#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 5.34 -0.27 0.52 1.09 -1.26 -4.33 121.20 122.28 2dc2 s ILE 10 Ca 0.00 0.44 -0.05 0.00 -1.10 0.00 0.00 60.65 59.94 2dc2 s ILE 10 Cb 0.00 -3.51 0.01 0.00 -1.06 0.00 0.00 42.46 37.90 2dc2 s ILE 10 CO 0.00 0.60 0.02 -0.13 -0.10 0.00 0.00 174.94 175.34 2dc2 s ARG 11 N -1.02 3.08 -0.40 2.79 3.00 0.92 -5.01 118.95 122.31 2dc2 s ARG 11 Ca 0.18 -0.85 -0.16 0.00 0.00 0.00 0.00 55.73 54.90 2dc2 s ARG 11 Cb -0.14 -3.21 0.01 0.00 0.00 0.00 0.00 34.95 31.61 2dc2 s ARG 11 CO 0.07 -0.39 0.40 0.15 0.00 0.00 0.00 175.30 175.53 2dc2 s LYS 12 N 1.45 3.22 -0.04 3.54 3.01 -1.26 -2.26 119.74 127.40 2dc2 s LYS 12 Ca 0.02 -0.69 0.03 0.00 -1.01 0.00 0.00 55.97 54.32 2dc2 s LYS 12 Cb -0.17 -3.92 0.01 0.00 -1.01 0.00 0.00 37.83 32.74 2dc2 s LYS 12 CO -0.00 -0.74 -0.11 0.08 0.51 0.00 0.00 175.35 175.08 2dc2 s VAL 13 N 2.04 1.01 -0.16 3.17 1.01 -0.87 -5.07 120.40 121.55 2dc2 s VAL 13 Ca 0.11 -0.45 -0.08 0.00 0.00 0.00 0.00 61.98 61.56 2dc2 s VAL 13 Cb -0.17 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 2dc2 s VAL 13 CO 0.13 0.32 0.12 -0.76 0.00 0.00 0.00 175.10 174.90 2dc2 s LEU 14 N 0.38 4.19 -0.19 3.92 1.43 -1.26 -1.81 118.68 125.35 2dc2 s LEU 14 Ca -0.08 0.31 0.00 0.00 -1.03 0.00 0.00 54.13 53.33 2dc2 s LEU 14 Cb -0.12 -2.05 0.02 0.00 0.03 0.00 0.00 46.19 44.07 2dc2 s LEU 14 CO 0.02 0.29 -0.17 -0.76 0.23 0.00 0.00 176.35 175.96 2dc2 s LEU 15 N -0.32 2.27 -0.19 1.79 1.02 -0.31 -4.98 118.68 117.96 2dc2 s LEU 15 Ca 0.11 -0.62 -0.03 0.00 0.02 0.00 0.00 54.13 53.61 2dc2 s LEU 15 Cb -0.12 -1.52 -0.02 0.00 0.02 0.00 0.00 46.19 44.55 2dc2 s LEU 15 CO 0.01 -0.01 -0.05 -0.22 0.02 0.00 0.00 176.35 176.11 2dc2 s LEU 16 N 1.32 2.98 0.03 1.79 1.98 -1.26 -2.33 118.68 123.19 2dc2 s LEU 16 Ca 0.05 -0.30 0.01 0.00 -2.89 0.00 0.00 54.13 51.00 2dc2 s LEU 16 Cb -0.13 -1.74 -0.02 0.00 0.66 0.00 0.00 46.19 44.96 2dc2 s LEU 16 CO -0.11 0.06 -0.06 -1.59 -1.89 0.00 0.00 176.35 172.76 2dc2 s LYS 17 N 1.01 0.43 0.41 1.98 -2.85 -1.24 -4.77 119.74 114.70 2dc2 s LYS 17 Ca 0.00 -0.55 0.08 0.00 -1.00 0.00 0.00 55.97 54.50 2dc2 s LYS 17 Cb -0.15 -0.22 0.01 0.00 -2.06 0.00 0.00 37.83 35.41 2dc2 s LYS 17 CO 0.00 0.04 0.54 -1.21 0.10 0.00 0.00 175.35 174.83 2dc2 s GLU 18 N -1.13 2.86 0.30 1.78 0.41 -1.26 -4.10 118.70 117.55 2dc2 s GLU 18 Ca -0.08 -1.22 -0.02 0.00 -0.41 0.00 0.00 54.97 53.24 2dc2 s GLU 18 Cb -0.08 -2.75 0.45 0.00 -1.78 0.00 0.00 34.13 29.98 2dc2 s GLU 18 CO -0.00 -0.22 1.96 0.22 -0.49 0.00 0.00 175.26 176.73 2dc2 h ASP 19 N 0.70 0.92 0.72 -0.19 3.58 -2.00 -1.74 116.42 118.40 2dc2 h ASP 19 Ca -0.41 -0.04 -0.12 0.00 0.42 0.00 0.00 57.03 56.89 2dc2 h ASP 19 Cb 1.28 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 42.08 2dc2 h ASP 19 CO 