#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 4.05 0.04 0.52 1.09 -1.26 -4.51 121.20 121.12 2dc2 s ILE 10 Ca 0.00 1.77 0.09 0.00 -1.10 0.00 0.00 60.65 61.40 2dc2 s ILE 10 Cb 0.00 -4.01 -0.03 0.00 -1.06 0.00 0.00 42.46 37.36 2dc2 s ILE 10 CO 0.00 0.21 -0.25 -0.60 -0.10 0.00 0.00 174.94 174.20 2dc2 s ARG 11 N -1.91 1.90 -0.27 2.79 3.52 -0.25 -5.02 118.95 119.71 2dc2 s ARG 11 Ca 0.49 -1.06 -0.04 0.00 -0.13 0.00 0.00 55.73 54.99 2dc2 s ARG 11 Cb -0.22 -2.03 0.02 0.00 -1.56 0.00 0.00 34.95 31.16 2dc2 s ARG 11 CO 0.27 0.52 0.00 0.15 -0.81 0.00 0.00 175.30 175.44 2dc2 s LYS 12 N -1.20 2.96 -0.08 5.12 -0.14 -1.26 -2.44 119.74 122.71 2dc2 s LYS 12 Ca 0.12 -0.92 0.03 0.00 -1.36 0.00 0.00 55.97 53.84 2dc2 s LYS 12 Cb -0.10 -3.16 0.01 0.00 -1.68 0.00 0.00 37.83 32.89 2dc2 s LYS 12 CO 0.02 -0.42 -0.16 0.08 -0.76 0.00 0.00 175.35 174.11 2dc2 s VAL 13 N 1.41 1.46 -0.16 3.17 1.01 -0.63 -5.05 120.40 121.60 2dc2 s VAL 13 Ca 0.01 -0.67 -0.11 0.00 0.00 0.00 0.00 61.98 61.21 2dc2 s VAL 13 Cb -0.17 -1.30 -0.05 0.00 0.00 0.00 0.00 36.38 34.87 2dc2 s VAL 13 CO -0.01 0.43 0.22 -0.76 0.00 0.00 0.00 175.10 174.97 2dc2 s LEU 14 N 0.54 4.27 0.03 3.92 1.02 -1.26 -1.49 118.68 125.71 2dc2 s LEU 14 Ca -0.16 0.44 0.05 0.00 0.02 0.00 0.00 54.13 54.48 2dc2 s LEU 14 Cb -0.16 -2.24 -0.02 0.00 0.02 0.00 0.00 46.19 43.79 2dc2 s LEU 14 CO 0.06 0.20 -0.14 -0.22 0.02 0.00 0.00 176.35 176.26 2dc2 s LEU 15 N 0.06 2.14 -0.29 1.79 0.20 -0.91 -4.98 118.68 116.69 2dc2 s LEU 15 Ca 0.14 -0.42 -0.06 0.00 0.69 0.00 0.00 54.13 54.48 2dc2 s LEU 15 Cb -0.12 -0.64 0.01 0.00 -0.43 0.00 0.00 46.19 45.00 2dc2 s LEU 15 CO 0.03 0.07 0.07 -0.22 -0.29 0.00 0.00 176.35 176.00 2dc2 s LEU 16 N -0.97 3.81 -0.07 -0.68 0.20 -1.26 -2.64 118.68 117.07 2dc2 s LEU 16 Ca 0.03 -0.72 -0.14 0.00 0.69 0.00 0.00 54.13 53.98 2dc2 s LEU 16 Cb -0.07 -1.87 -0.05 0.00 -0.43 0.00 0.00 46.19 43.77 2dc2 s LEU 16 CO 0.01 -0.19 0.36 -0.75 -0.29 0.00 0.00 176.35 175.50 2dc2 s LYS 17 N 1.49 4.01 0.20 1.98 2.20 -1.19 -4.81 119.74 123.61 2dc2 s LYS 17 Ca 0.02 0.29 0.11 0.00 -0.36 0.00 0.00 55.97 56.04 2dc2 s LYS 17 Cb -0.17 -3.29 -0.04 0.00 -1.51 0.00 0.00 37.83 32.81 2dc2 s LYS 17 CO 0.02 0.52 -0.21 -2.00 -0.36 0.00 0.00 175.35 173.32 2dc2 s GLU 18 N -0.48 1.62 0.34 4.03 2.12 -1.21 -4.48 118.70 120.65 2dc2 s GLU 18 Ca 0.22 -1.50 0.04 0.00 0.36 0.00 0.00 54.97 54.09 2dc2 s GLU 18 Cb -0.15 -1.89 0.66 0.00 0.26 0.00 0.00 34.13 33.00 2dc2 s GLU 18 CO 0.10 0.40 1.94 -0.44 -0.54 0.00 0.00 175.26 176.72 2dc2 h ASP 19 N 3.10 0.76 1.16 -1.70 5.19 -1.98 -1.76 116.42 121.19 2dc2 h ASP 19 Ca -0.46 0.00 -0.16 0.00 -0.62 0.00 0.00 57.03 55.80 2dc2 h ASP 19 Cb 1.21 -0.16 -0.02 0.00 0.18 0.00 0.00 39.33 40.54 2dc2 h ASP 19 CO 0.50 0.49 -0.87 1.12 -3.12 