#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 4.39 -0.11 0.52 1.10 -1.26 -3.60 121.20 122.24 2dc2 s ILE 10 Ca 0.00 1.59 0.03 0.00 -0.51 0.00 0.00 60.65 61.76 2dc2 s ILE 10 Cb 0.00 -4.36 0.01 0.00 0.15 0.00 0.00 42.46 38.26 2dc2 s ILE 10 CO 0.00 -0.51 -0.20 -0.60 -2.11 0.00 0.00 174.94 171.52 2dc2 s ARG 11 N 3.83 2.70 -0.27 3.50 3.52 -0.24 -5.03 118.95 126.95 2dc2 s ARG 11 Ca 0.48 -0.74 -0.03 0.00 -0.13 0.00 0.00 55.73 55.31 2dc2 s ARG 11 Cb -0.13 -2.15 0.03 0.00 -1.56 0.00 0.00 34.95 31.13 2dc2 s ARG 11 CO 0.18 0.04 -0.01 -1.59 -0.81 0.00 0.00 175.30 173.11 2dc2 s LYS 12 N 0.70 2.83 0.01 5.12 0.00 -1.26 -1.79 119.74 125.35 2dc2 s LYS 12 Ca -0.11 -1.00 0.04 0.00 0.00 0.00 0.00 55.97 54.90 2dc2 s LYS 12 Cb -0.16 -3.12 -0.03 0.00 0.00 0.00 0.00 37.83 34.52 2dc2 s LYS 12 CO 0.02 -0.45 -0.07 0.08 0.00 0.00 0.00 175.35 174.93 2dc2 s VAL 13 N 1.36 3.59 -0.25 1.79 1.01 -0.51 -4.96 120.40 122.43 2dc2 s VAL 13 Ca -0.00 -0.82 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 2dc2 s VAL 13 Cb -0.17 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 2dc2 s VAL 13 CO -0.02 0.38 0.27 -0.22 0.00 0.00 0.00 175.10 175.51 2dc2 s LEU 14 N -1.46 4.07 -0.21 3.92 0.20 -1.26 -1.90 118.68 122.04 2dc2 s LEU 14 Ca 0.17 0.20 -0.05 0.00 0.69 0.00 0.00 54.13 55.14 2dc2 s LEU 14 Cb -0.11 -2.28 -0.02 0.00 -0.43 0.00 0.00 46.19 43.35 2dc2 s LEU 14 CO 0.08 -0.07 -0.00 -0.22 -0.29 0.00 0.00 176.35 175.85 2dc2 s LEU 15 N 1.61 3.21 -0.29 -0.68 0.20 -0.61 -5.00 118.68 117.12 2dc2 s LEU 15 Ca 0.12 -0.23 -0.07 0.00 0.69 0.00 0.00 54.13 54.63 2dc2 s LEU 15 Cb -0.15 -1.82 0.00 0.00 -0.43 0.00 0.00 46.19 43.79 2dc2 s LEU 15 CO 0.09 0.04 0.08 -0.22 -0.29 0.00 0.00 176.35 176.05 2dc2 s LEU 16 N 1.12 3.82 -0.01 -0.68 0.20 -1.26 -2.66 118.68 119.20 2dc2 s LEU 16 Ca 0.02 -0.63 0.04 0.00 0.69 0.00 0.00 54.13 54.25 2dc2 s LEU 16 Cb -0.14 -1.89 -0.01 0.00 -0.43 0.00 0.00 46.19 43.71 2dc2 s LEU 16 CO 0.01 -0.17 -0.12 -1.59 -0.29 0.00 0.00 176.35 174.18 2dc2 s LYS 17 N 1.52 1.05 0.69 1.98 -2.85 -1.23 -4.95 119.74 115.94 2dc2 s LYS 17 Ca 0.03 -0.44 -0.11 0.00 -1.00 0.00 0.00 55.97 54.45 2dc2 s LYS 17 Cb -0.17 -1.00 0.01 0.00 -2.06 0.00 0.00 37.83 34.61 2dc2 s LYS 17 CO 0.03 0.25 1.08 -2.00 0.10 0.00 0.00 175.35 174.81 2dc2 s GLU 18 N -0.23 2.90 0.31 1.78 2.56 -1.26 -4.08 118.70 120.68 2dc2 s GLU 18 Ca 0.04 0.44 0.01 0.00 0.00 0.00 0.00 54.97 55.46 2dc2 s GLU 18 Cb -0.05 -2.05 0.56 0.00 2.00 0.00 0.00 34.13 34.58 2dc2 s GLU 18 CO -0.00 -0.98 1.91 -0.44 -0.56 0.00 0.00 175.26 175.18 2dc2 h ASP 19 N -0.59 0.88 0.87 -1.70 3.32 -2.00 -1.23 116.42 115.97 2dc2 h ASP 19 Ca -0.45 0.01 -0.17 0.00 0.02 0.00 0.00 57.03 56.44 2dc2 h ASP 19 Cb 1.25 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.60 2dc2 h ASP 19 CO 