#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dpp s ASP 11 N 0.00 7.01 0.00 4.38 -1.08 -1.26 -4.93 116.67 120.78 2dpp s ASP 11 Ca 0.00 1.87 0.19 0.00 -0.52 0.00 0.00 52.55 54.09 2dpp s ASP 11 Cb 0.00 -2.56 1.07 0.00 -1.46 0.00 0.00 42.92 39.97 2dpp s ASP 11 CO 0.00 -0.62 1.52 -0.81 0.52 0.00 0.00 175.17 175.78 2dpp n PRO 12 N 5.28 0.51 0.23 4.34 -0.04 -1.26 -0.63 135.00 143.43 2dpp n PRO 12 Ca 0.11 0.03 0.12 0.00 -0.04 0.00 0.00 63.50 63.72 2dpp n PRO 12 Cb 0.46 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.72 2dpp n PRO 12 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dpp h ARG 13 N 0.00 0.00 -1.20 0.54 3.08 -2.09 -3.39 114.38 111.32 2dpp h ARG 13 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 2dpp h ARG 13 Cb 0.04 0.00 -0.42 0.00 0.08 0.00 0.00 29.97 29.67 2dpp h ARG 13 CO 0.00 0.07 -0.85 1.19 -1.07 0.00 0.00 179.97 179.31 2dpp n PHE 14 N -3.13 2.76 0.23 3.04 3.72 0.20 -4.84 117.46 119.43 2dpp n PHE 14 Ca 0.03 -2.81 0.10 0.00 -0.05 0.00 0.00 57.45 54.71 2dpp n PHE 14 Cb 0.49 -0.19 0.54 0.00 -0.94 0.00 0.00 39.48 39.37 2dpp n PHE 14 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2dpp h PRO 15 N 2.57 0.00 0.00 -1.08 0.13 -1.78 -2.21 132.00 129.63 2dpp h PRO 15 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 2dpp h PRO 15 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2dpp h PRO 15 CO 0.73 0.22 0.00 -2.39 -0.23 0.00 0.00 178.00 176.33 2dpp n HIS 16 N -3.60 0.00 0.75 1.56 1.44 -1.26 -1.67 115.22 112.45 2dpp n HIS 16 Ca -0.01 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.83 2dpp n HIS 16 Cb 0.36 -0.38 0.44 0.00 0.12 0.00 0.00 29.99 30.53 2dpp n HIS 16 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2dpp n HIS 17 N -1.38 0.56 -3.98 -1.40 8.25 -0.83 -4.78 115.22 111.67 2dpp n HIS 17 Ca 0.06 0.16 -0.34 0.00 -0.26 0.00 0.00 57.72 57.35 2dpp n HIS 17 Cb 0.15 -0.74 -0.14 0.00 1.12 0.00 0.00 29.99 30.37 2dpp n HIS 17 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2dpp s HIS 18 N -3.07 3.24 0.65 4.41 3.76 -0.67 -5.10 115.29 118.51 2dpp s HIS 18 Ca 0.11 -2.02 -0.12 0.00 -0.15 0.00 0.00 55.06 52.89 2dpp s HIS 18 Cb 0.15 -2.03 -0.02 0.00 1.11 0.00 0.00 32.58 31.79 2dpp s HIS 18 CO 0.59 -0.83 1.04 -1.25 -0.85 0.00 0.00 174.74 173.45 2dpp s PRO 19 N 1.20 3.28 0.22 8.40 0.04 -1.26 -5.00 135.00 141.89 2dpp s PRO 19 Ca -0.06 0.89 -0.30 0.00 0.04 0.00 0.00 61.00 61.57 2dpp s PRO 19 Cb -0.19 -2.04 -0.10 0.00 0.04 0.00 0.00 34.50 32.21 2dpp s PRO 19 CO -0.03 -0.82 1.48 1.03 0.04 0.00 0.00 177.00 178.70 2dpp s ARG 20 N -4.97 4.25 0.85 4.56 1.81 -1.26 -5.01 118.95 119.19 2dpp s ARG 20 Ca 0.57 2.32 -0.11 0.00 -1.72 0.00 0.00 55.73 56.79 2dpp s ARG 20 Cb -0.13 -3.12 0.10 0.00 -0.45 0.00 0.00 34.95 31.35 2dpp s ARG 20 CO 0.52 -0.48 1.09 -1.25 -0.68 0.00 0.00 175.30 174.50 2dpp s PRO 21 N 0.09 1.59 0.50 3.54 0.04 -1.26 -4.91 135.00 134.59 2dpp s PRO 21 Ca 0.63 0.99 0.21 0.00 0.04 0.00 0.00 61.00 62.87 2dpp s PRO 21 Cb -0.42 -1.83 1.30 0.00 0.04 0.00 0.00 34.50 33.58 2dpp s PRO 21 CO 0.40 -2.06 2.07 1.96 0.04 0.00 0.00 177.00 179.41 2dpp h GLN 22 N -1.43 0.00 -0.25 4.56 4.20 -2.01 -0.30 115.11 119.88 2dpp h GLN 22 Ca -0.47 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.27 2dpp h GLN 22 Cb 1.26 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 2dpp h GLN 22 CO 0.53 0.12 0.17 0.66 -0.67 0.00 0.00 178.83 179.63 2dpp h SER 23 N 0.00 0.19 -0.14 1.46 4.64 -2.00 -1.06 113.55 116.64 2dpp h SER 23 Ca -0.00 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 2dpp h SER 23 Cb 0.25 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2dpp h SER 23 CO 0.02 0.13 0.03 0.15 -0.87 0.00 0.00 176.83 176.29 2dpp h PHE 24 N 0.22 0.24 -0.46 4.77 3.57 -1.40 -1.46 116.94 122.42 2dpp h PHE 24 Ca 0.10 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2dpp h PHE 24 Cb 0.13 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 2dpp h PHE 24 CO -0.00 0.39 0.30 -1.49 -2.23 0.00 0.00 178.31 175.28 2dpp h TRP 25 N 0.02 0.59 -0.55 0.41 4.06 -1.24 0.47 115.95 119.71 2dpp h TRP 25 Ca 0.04 0.01 0.11 0.00 2.06 0.00 0.00 58.89 61.11 2dpp h TRP 25 Cb 0.27 -0.20 -0.09 0.00 -1.00 0.00 0.00 29.16 28.14 2dpp h TRP 25 CO 0.01 0.38 0.02 1.49 -3.56 0.00 0.00 178.44 176.78 2dpp h GLU 26 N 0.63 0.13 -0.50 0.49 4.81 -1.25 0.85 114.58 119.74 2dpp h GLU 26 Ca 0.17 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.26 2dpp h GLU 26 Cb -0.06 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 2dpp h GLU 26 CO -0.04 0.09 -0.19 0.00 -0.73 0.00 0.00 179.01 178.14 2dpp h ALA 27 N 1.49 0.71 -0.15 2.92 0.00 -0.51 -1.85 119.26 121.87 2dpp h ALA 27 Ca 0.28 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2dpp h ALA 27 Cb 0.44 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2dpp h ALA 27 CO -0.45 0.68 0.10 0.00 0.00 0.00 0.00 179.25 179.57 2dpp h ARG 28 N 0.88 0.20 -0.42 0.00 2.47 -0.44 0.40 114.38 117.47 2dpp h ARG 28 Ca 0.12 -0.01 0.08 0.00 -1.26 0.00 0.00 59.98 58.90 2dpp h ARG 28 Cb 0.76 -0.04 -0.07 0.00 -1.65 0.00 0.00 29.97 28.97 2dpp h ARG 28 CO 0.06 0.14 -0.01 0.00 0.56 0.00 0.00 179.97 180.72 2dpp h ALA 29 N 1.05 0.38 -0.51 0.04 0.00 -0.56 -1.08 119.26 118.57 2dpp h ALA 29 Ca 0.06 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2dpp h ALA 29 Cb -0.01 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2dpp