0.47 0.69 -0.56 1.12 -2.88 0.00 0.00 179.24 178.07 2dc2 h HIS 20 N 1.07 0.00 -3.29 0.28 2.07 -2.06 -3.45 115.15 109.78 2dc2 h HIS 20 Ca 0.29 0.00 -0.46 0.00 -2.85 0.00 0.00 60.37 57.35 2dc2 h HIS 20 Cb -0.08 0.00 0.13 0.00 2.57 0.00 0.00 27.41 30.02 2dc2 h HIS 20 CO 0.00 0.56 0.29 -1.21 -3.07 0.00 0.00 177.93 174.50 2dc2 s GLU 21 N -3.56 1.16 0.00 5.12 2.02 -0.66 -5.12 118.70 117.66 2dc2 s GLU 21 Ca -0.01 -0.67 0.00 0.00 0.02 0.00 0.00 54.97 54.31 2dc2 s GLU 21 Cb 0.12 -2.06 0.00 0.00 0.10 0.00 0.00 34.13 32.29 2dc2 s GLU 21 CO 0.74 -1.96 0.00 0.41 0.02 0.00 0.00 175.26 174.48 2dc2 n GLY 22 N -3.35 6.13 0.06 -1.39 0.00 -1.26 -4.70 105.19 100.68 2dc2 n GLY 22 Ca 0.15 -1.76 -0.02 0.00 0.00 0.00 0.00 46.02 44.39 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 -0.11 0.00 0.99 3.38 -2.00 -3.46 115.31 114.12 2dc2 h LEU 23 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dc2 h LEU 23 Cb 0.00 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2dc2 h LEU 23 CO 0.00 -0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.13 2dc2 n GLY 24 N 0.64 0.74 3.08 0.83 0.00 -1.26 -4.71 105.19 104.50 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 -2.35 0.09 -0.04 -0.61 -5.25 -1.26 -1.15 121.20 110.62 2dc2 s ILE 25 Ca 0.00 -0.78 0.06 0.00 -0.99 0.00 0.00 60.65 58.94 2dc2 s ILE 25 Cb 0.00 -0.43 -0.01 0.00 2.95 0.00 0.00 42.46 44.97 2dc2 s ILE 25 CO 0.00 -0.43 -0.23 -0.44 -1.79 0.00 0.00 174.94 172.05 2dc2 s SER 26 N -1.47 2.82 0.21 4.36 0.01 -0.32 -4.97 113.70 114.34 2dc2 s SER 26 Ca -0.14 -0.46 0.09 0.00 1.31 0.00 0.00 55.95 56.75 2dc2 s SER 26 Cb -0.08 -0.62 -0.05 0.00 0.21 0.00 0.00 66.02 65.49 2dc2 s SER 26 CO 0.00 0.25 -0.18 0.27 0.41 0.00 0.00 173.24 173.99 2dc2 s ILE 27 N -0.27 2.02 -0.00 1.44 -4.36 -1.26 -2.25 121.20 116.52 2dc2 s ILE 27 Ca 0.01 -2.18 -0.04 0.00 -0.26 0.00 0.00 60.65 58.18 2dc2 s ILE 27 Cb -0.12 -2.07 -0.00 0.00 1.25 0.00 0.00 42.46 41.52 2dc2 s ILE 27 CO 0.02 -0.43 0.07 0.28 0.24 0.00 0.00 174.94 175.12 2dc2 s THR 28 N -2.49 0.07 -1.85 8.37 -1.32 0.02 -4.91 115.64 113.53 2dc2 s THR 28 Ca 0.23 -0.59 0.00 0.00 -1.21 0.00 0.00 61.69 60.11 2dc2 s THR 28 Cb -0.04 -0.30 0.00 0.00 -1.51 0.00 0.00 72.50 70.65 2dc2 s THR 28 CO 0.09 -0.33 0.00 0.61 -2.21 0.00 0.00 174.62 172.79 2dc2 n GLY 29 N 1.89 0.70 0.00 6.08 0.00 -1.26 -1.92 105.19 110.68 2dc2 n GLY 29 Ca -0.21 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.69 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 1.92 0.37 -0.02 0.00 -1.15 -4.79 105.19 101.53 2dc2 n GLY 30 Ca 0.00 0.39 0.13 0.00 0.00 0.00 0.00 46.02 46.55 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 0.46 -0.35 1.61 1.63 -1.76 -0.15 116.57 118.01 2dc2 h LYS 31 Ca 0.00 -0.03 0.07 0.00 -0.85 0.00 0.00 60.65 