0.63 0.56 -0.80 1.12 -1.72 0.00 0.00 179.24 179.03 2dc2 h HIS 20 N 1.00 0.00 -4.01 4.55 2.07 -2.06 -3.46 115.15 113.23 2dc2 h HIS 20 Ca 0.39 0.00 -0.44 0.00 -2.85 0.00 0.00 60.37 57.47 2dc2 h HIS 20 Cb 0.24 0.00 0.16 0.00 2.57 0.00 0.00 27.41 30.38 2dc2 h HIS 20 CO -0.00 0.80 0.35 -1.21 -3.07 0.00 0.00 177.93 174.79 2dc2 s GLU 21 N -3.11 0.47 0.00 5.12 2.02 -0.46 -5.10 118.70 117.63 2dc2 s GLU 21 Ca 0.00 -0.19 0.00 0.00 0.02 0.00 0.00 54.97 54.80 2dc2 s GLU 21 Cb 0.11 -1.81 0.00 0.00 0.10 0.00 0.00 34.13 32.53 2dc2 s GLU 21 CO 0.79 -2.56 0.00 0.41 0.02 0.00 0.00 175.26 173.91 2dc2 n GLY 22 N -2.94 5.44 0.02 -1.39 0.00 -1.26 -4.71 105.19 100.35 2dc2 n GLY 22 Ca 0.13 -1.24 -0.01 0.00 0.00 0.00 0.00 46.02 44.89 2dc2 n GLY 22 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dc2 n LEU 23 N 0.00 0.43 0.00 0.99 4.77 -1.26 -4.83 117.00 117.10 2dc2 n LEU 23 Ca 0.00 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 2dc2 n LEU 23 Cb 0.00 -0.57 0.00 0.00 -2.33 0.00 0.00 43.42 40.52 2dc2 n LEU 23 CO 0.00 -0.48 0.00 0.61 -1.33 0.00 0.00 177.39 176.19 2dc2 n GLY 24 N 1.63 0.78 3.12 -0.72 0.00 -1.26 -3.87 105.19 104.87 2dc2 n GLY 24 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 0.52 -0.08 -0.61 -5.25 -1.26 -0.76 121.20 111.75 2dc2 s ILE 25 Ca 0.00 -1.70 0.02 0.00 -0.99 0.00 0.00 60.65 57.97 2dc2 s ILE 25 Cb 0.00 -1.38 -0.02 0.00 2.95 0.00 0.00 42.46 44.00 2dc2 s ILE 25 CO 0.00 -0.80 -0.12 -0.44 -1.79 0.00 0.00 174.94 171.79 2dc2 s SER 26 N -2.68 4.21 0.25 4.36 0.01 -0.30 -4.99 113.70 114.56 2dc2 s SER 26 Ca 0.05 -0.19 0.11 0.00 1.31 0.00 0.00 55.95 57.24 2dc2 s SER 26 Cb 0.03 -1.18 -0.05 0.00 0.21 0.00 0.00 66.02 65.03 2dc2 s SER 26 CO -0.05 0.29 -0.15 0.27 0.41 0.00 0.00 173.24 174.01 2dc2 s ILE 27 N -0.39 2.78 0.03 1.44 -4.36 -1.26 -1.74 121.20 117.69 2dc2 s ILE 27 Ca 0.05 -2.12 -0.05 0.00 -0.26 0.00 0.00 60.65 58.26 2dc2 s ILE 27 Cb -0.12 -2.43 -0.01 0.00 1.25 0.00 0.00 42.46 41.15 2dc2 s ILE 27 CO 0.02 -0.30 0.09 0.28 0.24 0.00 0.00 174.94 175.27 2dc2 s THR 28 N -2.20 0.13 -3.83 8.37 -1.32 0.06 -4.88 115.64 111.97 2dc2 s THR 28 Ca 0.28 -1.05 0.00 0.00 -1.21 0.00 0.00 61.69 59.71 2dc2 s THR 28 Cb -0.06 -0.80 0.00 0.00 -1.51 0.00 0.00 72.50 70.12 2dc2 s THR 28 CO 0.15 -0.58 0.00 0.61 -2.21 0.00 0.00 174.62 172.59 2dc2 n GLY 29 N 0.90 0.83 0.00 6.08 0.00 -1.26 -1.40 105.19 110.35 2dc2 n GLY 29 Ca -0.20 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 43.83 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 1.40 0.36 -0.02 0.00 -1.07 -4.81 105.19 101.04 2dc2 n GLY 30 Ca 0.00 0.45 0.02 0.00 0.00 0.00 0.00 46.02 46.49 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 0.99 -0.21 1.61 3.11 -1.75 -1.26 116.57 119.06 2dc2 h LYS 31 Ca 0.00 -0.06 0.03 0.00 -2.81 0.00 