h ALA 29 CO -0.01 -0.40 0.11 0.87 0.00 0.00 0.00 179.25 179.82 2dpp h LYS 30 N 0.10 0.79 -0.15 0.00 1.57 -0.86 -1.64 116.57 116.37 2dpp h LYS 30 Ca 0.21 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2dpp h LYS 30 Cb 0.30 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2dpp h LYS 30 CO -0.36 0.73 0.08 0.00 -0.57 0.00 0.00 179.45 179.33 2dpp h ALA 31 N 1.36 0.20 -0.53 3.86 0.00 -0.48 -1.08 119.26 122.59 2dpp h ALA 31 Ca 0.17 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2dpp h ALA 31 Cb 0.31 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2dpp h ALA 31 CO 0.00 -0.26 0.24 -0.07 0.00 0.00 0.00 179.25 179.16 2dpp h LEU 32 N 0.14 0.71 0.11 0.00 -0.00 -1.07 0.80 115.31 116.02 2dpp h LEU 32 Ca 0.05 -0.15 0.01 0.00 -0.00 0.00 0.00 57.88 57.80 2dpp h LEU 32 Cb 0.08 -0.18 -0.02 0.00 -0.00 0.00 0.00 40.66 40.53 2dpp h LEU 32 CO -0.01 0.66 -0.19 -0.08 -0.00 0.00 0.00 178.44 178.82 2dpp h GLU 33 N 0.72 -0.36 0.35 1.13 4.81 -1.23 -1.58 114.58 118.42 2dpp h GLU 33 Ca 0.18 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2dpp h GLU 33 Cb 0.15 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 2dpp h GLU 33 CO -0.02 -0.24 -0.36 0.77 -0.73 0.00 0.00 179.01 178.43 2dpp h SER 34 N -0.37 -0.98 -0.74 1.04 0.02 -1.00 0.98 113.55 112.50 2dpp h SER 34 Ca 0.02 0.09 0.15 0.00 -0.84 0.00 0.00 61.79 61.20 2dpp h SER 34 Cb 0.39 0.33 -0.10 0.00 0.14 0.00 0.00 62.40 63.16 2dpp h SER 34 CO -0.10 -0.50 0.25 -0.07 -1.14 0.00 0.00 176.83 175.27 2dpp h LEU 35 N -0.74 0.18 -0.70 5.07 -0.00 -0.89 -1.76 115.31 116.48 2dpp h LEU 35 Ca -0.02 0.12 -0.13 0.00 -0.00 0.00 0.00 57.88 57.84 2dpp h LEU 35 Cb 0.67 0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 41.44 2dpp h LEU 35 CO -0.07 0.05 -0.44 -0.07 -0.00 0.00 0.00 178.44 177.91 2dpp h LEU 36 N 0.38 0.51 0.41 1.67 3.38 -0.79 -1.99 115.31 118.88 2dpp h LEU 36 Ca 0.41 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2dpp h LEU 36 Cb 0.64 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2dpp h LEU 36 CO -0.43 0.89 -0.20 0.40 0.09 0.00 0.00 178.44 179.18 2dpp h ILE 37 N 0.39 0.25 -1.00 1.22 2.04 -0.53 0.53 117.51 120.41 2dpp h ILE 37 Ca 0.03 -0.63 0.40 0.00 1.00 0.00 0.00 64.86 65.66 2dpp h ILE 37 Cb 0.93 0.40 -0.18 0.00 -0.74 0.00 0.00 36.82 37.23 2dpp h ILE 37 CO 0.08 0.06 0.51 -0.33 0.00 0.00 0.00 178.15 178.46 2dpp h GLU 38 N -1.06 0.03 -0.34 2.37 5.08 -1.32 0.20 114.58 119.55 2dpp h GLU 38 Ca -0.06 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2dpp h GLU 38 Cb 0.52 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2dpp h GLU 38 CO 0.09 0.02 0.00 1.63 -1.00 0.00 0.00 179.01 179.75 2dpp n LYS 39 N -5.26 1.84 -1.27 2.33 5.02 -0.75 -4.92 118.16 115.15 2dpp n LYS 39 Ca 0.36 -1.30 -0.09 0.00 -2.02 0.00 0.00 58.31 55.26 2dpp n LYS 39 Cb 1.22 -1.31 -0.04 0.00 -0.02 0.00 0.00 35.03 34.88 2dpp n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dpp n GLY 40 N 1.10 1.00 0.17 0.72 0.00 0.06 -4.89 105.19 103.34 2dpp n GLY 40 Ca 0.13 -0.16 0.05 0.00 0.00 0.00 0.00 46.02 46.04 2dpp n GLY 40 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2dpp h HIS 41 N 0.00 0.00 -4.14 1.61 3.86 -1.13 -3.47 115.15 111.88 2dpp h HIS 41 Ca -0.19 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 58.87 2dpp h HIS 41 Cb 0.92 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 29.23 2dpp h HIS 41 CO 0.46 0.39 -0.69 -0.51 0.86 0.00 0.00 177.93 178.44 2dpp s LEU 42 N -6.52 2.44 0.38 2.43 1.02 -0.88 -4.99 118.68 112.55 2dpp s LEU 42 Ca 0.03 -0.90 0.04 0.00 0.02 0.00 0.00 54.13 53.32 2dpp s LEU 42 Cb 0.08 0.14 -0.04 0.00 0.02 0.00 0.00 46.19 46.39 2dpp s LEU 42 CO 0.71 -0.52 0.08 -0.94 0.02 0.00 0.00 176.35 175.70 2dpp s SER 43 N -2.64 2.74 0.14 2.29 1.04 -1.26 -4.36 113.70 111.65 2dpp s SER 43 Ca 0.03 -1.54 -0.12 0.00 0.48 0.00 0.00 55.95 54.80 2dpp s SER 43 Cb 0.04 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.40 2dpp s SER 43 CO -0.08 -0.78 1.57 0.28 0.98 0.00 0.00 173.24 175.21 2dpp h SER 44 N 1.89 0.86 1.53 7.02 0.02 -1.99 -3.05 113.55 119.83 2dpp h SER 44 Ca -0.39 -0.34 -0.04 0.00 -0.84 0.00 0.00 61.79 60.18 2dpp h SER 44 Cb 1.26 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.56 2dpp h SER 44 CO 0.64 1.00 -0.18 -2.24 -1.14 0.00 0.00 176.83 174.91 2dpp h ASP 45 N 0.71 0.00 -0.13 3.07 2.03 -1.98 -2.66 116.42 117.46 2dpp h ASP 45 Ca 0.12 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.36 2dpp h ASP 45 Cb 0.60 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.10 2dpp h ASP 45 CO 0.04 0.18 -0.17 0.00 -1.03 0.00 0.00 179.24 178.26 2dpp h ALA 46 N 1.82 0.19 -0.86 4.15 0.00 -1.95 -1.22 119.26 121.40 2dpp h ALA 46 Ca -0.00 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.61 2dpp h ALA 46 Cb 1.00 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 2dpp h ALA 46 CO 0.02 0.10 0.55 0.82 0.00 0.00 0.00 179.25 180.74 2dpp h ILE 47 N -0.06 1.11 0.00 0.00 2.04 -1.49 -2.79 117.51 116.32 2dpp h ILE 47 Ca 0.02 -0.36 -0.17 0.00 1.00 0.00 0.00 64.86 65.34 2dpp h ILE 47 Cb 0.72 -0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 2dpp h ILE 47 CO 0.04 0.19 -0.85 -0.08 0.00 0.00 0.00 178.15 177.45 2dpp h GLU 48 N 1.05 0.00 -0.77 2.37 4.57 -1.46 -2.20 114.58 118.14 2dpp h GLU 48 Ca 0.35 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.51 2dpp h GLU 48 Cb 0.05 