#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 3.99 -0.07 4.25 1.09 -1.26 -4.00 121.20 125.20 2dc2 s ILE 10 Ca 0.00 1.99 0.05 0.00 -1.10 0.00 0.00 60.65 61.59 2dc2 s ILE 10 Cb 0.00 -4.26 -0.00 0.00 -1.06 0.00 0.00 42.46 37.14 2dc2 s ILE 10 CO 0.00 0.46 -0.22 -0.60 -0.10 0.00 0.00 174.94 174.49 2dc2 s ARG 11 N -1.26 2.49 -0.27 2.79 3.52 0.27 -5.01 118.95 121.48 2dc2 s ARG 11 Ca 0.42 -0.78 -0.08 0.00 -0.13 0.00 0.00 55.73 55.16 2dc2 s ARG 11 Cb -0.27 -2.01 -0.02 0.00 -1.56 0.00 0.00 34.95 31.10 2dc2 s ARG 11 CO 0.33 0.24 0.09 0.15 -0.81 0.00 0.00 175.30 175.30 2dc2 s LYS 12 N 0.16 3.51 0.01 5.12 3.01 -1.26 -2.39 119.74 127.89 2dc2 s LYS 12 Ca -0.11 -0.59 0.05 0.00 -1.01 0.00 0.00 55.97 54.32 2dc2 s LYS 12 Cb -0.15 -3.40 -0.02 0.00 -1.01 0.00 0.00 37.83 33.25 2dc2 s LYS 12 CO 0.05 -0.28 -0.15 0.14 0.51 0.00 0.00 175.35 175.63 2dc2 s VAL 13 N 1.60 1.17 -0.23 3.17 -7.23 -0.35 -5.01 120.40 113.52 2dc2 s VAL 13 Ca 0.05 -0.78 -0.07 0.00 -1.81 0.00 0.00 61.98 59.37 2dc2 s VAL 13 Cb -0.16 -1.01 -0.03 0.00 0.56 0.00 0.00 36.38 35.74 2dc2 s VAL 13 CO 0.04 0.21 0.07 -0.76 -0.31 0.00 0.00 175.10 174.36 2dc2 s LEU 14 N -0.65 3.54 -0.07 1.32 1.43 -1.26 0.24 118.68 123.22 2dc2 s LEU 14 Ca 0.04 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 2dc2 s LEU 14 Cb -0.07 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.19 2dc2 s LEU 14 CO 0.00 0.02 -0.06 -0.22 0.23 0.00 0.00 176.35 176.32 2dc2 s LEU 15 N 1.31 3.24 -0.23 1.79 2.96 0.19 -4.93 118.68 123.01 2dc2 s LEU 15 Ca 0.05 0.00 -0.04 0.00 -0.22 0.00 0.00 54.13 53.92 2dc2 s LEU 15 Cb -0.15 -1.71 -0.00 0.00 0.50 0.00 0.00 46.19 44.83 2dc2 s LEU 15 CO 0.04 0.36 -0.03 -0.76 -1.32 0.00 0.00 176.35 174.63 2dc2 s LEU 16 N -0.78 3.02 -0.16 -0.68 1.43 -1.26 -1.56 118.68 118.69 2dc2 s LEU 16 Ca 0.12 -0.46 -0.04 0.00 -1.03 0.00 0.00 54.13 52.71 2dc2 s LEU 16 Cb -0.11 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 2dc2 s LEU 16 CO 0.02 -0.05 -0.01 -0.75 0.23 0.00 0.00 176.35 175.79 2dc2 s LYS 17 N 1.47 3.71 0.33 1.70 2.36 -1.23 -4.94 119.74 123.14 2dc2 s LYS 17 Ca 0.05 -0.47 0.10 0.00 -2.55 0.00 0.00 55.97 53.10 2dc2 s LYS 17 Cb -0.15 -2.98 -0.06 0.00 -1.05 0.00 0.00 37.83 33.60 2dc2 s LYS 17 CO -0.03 0.28 -0.09 -1.21 1.55 0.00 0.00 175.35 175.86 2dc2 s GLU 18 N 0.28 1.88 0.31 4.03 0.41 -1.26 -4.04 118.70 120.31 2dc2 s GLU 18 Ca -0.01 -1.83 0.02 0.00 -0.41 0.00 0.00 54.97 52.73 2dc2 s GLU 18 Cb -0.14 -1.79 0.59 0.00 -1.78 0.00 0.00 34.13 31.01 2dc2 s GLU 18 CO 0.02 0.19 1.89 -0.44 -0.49 0.00 0.00 175.26 176.43 2dc2 h ASP 19 N 2.01 0.86 1.12 -0.19 3.32 -2.01 -1.79 116.42 119.75 2dc2 h ASP 19 Ca -0.42 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.56 2dc2 h ASP 19 Cb 1.25 