59.85 2dc2 h LYS 31 Cb 0.00 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.51 2dc2 h LYS 31 CO 0.00 0.30 0.25 1.49 -3.45 0.00 0.00 179.45 178.04 2dc2 h GLU 32 N 0.47 0.14 0.00 1.90 4.22 -1.86 -0.55 114.58 118.90 2dc2 h GLU 32 Ca 0.34 -0.01 -0.18 0.00 0.08 0.00 0.00 59.36 59.59 2dc2 h GLU 32 Cb 0.69 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 2dc2 h GLU 32 CO -0.11 0.09 -0.87 0.45 -2.18 0.00 0.00 179.01 176.39 2dc2 h HIS 33 N 0.15 0.00 0.00 0.92 3.86 -1.42 -3.48 115.15 115.18 2dc2 h HIS 33 Ca 0.16 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 2dc2 h HIS 33 Cb 0.46 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.93 2dc2 h HIS 33 CO -0.00 0.87 0.00 0.41 0.86 0.00 0.00 177.93 180.07 2dc2 n GLY 34 N 0.99 1.16 3.59 2.45 0.00 -0.22 -5.11 105.19 108.05 2dc2 n GLY 34 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.32 3.86 0.83 1.61 -7.23 -1.24 -4.93 120.40 112.98 2dc2 s VAL 35 Ca 0.00 -0.41 -0.12 0.00 -1.81 0.00 0.00 61.98 59.64 2dc2 s VAL 35 Cb 0.00 -2.61 0.10 0.00 0.56 0.00 0.00 36.38 34.43 2dc2 s VAL 35 CO 0.00 0.58 1.18 -2.84 -0.31 0.00 0.00 175.10 173.71 2dc2 s PRO 36 N -0.61 1.54 0.13 4.82 0.02 -1.26 -2.92 135.00 136.71 2dc2 s PRO 36 Ca 0.09 1.67 -0.27 0.00 0.02 0.00 0.00 61.00 62.51 2dc2 s PRO 36 Cb -0.12 -1.77 -0.07 0.00 0.02 0.00 0.00 34.50 32.56 2dc2 s PRO 36 CO 0.02 -2.27 0.86 0.42 -0.33 0.00 0.00 177.00 175.69 2dc2 s ILE 37 N -2.32 4.45 0.17 2.83 1.09 -1.26 -4.37 121.20 121.78 2dc2 s ILE 37 Ca 0.71 1.86 0.03 0.00 -1.10 0.00 0.00 60.65 62.15 2dc2 s ILE 37 Cb -0.26 -4.22 -0.05 0.00 -1.06 0.00 0.00 42.46 36.87 2dc2 s ILE 37 CO 0.52 0.42 -0.04 -1.48 -0.10 0.00 0.00 174.94 174.26 2dc2 s LEU 38 N -0.53 2.29 -0.06 2.97 0.05 -0.81 -1.35 118.68 121.24 2dc2 s LEU 38 Ca 0.41 -1.12 -0.25 0.00 0.05 0.00 0.00 54.13 53.22 2dc2 s LEU 38 Cb -0.23 -0.18 -0.03 0.00 -2.05 0.00 0.00 46.19 43.69 2dc2 s LEU 38 CO 0.27 -0.48 0.77 -0.63 -0.55 0.00 0.00 176.35 175.73 2dc2 s ILE 39 N -3.51 5.00 -0.04 1.48 1.01 0.13 -0.80 121.20 124.47 2dc2 s ILE 39 Ca 0.21 1.58 0.01 0.00 0.00 0.00 0.00 60.65 62.45 2dc2 s ILE 39 Cb 0.05 -4.10 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 2dc2 s ILE 39 CO 0.03 0.21 -0.03 -1.20 0.00 0.00 0.00 174.94 173.95 2dc2 n SER 40 N 3.94 3.77 -4.51 3.58 7.64 -0.95 -0.32 113.62 126.76 2dc2 n SER 40 Ca 0.01 -0.02 -0.31 0.00 1.01 0.00 0.00 58.87 59.56 2dc2 n SER 40 Cb 0.51 0.01 -0.12 0.00 -1.01 0.00 0.00 64.21 63.60 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 -2.07 2.18 -0.04 1.43 2.12 -1.13 -4.72 118.70 116.46 2dc2 s GLU 41 Ca -0.05 -0.94 0.02 0.00 0.36 0.00 0.00 54.97 54.37 2dc2 s GLU 41 Cb 0.01 -2.28 0.01 0.00 0.26 0.00 0.00 34.13 32.13 2dc2 s GLU 41 CO 0.09 0.55 -0.10 0.42 -0.54 0.00 0.00 175.26 