0.00 60.65 57.81 2dc2 h LYS 31 Cb 0.00 -0.22 -0.01 0.00 -1.00 0.00 0.00 32.23 31.00 2dc2 h LYS 31 CO 0.00 0.66 0.14 1.49 -2.81 0.00 0.00 179.45 178.93 2dc2 h GLU 32 N 1.02 0.15 0.00 1.90 4.81 -1.90 -1.12 114.58 119.44 2dc2 h GLU 32 Ca 0.31 -0.01 -0.17 0.00 -0.13 0.00 0.00 59.36 59.36 2dc2 h GLU 32 Cb -0.01 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 2dc2 h GLU 32 CO -0.08 0.10 -0.82 0.45 -0.73 0.00 0.00 179.01 177.92 2dc2 h HIS 33 N 0.16 0.00 0.00 0.92 3.86 -1.64 -3.48 115.15 114.97 2dc2 h HIS 33 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2dc2 h HIS 33 Cb 0.16 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.63 2dc2 h HIS 33 CO -0.00 0.80 0.00 0.41 0.86 0.00 0.00 177.93 180.00 2dc2 n GLY 34 N 1.31 1.97 3.07 2.45 0.00 -0.42 -5.08 105.19 108.47 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 0.83 1.61 -7.23 -1.12 -5.03 120.40 107.42 2dc2 s VAL 35 Ca 0.00 0.10 -0.12 0.00 -1.81 0.00 0.00 61.98 60.15 2dc2 s VAL 35 Cb 0.00 -0.36 0.10 0.00 0.56 0.00 0.00 36.38 36.67 2dc2 s VAL 35 CO 0.00 0.04 1.18 -2.84 -0.31 0.00 0.00 175.10 173.17 2dc2 s PRO 36 N 0.92 1.52 0.09 4.82 0.02 -1.26 -2.59 135.00 138.52 2dc2 s PRO 36 Ca -0.07 1.65 -0.28 0.00 0.02 0.00 0.00 61.00 62.33 2dc2 s PRO 36 Cb -0.08 -1.77 -0.06 0.00 0.02 0.00 0.00 34.50 32.61 2dc2 s PRO 36 CO -0.06 -2.28 0.87 0.42 -0.33 0.00 0.00 177.00 175.62 2dc2 s ILE 37 N -2.35 4.57 0.05 2.83 -1.09 -1.26 -4.50 121.20 119.44 2dc2 s ILE 37 Ca 0.70 1.87 0.00 0.00 -2.23 0.00 0.00 60.65 61.00 2dc2 s ILE 37 Cb -0.26 -4.23 -0.03 0.00 -1.58 0.00 0.00 42.46 36.36 2dc2 s ILE 37 CO 0.53 0.36 -0.04 -1.48 -1.23 0.00 0.00 174.94 173.07 2dc2 s LEU 38 N -0.15 2.40 -0.10 2.97 0.05 -0.49 -0.20 118.68 123.15 2dc2 s LEU 38 Ca 0.43 -0.81 -0.30 0.00 0.05 0.00 0.00 54.13 53.50 2dc2 s LEU 38 Cb -0.22 0.07 -0.01 0.00 -2.05 0.00 0.00 46.19 43.98 2dc2 s LEU 38 CO 0.27 -0.44 1.01 -0.63 -0.55 0.00 0.00 176.35 176.00 2dc2 s ILE 39 N -2.87 4.79 -0.24 1.48 1.01 0.14 -0.76 121.20 124.75 2dc2 s ILE 39 Ca -0.00 2.04 -0.02 0.00 0.00 0.00 0.00 60.65 62.67 2dc2 s ILE 39 Cb 0.00 -4.31 -0.15 0.00 0.01 0.00 0.00 42.46 38.01 2dc2 s ILE 39 CO -0.05 0.02 -0.24 -0.24 0.00 0.00 0.00 174.94 174.42 2dc2 n SER 40 N 4.92 2.06 -4.23 3.58 2.88 -0.71 -1.05 113.62 121.07 2dc2 n SER 40 Ca 0.09 -0.02 -0.21 0.00 -1.33 0.00 0.00 58.87 57.40 2dc2 n SER 40 Cb 0.49 -0.47 -0.12 0.00 -0.75 0.00 0.00 64.21 63.36 2dc2 n SER 40 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2dc2 s GLU 41 N -2.48 0.98 -0.08 -1.46 2.02 -1.16 -4.53 118.70 112.00 2dc2 s GLU 41 Ca -0.33 -1.08 -0.00 0.00 0.02 0.00 0.00 54.97 53.57 2dc2 s GLU 41 Cb 0.10 -1.10 0.02 0.00 0.10 0.00 0.00 34.13 33.26 2dc2 s GLU 41 CO 0.53 0.25 -0.04 0.42 0.02 0.00 0.00 175.26 176.43 2dc2 s ILE 42 N -1.32 0.67 