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 2dc2 h ASP 19 CO 0.67 0.52 -0.92 1.12 -1.72 0.00 0.00 179.24 178.91 2dc2 h HIS 20 N 0.96 0.00 -2.95 4.55 2.07 -2.04 -3.47 115.15 114.28 2dc2 h HIS 20 Ca 0.42 0.00 -0.47 0.00 -2.85 0.00 0.00 60.37 57.46 2dc2 h HIS 20 Cb 0.34 0.00 0.02 0.00 2.57 0.00 0.00 27.41 30.34 2dc2 h HIS 20 CO -0.00 0.35 -0.10 -1.21 -3.07 0.00 0.00 177.93 173.90 2dc2 s GLU 21 N -3.07 3.37 0.00 5.12 0.41 -0.67 -5.11 118.70 118.74 2dc2 s GLU 21 Ca 0.01 -0.27 0.00 0.00 -0.41 0.00 0.00 54.97 54.30 2dc2 s GLU 21 Cb 0.08 -2.57 0.00 0.00 -1.78 0.00 0.00 34.13 29.86 2dc2 s GLU 21 CO 0.77 -0.05 0.00 0.41 -0.49 0.00 0.00 175.26 175.90 2dc2 n GLY 22 N -1.98 6.75 0.06 -1.39 0.00 -1.26 -4.22 105.19 103.15 2dc2 n GLY 22 Ca -0.02 -1.79 -0.02 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.12 0.00 0.99 3.38 -1.98 -3.45 115.31 114.13 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 0.69 0.75 2.98 0.83 0.00 -1.26 -4.39 105.19 104.79 2dc2 n GLY 24 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.47 0.38 -0.12 -0.61 -4.36 -1.26 0.64 121.20 113.40 2dc2 s ILE 25 Ca 0.00 -0.50 -0.04 0.00 -0.26 0.00 0.00 60.65 59.84 2dc2 s ILE 25 Cb 0.00 -0.38 -0.04 0.00 1.25 0.00 0.00 42.46 43.30 2dc2 s ILE 25 CO 0.00 -0.09 0.04 -0.44 0.24 0.00 0.00 174.94 174.68 2dc2 s SER 26 N -0.64 5.49 0.20 4.36 0.01 0.72 -4.95 113.70 118.88 2dc2 s SER 26 Ca -0.03 0.16 0.10 0.00 1.31 0.00 0.00 55.95 57.49 2dc2 s SER 26 Cb -0.05 -1.72 -0.04 0.00 0.21 0.00 0.00 66.02 64.42 2dc2 s SER 26 CO -0.00 0.31 -0.21 0.27 0.41 0.00 0.00 173.24 174.02 2dc2 s ILE 27 N -0.49 2.17 0.26 1.44 -4.36 -1.26 -1.26 121.20 117.70 2dc2 s ILE 27 Ca 0.09 -2.06 0.03 0.00 -0.26 0.00 0.00 60.65 58.45 2dc2 s ILE 27 Cb -0.12 -2.05 -0.04 0.00 1.25 0.00 0.00 42.46 41.50 2dc2 s ILE 27 CO 0.02 -0.25 0.19 0.42 0.24 0.00 0.00 174.94 175.56 2dc2 s THR 28 N -1.98 0.05 0.00 8.37 -4.23 -0.81 -4.86 115.64 112.18 2dc2 s THR 28 Ca 0.21 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.72 2dc2 s THR 28 Cb -0.06 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.27 2dc2 s THR 28 CO 0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 2dc2 n GLY 29 N -0.44 -1.74 0.00 3.99 0.00 -1.26 -2.74 105.19 103.00 2dc2 n GLY 29 Ca 0.04 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.05 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 1.72 0.34 -0.02 0.00 -0.99 -4.82 105.19 101.42 2dc2 n GLY 30 Ca 0.00 0.34 -0.01 0.00 0.00 0.00 0.00 46.02 46.36 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 1.00 -0.09 1.61 3.11 -1.76 -1.86 116.57 118.58 2dc2 h LYS 31 Ca 0.00 -0.10 -0.05 0.00 -2.81 0.00 0.00 60.65 57.69 2dc2 h LYS 31 Cb 0.00 -0.21 -0.01 0.00 -1.00 0.00 0.00 32.23 31.01 2dc2 h LYS 31 CO 0.00 0.72 -0.17 1.05 -2.81 