175.68 2dc2 s ILE 42 N -1.00 0.90 -0.39 -3.70 1.01 -1.26 -1.18 121.20 115.58 2dc2 s ILE 42 Ca 0.16 -0.39 -0.22 0.00 0.00 0.00 0.00 60.65 60.20 2dc2 s ILE 42 Cb -0.11 -0.82 0.01 0.00 0.01 0.00 0.00 42.46 41.56 2dc2 s ILE 42 CO 0.07 0.29 0.74 -1.00 0.00 0.00 0.00 174.94 175.04 2dc2 s HIS 43 N 0.39 3.08 0.35 3.97 3.76 -0.30 -5.00 115.29 121.54 2dc2 s HIS 43 Ca -0.07 0.35 -0.28 0.00 -0.15 0.00 0.00 55.06 54.90 2dc2 s HIS 43 Cb -0.11 -3.42 -0.11 0.00 1.11 0.00 0.00 32.58 30.05 2dc2 s HIS 43 CO 0.01 -0.80 1.44 -2.14 -0.85 0.00 0.00 174.74 172.41 2dc2 s PRO 44 N 3.06 4.19 0.00 8.40 0.02 -1.26 -2.75 135.00 146.65 2dc2 s PRO 44 Ca 0.29 2.46 0.00 0.00 0.02 0.00 0.00 61.00 63.77 2dc2 s PRO 44 Cb -0.13 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.38 2dc2 s PRO 44 CO 0.18 -0.44 0.00 0.41 -0.33 0.00 0.00 177.00 176.82 2dc2 n GLY 45 N 0.79 2.88 3.70 0.52 0.00 -1.26 -5.02 105.19 106.81 2dc2 n GLY 45 Ca 0.02 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 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 0.57 0.53 1.61 1.11 -1.11 -4.72 119.66 117.65 2dc2 s GLN 46 Ca 0.00 0.44 0.31 0.00 0.01 0.00 0.00 55.36 56.13 2dc2 s GLN 46 Cb 0.00 -1.76 1.46 0.00 -1.01 0.00 0.00 33.01 31.70 2dc2 s GLN 46 CO 0.00 -2.62 1.87 -1.00 0.01 0.00 0.00 175.29 173.55 2dc2 h PRO 47 N -1.81 0.04 -0.37 2.91 0.13 -1.86 -0.45 132.00 130.59 2dc2 h PRO 47 Ca -0.54 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2dc2 h PRO 47 Cb 1.33 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.44 2dc2 h PRO 47 CO 0.59 0.02 0.22 0.00 -0.23 0.00 0.00 178.00 178.60 2dc2 h ALA 48 N 1.53 0.48 -0.33 -0.56 0.00 -1.85 -2.06 119.26 116.47 2dc2 h ALA 48 Ca 0.46 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 55.15 2dc2 h ALA 48 Cb 1.77 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 2dc2 h ALA 48 CO -0.03 -0.02 -0.43 -0.44 0.00 0.00 0.00 179.25 178.34 2dc2 h ASP 49 N 0.49 0.90 -0.46 0.00 5.19 -1.30 -3.04 116.42 118.19 2dc2 h ASP 49 Ca 0.13 -0.43 0.05 0.00 -0.62 0.00 0.00 57.03 56.17 2dc2 h ASP 49 Cb 0.02 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 39.25 2dc2 h ASP 49 CO -0.02 1.20 0.31 0.03 -3.12 0.00 0.00 179.24 177.64 2dc2 h ARG 50 N 0.68 0.40 0.00 3.56 3.08 -1.17 -1.11 114.38 119.81 2dc2 h ARG 50 Ca 0.05 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 59.99 2dc2 h ARG 50 Cb 1.00 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.95 2dc2 h ARG 50 CO 0.10 0.26 -0.42 0.00 -1.07 0.00 0.00 179.97 178.84 2dc2 n GLY 52 N -0.01 0.98 0.01 0.00 0.00 -0.42 -4.79 105.19 100.95 2dc2 n GLY 52 Ca -0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.57 -0.07 3.55 -0.02 0.00 -1.26 -4.95 105.19 101.85 2dc2 n GLY 53 Ca -0.09 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 