0.00 0.00 179.24 177.35 2dc2 h HIS 20 N 0.86 0.00 -3.54 4.55 2.07 -2.04 -3.43 115.15 113.63 2dc2 h HIS 20 Ca 0.34 0.00 -0.71 0.00 -2.85 0.00 0.00 60.37 57.14 2dc2 h HIS 20 Cb 0.22 0.00 -0.23 0.00 2.57 0.00 0.00 27.41 29.97 2dc2 h HIS 20 CO -0.00 0.68 -0.47 -1.21 -3.07 0.00 0.00 177.93 173.86 2dc2 s GLU 21 N -2.86 2.89 0.00 5.12 0.41 -0.66 -5.08 118.70 118.52 2dc2 s GLU 21 Ca 0.01 -1.05 0.00 0.00 -0.41 0.00 0.00 54.97 53.52 2dc2 s GLU 21 Cb 0.08 -3.86 0.00 0.00 -1.78 0.00 0.00 34.13 28.57 2dc2 s GLU 21 CO 0.78 -0.73 0.00 0.41 -0.49 0.00 0.00 175.26 175.23 2dc2 n GLY 22 N 5.08 -2.08 0.53 -1.39 0.00 -1.26 -3.29 105.19 102.77 2dc2 n GLY 22 Ca -0.11 -1.18 -0.20 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.12 0.00 0.99 6.46 -1.98 -3.44 115.31 116.21 2dc2 h LEU 23 Ca 0.00 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 2dc2 h LEU 23 Cb 0.00 0.29 0.00 0.00 -0.73 0.00 0.00 40.66 40.22 2dc2 h LEU 23 CO 0.00 -0.79 0.00 0.61 -0.62 0.00 0.00 178.44 177.64 2dc2 n GLY 24 N -1.58 1.04 3.04 3.75 0.00 -1.26 -4.60 105.19 105.58 2dc2 n GLY 24 Ca -0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.26 0.32 -0.07 -0.61 -4.36 -1.26 -1.44 121.20 111.52 2dc2 s ILE 25 Ca 0.00 -1.22 0.03 0.00 -0.26 0.00 0.00 60.65 59.21 2dc2 s ILE 25 Cb 0.00 -0.72 -0.02 0.00 1.25 0.00 0.00 42.46 42.97 2dc2 s ILE 25 CO 0.00 -0.59 -0.17 -0.44 0.24 0.00 0.00 174.94 173.99 2dc2 s SER 26 N -1.90 3.79 0.21 4.36 0.01 -0.88 -4.99 113.70 114.30 2dc2 s SER 26 Ca -0.08 -0.30 0.10 0.00 1.31 0.00 0.00 55.95 56.99 2dc2 s SER 26 Cb -0.05 -1.00 -0.04 0.00 0.21 0.00 0.00 66.02 65.13 2dc2 s SER 26 CO -0.02 0.28 -0.16 0.27 0.41 0.00 0.00 173.24 174.02 2dc2 s ILE 27 N -0.36 2.78 0.01 1.44 -4.36 -1.26 -2.63 121.20 116.83 2dc2 s ILE 27 Ca 0.03 -1.95 -0.01 0.00 -0.26 0.00 0.00 60.65 58.46 2dc2 s ILE 27 Cb -0.12 -2.39 -0.01 0.00 1.25 0.00 0.00 42.46 41.19 2dc2 s ILE 27 CO 0.02 -0.19 -0.01 0.28 0.24 0.00 0.00 174.94 175.29 2dc2 s THR 28 N -1.89 0.08 -1.91 8.37 -1.32 -0.31 -4.93 115.64 113.73 2dc2 s THR 28 Ca 0.25 -0.63 0.00 0.00 -1.21 0.00 0.00 61.69 60.09 2dc2 s THR 28 Cb -0.08 -0.21 0.00 0.00 -1.51 0.00 0.00 72.50 70.71 2dc2 s THR 28 CO 0.14 -0.35 0.00 0.61 -2.21 0.00 0.00 174.62 172.81 2dc2 n GLY 29 N 2.01 0.60 3.16 6.08 0.00 -1.26 -2.05 105.19 113.73 2dc2 n GLY 29 Ca -0.20 -2.15 0.05 0.00 0.00 0.00 0.00 46.02 43.72 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 0.11 0.50 -0.02 0.00 -1.24 -4.81 107.32 101.86 2dc2 s GLY 30 Ca 0.00 3.41 0.16 0.00 0.00 0.00 0.00 44.72 48.29 2dc2 s GLY 30 CO 0.00 3.73 2.11 1.70 0.00 0.00 0.00 173.10 180.64 2dc2 h LYS 31 N 7.57 0.00 -0.33 2.90 1.63 -1.58 -1.80 116.57 124.96 2dc2 h LYS 31 Ca -0.11 0.00 0.07 0.00 -0.85 0.00 0.00 60.65 59.76 2dc2 h LYS 31 Cb 1.16 