0.02 -1.63 1.01 -1.26 -1.14 121.20 117.54 2dc2 s ILE 42 Ca 0.03 -0.10 -0.27 0.00 0.00 0.00 0.00 60.65 60.31 2dc2 s ILE 42 Cb -0.09 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.60 2dc2 s ILE 42 CO 0.03 0.29 0.86 -1.00 0.00 0.00 0.00 174.94 175.13 2dc2 s HIS 43 N 1.58 3.70 0.46 3.97 3.76 0.06 -5.02 115.29 123.80 2dc2 s HIS 43 Ca 0.00 1.57 -0.22 0.00 -0.15 0.00 0.00 55.06 56.27 2dc2 s HIS 43 Cb -0.13 -2.96 -0.08 0.00 1.11 0.00 0.00 32.58 30.51 2dc2 s HIS 43 CO -0.04 0.13 1.07 -1.25 -0.85 0.00 0.00 174.74 173.79 2dc2 s PRO 44 N 0.47 3.88 -0.40 8.40 0.04 -1.26 -3.94 135.00 142.18 2dc2 s PRO 44 Ca 0.44 1.49 -0.02 0.00 0.04 0.00 0.00 61.00 62.95 2dc2 s PRO 44 Cb -0.21 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 32.06 2dc2 s PRO 44 CO 0.25 -0.39 0.27 0.41 0.04 0.00 0.00 177.00 177.58 2dc2 n GLY 45 N 0.08 0.46 3.36 0.56 0.00 -1.26 -5.05 105.19 103.32 2dc2 n GLY 45 Ca 0.08 -0.46 -0.19 0.00 0.00 0.00 0.00 46.02 45.45 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 -5.15 1.56 0.48 1.61 -0.21 -1.25 -5.02 119.66 111.67 2dc2 s GLN 46 Ca 0.13 -1.88 0.26 0.00 0.02 0.00 0.00 55.36 53.89 2dc2 s GLN 46 Cb -0.06 -0.29 1.31 0.00 1.00 0.00 0.00 33.01 34.97 2dc2 s GLN 46 CO 0.16 -0.36 1.86 -1.35 -2.12 0.00 0.00 175.29 173.48 2dc2 h PRO 47 N 2.23 0.17 -0.23 2.91 0.11 -1.88 -0.43 132.00 134.88 2dc2 h PRO 47 Ca -0.36 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.70 2dc2 h PRO 47 Cb 1.25 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2dc2 h PRO 47 CO 0.58 0.11 0.01 0.00 -0.21 0.00 0.00 178.00 178.49 2dc2 h ALA 48 N 1.57 0.31 -0.42 -0.75 0.00 -1.89 -2.23 119.26 115.85 2dc2 h ALA 48 Ca 0.47 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 2dc2 h ALA 48 Cb 1.55 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 2dc2 h ALA 48 CO -0.10 0.03 -0.33 0.22 0.00 0.00 0.00 179.25 179.07 2dc2 h ASP 49 N 0.18 1.02 -0.17 0.00 3.58 -1.41 -2.95 116.42 116.66 2dc2 h ASP 49 Ca 0.07 -0.44 0.00 0.00 0.42 0.00 0.00 57.03 57.07 2dc2 h ASP 49 Cb 0.40 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.15 2dc2 h ASP 49 CO 0.01 1.24 0.11 0.03 -2.88 0.00 0.00 179.24 177.76 2dc2 h ARG 50 N 0.80 0.23 0.00 0.28 3.08 -1.09 -1.77 114.38 115.90 2dc2 h ARG 50 Ca 0.08 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 59.97 2dc2 h ARG 50 Cb 0.92 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.90 2dc2 h ARG 50 CO 0.09 0.15 -0.66 0.00 -1.07 0.00 0.00 179.97 178.48 2dc2 n GLY 52 N 0.82 1.00 0.03 0.00 0.00 -0.67 -4.83 105.19 101.55 2dc2 n GLY 52 Ca 0.00 -0.28 -0.04 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 -1.08 -0.20 3.58 -0.02 0.00 -1.26 -4.95 105.19 101.26 2dc2 n GLY 53 Ca -0.09 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 2dc2 n GLY 53 