0.00 0.00 179.45 178.24 2dc2 h GLU 32 N 1.02 0.14 0.00 1.90 4.11 -1.89 -2.44 114.58 117.42 2dc2 h GLU 32 Ca 0.26 -0.03 -0.18 0.00 0.07 0.00 0.00 59.36 59.48 2dc2 h GLU 32 Cb -0.01 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2dc2 h GLU 32 CO -0.05 0.32 -0.85 0.45 0.07 0.00 0.00 179.01 178.95 2dc2 h HIS 33 N 0.13 0.00 0.00 2.06 3.86 -1.75 -3.48 115.15 115.97 2dc2 h HIS 33 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2dc2 h HIS 33 Cb 0.39 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.86 2dc2 h HIS 33 CO 0.00 0.85 0.00 0.41 0.86 0.00 0.00 177.93 180.05 2dc2 n GLY 34 N 1.10 1.98 2.97 2.45 0.00 -0.81 -5.07 105.19 107.80 2dc2 n GLY 34 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 0.83 1.61 -7.23 -0.86 -5.03 120.40 107.69 2dc2 s VAL 35 Ca 0.00 0.13 -0.12 0.00 -1.81 0.00 0.00 61.98 60.18 2dc2 s VAL 35 Cb 0.00 -0.25 0.10 0.00 0.56 0.00 0.00 36.38 36.79 2dc2 s VAL 35 CO 0.00 0.05 1.18 -2.84 -0.31 0.00 0.00 175.10 173.18 2dc2 s PRO 36 N 0.90 1.52 -0.08 4.82 0.02 -1.26 -2.35 135.00 138.57 2dc2 s PRO 36 Ca -0.07 1.66 -0.26 0.00 0.02 0.00 0.00 61.00 62.35 2dc2 s PRO 36 Cb -0.09 -1.77 -0.03 0.00 0.02 0.00 0.00 34.50 32.63 2dc2 s PRO 36 CO -0.05 -2.28 0.83 0.42 -0.33 0.00 0.00 177.00 175.59 2dc2 s ILE 37 N -2.34 4.94 0.07 2.83 -1.09 -1.26 -4.43 121.20 119.92 2dc2 s ILE 37 Ca 0.70 1.70 0.05 0.00 -2.23 0.00 0.00 60.65 60.88 2dc2 s ILE 37 Cb -0.26 -4.16 -0.03 0.00 -1.58 0.00 0.00 42.46 36.43 2dc2 s ILE 37 CO 0.53 0.15 -0.15 -0.76 -1.23 0.00 0.00 174.94 173.48 2dc2 s LEU 38 N 1.30 2.28 -0.30 2.97 1.02 -1.11 -1.74 118.68 123.09 2dc2 s LEU 38 Ca 0.42 -0.62 -0.29 0.00 0.02 0.00 0.00 54.13 53.66 2dc2 s LEU 38 Cb -0.18 -0.55 0.00 0.00 0.02 0.00 0.00 46.19 45.48 2dc2 s LEU 38 CO 0.19 -0.06 1.30 -0.63 0.02 0.00 0.00 176.35 177.17 2dc2 s ILE 39 N -1.26 4.15 -0.11 -0.59 -1.09 0.23 -1.92 121.20 120.61 2dc2 s ILE 39 Ca -0.01 1.29 -0.20 0.00 -2.23 0.00 0.00 60.65 59.50 2dc2 s ILE 39 Cb -0.10 -4.17 -0.27 0.00 -1.58 0.00 0.00 42.46 36.34 2dc2 s ILE 39 CO 0.02 -0.49 0.62 0.28 -1.23 0.00 0.00 174.94 174.15 2dc2 h SER 40 N 9.29 0.28 -5.22 3.58 0.02 -1.50 -1.77 113.55 118.23 2dc2 h SER 40 Ca -0.26 -0.85 -0.10 0.00 -0.84 0.00 0.00 61.79 59.73 2dc2 h SER 40 Cb 1.10 -0.09 -0.14 0.00 0.14 0.00 0.00 62.40 63.41 2dc2 h SER 40 CO 1.04 1.44 -0.45 -1.61 -1.14 0.00 0.00 176.83 176.11 2dc2 s GLU 41 N -2.40 0.86 -0.13 3.45 2.02 -1.17 -4.43 118.70 116.89 2dc2 s GLU 41 Ca -0.20 -1.10 -0.01 0.00 0.02 0.00 0.00 54.97 53.69 2dc2 s GLU 41 Cb 0.02 0.31 0.04 0.00 0.10 0.00 0.00 34.13 34.61 2dc2 s GLU 41 CO 0.74 -0.26 -0.02 0.42 0.02 0.00 0.00 175.26 176.15 2dc2 s ILE 42 N -3.91 0.76 0.21 -1.63 1.09 -1.26 -0.20 121.20 116.27 2dc2 s ILE 42 Ca 0.09 -0.32 -0.30 0.00 -1.10 