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.61 2dpp h GLU 48 CO -0.13 0.79 0.41 -0.09 -1.18 0.00 0.00 179.01 178.80 2dpp h ARG 49 N 0.00 1.08 0.20 1.92 9.65 -1.03 -1.04 114.38 125.16 2dpp h ARG 49 Ca -0.02 -0.13 -0.01 0.00 -1.10 0.00 0.00 59.98 58.72 2dpp h ARG 49 Cb 1.63 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 30.01 2dpp h ARG 49 CO 0.10 0.81 -0.10 0.28 2.80 0.00 0.00 179.97 183.86 2dpp h VAL 50 N 1.06 0.86 -0.55 0.20 2.07 -1.23 -1.64 116.25 117.02 2dpp h VAL 50 Ca 0.27 -0.34 0.07 0.00 0.82 0.00 0.00 66.70 67.52 2dpp h VAL 50 Cb 0.05 1.07 -0.06 0.00 -1.52 0.00 0.00 31.29 30.83 2dpp h VAL 50 CO -0.04 0.08 0.24 0.40 0.02 0.00 0.00 177.57 178.27 2dpp h ILE 51 N -0.44 0.88 -0.40 4.57 2.04 -1.33 -1.11 117.51 121.71 2dpp h ILE 51 Ca -0.03 -0.16 0.02 0.00 1.00 0.00 0.00 64.86 65.70 2dpp h ILE 51 Cb 0.33 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 2dpp h ILE 51 CO 0.05 0.08 0.22 0.50 0.00 0.00 0.00 178.15 179.00 2dpp h LYS 52 N 0.46 0.43 0.21 2.37 3.64 -1.09 0.13 116.57 122.72 2dpp h LYS 52 Ca 0.26 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.62 2dpp h LYS 52 Cb 0.24 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.92 2dpp h LYS 52 CO -0.22 0.29 -0.37 1.25 -2.27 0.00 0.00 179.45 178.12 2dpp h HIS 53 N 0.45 -1.03 0.02 1.91 2.76 -0.24 -1.73 115.15 117.28 2dpp h HIS 53 Ca 0.16 0.02 -0.24 0.00 -2.20 0.00 0.00 60.37 58.12 2dpp h HIS 53 Cb 0.04 0.42 0.01 0.00 1.55 0.00 0.00 27.41 29.43 2dpp h HIS 53 CO -0.08 -0.49 -0.99 1.88 -1.30 0.00 0.00 177.93 176.94 2dpp h TYR 54 N -0.66 0.64 0.00 5.26 -1.99 -1.16 -0.59 116.97 118.48 2dpp h TYR 54 Ca 0.01 -0.36 -0.16 0.00 2.00 0.00 0.00 58.73 60.22 2dpp h TYR 54 Cb 0.65 -0.07 -0.02 0.00 2.00 0.00 0.00 36.73 39.29 2dpp h TYR 54 CO -0.29 1.19 -0.75 1.49 -0.00 0.00 0.00 178.16 179.80 2dpp h GLU 55 N 0.23 0.00 0.00 4.88 4.81 -0.81 -3.41 114.58 120.27 2dpp h GLU 55 Ca -0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2dpp h GLU 55 Cb 1.64 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.02 2dpp h GLU 55 CO 0.17 0.75 -0.52 0.72 -0.73 0.00 0.00 179.01 179.41 2dpp n HIS 56 N -3.34 0.00 0.04 0.92 8.25 -0.81 -4.87 115.22 115.41 2dpp n HIS 56 Ca 0.01 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.49 2dpp n HIS 56 Cb 0.82 0.19 0.37 0.00 1.12 0.00 0.00 29.99 32.49 2dpp n HIS 56 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2dpp h GLU 57 N 0.00 0.44 -6.20 -0.41 5.08 -0.38 -3.45 114.58 109.67 2dpp h GLU 57 Ca 0.00 -0.07 -0.52 0.00 -1.00 0.00 0.00 59.36 57.78 2dpp h GLU 57 Cb 0.52 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 2dpp h GLU 57 CO 0.00 0.43 -0.54 -0.51 -1.00 0.00 0.00 179.01 177.39 2dpp s LEU 58 N -9.13 3.77 -0.13 1.33 2.01 -0.35 -5.03 118.68 111.16 2dpp s LEU 58 Ca -0.07 -0.26 -0.34 0.00 0.01 0.00 0.00 54.13 53.47 2dpp s LEU 58 Cb 0.16 -2.31 0.15 0.00 0.01 0.00 0.00 46.19 44.19 2dpp s LEU 58 CO 0.74 -0.02 1.39 -0.83 1.01 0.00 0.00 176.35 178.64 2dpp s GLY 59 N -3.74 -0.42 0.09 -3.19 0.00 -1.26 -4.81 107.32 94.00 2dpp s GLY 59 Ca 0.32 1.14 0.08 0.00 0.00 0.00 0.00 44.72 46.27 2dpp s GLY 59 CO 0.24 0.28 1.26 -1.55 0.00 0.00 0.00 173.10 173.33 2dpp n PRO 60 N -0.38 0.05 0.24 2.90 -0.04 -0.98 -2.73 135.00 134.07 2dpp n PRO 60 Ca -0.06 0.50 0.10 0.00 -0.04 0.00 0.00 63.50 64.00 2dpp n PRO 60 Cb 0.62 -1.64 0.62 0.00 -0.04 0.00 0.00 33.50 33.07 2dpp n PRO 60 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dpp h MET 61 N 0.00 0.00 -0.12 0.54 -0.00 -1.88 -1.51 114.93 111.96 2dpp h MET 61 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.67 2dpp h MET 61 Cb 0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.65 2dpp h MET 61 CO 0.00 0.17 -0.06 -0.91 -0.00 0.00 0.00 176.91 176.10 2dpp h ASN 62 N 0.00 0.26 0.01 -0.10 -0.26 -1.64 -1.98 115.58 111.86 2dpp h ASN 62 Ca -0.00 -0.42 -0.02 0.00 -0.56 0.00 0.00 56.30 55.29 2dpp h ASN 62 Cb 0.40 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.58 2dpp h ASN 62 CO 0.02 0.63 -0.05 1.23 -1.06 0.00 0.00 177.43 178.20 2dpp h GLY 63 N -0.11 0.12 1.98 2.83 0.00 -0.87 -2.29 103.07 104.73 2dpp h GLY 63 Ca 0.02 -0.05 -0.13 0.00 0.00 0.00 0.00 47.33 47.17 2dpp h GLY 63 CO 0.02 0.05 -0.59 0.00 0.00 0.00 0.00 176.54 176.02 2dpp h ALA 64 N 1.85 1.01 -0.11 3.60 0.00 -1.08 -0.30 119.26 124.22 2dpp h ALA 64 Ca 0.03 -0.54 -0.16 0.00 0.00 0.00 0.00 54.91 54.24 2dpp h ALA 64 Cb 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2dpp h ALA 64 CO 0.01 0.73 -0.60 0.87 0.00 0.00 0.00 179.25 180.27 2dpp h LYS 65 N 0.02 0.38 -0.11 0.00 1.57 -0.78 -2.17 116.57 115.48 2dpp h LYS 65 Ca -0.01 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.42 2dpp h LYS 65 Cb 1.05 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.40 2dpp h LYS 65 CO 0.08 0.87 -0.30 0.28 -0.57 0.00 0.00 179.45 179.80 2dpp h VAL 66 N 0.29 1.39 -0.07 0.50 2.07 -1.19 -0.60 116.25 118.64 2dpp h VAL 66 Ca -0.00 -1.63 0.03 0.00 0.82 0.00 0.00 66.70 65.92 2dpp h VAL 66 Cb 1.12 2.15 -0.04 0.00 -1.52 0.00 0.00 31.29 33.01 2dpp h VAL 66 CO 0.10 0.48 -0.13 0.58 0.02 0.00 0.00 177.57 178.62 2dpp h VAL 67 N -0.04 0.66 -0.61 2.57 2.07 -1.05 -0.01 116.25 119.85 2dpp h VAL 67 Ca -0.01 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 2dpp h VAL 67 Cb 0.92 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 2dpp h VAL 67 CO 0.07 0.00 0.19 0.00 0.02 