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dc2 s LEU 54 N -4.97 3.42 0.22 0.99 0.20 -1.26 -4.98 118.68 112.31 2dc2 s LEU 54 Ca -0.07 0.85 0.09 0.00 0.69 0.00 0.00 54.13 55.68 2dc2 s LEU 54 Cb 0.02 -3.08 -0.04 0.00 -0.43 0.00 0.00 46.19 42.66 2dc2 s LEU 54 CO 0.21 -1.99 -0.00 -1.38 -0.29 0.00 0.00 176.35 172.90 2dc2 s HIS 55 N 7.79 2.77 0.32 5.38 -3.43 -1.26 -4.84 115.29 122.01 2dc2 s HIS 55 Ca 0.73 -0.18 -0.29 0.00 -0.80 0.00 0.00 55.06 54.52 2dc2 s HIS 55 Cb -0.17 -1.28 -0.11 0.00 -1.43 0.00 0.00 32.58 29.59 2dc2 s HIS 55 CO 0.28 0.56 1.46 0.08 -2.00 0.00 0.00 174.74 175.12 2dc2 s VAL 56 N -2.02 2.32 -0.35 -5.38 1.01 -1.26 -3.56 120.40 111.16 2dc2 s VAL 56 Ca 0.29 0.30 -0.01 0.00 0.00 0.00 0.00 61.98 62.56 2dc2 s VAL 56 Cb -0.08 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 2dc2 s VAL 56 CO 0.19 0.06 0.30 0.61 0.00 0.00 0.00 175.10 176.26 2dc2 n GLY 57 N 1.24 0.22 3.32 4.51 0.00 -0.21 -4.96 105.19 109.31 2dc2 n GLY 57 Ca 0.03 -0.21 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.32 4.30 -0.16 1.61 -1.08 -1.14 -2.86 116.67 114.02 2dc2 s ASP 58 Ca 0.05 -0.38 -0.19 0.00 -0.52 0.00 0.00 52.55 51.51 2dc2 s ASP 58 Cb -0.01 -1.73 -0.04 0.00 -1.46 0.00 0.00 42.92 39.68 2dc2 s ASP 58 CO 0.22 -0.01 0.52 0.00 0.52 0.00 0.00 175.17 176.43 2dc2 s ALA 59 N 1.39 3.51 0.32 3.66 0.00 -0.28 0.28 121.76 130.63 2dc2 s ALA 59 Ca 0.05 -0.28 -0.15 0.00 0.00 0.00 0.00 51.96 51.58 2dc2 s ALA 59 Cb -0.14 -2.77 -0.09 0.00 0.00 0.00 0.00 23.12 20.12 2dc2 s ALA 59 CO -0.03 -0.26 0.73 0.42 0.00 0.00 0.00 175.76 176.63 2dc2 s ILE 60 N 1.21 4.68 0.00 0.00 1.01 0.71 0.34 121.20 129.16 2dc2 s ILE 60 Ca 0.26 0.95 0.00 0.00 0.00 0.00 0.00 60.65 61.86 2dc2 s ILE 60 Cb -0.15 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.70 2dc2 s ILE 60 CO 0.10 -0.18 0.00 0.18 0.00 0.00 0.00 174.94 175.04 2dc2 n LEU 61 N -0.35 0.00 -4.00 2.97 4.77 -0.89 -4.46 117.00 115.03 2dc2 n LEU 61 Ca 0.03 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.88 2dc2 n LEU 61 Cb 0.53 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.49 2dc2 n LEU 61 CO 0.41 -0.39 -0.39 0.00 -1.33 0.00 0.00 177.39 175.69 2dc2 s ALA 62 N -2.00 0.44 -0.12 -1.18 0.00 -1.16 -0.73 121.76 117.00 2dc2 s ALA 62 Ca 0.00 -0.50 -0.02 0.00 0.00 0.00 0.00 51.96 51.44 2dc2 s ALA 62 Cb 0.00 -0.00 0.04 0.00 0.00 0.00 0.00 23.12 23.16 2dc2 s ALA 62 CO 0.00 0.01 0.01 0.08 0.00 0.00 0.00 175.76 175.87 2dc2 s VAL 63 N -0.84 0.44 -1.46 0.00 1.01 0.39 -0.85 120.40 119.08 2dc2 s VAL 63 Ca -0.06 -0.15 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 2dc2 s VAL 63 Cb -0.06 -0.74 0.03 0.00 0.00 0.00 0.00 36.38 35.61 2dc2 s VAL 63 CO 0.00 0.07 0.74 -3.20 0.00 0.00 0.00 175.10 172.72 2dc2 n ASN 64 N 5.11 -5.45 0.00 3.32 2.85 0.15 -0.83 115.26 120.40 2dc2 