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 -4.66 3.36 0.21 0.99 0.20 -1.26 -4.94 118.68 112.58 2dc2 s LEU 54 Ca -0.02 0.82 0.08 0.00 0.69 0.00 0.00 54.13 55.70 2dc2 s LEU 54 Cb 0.01 -2.51 -0.04 0.00 -0.43 0.00 0.00 46.19 43.22 2dc2 s LEU 54 CO 0.08 -2.78 0.03 -1.38 -0.29 0.00 0.00 176.35 172.01 2dc2 s HIS 55 N 11.43 2.86 0.22 5.38 -3.43 -1.26 -4.89 115.29 125.59 2dc2 s HIS 55 Ca 0.89 -0.15 -0.31 0.00 -0.80 0.00 0.00 55.06 54.69 2dc2 s HIS 55 Cb -0.16 -1.34 -0.10 0.00 -1.43 0.00 0.00 32.58 29.55 2dc2 s HIS 55 CO 0.24 0.54 1.54 0.08 -2.00 0.00 0.00 174.74 175.14 2dc2 s VAL 56 N -1.93 2.51 0.00 -5.38 1.01 -1.26 -3.84 120.40 111.51 2dc2 s VAL 56 Ca 0.29 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.67 2dc2 s VAL 56 Cb -0.08 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 33.04 2dc2 s VAL 56 CO 0.20 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.96 2dc2 n GLY 57 N 2.97 0.64 3.29 4.51 0.00 0.56 -4.96 105.19 112.20 2dc2 n GLY 57 Ca 0.11 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.65 4.29 -0.21 1.61 1.01 -1.16 -2.12 116.67 118.44 2dc2 s ASP 58 Ca 0.00 -0.50 -0.19 0.00 0.71 0.00 0.00 52.55 52.57 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 -0.05 0.55 0.00 0.21 0.00 0.00 175.17 175.89 2dc2 s ALA 59 N 1.45 3.55 0.13 5.23 0.00 -0.83 0.18 121.76 131.47 2dc2 s ALA 59 Ca 0.05 -0.38 -0.30 0.00 0.00 0.00 0.00 51.96 51.32 2dc2 s ALA 59 Cb -0.15 -2.87 -0.07 0.00 0.00 0.00 0.00 23.12 20.04 2dc2 s ALA 59 CO -0.04 -0.51 1.08 0.42 0.00 0.00 0.00 175.76 176.71 2dc2 s ILE 60 N 1.80 4.10 0.00 0.00 1.01 -0.46 -1.92 121.20 125.73 2dc2 s ILE 60 Ca 0.25 1.71 0.00 0.00 0.00 0.00 0.00 60.65 62.61 2dc2 s ILE 60 Cb -0.16 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.22 2dc2 s ILE 60 CO 0.10 0.25 0.00 0.18 0.00 0.00 0.00 174.94 175.47 2dc2 n LEU 61 N 2.84 0.05 -4.04 2.97 4.32 -0.92 -4.65 117.00 117.56 2dc2 n LEU 61 Ca 0.04 0.00 -0.15 0.00 -0.02 0.00 0.00 56.01 55.87 2dc2 n LEU 61 Cb 0.47 0.00 -0.13 0.00 -1.62 0.00 0.00 43.42 42.14 2dc2 n LEU 61 CO 0.53 -0.15 -0.42 0.00 -1.22 0.00 0.00 177.39 176.14 2dc2 s ALA 62 N -1.99 0.65 -0.09 -1.18 0.00 -1.16 -1.60 121.76 116.39 2dc2 s ALA 62 Ca 0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 51.96 51.35 2dc2 s ALA 62 Cb 0.00 -0.06 0.04 0.00 0.00 0.00 0.00 23.12 23.10 2dc2 s ALA 62 CO 0.00 0.07 0.06 0.08 0.00 0.00 0.00 175.76 175.98 2dc2 s VAL 63 N -0.82 -0.05 -1.54 0.00 1.01 0.54 -1.31 120.40 118.23 2dc2 s VAL 63 Ca -0.03 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.10 2dc2 s VAL 63 Cb -0.07 -0.34 0.01 0.00 0.00 0.00 0.00 36.38 35.99 2dc2 s VAL 63 CO 0.00 0.03 0.42 -3.20 0.00 0.00 0.00 175.10 172.36 2dc2 n ASN 64 N 5.27 -5.63 0.00 3.32 2.85 -0.30 -1.08 115.26 119.69 2dc2 