0.00 0.00 177.57 177.84 2dpp h ALA 68 N 0.85 1.19 0.27 1.67 0.00 -1.41 -0.39 119.26 121.44 2dpp h ALA 68 Ca 0.07 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2dpp h ALA 68 Cb 0.28 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2dpp h ALA 68 CO -0.18 0.57 -0.19 -0.22 0.00 0.00 0.00 179.25 179.23 2dpp h LYS 69 N 0.89 -0.43 -0.96 0.00 3.64 -0.77 -0.50 116.57 118.44 2dpp h LYS 69 Ca 0.20 0.03 0.19 0.00 -1.27 0.00 0.00 60.65 59.80 2dpp h LYS 69 Cb 0.26 0.10 -0.09 0.00 -0.41 0.00 0.00 32.23 32.09 2dpp h LYS 69 CO -0.01 -0.29 0.61 0.00 -2.27 0.00 0.00 179.45 177.49 2dpp h ALA 70 N 0.25 1.91 -0.01 5.00 0.00 -0.83 0.22 119.26 125.81 2dpp h ALA 70 Ca -0.02 0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 2dpp h ALA 70 Cb 0.39 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2dpp h ALA 70 CO 0.01 -0.24 -0.87 -1.49 0.00 0.00 0.00 179.25 176.66 2dpp h TRP 71 N 0.62 0.37 0.00 0.00 6.55 -0.40 -3.34 115.95 119.75 2dpp h TRP 71 Ca 0.52 -0.20 0.00 0.00 0.95 0.00 0.00 58.89 60.16 2dpp h TRP 71 Cb 1.00 -0.04 0.00 0.00 -0.86 0.00 0.00 29.16 29.25 2dpp h TRP 71 CO -0.00 1.00 -1.44 0.25 -1.05 0.00 0.00 178.44 177.20 2dpp n THR 72 N -3.70 0.34 -3.98 1.49 -2.24 -0.26 -4.74 114.28 101.20 2dpp n THR 72 Ca -0.04 -0.52 -0.30 0.00 -2.27 0.00 0.00 64.05 60.91 2dpp n THR 72 Cb 0.80 -0.18 -0.14 0.00 -2.10 0.00 0.00 70.33 68.70 2dpp n THR 72 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dpp s ASP 73 N -4.97 4.52 0.49 3.42 -1.08 0.71 -5.00 116.67 114.75 2dpp s ASP 73 Ca -0.04 -2.62 0.16 0.00 -0.52 0.00 0.00 52.55 49.53 2dpp s ASP 73 Cb 0.12 -1.64 1.15 0.00 -1.46 0.00 0.00 42.92 41.09 2dpp s ASP 73 CO 0.84 -0.30 2.07 -0.65 0.52 0.00 0.00 175.17 177.66 2dpp h PRO 74 N 7.01 0.00 -0.60 4.34 0.11 -1.84 -1.16 132.00 139.86 2dpp h PRO 74 Ca -0.06 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.96 2dpp h PRO 74 Cb 0.95 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 2dpp h PRO 74 CO 0.61 0.09 0.02 0.00 -0.21 0.00 0.00 178.00 178.52 2dpp h ALA 75 N 1.91 0.91 -0.05 -0.75 0.00 -1.94 -2.35 119.26 116.99 2dpp h ALA 75 Ca -0.00 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 2dpp h ALA 75 Cb 0.16 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2dpp h ALA 75 CO 0.01 0.65 -0.29 0.35 0.00 0.00 0.00 179.25 179.98 2dpp h PHE 76 N 0.94 0.38 -0.72 0.00 3.57 -1.70 -1.73 116.94 117.70 2dpp h PHE 76 Ca 0.17 -0.17 0.13 0.00 3.53 0.00 0.00 57.97 61.63 2dpp h PHE 76 Cb 0.51 -0.06 -0.13 0.00 2.79 0.00 0.00 35.95 39.06 2dpp h PHE 76 CO 0.03 0.91 -0.31 -0.22 -2.23 0.00 0.00 178.31 176.49 2dpp h LYS 77 N -0.25 -0.09 -0.81 1.11 3.64 -1.27 0.32 116.57 119.21 2dpp h LYS 77 Ca -0.02 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2dpp h LYS 77 Cb 0.95 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.74 2dpp h LYS 77 CO 0.06 -0.06 0.53 0.37 -2.27 0.00 0.00 179.45 178.07 2dpp h GLN 78 N -0.09 1.00 -0.08 1.90 4.15 -1.40 -1.62 115.11 118.98 2dpp h GLN 78 Ca 0.29 -0.06 0.02 0.00 0.77 0.00 0.00 58.65 59.67 2dpp h GLN 78 Cb 0.57 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 28.01 2dpp h GLN 78 CO -0.77 0.66 -0.02 0.00 -1.93 0.00 0.00 178.83 176.77 2dpp h ARG 79 N 1.03 -0.01 -0.25 1.69 3.08 -0.20 -2.38 114.38 117.35 2dpp h ARG 79 Ca 0.32 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.43 2dpp h ARG 79 Cb -0.02 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.97 2dpp h ARG 79 CO -0.10 -0.00 -0.18 1.25 -1.07 0.00 0.00 179.97 179.86 2dpp h LEU 80 N -0.01 -0.59 -1.25 3.04 5.85 -0.76 -0.89 115.31 120.70 2dpp h LEU 80 Ca 0.04 0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 2dpp h LEU 80 Cb 0.06 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2dpp h LEU 80 CO -0.08 -0.22 -0.34 -0.07 -0.34 0.00 0.00 178.44 177.39 2dpp h LEU 81 N -0.17 0.00 -0.03 2.25 3.38 -1.29 -0.60 115.31 118.84 2dpp h LEU 81 Ca 0.14 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.86 2dpp h LEU 81 Cb 0.38 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 2dpp h LEU 81 CO -0.35 0.34 -1.09 -0.33 0.09 0.00 0.00 178.44 177.09 2dpp h GLU 82 N 0.00 0.28 -0.48 1.13 5.08 -0.83 -3.42 114.58 116.34 2dpp h GLU 82 Ca -0.00 -0.39 -0.18 0.00 -1.00 0.00 0.00 59.36 57.79 2dpp h GLU 82 Cb 0.70 0.13 -0.15 0.00 0.50 0.00 0.00 28.75 29.94 2dpp h GLU 82 CO 0.04 1.13 -0.47 -3.47 -1.00 0.00 0.00 179.01 175.25 2dpp n ASP 83 N -3.60 -3.10 0.20 1.42 4.64 -0.41 -5.02 116.55 110.68 2dpp n ASP 83 Ca -0.07 -3.02 0.05 0.00 -1.38 0.00 0.00 54.79 50.36 2dpp n ASP 83 Cb 0.93 1.74 0.42 0.00 -1.04 0.00 0.00 41.12 43.18 2dpp n ASP 83 CO 0.00 0.00 0.00 0.77 -0.82 0.00 0.00 177.20 177.15 2dpp h SER 84 N 4.46 0.00 -0.49 1.67 4.64 -1.31 -2.39 113.55 120.12 2dpp h SER 84 Ca -0.05 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.15 2dpp h SER 84 Cb 1.