n ASN 64 Ca -0.08 -0.43 0.00 0.00 -0.11 0.00 0.00 54.58 53.96 2dc2 n ASN 64 Cb 0.49 -4.39 0.00 0.00 1.24 0.00 0.00 39.78 37.12 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 -1.56 2.61 3.75 8.20 0.00 -1.26 -5.01 105.19 111.93 2dc2 n GLY 65 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.20 4.57 0.20 1.61 1.01 -0.01 -5.04 120.40 120.54 2dc2 s VAL 66 Ca 0.00 1.71 -0.30 0.00 0.00 0.00 0.00 61.98 63.39 2dc2 s VAL 66 Cb 0.00 -4.15 -0.08 0.00 0.00 0.00 0.00 36.38 32.15 2dc2 s VAL 66 CO 0.00 0.42 1.04 0.54 0.00 0.00 0.00 175.10 177.10 2dc2 s ASN 67 N -0.44 7.39 0.00 3.32 4.22 -1.26 -0.46 114.94 127.70 2dc2 s ASN 67 Ca 0.39 2.06 0.06 0.00 -2.14 0.00 0.00 52.86 53.22 2dc2 s ASN 67 Cb -0.22 -2.61 0.03 0.00 1.28 0.00 0.00 41.25 39.74 2dc2 s ASN 67 CO 0.25 -0.09 0.62 -0.11 -2.04 0.00 0.00 177.10 175.73 2dc2 n LEU 68 N 1.97 1.31 0.05 3.54 7.94 0.09 -4.55 117.00 127.35 2dc2 n LEU 68 Ca 0.01 -0.92 -0.07 0.00 -1.11 0.00 0.00 56.01 53.92 2dc2 n LEU 68 Cb 0.46 0.00 0.11 0.00 0.53 0.00 0.00 43.42 44.52 2dc2 n LEU 68 CO 0.53 0.27 0.50 -0.09 -1.11 0.00 0.00 177.39 177.49 2dc2 h ARG 69 N 1.00 0.37 -0.56 1.96 2.43 -1.90 -3.15 114.38 114.53 2dc2 h ARG 69 Ca 0.00 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 58.94 2dc2 h ARG 69 Cb 0.23 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 2dc2 h ARG 69 CO 0.00 0.83 0.00 -3.47 -1.51 0.00 0.00 179.97 175.82 2dc2 n ASP 70 N -3.92 3.89 -4.75 -3.80 -0.08 -1.26 -4.92 116.55 101.70 2dc2 n ASP 70 Ca -0.03 -2.21 -0.36 0.00 -1.51 0.00 0.00 54.79 50.69 2dc2 n ASP 70 Cb 0.60 -0.44 -0.08 0.00 2.34 0.00 0.00 41.12 43.53 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 -1.39 4.83 0.75 5.18 -4.23 -1.19 -5.09 115.64 114.48 2dc2 s THR 71 Ca 0.41 -0.05 -0.11 0.00 -1.18 0.00 0.00 61.69 60.77 2dc2 s THR 71 Cb 0.24 -3.08 0.04 0.00 1.34 0.00 0.00 72.50 71.04 2dc2 s THR 71 CO 0.24 0.59 1.08 -0.54 -0.54 0.00 0.00 174.62 175.44 2dc2 s LYS 72 N -0.77 2.51 0.16 3.99 3.01 -1.26 -4.33 119.74 123.05 2dc2 s LYS 72 Ca 0.12 0.94 -0.17 0.00 -1.01 0.00 0.00 55.97 55.86 2dc2 s LYS 72 Cb -0.12 -1.94 0.08 0.00 -1.01 0.00 0.00 37.83 34.84 2dc2 s LYS 72 CO 0.03 -1.40 1.70 1.25 0.51 0.00 0.00 175.35 177.43 2dc2 h HIS 73 N -0.94 -0.07 -0.66 3.18 -0.00 -1.92 0.23 115.15 114.97 2dc2 h HIS 73 Ca -0.45 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 59.92 2dc2 h HIS 73 Cb 1.23 0.08 -0.03 0.00 -0.00 0.00 0.00 27.41 28.69 2dc2 h HIS 73 CO 0.57 -0.09 0.28 -0.22 -0.00 0.00 0.00 177.93 178.47 2dc2 h LYS 74 N 0.07 0.98 -0.80 5.26 3.11 -1.96 -2.59 116.57 120.64 2dc2 h LYS 74 Ca 0.17 -0.17 -0.04 0.00 -2.81 0.00 0.00 60.65 57.81 2dc2 h LYS 74 Cb 0.25 -0.16 -0.04 0.00 -1.00 0.00 0.00 32.23 31.28 2dc2 h LYS 74 CO -0.31 0.81 0.36 1.49 -2.81 0.00 0.00 179.45 178.98 2dc2 h