120.40 114.95 2dc2 s VAL 94 Ca 0.46 -1.04 0.00 0.00 -1.81 0.00 0.00 61.98 59.59 2dc2 s VAL 94 Cb -0.17 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 35.00 2dc2 s VAL 94 CO 0.12 0.57 0.00 0.00 -0.31 0.00 0.00 175.10 175.48