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.15 2dpp h SER 84 CO 0.15 0.32 -0.15 -0.33 -0.87 0.00 0.00 176.83 175.95 2dpp h GLU 85 N 0.00 0.97 0.47 4.77 5.08 -1.86 0.15 114.58 124.16 2dpp h GLU 85 Ca -0.00 -0.39 -0.02 0.00 -1.00 0.00 0.00 59.36 57.95 2dpp h GLU 85 Cb 0.62 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2dpp h GLU 85 CO 0.04 1.06 -0.23 1.15 -1.00 0.00 0.00 179.01 180.03 2dpp h THR 86 N 0.82 0.39 -0.56 1.13 2.02 -1.85 -2.57 112.91 112.29 2dpp h THR 86 Ca 0.12 -0.46 0.07 0.00 0.77 0.00 0.00 66.41 66.91 2dpp h THR 86 Cb 0.72 0.56 -0.06 0.00 -1.74 0.00 0.00 68.15 67.63 2dpp h THR 86 CO 0.06 0.06 0.24 0.58 0.37 0.00 0.00 175.52 176.83 2dpp h VAL 87 N -0.96 0.86 -0.10 3.16 2.07 -1.31 -1.24 116.25 118.73 2dpp h VAL 87 Ca -0.07 -0.16 -0.10 0.00 0.82 0.00 0.00 66.70 67.20 2dpp h VAL 87 Cb 0.59 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 2dpp h VAL 87 CO 0.11 0.08 -0.40 -0.07 0.02 0.00 0.00 177.57 177.31 2dpp h LEU 88 N 0.45 0.22 -0.38 2.57 3.38 -0.73 -2.09 115.31 118.74 2dpp h LEU 88 Ca 0.27 -0.09 -0.18 0.00 0.09 0.00 0.00 57.88 57.96 2dpp h LEU 88 Cb 0.26 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2dpp h LEU 88 CO -0.23 0.61 -0.62 -0.09 0.09 0.00 0.00 178.44 178.20 2dpp h ARG 89 N 0.18 0.66 0.00 1.13 2.43 -0.99 -0.47 114.38 117.31 2dpp h ARG 89 Ca 0.02 -0.45 -0.01 0.00 -0.81 0.00 0.00 59.98 58.72 2dpp h ARG 89 Cb 0.79 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.41 2dpp h ARG 89 CO 0.06 1.07 -0.06 0.93 -1.51 0.00 0.00 179.97 180.46 2dpp h GLU 90 N 0.49 0.00 -0.00 0.20 5.08 -0.62 -2.14 114.58 117.58 2dpp h GLU 90 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2dpp h GLU 90 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2dpp h GLU 90 CO 0.12 0.06 -0.04 1.28 -1.00 0.00 0.00 179.01 179.44 2dpp n LEU 91 N -4.00 0.06 0.00 1.33 4.77 -0.84 -4.92 117.00 113.39 2dpp n LEU 91 Ca -0.03 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 2dpp n LEU 91 Cb 0.15 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 2dpp n LEU 91 CO 0.31 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2dpp n GLY 92 N 1.41 0.74 3.25 -0.72 0.00 -0.81 -5.03 105.19 104.04 2dpp n GLY 92 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 2dpp n GLY 92 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2dpp n TYR 93 N -2.15 4.30 -3.79 1.61 0.53 -0.22 -4.89 117.16 112.55 2dpp n TYR 93 Ca 0.00 -3.30 -0.13 0.00 -1.02 0.00 0.00 57.90 53.45 2dpp n TYR 93 Cb 0.00 -1.88 -0.10 0.00 -1.03 0.00 0.00 39.34 36.33 2dpp n TYR 93 CO 0.00 0.00 0.00 -0.47 -1.02 0.00 0.00 176.86 175.37 2dpp s TYR 94 N -0.08 -0.18 -5.00 -0.72 5.04 -1.26 -4.43 117.35 110.72 2dpp s TYR 94 Ca 0.37 0.35 0.00 0.00 -2.44 0.00 0.00 57.07 55.35 2dpp s TYR 94 Cb -0.01 0.07 0.00 0.00 0.35 0.00 0.00 41.96 42.37 2dpp s TYR 94 CO -0.01 -0.30 0.00 0.41 -1.34 0.00 0.00 175.55 174.32 2dpp n GLY 95 N 1.82 -0.77 3.68 8.97 0.00 -1.23 -4.90 105.19 112.77 2dpp n GLY 95 Ca -0.19 -1.18 -0.49 0.00 0.00 0.00 0.00 46.02 44.16 2dpp n GLY 95 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dpp n LEU 96 N 0.00 3.18 -1.36 0.99 7.94 -1.26 -0.89 117.00 125.60 2dpp n LEU 96 Ca 0.00 1.01 -0.16 0.00 -1.11 0.00 0.00 56.01 55.75 2dpp n LEU 96 Cb 0.00 -1.34 -0.06 0.00 0.53 0.00 0.00 43.42 42.55 2dpp n LEU 96 CO 0.00 -0.18 -0.16 0.00 -1.11 0.00 0.00 177.39 175.94 2dpp n GLN 97 N 5.85 -1.16 -2.32 1.96 1.13 -1.26 -4.28 117.38 117.29 2dpp n GLN 97 Ca 0.22 1.02 0.01 0.00 -1.94 0.00 0.00 57.00 56.31 2dpp n GLN 97 Cb 0.27 -5.25 0.04 0.00 0.11 0.00 0.00 30.24 25.41 2dpp n GLN 97 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2dpp n GLY 98 N -0.99 1.49 0.09 1.08 0.00 -0.07 -3.58 105.19 103.21 2dpp n GLY 98 Ca -0.17 -0.91 -0.03 0.00 0.00 0.00 0.00 46.02 44.91 2dpp n GLY 98 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dpp h GLU 99 N 1.90 0.00 -2.75 1.61 3.07 -1.85 -3.26 114.58 113.31 2dpp h GLU 99 Ca -0.20 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 58.07 2dpp h GLU 99 Cb 1.49 0.00 -0.39 0.00 -0.84 0.00 0.00 28.75 29.00 2dpp h GLU 99 CO 0.12 0.64 -0.80 -1.01 -1.40 0.00 0.00 179.01 176.56 2dpp s HIS 100 N -2.81 1.24 -0.24 4.33 3.76 -1.26 -4.99 115.29 115.33 2dpp s HIS 100 Ca 0.00 -1.96 -0.08 0.00 -0.15 0.00 0.00 55.06 52.87 2dpp s HIS 100 Cb 0.09 -1.31 -0.04 0.00 1.11 0.00 0.00 32.58 32.43 2dpp s HIS 100 CO 0.80 -0.81 0.09 0.42 -0.85 0.00 0.00 174.74 174.39 2dpp s ILE 101 N 0.76 4.63 0.02 0.60 1.01 -1.26 -0.88 121.20 126.08 2dpp s ILE 101 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.76 2dpp s ILE 101 Cb -0.23 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.05 2dpp s ILE 101 CO 0.00 0.36 0.10 -0.13 0.00 0.00 0.00 174.94 175.27 2dpp s ARG 102 N 1.28 3.10 -0.13 2.79 1.81 0.87 -3.63 118.95 125.03 2dpp s ARG 102 Ca 0.05 -0.50 -0.00 0.00 -1.72 0.00 0.00 55.73 53.56 2dpp s ARG 102 Cb -0.15 -2.87 -0.01 0.00 -0.45 0.00 0.00 34.95 31.47 2dpp s ARG 102 CO 0.04 0.63 -0.12 0.08 -0.68 0.00 0.00 175.30 175.25 2dpp s VAL 103 N -1.27 3.09 -0.13 3.52 1.01 -1.26 -0.50 120.40 124.86 2dpp s VAL 103 Ca 0.25 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.62 2dpp s VAL 103 Cb -0.12 -2.30 0.01 0.00 0.00 0.00 0.00 36.38 33.96 2dpp s VAL 103 CO 0.17 0.52 -0.22 0.68 0.00 0.00 0.00 175.10 176.25 2dpp s VAL 104 N 0.38 2.00 -0.25 2.92 -7.23 -0.55 -4.88 120.40 112.79 2dpp s VAL 104 Ca -0.10 -0.96 -0.18 0.00 -1.81 0.00 0.00 61.98 58.93 2dpp s VAL 104 Cb -0.16 -1.76 -0.03 0.00 0.56 0.00 0.00 36.38 34.99 2dpp s VAL 104 CO 0.05 0.54 0.51 -0.70 -0.31 0.00 0.00 175.10 175.20 2dpp s GLU 105 N 0.70 4.10 0.27 4.82 2.12 -1.26 -0.81 118.70 128.63 2dpp s GLU 105 Ca -0.10 0.34 -0.30 0.00 0.36 0.00 0.00 54.97 55.27 2dpp s GLU 105 Cb -0.16 -3.63 -0.10 0.00 0.26 0.00 0.00 34.13 30.50 2dpp s GLU 105 CO 0.01 -0.31 1.38 -0.80 -0.54 0.00 0.00 175.26 175.00 2dpp s ASN 106 N 1.45 6.72 0.41 -1.70 0.01 -0.65 -4.84 114.94 116.34 2dpp s ASN 106 Ca 0.22 2.64 0.04 0.00 -0.71 0.00 0.00 52.86 55.05 2dpp s ASN 106 Cb -0.16 -2.63 -0.02 0.00 0.41 0.00 0.00 41.25 38.85 2dpp s ASN 106 CO 0.09 -0.63 0.13 0.42 -1.51 0.00 0.00 177.10 175.60 2dpp s THR 107 N -0.38 0.60 0.48 1.60 -4.23 -0.16 -4.57 115.64 108.98 2dpp s THR 107 Ca 0.55 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 59.28 2dpp s THR 107 Cb -0.40 -2.34 0.39 0.00 1.34 0.00 0.00 72.50 71.49 2dpp s THR 107 CO 0.46 0.00 1.93 0.44 -0.54 0.00 0.00 174.62 176.91 2dpp h ASP 108 N 1.77 0.20 -0.05 3.99 3.32 -2.02 -2.98 116.42 120.66 2dpp h ASP 108 Ca -0.35 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.71 2dpp h ASP 108 Cb 1.27 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.80 2dpp h ASP 108 CO 0.57 0.10 0.00 0.35 -1.72 0.00 0.00 179.24 178.53 2dpp n THR 109 N -4.42 0.64 -3.87 0.35 -2.24 -1.26 -4.86 114.28 98.63 2dpp n THR 109 Ca 0.14 -0.82 -0.25 0.00 -2.27 0.00 0.00 64.05 60.85 2dpp n THR 109 Cb 0.65 0.70 -0.17 0.00 -2.10 0.00 0.00 70.33 69.40 2dpp n THR 109 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2dpp s VAL 110 N -0.72 0.70 -0.15 2.28 1.01 -1.12 -0.22 120.40 122.19 2dpp s VAL 110 Ca 0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 61.98 61.93 2dpp s VAL 110 Cb 0.02 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.61 2dpp s VAL 110 CO 0.03 0.31 -0.13 -2.28 0.00 0.00 0.00 175.10 173.04 2dpp s HIS 111 N 1.77 2.82 -0.12 5.22 2.46 0.77 -0.99 115.29 127.22 2dpp s HIS 111 Ca 0.04 -0.78 -0.07 0.00 0.47 0.00 0.00 55.06 54.71 2dpp s HIS 111 Cb -0.13 -1.88 -0.04 0.00 -0.13 0.00 0.00 32.58 30.40 2dpp s HIS 111 CO -0.06 -0.32 0.15 -0.80 -2.47 0.00 0.00 174.74 171.24 2dpp s ASN 112 N 0.59 6.40 0.01 9.88 0.01 -1.26 -0.90 114.94 129.66 2dpp s ASN 112 Ca -0.08 0.48 0.02 0.00 -0.71 0.00 0.00 52.86 52.57 2dpp s ASN 112 Cb -0.16 -2.07 -0.01 0.00 0.41 0.00 0.00 41.25 39.42 2dpp s ASN 112 CO 0.03 0.41 -0.05 0.54 -1.51 0.00 0.00 177.10 176.52 2dpp s VAL 113 N -1.03 0.39 0.19 1.60 0.11 -0.58 -4.17 120.40 116.90 2dpp s VAL 113 Ca 0.15 -0.41 0.09 0.00 -2.93 0.00 0.00 61.98 58.88 2dpp s VAL 113 Cb -0.12 -0.37 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 2dpp s VAL 113 CO 0.04 -0.02 -0.12 0.68 -3.33 0.00 0.00 175.10 172.35 2dpp s VAL 114 N -0.43 3.05 0.07 2.04 -7.23 -0.29 -0.91 120.40 116.70 2dpp s VAL 114 Ca -0.01 -1.74 -0.23 0.00 -1.81 0.00 0.00 61.98 58.19 2dpp s VAL 114 Cb -0.04 -2.51 0.06 0.00 0.56 0.00 0.00 36.38 34.45 2dpp s VAL 114 CO -0.00 -0.12 0.54 0.54 -0.31 0.00 0.00 175.10 175.75 2dpp s VAL 115 N -1.73 0.02 -0.42 1.32 0.11 -0.94 -4.93 120.40 113.82 2dpp s VAL 115 Ca 0.24 -0.20 0.04 0.00 -2.93 0.00 0.00 61.98 59.13 2dpp s VAL 115 Cb -0.08 -1.00 0.12 0.00 -1.53 0.00 0.00 36.38 33.88 2dpp s VAL 115 CO 0.14 -0.11 0.16 0.00 -3.33 0.00 0.00 175.10 171.96 2dpp h THR 117 N 6.01 0.87 0.00 0.00 1.35 -1.92 -3.37 112.91 115.86 2dpp h THR 117 Ca -0.06 -0.71 -0.25 0.00 -0.55 0.00 0.00 66.41 64.85 2dpp h THR 117 Cb 0.96 1.41 -0.04 0.00 -1.73 0.00 0.00 68.15 68.75 2dpp h THR 117 CO 0.59 0.18 -1.32 -0.07 -0.25 0.00 0.00 175.52 174.65 2dpp h LEU 118 N 0.00 0.00 -5.82 3.87 3.38 -1.93 -3.46 115.31 111.35 2dpp h LEU 118 Ca -0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.46 2dpp h LEU 118 Cb 0.40 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.74 2dpp h LEU 118 CO 0.02 0.99 -1.07 -1.54 0.09 0.00 0.00 178.44 176.94 2dpp n SER 120 N -3.21 1.68 0.00 -0.43 3.41 -1.26 -5.22 113.62 108.60 2dpp n SER 120 Ca -0.08 -3.16 0.00 0.00 -0.26 0.00 0.00 58.87 55.37 2dpp n SER 120 Cb 0.99 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 2dpp n SER 120 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dpp n TYR 122 N 0.15 0.00 -2.56 7.33 9.36 -1.26 -4.88 117.16 125.31 2dpp n TYR 122 Ca 0.26 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 61.06 2dpp n TYR 122 Cb 0.60 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 39.30 2dpp n TYR 122 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2dpp s PRO 123 N -3.75 3.88 0.22 2.98 0.04 -1.26 -4.84 135.00 132.27 2dpp s PRO 123 Ca 0.00 -1.85 -0.19 0.00 0.04 0.00 0.00 61.00 59.01 2dpp s PRO 123 Cb 0.00 -5.50 0.21 0.00 0.04 0.00 0.00 34.50 29.24 2dpp s PRO 123 CO 0.00 -2.31 1.56 -1.49 0.04 0.00 0.00 177.00 174.79 2dpp h TRP 124 N 7.96 -1.09 0.00 0.56 6.55 -1.66 0.02 115.95 128.29 2dpp h TRP 124 Ca 0.41 0.10 0.00 0.00 0.95 0.00 0.00 58.89 60.35 2dpp h TRP 124 Cb 0.89 0.61 0.00 0.00 -0.86 0.00 0.00 29.16 29.80 2dpp h TRP 124 CO 1.40 -0.40 0.23 -1.35 -1.05 0.00 0.00 178.44 177.27 2dpp h PRO 125 N -0.04 0.00 0.00 0.49 0.11 -1.81 -0.78 132.00 129.98 2dpp h PRO 125 Ca 0.32 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.26 2dpp h PRO 125 Cb 0.58 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.66 2dpp h PRO 125 CO -0.93 0.00 -1.65 -0.11 -0.21 0.00 0.00 178.00 175.10 2dpp n LEU 126 N -2.68 2.14 -0.05 2.35 0.00 -0.12 -4.62 117.00 114.03 2dpp n LEU 126 Ca -0.02 -0.04 0.01 0.00 0.00 0.00 0.00 56.01 55.96 2dpp n LEU 126 Cb 0.27 -0.23 -0.00 0.00 0.00 0.00 0.00 43.42 43.46 2dpp n LEU 126 CO 0.13 0.56 0.12 0.18 0.00 0.00 0.00 177.39 178.38 2dpp n LEU 127 N -2.70 0.59 0.00 -1.96 4.77 -0.54 -1.24 117.00 115.93 2dpp n LEU 127 Ca -0.19 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.08 2dpp n LEU 127 Cb 0.74 