n ASN 64 Ca -0.05 -0.21 0.00 0.00 -0.11 0.00 0.00 54.58 54.21 2dc2 n ASN 64 Cb 0.50 -4.60 0.00 0.00 1.24 0.00 0.00 39.78 36.91 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 2.58 3.71 8.20 0.00 -1.26 -5.01 105.19 112.08 2dc2 n GLY 65 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.15 5.12 0.25 1.61 1.01 -0.24 -5.06 120.40 120.93 2dc2 s VAL 66 Ca 0.00 1.14 -0.28 0.00 0.00 0.00 0.00 61.98 62.84 2dc2 s VAL 66 Cb 0.00 -3.91 -0.09 0.00 0.00 0.00 0.00 36.38 32.38 2dc2 s VAL 66 CO 0.00 0.27 0.91 0.54 0.00 0.00 0.00 175.10 176.81 2dc2 s ASN 67 N 0.79 7.51 -0.16 3.32 4.22 -1.26 -0.34 114.94 129.02 2dc2 s ASN 67 Ca 0.30 1.85 0.17 0.00 -2.14 0.00 0.00 52.86 53.05 2dc2 s ASN 67 Cb -0.16 -2.58 0.38 0.00 1.28 0.00 0.00 41.25 40.17 2dc2 s ASN 67 CO 0.13 0.11 1.25 0.18 -2.04 0.00 0.00 177.10 176.72 2dc2 n LEU 68 N 1.25 2.91 0.05 3.54 4.32 -0.62 -4.67 117.00 123.78 2dc2 n LEU 68 Ca -0.02 -3.15 -0.06 0.00 -0.02 0.00 0.00 56.01 52.76 2dc2 n LEU 68 Cb 0.48 -0.48 0.10 0.00 -1.62 0.00 0.00 43.42 41.91 2dc2 n LEU 68 CO 0.48 0.77 0.49 -0.09 -1.22 0.00 0.00 177.39 177.82 2dc2 h ARG 69 N 0.64 0.36 -0.52 3.23 9.65 -1.91 -3.16 114.38 122.66 2dc2 h ARG 69 Ca 0.01 -0.23 0.00 0.00 -1.10 0.00 0.00 59.98 58.66 2dc2 h ARG 69 Cb 1.16 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.77 2dc2 h ARG 69 CO 0.08 0.83 0.00 -0.40 2.80 0.00 0.00 179.97 183.28 2dc2 n ASP 70 N -3.92 3.48 -4.82 -3.80 5.75 -1.26 -4.98 116.55 106.99 2dc2 n ASP 70 Ca -0.03 -1.97 -0.22 0.00 -0.01 0.00 0.00 54.79 52.56 2dc2 n ASP 70 Cb 0.60 -0.35 0.10 0.00 -1.03 0.00 0.00 41.12 40.44 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 -1.09 2.00 0.29 2.12 -4.23 -1.20 -5.08 115.64 108.44 2dc2 s THR 71 Ca 0.38 -0.80 0.10 0.00 -1.18 0.00 0.00 61.69 60.18 2dc2 s THR 71 Cb 0.20 -2.20 -0.05 0.00 1.34 0.00 0.00 72.50 71.80 2dc2 s THR 71 CO 0.27 0.00 -0.01 -0.54 -0.54 0.00 0.00 174.62 173.80 2dc2 s LYS 72 N -4.97 2.20 0.14 3.99 3.01 -1.26 -4.48 119.74 118.37 2dc2 s LYS 72 Ca 0.66 -1.52 -0.20 0.00 -1.01 0.00 0.00 55.97 53.89 2dc2 s LYS 72 Cb -0.04 -2.08 0.01 0.00 -1.01 0.00 0.00 37.83 34.71 2dc2 s LYS 72 CO 0.43 0.30 1.67 1.25 0.51 0.00 0.00 175.35 179.51 2dc2 h HIS 73 N 1.89 -0.29 -0.77 3.18 -0.00 -1.91 0.20 115.15 117.45 2dc2 h HIS 73 Ca -0.43 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 59.96 2dc2 h HIS 73 Cb 1.25 0.16 -0.04 0.00 -0.00 0.00 0.00 27.41 28.79 2dc2 h HIS 73 CO 0.70 -0.18 0.48 -0.22 -0.00 0.00 0.00 177.93 178.71 2dc2 h LYS 74 N -0.10 1.04 -0.64 5.26 3.64 -1.96 -2.23 116.57 121.57 2dc2 h LYS 74 Ca 0.12 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 2dc2 h LYS 74 Cb 0.28 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 2dc2 h LYS 74 CO -0.29 0.72 0.22 0.93 -2.27 0.00 0.00 