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.77 2dc2 h LYS 31 CO -0.11 0.05 0.23 1.49 -3.45 0.00 0.00 179.45 177.66 2dc2 h GLU 32 N 0.00 0.13 0.00 1.90 4.81 -1.84 0.10 114.58 119.68 2dc2 h GLU 32 Ca -0.00 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 2dc2 h GLU 32 Cb 0.09 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2dc2 h GLU 32 CO 0.01 0.09 -0.30 0.45 -0.73 0.00 0.00 179.01 178.52 2dc2 h HIS 33 N 0.14 0.00 0.00 0.92 3.86 -1.74 -3.47 115.15 114.86 2dc2 h HIS 33 Ca 0.15 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 2dc2 h HIS 33 Cb 0.43 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.90 2dc2 h HIS 33 CO -0.00 0.30 0.00 0.41 0.86 0.00 0.00 177.93 179.50 2dc2 n GLY 34 N 1.10 1.83 3.08 2.45 0.00 0.02 -5.13 105.19 108.55 2dc2 n GLY 34 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 0.74 1.61 -7.23 -1.22 -5.02 120.40 107.28 2dc2 s VAL 35 Ca 0.00 -0.02 -0.13 0.00 -1.81 0.00 0.00 61.98 60.02 2dc2 s VAL 35 Cb 0.00 -0.28 0.04 0.00 0.56 0.00 0.00 36.38 36.70 2dc2 s VAL 35 CO 0.00 -0.01 1.12 -2.16 -0.31 0.00 0.00 175.10 173.74 2dc2 s PRO 36 N 0.05 2.32 0.09 4.82 0.04 -1.26 -1.91 135.00 139.15 2dc2 s PRO 36 Ca -0.00 1.39 -0.24 0.00 0.04 0.00 0.00 61.00 62.19 2dc2 s PRO 36 Cb -0.02 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.57 2dc2 s PRO 36 CO 0.00 -1.63 0.72 0.42 0.04 0.00 0.00 177.00 176.56 2dc2 s ILE 37 N -2.50 4.61 0.10 0.56 1.01 -1.26 -4.51 121.20 119.20 2dc2 s ILE 37 Ca 0.66 1.55 0.06 0.00 0.00 0.00 0.00 60.65 62.93 2dc2 s ILE 37 Cb -0.21 -4.07 -0.03 0.00 0.01 0.00 0.00 42.46 38.16 2dc2 s ILE 37 CO 0.49 0.46 -0.16 -0.76 0.00 0.00 0.00 174.94 174.96 2dc2 s LEU 38 N -0.65 2.32 -0.21 2.97 1.02 -0.87 -2.25 118.68 121.00 2dc2 s LEU 38 Ca 0.35 -0.69 -0.23 0.00 0.02 0.00 0.00 54.13 53.58 2dc2 s LEU 38 Cb -0.21 -0.65 -0.02 0.00 0.02 0.00 0.00 46.19 45.33 2dc2 s LEU 38 CO 0.23 -0.05 0.73 -0.63 0.02 0.00 0.00 176.35 176.66 2dc2 s ILE 39 N -1.45 4.93 -0.06 -0.59 1.01 0.95 -1.16 121.20 124.83 2dc2 s ILE 39 Ca 0.04 1.39 0.07 0.00 0.00 0.00 0.00 60.65 62.15 2dc2 s ILE 39 Cb -0.09 -4.04 -0.10 0.00 0.01 0.00 0.00 42.46 38.24 2dc2 s ILE 39 CO 0.03 0.03 0.06 -1.20 0.00 0.00 0.00 174.94 173.86 2dc2 n SER 40 N 5.44 3.13 -4.63 3.58 7.64 -1.08 0.39 113.62 128.09 2dc2 n SER 40 Ca 0.02 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.58 2dc2 n SER 40 Cb 0.49 0.84 -0.10 0.00 -1.01 0.00 0.00 64.21 64.43 2dc2 n SER 40 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2dc2 s GLU 41 N -2.27 2.64 -0.08 1.43 2.02 -1.14 -4.77 118.70 116.53 2dc2 s GLU 41 Ca -0.04 -0.68 -0.01 0.00 0.02 0.00 0.00 54.97 54.27 2dc2 s GLU 41 Cb 0.03 -2.57 0.03 0.00 0.10 0.00 0.00 34.13 31.72 2dc2 s GLU 41 CO 0.32 0.61 -0.03 0.42 0.02 0.00 0.00 175.26 