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.83 2dpp n LEU 127 CO 0.14 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 2dpp n GLY 128 N 0.67 -0.78 3.80 -0.72 0.00 -0.30 -2.31 105.19 105.55 2dpp n GLY 128 Ca 0.01 -1.18 -0.37 0.00 0.00 0.00 0.00 46.02 44.48 2dpp n GLY 128 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dpp s LEU 129 N 0.00 4.40 0.82 0.99 1.43 -1.26 -3.84 118.68 121.22 2dpp s LEU 129 Ca 0.00 1.57 -0.12 0.00 -1.03 0.00 0.00 54.13 54.54 2dpp s LEU 129 Cb 0.00 -3.61 0.09 0.00 0.03 0.00 0.00 46.19 42.70 2dpp s LEU 129 CO 0.00 0.05 1.18 -2.16 0.23 0.00 0.00 176.35 175.65 2dpp s PRO 130 N -1.79 1.58 0.71 1.29 0.04 -1.26 -4.99 135.00 130.57 2dpp s PRO 130 Ca 0.43 1.65 -0.16 0.00 0.04 0.00 0.00 61.00 62.95 2dpp s PRO 130 Cb -0.19 -1.78 0.02 0.00 0.04 0.00 0.00 34.50 32.59 2dpp s PRO 130 CO 0.23 -2.24 1.19 -2.30 0.04 0.00 0.00 177.00 173.92 2dpp n PRO 131 N -3.50 0.72 -0.18 0.56 -0.02 -1.26 -4.93 135.00 126.38 2dpp n PRO 131 Ca 0.13 0.31 -0.01 0.00 -2.02 0.00 0.00 63.50 61.90 2dpp n PRO 131 Cb 0.51 -2.43 0.06 0.00 -0.02 0.00 0.00 33.50 31.62 2dpp n PRO 131 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2dpp h SER 132 N -0.04 -0.39 0.84 2.55 4.64 -2.01 -1.84 113.55 117.29 2dpp h SER 132 Ca -0.49 0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 60.96 2dpp h SER 132 Cb 1.33 0.30 -0.00 0.00 -0.31 0.00 0.00 62.40 63.71 2dpp h SER 132 CO 0.50 -0.14 -0.12 4.11 -0.87 0.00 0.00 176.83 180.30 2dpp h TRP 133 N 0.05 0.00 -0.03 4.77 5.08 -1.95 -3.07 115.95 120.79 2dpp h TRP 133 Ca 0.27 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 60.13 2dpp h TRP 133 Cb 0.43 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.57 2dpp h TRP 133 CO -0.40 0.12 -0.51 -0.92 -1.28 0.00 0.00 178.44 175.45 2dpp h TYR 134 N 0.00 0.09 -0.03 0.12 5.03 -1.70 -2.32 116.97 118.17 2dpp h TYR 134 Ca -0.00 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.28 2dpp h TYR 134 Cb 0.58 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 38.84 2dpp h TYR 134 CO 0.00 0.57 0.00 1.63 -1.32 0.00 0.00 178.16 179.04 2dpp n LYS 135 N -3.94 1.48 -4.04 1.82 5.02 -1.16 -4.58 118.16 112.77 2dpp n LYS 135 Ca -0.02 -0.70 -0.28 0.00 -2.02 0.00 0.00 58.31 55.29 2dpp n LYS 135 Cb 0.53 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 34.02 2dpp n LYS 135 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2dpp s GLU 136 N -1.98 3.01 0.38 1.97 0.41 -0.87 -4.91 118.70 116.72 2dpp s GLU 136 Ca 0.39 -0.73 0.13 0.00 -0.41 0.00 0.00 54.97 54.35 2dpp s GLU 136 Cb 0.21 -2.75 0.94 0.00 -1.78 0.00 0.00 34.13 30.75 2dpp s GLU 136 CO 0.33 0.53 1.86 -1.35 -0.49 0.00 0.00 175.26 176.14 2dpp h PRO 137 N 2.75 0.54 -0.29 0.39 0.11 -1.92 -3.00 132.00 130.58 2dpp h PRO 137 Ca -0.47 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.62 2dpp h PRO 137 Cb 1.18 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 2dpp h PRO 137 CO 0.66 0.36 0.14 0.00 -0.21 0.00 0.00 178.00 178.95 2dpp h ALA 138 N 1.61 0.35 -0.01 -0.75 0.00 -1.95 -0.18 119.26 118.32 2dpp h ALA 138 Ca 0.46 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.35 2dpp h ALA 138 Cb 0.92 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2dpp h ALA 138 CO -0.20 -0.24 -0.08 -0.92 0.00 0.00 0.00 179.25 177.81 2dpp h TYR 139 N 0.30 0.11 -0.50 0.00 3.20 -1.76 -2.20 116.97 116.12 2dpp h TYR 139 Ca 0.12 -0.05 0.10 0.00 3.14 0.00 0.00 58.73 62.04 2dpp h TYR 139 Cb 0.03 -0.02 -0.10 0.00 1.54 0.00 0.00 36.73 38.19 2dpp h TYR 139 CO -0.09 0.74 -0.19 0.00 -1.64 0.00 0.00 178.16 176.97 2dpp h ARG 140 N -0.56 -0.08 -0.37 1.82 3.08 -1.49 -1.90 114.38 114.89 2dpp h ARG 140 Ca -0.01 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 2dpp h ARG 140 Cb 0.75 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.80 2dpp h ARG 140 CO 0.02 -0.05 0.09 0.00 -1.07 0.00 0.00 179.97 178.96 2dpp h ALA 141 N 1.31 0.49 0.07 0.04 0.00 -1.08 -3.38 119.26 116.72 2dpp h ALA 141 Ca 0.24 -0.18 -0.31 0.00 0.00 0.00 0.00 54.91 54.65 2dpp h ALA 141 Cb 0.44 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2dpp h ALA 141 CO -0.55 0.16 -1.66 0.00 0.00 0.00 0.00 179.25 177.20 2dpp h ARG 142 N 0.45 0.15 0.00 0.00 3.08 -1.31 -3.39 114.38 113.36 2dpp h ARG 142 Ca 0.12 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.86 2dpp h ARG 142 Cb 0.30 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 2dpp h ARG 142 CO 0.00 0.92 -0.24 -0.24 -1.07 0.00 0.00 179.97 179.33 2dpp h VAL 143 N 0.04 0.84 0.00 2.04 3.04 -1.51 0.13 116.25 120.83 2dpp h VAL 143 Ca -0.28 -0.96 0.00 0.00 -1.01 0.00 0.00 66.70 64.45 2dpp h VAL 143 Cb 2.00 1.57 0.00 0.00 -2.01 0.00 0.00 31.29 32.86 2dpp h VAL 143 CO 0.12 0.24 0.00 -0.37 -1.01 0.00 0.00 177.57 176.55 2dpp h VAL 144 N 0.00 0.00 0.00 1.51 -1.51 -1.78 -3.05 116.25 111.42 2dpp h VAL 144 Ca -0.00 -0.83 -0.28 0.00 -1.23 0.00 0.00 66.70 64.36 2dpp h VAL 144 Cb 0.56 1.82 -0.05 0.00 -2.13 0.00 0.00 31.29 31.48 2dpp h VAL 144 CO 0.03 0.00 -2.08 1.17 -1.23 0.00 0.00 177.57 175.46 2dpp n LYS 145 N -2.94 0.68 -3.19 5.19 4.81 -0.60 -4.78 118.16 117.34 2dpp n LYS 145 Ca 0.04 0.09 -0.21 0.00 -0.87 0.00 0.00 58.31 57.36 2dpp n LYS 145 Cb 0.47 -1.38 -0.05 0.00 0.02 0.00 0.00 35.03 34.09 2dpp n LYS 145 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 2dpp n GLU 146 N -2.96 1.03 -0.05 1.64 0.28 0.36 -4.95 120.64 115.99 