0.00 0.00 60.65 59.02 2dc2 s ILE 42 Cb 0.05 -0.96 -0.10 0.00 -1.06 0.00 0.00 42.46 40.40 2dc2 s ILE 42 CO -0.08 0.16 1.45 -1.00 -0.10 0.00 0.00 174.94 175.37 2dc2 s HIS 43 N 1.79 3.07 0.56 3.97 3.76 0.21 -4.98 115.29 123.68 2dc2 s HIS 43 Ca 0.03 0.96 -0.17 0.00 -0.15 0.00 0.00 55.06 55.72 2dc2 s HIS 43 Cb -0.14 -3.81 -0.05 0.00 1.11 0.00 0.00 32.58 29.69 2dc2 s HIS 43 CO -0.07 -2.72 1.06 -1.25 -0.85 0.00 0.00 174.74 170.91 2dc2 s PRO 44 N 0.10 3.43 -0.64 8.40 0.04 -1.26 -3.91 135.00 141.15 2dc2 s PRO 44 Ca 0.62 1.29 -0.01 0.00 0.04 0.00 0.00 61.00 62.94 2dc2 s PRO 44 Cb -0.41 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.08 2dc2 s PRO 44 CO 0.39 -0.73 0.07 0.41 0.04 0.00 0.00 177.00 177.18 2dc2 n GLY 45 N -0.68 0.10 3.42 0.56 0.00 -1.26 -5.04 105.19 102.29 2dc2 n GLY 45 Ca 0.09 -0.53 -0.20 0.00 0.00 0.00 0.00 46.02 45.38 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 -4.56 1.58 0.57 1.61 1.11 -1.25 -5.03 119.66 113.69 2dc2 s GLN 46 Ca 0.03 -1.86 0.28 0.00 0.01 0.00 0.00 55.36 53.82 2dc2 s GLN 46 Cb -0.01 -0.75 1.50 0.00 -1.01 0.00 0.00 33.01 32.73 2dc2 s GLN 46 CO 0.04 -0.19 1.97 -1.00 0.01 0.00 0.00 175.29 176.12 2dc2 h PRO 47 N 2.20 0.00 -0.48 2.91 0.13 -1.86 -1.75 132.00 133.15 2dc2 h PRO 47 Ca -0.40 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.77 2dc2 h PRO 47 Cb 1.24 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 2dc2 h PRO 47 CO 0.68 0.00 0.24 0.00 -0.23 0.00 0.00 178.00 178.68 2dc2 h ALA 48 N 1.60 0.60 -0.29 -0.56 0.00 -1.88 -1.64 119.26 117.10 2dc2 h ALA 48 Ca 0.20 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.97 2dc2 h ALA 48 Cb 0.99 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2dc2 h ALA 48 CO -0.00 -0.12 -0.48 -0.44 0.00 0.00 0.00 179.25 178.21 2dc2 h ASP 49 N 0.47 0.86 -0.97 0.00 3.32 -1.60 -3.08 116.42 115.42 2dc2 h ASP 49 Ca 0.21 -0.43 0.08 0.00 0.02 0.00 0.00 57.03 56.90 2dc2 h ASP 49 Cb 0.12 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 39.36 2dc2 h ASP 49 CO -0.15 1.20 0.62 0.03 -1.72 0.00 0.00 179.24 179.23 2dc2 h ARG 50 N 0.62 1.05 0.00 3.56 3.08 -1.31 -1.20 114.38 120.18 2dc2 h ARG 50 Ca 0.03 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 2dc2 h ARG 50 Cb 1.06 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 2dc2 h ARG 50 CO 0.11 0.70 -0.41 0.00 -1.07 0.00 0.00 179.97 179.29 2dc2 n GLY 52 N 0.02 1.20 0.00 0.00 0.00 -0.45 -4.85 105.19 101.10 2dc2 n GLY 52 Ca -0.01 -0.54 -0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.66 -0.01 3.56 -0.02 0.00 -1.26 -4.93 105.19 100.88 2dc2 n GLY 53 Ca -0.11 -0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 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 -4.18 3.17 0.22 0.99 2.01 -1.24 -4.93 118.68 114.71 