176.60 2dc2 s ILE 42 N -1.02 0.59 -0.38 -1.63 -1.09 -1.26 -2.07 121.20 114.34 2dc2 s ILE 42 Ca 0.18 -0.03 -0.16 0.00 -2.23 0.00 0.00 60.65 58.41 2dc2 s ILE 42 Cb -0.11 -0.69 0.01 0.00 -1.58 0.00 0.00 42.46 40.08 2dc2 s ILE 42 CO 0.08 0.29 0.36 -1.00 -1.23 0.00 0.00 174.94 173.44 2dc2 s HIS 43 N 1.76 3.20 0.59 3.97 3.76 -0.52 -5.03 115.29 123.02 2dc2 s HIS 43 Ca 0.03 -0.28 -0.18 0.00 -0.15 0.00 0.00 55.06 54.48 2dc2 s HIS 43 Cb -0.13 -2.71 -0.04 0.00 1.11 0.00 0.00 32.58 30.82 2dc2 s HIS 43 CO -0.05 -0.55 1.14 -1.25 -0.85 0.00 0.00 174.74 173.17 2dc2 s PRO 44 N 1.96 3.11 0.00 8.40 0.04 -1.26 -3.77 135.00 143.47 2dc2 s PRO 44 Ca 0.10 1.58 0.00 0.00 0.04 0.00 0.00 61.00 62.72 2dc2 s PRO 44 Cb -0.17 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.39 2dc2 s PRO 44 CO 0.12 -1.04 0.00 0.41 0.04 0.00 0.00 177.00 176.53 2dc2 n GLY 45 N 0.02 2.93 3.94 0.56 0.00 -1.26 -4.98 105.19 106.40 2dc2 n GLY 45 Ca 0.12 -0.68 -0.28 0.00 0.00 0.00 0.00 46.02 45.17 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 0.00 1.15 0.52 1.61 -0.21 -1.25 -4.84 119.66 116.64 2dc2 s GLN 46 Ca 0.00 -0.45 0.30 0.00 0.02 0.00 0.00 55.36 55.23 2dc2 s GLN 46 Cb 0.00 -1.98 1.44 0.00 1.00 0.00 0.00 33.01 33.47 2dc2 s GLN 46 CO 0.00 -2.02 1.88 -1.35 -2.12 0.00 0.00 175.29 171.68 2dc2 h PRO 47 N -1.27 0.05 -0.46 2.91 0.11 -1.87 -1.31 132.00 130.17 2dc2 h PRO 47 Ca -0.43 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.71 2dc2 h PRO 47 Cb 1.26 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.32 2dc2 h PRO 47 CO 0.44 0.03 0.23 0.00 -0.21 0.00 0.00 178.00 178.50 2dc2 h ALA 48 N 1.56 0.57 -0.27 -0.75 0.00 -1.85 0.12 119.26 118.64 2dc2 h ALA 48 Ca 0.44 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 55.23 2dc2 h ALA 48 Cb 1.66 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 2dc2 h ALA 48 CO -0.03 -0.12 -0.37 0.22 0.00 0.00 0.00 179.25 178.95 2dc2 h ASP 49 N 0.46 0.79 0.10 0.00 3.58 -1.44 -3.03 116.42 116.88 2dc2 h ASP 49 Ca 0.20 -0.50 -0.02 0.00 0.42 0.00 0.00 57.03 57.12 2dc2 h ASP 49 Cb 0.10 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 40.92 2dc2 h ASP 49 CO -0.13 1.14 -0.10 0.03 -2.88 0.00 0.00 179.24 177.30 2dc2 h ARG 50 N 0.46 0.01 0.00 0.28 3.08 -1.19 -1.86 114.38 115.16 2dc2 h ARG 50 Ca 0.03 -0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.99 2dc2 h ARG 50 Cb 0.96 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 2dc2 h ARG 50 CO 0.09 0.11 -0.41 0.00 -1.07 0.00 0.00 179.97 178.69 2dc2 n GLY 52 N -0.09 1.30 0.34 0.00 0.00 -0.70 -4.56 105.19 101.49 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 -7.28 -0.02 0.00 -1.89 -3.38 103.07 90.50 2dc2 h GLY 53 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 2dc2 h GLY 53 CO 0.00 0.00 0.48 -2.27 