179.45 178.76 2dc2 h GLU 75 N 1.05 0.96 -0.63 1.90 3.07 -1.77 -2.61 114.58 116.55 2dc2 h GLU 75 Ca 0.28 -0.18 -0.05 0.00 -0.50 0.00 0.00 59.36 58.91 2dc2 h GLU 75 Cb -0.07 -0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 27.66 2dc2 h GLU 75 CO -0.06 0.81 0.19 0.00 -1.40 0.00 0.00 179.01 178.56 2dc2 h ALA 76 N 1.31 1.15 -0.50 3.43 0.00 -0.06 -2.09 119.26 122.50 2dc2 h ALA 76 Ca 0.21 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2dc2 h ALA 76 Cb 0.23 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2dc2 h ALA 76 CO -0.01 0.59 0.26 0.28 0.00 0.00 0.00 179.25 180.36 2dc2 h VAL 77 N 0.92 1.18 -0.40 0.00 2.07 -1.06 -0.52 116.25 118.44 2dc2 h VAL 77 Ca 0.21 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 2dc2 h VAL 77 Cb 0.27 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 2dc2 h VAL 77 CO -0.01 0.19 0.19 0.74 0.02 0.00 0.00 177.57 178.70 2dc2 h THR 78 N 0.66 1.18 -0.84 2.57 2.02 -1.29 -2.53 112.91 114.67 2dc2 h THR 78 Ca 0.17 -0.51 -0.02 0.00 0.77 0.00 0.00 66.41 66.82 2dc2 h THR 78 Cb 0.07 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 2dc2 h THR 78 CO -0.03 0.19 0.45 0.40 0.37 0.00 0.00 175.52 176.90 2dc2 h ILE 79 N 0.51 1.25 -0.93 3.11 2.04 -1.15 -2.31 117.51 120.04 2dc2 h ILE 79 Ca 0.14 -0.65 0.05 0.00 1.00 0.00 0.00 64.86 65.40 2dc2 h ILE 79 Cb 0.13 0.13 -0.06 0.00 -0.74 0.00 0.00 36.82 36.29 2dc2 h ILE 79 CO -0.02 0.29 0.61 -0.07 0.00 0.00 0.00 178.15 178.96 2dc2 h LEU 80 N 1.18 0.97 -1.03 1.44 3.38 -0.82 -1.28 115.31 119.16 2dc2 h LEU 80 Ca 0.30 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.17 2dc2 h LEU 80 Cb 0.06 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2dc2 h LEU 80 CO -0.04 0.65 -0.31 -1.28 0.09 0.00 0.00 178.44 177.54 2dc2 h SER 81 N 1.12 0.31 0.28 -0.43 0.87 -1.01 -2.73 113.55 111.95 2dc2 h SER 81 Ca 0.38 -0.11 -0.04 0.00 -1.23 0.00 0.00 61.79 60.79 2dc2 h SER 81 Cb 0.09 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2dc2 h SER 81 CO -0.13 0.61 -0.21 1.56 -0.53 0.00 0.00 176.83 178.13 2dc2 h GLN 82 N 0.27 0.00 -6.14 2.24 4.20 -0.83 -3.42 115.11 111.43 2dc2 h GLN 82 Ca 0.04 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.16 2dc2 h GLN 82 Cb 0.69 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.45 2dc2 h GLN 82 CO 0.05 0.21 1.37 -0.65 -0.67 0.00 0.00 178.83 179.14 2dc2 s GLN 83 N -4.41 3.28 0.06 1.46 -1.52 -1.03 -4.97 119.66 112.52 2dc2 s GLN 83 Ca -0.03 1.76 0.05 0.00 -1.95 0.00 0.00 55.36 55.19 2dc2 s GLN 83 Cb 0.15 -4.27 -0.04 0.00 -0.22 0.00 0.00 33.01 28.63 2dc2 s GLN 83 CO 0.68 -1.92 -0.08 0.50 -0.25 0.00 0.00 175.29 174.22 2dc2 s ARG 84 N 5.90 2.36 5.62 2.91 6.06 -1.26 -4.95 118.95 135.60 2dc2 s ARG 84 Ca 0.90 -0.87 0.00 0.00 -2.50 0.00 0.00 55.73 53.25 2dc2 s ARG 84 