2dc2 s LEU 54 Ca -0.00 -0.78 0.08 0.00 0.01 0.00 0.00 54.13 53.44 2dc2 s LEU 54 Cb 0.00 -2.56 -0.04 0.00 0.01 0.00 0.00 46.19 43.60 2dc2 s LEU 54 CO 0.01 -2.74 0.02 -1.38 1.01 0.00 0.00 176.35 173.27 2dc2 s HIS 55 N 10.03 2.82 0.36 0.29 -3.43 -1.26 -4.79 115.29 119.30 2dc2 s HIS 55 Ca 0.69 -0.17 -0.28 0.00 -0.80 0.00 0.00 55.06 54.50 2dc2 s HIS 55 Cb -0.06 -1.30 -0.11 0.00 -1.43 0.00 0.00 32.58 29.68 2dc2 s HIS 55 CO 0.00 0.56 1.41 0.08 -2.00 0.00 0.00 174.74 174.79 2dc2 s VAL 56 N -2.02 2.33 -0.40 -5.38 1.01 -1.26 -3.53 120.40 111.15 2dc2 s VAL 56 Ca 0.30 0.33 -0.01 0.00 0.00 0.00 0.00 61.98 62.60 2dc2 s VAL 56 Cb -0.08 -3.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 2dc2 s VAL 56 CO 0.20 0.08 0.33 0.61 0.00 0.00 0.00 175.10 176.32 2dc2 n GLY 57 N 0.60 0.18 3.52 4.51 0.00 -0.67 -5.01 105.19 108.32 2dc2 n GLY 57 Ca 0.01 -0.19 -0.33 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 -3.37 4.35 -0.18 1.61 2.15 -1.16 -3.69 116.67 116.37 2dc2 s ASP 58 Ca 0.05 -0.12 -0.05 0.00 0.43 0.00 0.00 52.55 52.86 2dc2 s ASP 58 Cb -0.01 -1.08 -0.03 0.00 -0.30 0.00 0.00 42.92 41.50 2dc2 s ASP 58 CO 0.25 0.34 0.00 0.00 -0.17 0.00 0.00 175.17 175.59 2dc2 s ALA 59 N -0.66 3.10 0.18 3.66 0.00 -0.80 0.78 121.76 128.01 2dc2 s ALA 59 Ca 0.10 -0.90 -0.10 0.00 0.00 0.00 0.00 51.96 51.06 2dc2 s ALA 59 Cb -0.11 -1.74 -0.07 0.00 0.00 0.00 0.00 23.12 21.19 2dc2 s ALA 59 CO 0.01 0.01 0.51 0.42 0.00 0.00 0.00 175.76 176.72 2dc2 s ILE 60 N 0.70 4.95 0.07 0.00 1.01 -0.71 0.10 121.20 127.33 2dc2 s ILE 60 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 60.65 61.17 2dc2 s ILE 60 Cb -0.14 -3.65 0.00 0.00 0.01 0.00 0.00 42.46 38.68 2dc2 s ILE 60 CO 0.02 0.07 0.00 0.18 0.00 0.00 0.00 174.94 175.21 2dc2 n LEU 61 N 0.26 0.07 -4.02 2.97 4.77 -0.88 -4.65 117.00 115.52 2dc2 n LEU 61 Ca -0.02 0.11 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 2dc2 n LEU 61 Cb 0.52 0.05 -0.12 0.00 -2.33 0.00 0.00 43.42 41.54 2dc2 n LEU 61 CO 0.44 -0.47 -0.39 0.00 -1.33 0.00 0.00 177.39 175.65 2dc2 s ALA 62 N -2.00 0.43 -0.12 -1.18 0.00 -1.15 -0.71 121.76 117.03 2dc2 s ALA 62 Ca 0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 51.96 51.34 2dc2 s ALA 62 Cb 0.00 0.03 0.04 0.00 0.00 0.00 0.00 23.12 23.20 2dc2 s ALA 62 CO 0.00 -0.02 0.03 0.08 0.00 0.00 0.00 175.76 175.85 2dc2 s VAL 63 N -1.10 0.31 -1.55 0.00 1.01 0.13 -0.42 120.40 118.78 2dc2 s VAL 63 Ca -0.08 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.77 2dc2 s VAL 63 Cb -0.08 -0.65 0.01 0.00 0.00 0.00 0.00 36.38 35.66 2dc2 s VAL 63 CO 0.00 0.04 0.38 -3.20 0.00 0.00 0.00 175.10 172.32 2dc2 n ASN 64 N 5.15 -5.63 0.00 3.32 2.85 0.16 -1.03 115.26 120.08 2dc2 n ASN 64 Ca -0.07 -0.18 0.00 0.00 -0.11 0.00 0.00 54.58 54.21 