0.00 0.00 0.00 176.54 174.75 2dc2 s LEU 54 N -6.96 3.05 0.22 3.11 1.98 -1.26 -4.92 118.68 113.91 2dc2 s LEU 54 Ca -0.04 -0.37 0.09 0.00 -2.89 0.00 0.00 54.13 50.92 2dc2 s LEU 54 Cb 0.13 -2.55 -0.04 0.00 0.66 0.00 0.00 46.19 44.39 2dc2 s LEU 54 CO 0.47 -3.17 -0.06 -1.38 -1.89 0.00 0.00 176.35 170.31 2dc2 s HIS 55 N 11.88 2.64 0.31 5.38 -3.43 -1.26 -4.88 115.29 125.93 2dc2 s HIS 55 Ca 0.79 -0.23 -0.29 0.00 -0.80 0.00 0.00 55.06 54.53 2dc2 s HIS 55 Cb -0.09 -1.23 -0.11 0.00 -1.43 0.00 0.00 32.58 29.73 2dc2 s HIS 55 CO 0.03 0.58 1.43 0.08 -2.00 0.00 0.00 174.74 174.86 2dc2 s VAL 56 N -2.03 2.45 0.00 -5.38 1.01 -1.26 -3.81 120.40 111.37 2dc2 s VAL 56 Ca 0.28 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.68 2dc2 s VAL 56 Cb -0.07 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.04 2dc2 s VAL 56 CO 0.17 0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.97 2dc2 n GLY 57 N 1.36 0.66 3.31 4.51 0.00 0.16 -4.96 105.19 110.23 2dc2 n GLY 57 Ca 0.04 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.22 4.21 -0.24 1.61 1.01 -1.16 -2.51 116.67 117.36 2dc2 s ASP 58 Ca 0.00 -0.39 -0.15 0.00 0.71 0.00 0.00 52.55 52.71 2dc2 s ASP 58 Cb 0.00 -1.71 -0.04 0.00 1.01 0.00 0.00 42.92 42.18 2dc2 s ASP 58 CO 0.00 0.00 0.39 0.00 0.21 0.00 0.00 175.17 175.77 2dc2 s ALA 59 N 1.32 3.57 0.14 5.23 0.00 -0.99 -0.03 121.76 130.99 2dc2 s ALA 59 Ca 0.04 -0.70 -0.30 0.00 0.00 0.00 0.00 51.96 51.00 2dc2 s ALA 59 Cb -0.14 -2.68 -0.07 0.00 0.00 0.00 0.00 23.12 20.23 2dc2 s ALA 59 CO -0.03 -0.52 1.06 0.42 0.00 0.00 0.00 175.76 176.68 2dc2 s ILE 60 N 1.79 4.14 0.01 0.00 1.09 -0.96 -1.87 121.20 125.40 2dc2 s ILE 60 Ca 0.17 1.78 0.00 0.00 -1.10 0.00 0.00 60.65 61.49 2dc2 s ILE 60 Cb -0.15 -4.13 0.00 0.00 -1.06 0.00 0.00 42.46 37.11 2dc2 s ILE 60 CO 0.09 0.27 0.00 0.18 -0.10 0.00 0.00 174.94 175.38 2dc2 n LEU 61 N 2.70 0.06 -3.89 2.97 4.77 -0.54 -4.59 117.00 118.49 2dc2 n LEU 61 Ca 0.03 0.01 -0.11 0.00 -0.03 0.00 0.00 56.01 55.91 2dc2 n LEU 61 Cb 0.47 -0.02 -0.11 0.00 -2.33 0.00 0.00 43.42 41.43 2dc2 n LEU 61 CO 0.53 -0.09 -0.26 0.00 -1.33 0.00 0.00 177.39 176.24 2dc2 s ALA 62 N -2.00 -0.16 -0.12 -1.18 0.00 -1.16 -1.01 121.76 116.13 2dc2 s ALA 62 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 51.96 51.81 2dc2 s ALA 62 Cb 0.00 0.03 0.04 0.00 0.00 0.00 0.00 23.12 23.19 2dc2 s ALA 62 CO 0.00 -0.14 0.03 0.08 0.00 0.00 0.00 175.76 175.73 2dc2 s VAL 63 N -0.90 0.34 -1.66 0.00 1.01 -0.09 -0.48 120.40 118.62 2dc2 s VAL 63 Ca -0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 2dc2 s VAL 63 Cb -0.06 -0.66 0.00 0.00 0.00 0.00 0.00 36.38 35.66 2dc2 s VAL 63 CO 0.00 0.05 0.36 -3.20 0.00 0.00 0.00 175.10 172.31 2dc2 n ASN 64 N 5.14 -6.05 0.00 3.32 2.85 0.88 -1.23 115.26 120.17 2dc2 