GLU 75 N 0.93 1.17 -0.33 1.90 4.57 -1.71 -2.60 114.58 118.51 2dc2 h GLU 75 Ca 0.22 -0.19 -0.04 0.00 -1.18 0.00 0.00 59.36 58.17 2dc2 h GLU 75 Cb 0.18 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 2dc2 h GLU 75 CO -0.02 0.92 0.01 0.00 -1.18 0.00 0.00 179.01 178.75 2dc2 h ALA 76 N 1.23 1.41 -0.62 2.92 0.00 -0.25 -2.34 119.26 121.61 2dc2 h ALA 76 Ca 0.27 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2dc2 h ALA 76 Cb 0.16 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2dc2 h ALA 76 CO -0.03 0.42 0.31 0.28 0.00 0.00 0.00 179.25 180.23 2dc2 h VAL 77 N 0.49 1.21 -0.43 0.00 2.07 -1.09 -0.27 116.25 118.22 2dc2 h VAL 77 Ca 0.11 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 2dc2 h VAL 77 Cb 0.30 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2dc2 h VAL 77 CO 0.01 0.23 0.15 0.74 0.02 0.00 0.00 177.57 178.72 2dc2 h THR 78 N 0.84 1.21 -0.73 2.57 2.02 -1.37 -2.42 112.91 115.04 2dc2 h THR 78 Ca 0.21 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.66 2dc2 h THR 78 Cb 0.09 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.32 2dc2 h THR 78 CO -0.03 0.25 0.32 0.40 0.37 0.00 0.00 175.52 176.83 2dc2 h ILE 79 N 0.56 1.25 -0.84 3.11 2.04 -1.15 -2.15 117.51 120.32 2dc2 h ILE 79 Ca 0.14 -0.73 0.02 0.00 1.00 0.00 0.00 64.86 65.29 2dc2 h ILE 79 Cb 0.24 0.37 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 2dc2 h ILE 79 CO -0.01 0.30 0.55 -0.07 0.00 0.00 0.00 178.15 178.92 2dc2 h LEU 80 N 1.04 0.92 -1.23 1.44 3.38 -0.86 -1.64 115.31 118.35 2dc2 h LEU 80 Ca 0.25 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 2dc2 h LEU 80 Cb 0.17 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2dc2 h LEU 80 CO -0.03 0.65 -0.33 0.28 0.09 0.00 0.00 178.44 179.10 2dc2 h SER 81 N 1.08 0.00 0.30 -0.43 0.02 -1.10 -2.80 113.55 110.63 2dc2 h SER 81 Ca 0.33 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.23 2dc2 h SER 81 Cb -0.04 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 2dc2 h SER 81 CO -0.10 0.33 -0.21 1.56 -1.14 0.00 0.00 176.83 177.27 2dc2 h GLN 82 N 0.00 0.00 -6.26 3.45 1.08 -0.64 -3.42 115.11 109.32 2dc2 h GLN 82 Ca -0.00 0.00 -0.56 0.00 -1.45 0.00 0.00 58.65 56.64 2dc2 h GLN 82 Cb 0.71 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.13 2dc2 h GLN 82 CO 0.04 0.21 1.14 -0.65 -0.95 0.00 0.00 178.83 178.62 2dc2 s GLN 83 N -4.37 3.95 0.01 1.46 -1.52 -1.06 -5.00 119.66 113.14 2dc2 s GLN 83 Ca -0.03 2.00 0.06 0.00 -1.95 0.00 0.00 55.36 55.44 2dc2 s GLN 83 Cb 0.14 -4.04 -0.03 0.00 -0.22 0.00 0.00 33.01 28.86 2dc2 s GLN 83 CO 0.67 -1.12 -0.16 0.50 -0.25 0.00 0.00 175.29 174.93 2dc2 s ARG 84 N 4.48 2.25 5.00 2.91 3.52 -1.26 -4.98 118.95 130.86 2dc2 s ARG 84 Ca 0.76 -0.87 0.00 0.00 -0.13 0.00 0.00 55.73 55.48 2dc2 s ARG 84 Cb -0.31 -2.28 0.00 