2dc2 n ASN 64 Cb 0.49 -4.61 0.00 0.00 1.24 0.00 0.00 39.78 36.90 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 -1.29 2.57 3.78 8.20 0.00 -1.26 -4.97 105.19 112.22 2dc2 n GLY 65 Ca -0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.19 4.80 0.16 1.61 1.01 -0.20 -5.05 120.40 120.55 2dc2 s VAL 66 Ca 0.00 1.27 -0.30 0.00 0.00 0.00 0.00 61.98 62.95 2dc2 s VAL 66 Cb 0.00 -3.93 -0.07 0.00 0.00 0.00 0.00 36.38 32.37 2dc2 s VAL 66 CO 0.00 0.48 1.07 0.21 0.00 0.00 0.00 175.10 176.86 2dc2 s ASN 67 N -0.62 7.32 -0.08 3.32 2.47 -1.26 0.20 114.94 126.28 2dc2 s ASN 67 Ca 0.31 2.03 0.18 0.00 0.42 0.00 0.00 52.86 55.79 2dc2 s ASN 67 Cb -0.19 -2.60 -0.24 0.00 -1.45 0.00 0.00 41.25 36.77 2dc2 s ASN 67 CO 0.19 -0.18 0.40 -0.11 -3.72 0.00 0.00 177.10 173.67 2dc2 n LEU 68 N 2.46 0.29 0.23 3.21 0.00 0.11 -4.19 117.00 119.11 2dc2 n LEU 68 Ca 0.03 0.13 0.15 0.00 0.00 0.00 0.00 56.01 56.32 2dc2 n LEU 68 Cb 0.47 0.25 0.62 0.00 0.00 0.00 0.00 43.42 44.76 2dc2 n LEU 68 CO 0.53 0.29 0.95 -0.09 0.00 0.00 0.00 177.39 179.07 2dc2 h ARG 69 N 0.00 0.00 -0.65 1.96 2.43 -1.87 -2.57 114.38 113.67 2dc2 h ARG 69 Ca -0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 2dc2 h ARG 69 Cb 1.79 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.34 2dc2 h ARG 69 CO 0.03 0.00 0.00 -3.47 -1.51 0.00 0.00 179.97 175.02 2dc2 n ASP 70 N -2.79 3.80 -4.12 -3.80 2.03 -1.26 -4.93 116.55 105.49 2dc2 n ASP 70 Ca 0.01 -2.15 -0.15 0.00 0.52 0.00 0.00 54.79 53.02 2dc2 n ASP 70 Cb 0.28 -0.48 -0.12 0.00 -0.72 0.00 0.00 41.12 40.09 2dc2 n ASP 70 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2dc2 s THR 71 N -1.38 0.82 0.71 5.18 -1.32 -0.97 -5.11 115.64 113.58 2dc2 s THR 71 Ca 0.45 -1.24 -0.11 0.00 -1.21 0.00 0.00 61.69 59.57 2dc2 s THR 71 Cb 0.25 -0.89 0.02 0.00 -1.51 0.00 0.00 72.50 70.37 2dc2 s THR 71 CO 0.27 -0.34 1.07 -0.54 -2.21 0.00 0.00 174.62 172.86 2dc2 s LYS 72 N -1.80 2.81 0.14 7.08 3.01 -1.26 -4.42 119.74 125.29 2dc2 s LYS 72 Ca -0.05 0.84 -0.22 0.00 -1.01 0.00 0.00 55.97 55.54 2dc2 s LYS 72 Cb -0.09 -1.98 -0.01 0.00 -1.01 0.00 0.00 37.83 34.74 2dc2 s LYS 72 CO 0.01 -1.16 1.66 1.25 0.51 0.00 0.00 175.35 177.62 2dc2 h HIS 73 N -0.76 -0.42 -0.68 3.18 2.76 -1.91 0.47 115.15 117.80 2dc2 h HIS 73 Ca -0.45 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 57.73 2dc2 h HIS 73 Cb 1.22 0.21 -0.03 0.00 1.55 0.00 0.00 27.41 30.36 2dc2 h HIS 73 CO 0.58 -0.24 0.36 0.87 -1.30 0.00 0.00 177.93 178.20 2dc2 h LYS 74 N -0.19 0.95 -0.61 5.26 1.57 -1.94 -2.40 116.57 119.20 2dc2 h LYS 74 Ca 0.11 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 2dc2 h LYS 74 Cb 0.35 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 2dc2 h LYS 74 CO -0.28 0.73 0.11 0.93 -0.57 0.00 0.00 179.45 