Cb -0.28 -2.41 0.00 0.00 0.06 0.00 0.00 34.95 32.31 2dc2 s ARG 84 CO 0.34 0.55 0.00 0.41 -2.50 0.00 0.00 175.30 174.11 2dc2 n GLY 85 N 1.07 1.20 3.68 8.12 0.00 -1.26 -4.58 105.19 113.42 2dc2 n GLY 85 Ca -0.14 0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 4.37 -0.13 1.61 2.12 -1.26 -3.60 118.70 121.81 2dc2 s GLU 86 Ca 0.00 1.21 0.01 0.00 0.36 0.00 0.00 54.97 56.55 2dc2 s GLU 86 Cb 0.00 -3.55 0.02 0.00 0.26 0.00 0.00 34.13 30.86 2dc2 s GLU 86 CO 0.00 -0.31 -0.15 0.42 -0.54 0.00 0.00 175.26 174.68 2dc2 s ILE 87 N 2.03 1.55 -0.14 -3.70 1.01 -0.98 -5.03 121.20 115.93 2dc2 s ILE 87 Ca 0.44 -0.64 -0.16 0.00 0.00 0.00 0.00 60.65 60.29 2dc2 s ILE 87 Cb -0.17 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.82 2dc2 s ILE 87 CO 0.15 0.45 0.38 -1.61 0.00 0.00 0.00 174.94 174.32 2dc2 s GLU 88 N 1.27 4.29 -0.09 2.79 2.02 -1.26 -1.16 118.70 126.57 2dc2 s GLU 88 Ca -0.00 0.27 0.03 0.00 0.02 0.00 0.00 54.97 55.29 2dc2 s GLU 88 Cb -0.14 -3.44 0.01 0.00 0.10 0.00 0.00 34.13 30.66 2dc2 s GLU 88 CO -0.07 0.18 -0.18 0.12 0.02 0.00 0.00 175.26 175.33 2dc2 s PHE 89 N 0.59 2.04 -0.20 1.61 5.36 -0.75 -1.15 117.98 125.49 2dc2 s PHE 89 Ca 0.21 -0.82 0.01 0.00 -0.96 0.00 0.00 56.93 55.37 2dc2 s PHE 89 Cb -0.14 -1.41 0.04 0.00 -0.34 0.00 0.00 43.02 41.17 2dc2 s PHE 89 CO 0.07 -0.36 -0.12 -1.21 -1.46 0.00 0.00 175.22 172.15 2dc2 s GLU 90 N 0.51 2.16 0.22 10.12 2.02 -0.43 -2.05 118.70 131.26 2dc2 s GLU 90 Ca -0.16 -0.86 0.00 0.00 0.02 0.00 0.00 54.97 53.97 2dc2 s GLU 90 Cb -0.17 -2.44 -0.04 0.00 0.10 0.00 0.00 34.13 31.58 2dc2 s GLU 90 CO 0.06 -0.40 0.13 0.14 0.02 0.00 0.00 175.26 175.21 2dc2 s VAL 91 N 1.37 0.13 -0.01 2.63 -7.23 -0.96 -2.16 120.40 114.17 2dc2 s VAL 91 Ca -0.01 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.19 2dc2 s VAL 91 Cb -0.16 -2.53 -0.00 0.00 0.56 0.00 0.00 36.38 34.25 2dc2 s VAL 91 CO -0.09 0.00 -0.09 0.68 -0.31 0.00 0.00 175.10 175.30 2dc2 s VAL 92 N -4.02 0.72 -0.16 1.32 -7.23 -0.81 -0.05 120.40 110.17 2dc2 s VAL 92 Ca 0.39 -0.37 -0.29 0.00 -1.81 0.00 0.00 61.98 59.89 2dc2 s VAL 92 Cb 0.07 -0.62 -0.04 0.00 0.56 0.00 0.00 36.38 36.35 2dc2 s VAL 92 CO 0.13 0.21 1.72 -0.47 -0.31 0.00 0.00 175.10 176.39 2dc2 s TYR 93 N -0.09 1.90 -0.16 2.82 6.14 -1.26 -1.97 117.35 124.72 2dc2 s TYR 93 Ca 0.02 0.37 -0.08 0.00 0.64 0.00 0.00 57.07 58.02 2dc2 s TYR 93 Cb -0.05 -3.99 -0.04 0.00 0.42 0.00 0.00 41.96 38.30 2dc2 s TYR 93 CO -0.00 -3.51 0.10 0.54 0.64 0.00 0.00 175.55 173.32 2dc2 s VAL 94 N 5.20 5.16 0.00 3.14 0.11 -0.90 -5.00 120.40 128.12 2dc2 s VAL 94 Ca 0.77 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.91 2dc2 s VAL 94 Cb -0.29 -3.30 0.00 0.00 -1.53 0.00 0.00 36.38 31.26 2dc2 s VAL 94 CO 0.31 0.51 0.00 0.00 -3.33 0.00 0.00 175.10 172.59