n ASN 64 Ca -0.07 -0.18 0.00 0.00 -0.11 0.00 0.00 54.58 54.22 2dc2 n ASN 64 Cb 0.49 -4.94 0.00 0.00 1.24 0.00 0.00 39.78 36.57 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 -1.32 2.45 3.72 8.20 0.00 -1.26 -5.00 105.19 111.99 2dc2 n GLY 65 Ca -0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.24 4.73 -0.03 1.61 1.01 -0.37 -5.02 120.40 120.10 2dc2 s VAL 66 Ca 0.00 1.90 -0.30 0.00 0.00 0.00 0.00 61.98 63.58 2dc2 s VAL 66 Cb 0.00 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 2dc2 s VAL 66 CO 0.00 0.27 1.15 0.54 0.00 0.00 0.00 175.10 177.06 2dc2 s ASN 67 N 0.40 7.12 0.00 3.32 4.22 -1.26 -0.91 114.94 127.83 2dc2 s ASN 67 Ca 0.46 1.80 0.00 0.00 -2.14 0.00 0.00 52.86 52.98 2dc2 s ASN 67 Cb -0.21 -2.56 0.00 0.00 1.28 0.00 0.00 41.25 39.75 2dc2 s ASN 67 CO 0.26 -0.51 0.53 -0.11 -2.04 0.00 0.00 177.10 175.24 2dc2 n LEU 68 N 4.78 1.06 0.11 3.54 0.00 -0.18 -4.64 117.00 121.68 2dc2 n LEU 68 Ca 0.10 -1.06 -0.02 0.00 0.00 0.00 0.00 56.01 55.02 2dc2 n LEU 68 Cb 0.47 0.00 0.18 0.00 0.00 0.00 0.00 43.42 44.07 2dc2 n LEU 68 CO 0.54 0.27 0.54 -0.09 0.00 0.00 0.00 177.39 178.65 2dc2 h ARG 69 N 0.00 0.13 -0.56 1.96 2.43 -1.70 -3.08 114.38 113.56 2dc2 h ARG 69 Ca 0.00 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2dc2 h ARG 69 Cb 0.06 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2dc2 h ARG 69 CO 0.00 0.65 0.00 -3.47 -1.51 0.00 0.00 179.97 175.64 2dc2 n ASP 70 N -3.90 3.83 -4.89 -3.80 2.03 -1.26 -4.88 116.55 103.68 2dc2 n ASP 70 Ca -0.02 -2.18 -0.31 0.00 0.52 0.00 0.00 54.79 52.80 2dc2 n ASP 70 Cb 0.57 -0.43 -0.04 0.00 -0.72 0.00 0.00 41.12 40.49 2dc2 n ASP 70 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2dc2 s THR 71 N -1.34 5.25 0.71 5.18 -4.23 -1.17 -5.03 115.64 115.02 2dc2 s THR 71 Ca 0.41 -0.43 -0.11 0.00 -1.18 0.00 0.00 61.69 60.38 2dc2 s THR 71 Cb 0.24 -3.55 0.02 0.00 1.34 0.00 0.00 72.50 70.55 2dc2 s THR 71 CO 0.24 0.15 1.07 -0.54 -0.54 0.00 0.00 174.62 175.00 2dc2 s LYS 72 N -2.44 2.81 0.15 3.99 3.01 -1.26 -4.36 119.74 121.63 2dc2 s LYS 72 Ca 0.33 0.86 -0.18 0.00 -1.01 0.00 0.00 55.97 55.97 2dc2 s LYS 72 Cb -0.13 -1.98 0.03 0.00 -1.01 0.00 0.00 37.83 34.74 2dc2 s LYS 72 CO 0.26 -1.17 1.70 1.25 0.51 0.00 0.00 175.35 177.90 2dc2 h HIS 73 N -0.77 -0.10 -0.67 3.18 -0.00 -1.90 -0.40 115.15 114.49 2dc2 h HIS 73 Ca -0.44 0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 59.92 2dc2 h HIS 73 Cb 1.22 0.09 -0.03 0.00 -0.00 0.00 0.00 27.41 28.69 2dc2 h HIS 73 CO 0.59 -0.10 0.30 0.87 -0.00 0.00 0.00 177.93 179.59 2dc2 h LYS 74 N 0.04 0.96 -0.62 5.26 1.79 -1.94 -2.21 116.57 119.84 2dc2 h LYS 74 Ca 0.14 -0.14 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 2dc2 h LYS 74 Cb 0.21 -0.17 -0.03 0.00 -1.58 0.00 0.00 32.23 30.66 2dc2 h