180.38 2dc2 h GLU 75 N 0.93 0.98 -0.26 3.15 4.39 -1.77 -2.69 114.58 119.31 2dc2 h GLU 75 Ca 0.24 -0.24 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 2dc2 h GLU 75 Cb 0.06 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 2dc2 h GLU 75 CO -0.04 0.90 -0.03 0.00 -1.16 0.00 0.00 179.01 178.69 2dc2 h ALA 76 N 1.19 1.48 -0.55 3.43 0.00 0.30 -2.57 119.26 122.53 2dc2 h ALA 76 Ca 0.19 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2dc2 h ALA 76 Cb 0.38 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2dc2 h ALA 76 CO 0.01 0.37 0.28 0.28 0.00 0.00 0.00 179.25 180.19 2dc2 h VAL 77 N 0.38 1.20 -0.62 0.00 2.07 -1.09 -1.99 116.25 116.19 2dc2 h VAL 77 Ca 0.08 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2dc2 h VAL 77 Cb 0.30 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 2dc2 h VAL 77 CO 0.01 0.22 0.39 0.74 0.02 0.00 0.00 177.57 178.95 2dc2 h THR 78 N 0.74 1.17 -0.76 2.57 2.02 -1.41 -2.43 112.91 114.82 2dc2 h THR 78 Ca 0.19 -0.36 0.03 0.00 0.77 0.00 0.00 66.41 67.04 2dc2 h THR 78 Cb 0.09 0.29 -0.05 0.00 -1.74 0.00 0.00 68.15 66.75 2dc2 h THR 78 CO -0.03 0.18 0.48 0.40 0.37 0.00 0.00 175.52 176.91 2dc2 h ILE 79 N 0.85 1.10 -0.94 3.11 2.04 -1.18 -1.90 117.51 120.58 2dc2 h ILE 79 Ca 0.23 -0.32 0.06 0.00 1.00 0.00 0.00 64.86 65.83 2dc2 h ILE 79 Cb -0.05 0.10 -0.06 0.00 -0.74 0.00 0.00 36.82 36.06 2dc2 h ILE 79 CO -0.04 0.17 0.60 -0.07 0.00 0.00 0.00 178.15 178.80 2dc2 h LEU 80 N 0.92 0.96 -1.17 1.44 4.07 -0.90 -1.19 115.31 119.44 2dc2 h LEU 80 Ca 0.31 0.01 -0.04 0.00 0.08 0.00 0.00 57.88 58.24 2dc2 h LEU 80 Cb 0.04 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 41.56 2dc2 h LEU 80 CO -0.12 0.61 0.18 -1.28 -1.08 0.00 0.00 178.44 176.75 2dc2 h SER 81 N 1.09 0.70 0.40 -0.43 0.87 -1.01 -1.82 113.55 113.35 2dc2 h SER 81 Ca 0.41 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.84 2dc2 h SER 81 Cb 0.17 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2dc2 h SER 81 CO -0.17 0.65 -0.13 1.56 -0.53 0.00 0.00 176.83 178.21 2dc2 h GLN 82 N 0.75 0.00 -5.59 2.24 1.08 -0.82 -3.40 115.11 109.38 2dc2 h GLN 82 Ca 0.18 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 57.17 2dc2 h GLN 82 Cb 0.20 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.60 2dc2 h GLN 82 CO -0.01 0.13 0.57 -0.65 -0.95 0.00 0.00 178.83 177.92 2dc2 s GLN 83 N -4.16 2.16 0.06 1.46 -1.52 -0.69 -4.93 119.66 112.04 2dc2 s GLN 83 Ca -0.03 0.19 0.02 0.00 -1.95 0.00 0.00 55.36 53.59 2dc2 s GLN 83 Cb 0.13 -4.87 -0.04 0.00 -0.22 0.00 0.00 33.01 28.01 2dc2 s GLN 83 CO 0.59 -3.74 0.13 1.03 -0.25 0.00 0.00 175.29 173.05 2dc2 s ARG 84 N 7.82 3.10 3.74 2.91 0.52 -1.26 -4.80 118.95 130.99 2dc2 s ARG 84 Ca 0.80 -0.58 0.00 0.00 -0.52 0.00 0.00 55.73 55.43 2dc2 s ARG 