0.00 -1.56 0.00 0.00 34.95 30.81 2dc2 s ARG 84 CO 0.31 0.57 0.00 0.41 -0.81 0.00 0.00 175.30 175.77 2dc2 n GLY 85 N 1.75 1.02 3.67 8.12 0.00 -1.26 -4.54 105.19 113.95 2dc2 n GLY 85 Ca -0.16 0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.93 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 4.33 -0.11 1.61 2.12 -1.26 -3.53 118.70 121.86 2dc2 s GLU 86 Ca 0.00 1.46 0.01 0.00 0.36 0.00 0.00 54.97 56.80 2dc2 s GLU 86 Cb 0.00 -3.61 0.02 0.00 0.26 0.00 0.00 34.13 30.80 2dc2 s GLU 86 CO 0.00 -0.50 -0.11 0.42 -0.54 0.00 0.00 175.26 174.53 2dc2 s ILE 87 N 2.66 1.23 -0.22 -3.70 1.01 -1.09 -5.04 121.20 116.06 2dc2 s ILE 87 Ca 0.49 -0.45 -0.16 0.00 0.00 0.00 0.00 60.65 60.52 2dc2 s ILE 87 Cb -0.19 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 2dc2 s ILE 87 CO 0.14 0.39 0.43 -0.70 0.00 0.00 0.00 174.94 175.20 2dc2 s GLU 88 N 1.32 4.15 -0.09 2.79 2.12 -1.26 -1.57 118.70 126.16 2dc2 s GLU 88 Ca -0.01 0.23 0.03 0.00 0.36 0.00 0.00 54.97 55.58 2dc2 s GLU 88 Cb -0.14 -3.57 -0.01 0.00 0.26 0.00 0.00 34.13 30.67 2dc2 s GLU 88 CO -0.05 -0.12 -0.20 -0.06 -0.54 0.00 0.00 175.26 174.29 2dc2 s PHE 89 N 1.56 2.61 -0.22 5.30 0.40 -0.80 0.31 117.98 127.15 2dc2 s PHE 89 Ca 0.20 -0.70 0.02 0.00 -0.60 0.00 0.00 56.93 55.84 2dc2 s PHE 89 Cb -0.15 -1.70 0.04 0.00 0.51 0.00 0.00 43.02 41.72 2dc2 s PHE 89 CO 0.09 -0.21 -0.16 -2.00 0.70 0.00 0.00 175.22 173.64 2dc2 s GLU 90 N 0.02 2.66 0.23 0.44 2.12 -0.03 -1.42 118.70 122.72 2dc2 s GLU 90 Ca -0.07 -1.06 0.00 0.00 0.36 0.00 0.00 54.97 54.20 2dc2 s GLU 90 Cb -0.15 -2.72 -0.05 0.00 0.26 0.00 0.00 34.13 31.47 2dc2 s GLU 90 CO 0.05 -0.37 0.11 0.14 -0.54 0.00 0.00 175.26 174.65 2dc2 s VAL 91 N 1.21 0.31 -0.02 3.70 -7.23 -0.74 -2.10 120.40 115.53 2dc2 s VAL 91 Ca -0.01 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.17 2dc2 s VAL 91 Cb -0.16 -2.55 0.01 0.00 0.56 0.00 0.00 36.38 34.25 2dc2 s VAL 91 CO -0.09 -0.03 -0.02 -0.69 -0.31 0.00 0.00 175.10 173.96 2dc2 s VAL 92 N -3.93 0.28 -0.09 1.32 1.01 0.15 -1.08 120.40 118.06 2dc2 s VAL 92 Ca 0.38 -0.04 -0.29 0.00 0.00 0.00 0.00 61.98 62.02 2dc2 s VAL 92 Cb 0.07 -0.31 -0.06 0.00 0.00 0.00 0.00 36.38 36.09 2dc2 s VAL 92 CO 0.12 0.13 1.77 -0.47 0.00 0.00 0.00 175.10 176.66 2dc2 s TYR 93 N 0.58 1.77 -0.22 5.22 6.14 -1.24 -1.12 117.35 128.48 2dc2 s TYR 93 Ca -0.06 0.16 -0.11 0.00 0.64 0.00 0.00 57.07 57.70 2dc2 s TYR 93 Cb -0.09 -4.01 -0.05 0.00 0.42 0.00 0.00 41.96 38.23 2dc2 s TYR 93 CO -0.01 -4.05 0.17 0.54 0.64 0.00 0.00 175.55 172.85 2dc2 s VAL 94 N 4.82 5.36 0.00 3.14 0.11 -1.13 -4.54 120.40 128.16 2dc2 s VAL 94 Ca 0.79 0.24 0.00 0.00 -2.93 0.00 0.00 61.98 60.08 2dc2 s VAL 94 Cb -0.33 -3.51 0.00 0.00 -1.53 0.00 0.00 36.38 31.00 2dc2 s VAL 94 CO 0.33 0.37 0.00 0.00 -3.33 0.00 0.00 175.10 172.47