LYS 74 CO -0.28 0.76 0.24 0.93 -1.08 0.00 0.00 179.45 180.02 2dc2 h GLU 75 N 0.95 0.90 -0.43 3.15 5.08 -1.68 -2.47 114.58 120.09 2dc2 h GLU 75 Ca 0.23 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2dc2 h GLU 75 Cb 0.13 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2dc2 h GLU 75 CO -0.03 0.74 0.09 0.00 -1.00 0.00 0.00 179.01 178.81 2dc2 h ALA 76 N 1.38 1.36 -0.61 3.43 0.00 -0.48 -1.99 119.26 122.34 2dc2 h ALA 76 Ca 0.21 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2dc2 h ALA 76 Cb 0.18 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2dc2 h ALA 76 CO -0.02 0.46 0.31 0.28 0.00 0.00 0.00 179.25 180.28 2dc2 h VAL 77 N 0.62 1.21 -0.10 0.00 2.07 -1.24 0.12 116.25 118.92 2dc2 h VAL 77 Ca 0.14 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 2dc2 h VAL 77 Cb 0.26 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2dc2 h VAL 77 CO -0.00 0.24 -0.00 0.74 0.02 0.00 0.00 177.57 178.57 2dc2 h THR 78 N 0.84 1.26 -0.72 2.57 2.02 -1.39 -2.47 112.91 115.02 2dc2 h THR 78 Ca 0.21 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.56 2dc2 h THR 78 Cb 0.10 1.60 -0.03 0.00 -1.74 0.00 0.00 68.15 68.07 2dc2 h THR 78 CO -0.03 0.23 0.40 0.40 0.37 0.00 0.00 175.52 176.90 2dc2 h ILE 79 N -0.10 1.22 -0.94 3.11 2.04 -1.23 -2.41 117.51 119.20 2dc2 h ILE 79 Ca 0.03 -0.53 0.04 0.00 1.00 0.00 0.00 64.86 65.40 2dc2 h ILE 79 Cb 0.36 0.26 -0.05 0.00 -0.74 0.00 0.00 36.82 36.64 2dc2 h ILE 79 CO 0.01 0.24 0.62 -0.07 0.00 0.00 0.00 178.15 178.94 2dc2 h LEU 80 N 0.99 1.02 -1.15 1.44 3.38 -0.72 -1.50 115.31 118.77 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 0.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2dc2 h LEU 80 CO -0.04 0.70 -0.19 -1.28 0.09 0.00 0.00 178.44 177.72 2dc2 h SER 81 N 1.18 0.35 0.34 -0.43 0.87 -0.97 -2.43 113.55 112.46 2dc2 h SER 81 Ca 0.37 -0.10 -0.04 0.00 -1.23 0.00 0.00 61.79 60.80 2dc2 h SER 81 Cb 0.01 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 2dc2 h SER 81 CO -0.12 0.56 -0.19 1.56 -0.53 0.00 0.00 176.83 178.12 2dc2 h GLN 82 N 0.33 0.00 -5.71 2.24 4.20 -0.87 -3.40 115.11 111.90 2dc2 h GLN 82 Ca 0.06 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.42 2dc2 h GLN 82 Cb 0.53 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 2dc2 h GLN 82 CO 0.03 0.19 1.02 -0.65 -0.67 0.00 0.00 178.83 178.75 2dc2 s GLN 83 N -4.29 2.29 -0.02 1.46 -1.52 -0.92 -4.95 119.66 111.72 2dc2 s GLN 83 Ca -0.03 0.54 -0.05 0.00 -1.95 0.00 0.00 55.36 53.87 2dc2 s GLN 83 Cb 0.14 -4.68 -0.04 0.00 -0.22 0.00 0.00 33.01 28.21 2dc2 s GLN 83 CO 0.64 -3.34 0.22 0.50 -0.25 0.00 0.00 175.29 173.06 2dc2 s ARG 84 N 7.66 3.52 5.82 2.91 3.52 -1.26 -4.90 118.95 136.21 2dc2 s ARG 84 Ca 0.80 -0.16 0.00 0.00 -0.13 0.00 0.00 55.73 56.24 2dc2 s ARG 84 Cb -0.12 -3.11 0.00 0.00 -1.56 0.00 0.00 34.95 30.16 2dc2 s ARG 84 CO 0.14 0.68 0.00 0.41 -0.81 0.00 0.00 175.30 175.72 2dc2 n GLY 85 N 1.22 1.30 3.73 8.12 0.00 -1.26 -4.66 105.19 113.65 2dc2 n GLY 85 Ca -0.13 0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 4.74 -0.05 1.61 2.12 -1.26 -3.18 118.70 122.67 2dc2 s GLU 86 Ca 0.00 1.46 -0.01 0.00 0.36 0.00 0.00 54.97 56.78 2dc2 s GLU 86 Cb 0.00 -3.35 0.03 0.00 0.26 0.00 0.00 34.13 31.07 2dc2 s GLU 86 CO 0.00 0.29 0.01 0.42 -0.54 0.00 0.00 175.26 175.44 2dc2 s ILE 87 N -0.30 0.22 -0.24 -3.70 1.01 -1.08 -5.00 121.20 112.11 2dc2 s ILE 87 Ca 0.45 0.18 -0.15 0.00 0.00 0.00 0.00 60.65 61.14 2dc2 s ILE 87 Cb -0.24 -0.39 -0.04 0.00 0.01 0.00 0.00 42.46 41.80 2dc2 s ILE 87 CO 0.30 0.22 0.36 -0.70 0.00 0.00 0.00 174.94 175.12 2dc2 s GLU 88 N 1.79 4.07 -0.15 2.79 2.12 -1.26 -2.15 118.70 125.91 2dc2 s GLU 88 Ca 0.01 0.05 -0.02 0.00 0.36 0.00 0.00 54.97 55.38 2dc2 s GLU 88 Cb -0.13 -3.60 -0.02 0.00 0.26 0.00 0.00 34.13 30.64 2dc2 s GLU 88 CO -0.04 -0.16 -0.08 -0.06 -0.54 0.00 0.00 175.26 174.38 2dc2 s PHE 89 N 1.71 2.91 -0.23 5.30 0.08 -0.55 -0.09 117.98 127.11 2dc2 s PHE 89 Ca 0.15 -0.54 -0.00 0.00 0.12 0.00 0.00 56.93 56.67 2dc2 s PHE 89 Cb -0.15 -1.92 0.03 0.00 -0.57 0.00 0.00 43.02 40.41 2dc2 s PHE 89 CO 0.09 -0.18 -0.10 -2.00 -0.10 0.00 0.00 175.22 172.92 2dc2 s GLU 90 N 0.49 2.76 0.24 0.44 2.12 0.37 -1.61 118.70 123.50 2dc2 s GLU 90 Ca -0.06 -1.01 0.01 0.00 0.36 0.00 0.00 54.97 54.26 2dc2 s GLU 90 Cb -0.15 -2.87 -0.04 0.00 0.26 0.00 0.00 34.13 31.33 2dc2 s GLU 90 CO 0.04 -0.39 0.13 0.14 -0.54 0.00 0.00 175.26 174.64 2dc2 s VAL 91 N 1.27 0.21 -0.01 3.70 -7.23 -1.02 -1.46 120.40 115.86 2dc2 s VAL 91 Ca -0.00 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 2dc2 s VAL 91 Cb -0.16 -2.54 0.00 0.00 0.56 0.00 0.00 36.38 34.23 2dc2 s VAL 91 CO -0.07 0.00 -0.05 0.54 -0.31 0.00 0.00 175.10 175.22 2dc2 s VAL 92 N -3.93 0.41 -0.07 1.32 0.11 -0.78 -1.09 120.40 116.36 2dc2 s VAL 92 Ca 0.38 -0.18 -0.30 0.00 -2.93 0.00 0.00 61.98 58.96 2dc2 s VAL 92 Cb 0.07 -0.37 -0.05 0.00 -1.53 0.00 0.00 36.38 34.50 2dc2 s VAL 92 CO 0.14 0.13 1.60 -0.47 -3.33 0.00 0.00 175.10 173.17 2dc2 s TYR 93 N 0.13 2.11 -0.18 1.54 6.14 -1.26 -2.36 117.35 123.46 2dc2 s TYR 93 Ca -0.01 0.31 -0.03 0.00 0.64 0.00 0.00 57.07 57.98 2dc2 s TYR 93 Cb -0.05 -3.85 -0.02 0.00 0.42 0.00 0.00 41.96 38.46 2dc2 s TYR 93 CO -0.00 -3.53 -0.05 0.08 0.64 0.00 0.00 175.55 172.68 2dc2 s VAL 94 N 3.96 3.52 0.00 3.14 1.01 -1.05 -5.01 120.40 125.98 2dc2 s VAL 94 Ca 0.71 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 62.22 2dc2 s VAL 94 Cb -0.32 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.50 2dc2 s VAL 94 CO 0.27 0.46 0.19 0.00 0.00 0.00 0.00 175.10 176.02