84 Cb -0.10 -2.85 0.00 0.00 0.52 0.00 0.00 34.95 32.51 2dc2 s ARG 84 CO 0.06 0.59 0.00 0.41 0.02 0.00 0.00 175.30 176.38 2dc2 n GLY 85 N 0.46 0.69 3.81 -3.53 0.00 -1.26 -4.63 105.19 100.73 2dc2 n GLY 85 Ca -0.08 0.49 -0.38 0.00 0.00 0.00 0.00 46.02 46.05 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 4.04 -0.04 1.61 2.12 -1.26 -3.53 118.70 121.63 2dc2 s GLU 86 Ca 0.00 0.44 -0.01 0.00 0.36 0.00 0.00 54.97 55.76 2dc2 s GLU 86 Cb 0.00 -3.27 0.03 0.00 0.26 0.00 0.00 34.13 31.14 2dc2 s GLU 86 CO 0.00 0.56 0.02 0.42 -0.54 0.00 0.00 175.26 175.72 2dc2 s ILE 87 N -0.68 0.17 -0.19 -3.70 1.01 -0.60 -4.97 121.20 112.24 2dc2 s ILE 87 Ca 0.24 0.18 -0.09 0.00 0.00 0.00 0.00 60.65 60.98 2dc2 s ILE 87 Cb -0.16 -0.32 -0.05 0.00 0.01 0.00 0.00 42.46 41.94 2dc2 s ILE 87 CO 0.13 0.19 0.11 -1.61 0.00 0.00 0.00 174.94 173.75 2dc2 s GLU 88 N 1.59 4.12 -0.11 2.79 2.02 -1.26 0.53 118.70 128.37 2dc2 s GLU 88 Ca -0.02 -0.26 0.03 0.00 0.02 0.00 0.00 54.97 54.74 2dc2 s GLU 88 Cb -0.13 -3.35 -0.00 0.00 0.10 0.00 0.00 34.13 30.75 2dc2 s GLU 88 CO -0.03 0.29 -0.22 -0.06 0.02 0.00 0.00 175.26 175.26 2dc2 s PHE 89 N 0.37 2.63 -0.21 1.61 0.40 0.14 0.37 117.98 123.28 2dc2 s PHE 89 Ca 0.06 -1.03 0.02 0.00 -0.60 0.00 0.00 56.93 55.38 2dc2 s PHE 89 Cb -0.11 -1.76 0.03 0.00 0.51 0.00 0.00 43.02 41.69 2dc2 s PHE 89 CO -0.01 -0.42 -0.16 -2.00 0.70 0.00 0.00 175.22 173.33 2dc2 s GLU 90 N 0.44 2.72 0.23 0.44 2.12 0.44 -1.22 118.70 123.87 2dc2 s GLU 90 Ca -0.15 -1.02 0.01 0.00 0.36 0.00 0.00 54.97 54.17 2dc2 s GLU 90 Cb -0.17 -2.70 -0.04 0.00 0.26 0.00 0.00 34.13 31.47 2dc2 s GLU 90 CO 0.06 -0.34 0.15 0.14 -0.54 0.00 0.00 175.26 174.73 2dc2 s VAL 91 N 1.23 0.11 -0.03 3.70 -7.23 -1.00 -2.08 120.40 115.09 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 -2.52 0.02 0.00 0.56 0.00 0.00 36.38 34.28 2dc2 s VAL 91 CO -0.10 0.00 -0.01 -0.69 -0.31 0.00 0.00 175.10 173.99 2dc2 s VAL 92 N -3.96 0.25 0.06 1.32 1.01 0.12 -0.57 120.40 118.62 2dc2 s VAL 92 Ca 0.39 0.00 -0.31 0.00 0.00 0.00 0.00 61.98 62.06 2dc2 s VAL 92 Cb 0.06 -0.30 -0.07 0.00 0.00 0.00 0.00 36.38 36.07 2dc2 s VAL 92 CO 0.15 0.14 1.41 -0.47 0.00 0.00 0.00 175.10 176.33 2dc2 s TYR 93 N 0.75 3.01 -0.08 5.22 6.14 -1.26 -1.91 117.35 129.21 2dc2 s TYR 93 Ca -0.08 0.86 0.02 0.00 0.64 0.00 0.00 57.07 58.51 2dc2 s TYR 93 Cb -0.11 -3.69 -0.02 0.00 0.42 0.00 0.00 41.96 38.56 2dc2 s TYR 93 CO -0.01 -2.49 -0.15 0.08 0.64 0.00 0.00 175.55 173.62 2dc2 s VAL 94 N 1.80 2.93 0.00 3.14 1.01 -1.24 -4.80 120.40 123.24 2dc2 s VAL 94 Ca 0.65 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.89 2dc2 s VAL 94 Cb -0.34 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 33.86 2dc2 s VAL 94 CO 0.29 0.56 0.00 0.00 0.00 0.00 0.00 175.10 175.95