2dpp n GLU 146 Ca -0.32 -3.43 0.10 0.00 -0.16 0.00 0.00 57.16 53.35 2dpp n GLU 146 Cb 0.89 -1.56 0.49 0.00 1.43 0.00 0.00 31.44 32.68 2dpp n GLU 146 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 177.13 175.97 2dpp h PRO 147 N 3.42 0.42 -0.18 3.44 0.13 -1.67 -1.53 132.00 136.02 2dpp h PRO 147 Ca 0.09 -0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 65.11 2dpp h PRO 147 Cb 0.90 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 2dpp h PRO 147 CO 0.51 0.28 -0.25 0.00 -0.23 0.00 0.00 178.00 178.31 2dpp h ARG 148 N 0.43 0.34 0.05 0.86 3.08 -1.92 -0.07 114.38 117.16 2dpp h ARG 148 Ca 0.23 -0.12 -0.24 0.00 0.07 0.00 0.00 59.98 59.92 2dpp h ARG 148 Cb 0.37 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.40 2dpp h ARG 148 CO -0.06 0.57 -1.05 1.96 -1.07 0.00 0.00 179.97 180.32 2dpp h GLN 149 N 0.31 0.37 -0.11 0.04 4.20 -1.71 -2.77 115.11 115.43 2dpp h GLN 149 Ca 0.05 -0.46 -0.02 0.00 0.06 0.00 0.00 58.65 58.28 2dpp h GLN 149 Cb 0.61 0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.53 2dpp h GLN 149 CO 0.04 1.15 -0.01 0.28 -0.67 0.00 0.00 178.83 179.62 2dpp h VAL 150 N 0.18 1.26 -0.36 -0.54 2.07 -1.08 -2.81 116.25 114.97 2dpp h VAL 150 Ca -0.10 -0.85 0.07 0.00 0.82 0.00 0.00 66.70 66.64 2dpp h VAL 150 Cb 1.72 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 33.09 2dpp h VAL 150 CO 0.18 0.24 0.25 -0.07 0.02 0.00 0.00 177.57 178.19 2dpp h LEU 151 N -0.10 0.16 -0.53 2.57 3.38 -1.07 -2.63 115.31 117.08 2dpp h LEU 151 Ca 0.03 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 2dpp h LEU 151 Cb 0.38 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 2dpp h LEU 151 CO 0.01 0.10 -0.05 0.11 0.09 0.00 0.00 178.44 178.70 2dpp h LYS 152 N 0.18 0.98 -0.14 1.13 1.57 -1.23 0.15 116.57 119.22 2dpp h LYS 152 Ca 0.16 -0.34 0.04 0.00 -1.87 0.00 0.00 60.65 58.64 2dpp h LYS 152 Cb 0.42 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 2dpp h LYS 152 CO -0.03 1.01 0.21 0.93 -0.57 0.00 0.00 179.45 181.01 2dpp h GLU 153 N 0.85 0.00 -0.09 3.15 5.08 -1.38 -0.33 114.58 121.86 2dpp h GLU 153 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2dpp h GLU 153 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2dpp h GLU 153 CO 0.04 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 179.24 2dpp n PHE 154 N -3.53 0.11 -0.31 4.33 3.01 0.42 -4.93 117.46 116.56 2dpp n PHE 154 Ca 0.01 -0.05 0.00 0.00 1.01 0.00 0.00 57.45 58.41 2dpp n PHE 154 Cb 0.31 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.78 2dpp n PHE 154 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dpp n GLY 155 N 1.18 0.76 3.24 1.37 0.00 -0.13 -4.93 105.19 106.68 2dpp n GLY 155 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 2dpp n GLY 155 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dpp s LEU 156 N 0.00 5.24 -0.78 0.99 2.96 -0.60 -4.98 118.68 121.50 2dpp s LEU 156 Ca 0.00 -1.64 -0.06 0.00 -0.22 0.00 0.00 54.13 52.21 2dpp s LEU 156 Cb 0.00 -1.97 0.20 0.00 0.50 0.00 0.00 46.19 44.92 2dpp s LEU 156 CO 0.00 -0.56 0.66 -0.62 -1.32 0.00 0.00 176.35 174.51 2dpp s ASP 157 N 2.18 5.94 0.48 3.68 3.68 -1.26 -2.80 116.67 128.56 2dpp s ASP 157 Ca 0.04 -3.12 -0.21 0.00 2.13 0.00 0.00 52.55 51.39 2dpp s ASP 157 Cb -0.24 -1.98 -0.08 0.00 -1.45 0.00 0.00 42.92 39.18 2dpp s ASP 157 CO 0.01 -0.36 1.07 -0.76 0.13 0.00 0.00 175.17 175.26 2dpp s LEU 158 N -0.46 3.90 0.81 -1.34 1.43 -1.26 -5.04 118.68 116.71 2dpp s LEU 158 Ca 0.21 2.03 -0.11 0.00 -1.03 0.00 0.00 54.13 55.24 2dpp s LEU 158 Cb -0.14 -4.47 0.08 0.00 0.03 0.00 0.00 46.19 41.70 2dpp s LEU 158 CO -0.07 -0.83 1.09 -2.84 0.23 0.00 0.00 176.35 173.93 2dpp s PRO 159 N -3.06 1.96 0.47 1.29 0.02 -1.26 -4.93 135.00 129.50 2dpp s PRO 159 Ca 0.66 1.10 0.15 0.00 0.02 0.00 0.00 61.00 62.93 2dpp s PRO 159 Cb -0.20 -1.87 1.09 0.00 0.02 0.00 0.00 34.50 33.54 2dpp s PRO 159 CO 0.24 -1.83 2.05 -0.44 -0.33 0.00 0.00 177.00 176.69 2dpp h ASP 160 N -1.26 0.02 0.58 2.53 3.32 -2.04 -1.79 116.42 117.76 2dpp h ASP 160 Ca -0.45 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2dpp h ASP 160 Cb 1.24 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2dpp h ASP 160 CO 0.52 0.12 0.00 -1.54 -1.72 0.00 0.00 179.24 176.62 2dpp n SER 161 N -4.41 0.00 -4.75 6.45 3.41 -1.26 -4.72 113.62 108.34 2dpp n SER 161 Ca -0.02 0.20 -0.38 0.00 -0.26 0.00 0.00 58.87 58.40 2dpp n SER 161 Cb 0.18 -0.38 -0.06 0.00 -0.26 0.00 0.00 64.21 63.70 2dpp n SER 161 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2dpp s VAL 162 N -2.76 5.04 0.18 -3.33 -7.23 -0.68 -4.89 120.40 106.73 2dpp s VAL 162 Ca 0.17 1.11 -0.28 0.00 -1.81 0.00 0.00 61.98 61.17 2dpp s VAL 162 Cb 0.15 -3.88 -0.08 0.00 0.56 0.00 0.00 36.38 33.13 2dpp s VAL 162 CO 0.37 0.38 0.88 -1.61 -0.31 0.00 0.00 175.10 174.82 2dpp s GLU 163 N 0.14 4.72 -0.17 4.82 2.02 0.70 -4.92 118.70 126.01 2dpp s GLU 163 Ca 0.29 1.36 -0.04 0.00 0.02 0.00 0.00 54.97 56.60 2dpp s GLU 163 Cb -0.17 -3.30 -0.02 0.00 0.10 0.00 0.00 34.13 30.74 2dpp s GLU 163 CO 0.14 0.46 -0.03 0.42 0.02 0.00 0.00 175.26 176.27 2dpp s ILE 164 N -0.87 3.83 -0.23 -1.63 1.01 -1.26 -0.16 121.20 121.89 2dpp s ILE 164 Ca 0.40 -0.37 -0.04 0.00 0.00 0.00 0.00 60.65 60.65 2dpp s ILE 164 Cb -0.24 -2.70 -0.00 0.00 0.01 0.00 0.00 42.46 39.53 2dpp s ILE 164 CO 0.29 0.47 -0.04 -0.13 0.00 0.00 0.00 174.94 175.53 2dpp s ARG 165 N 0.67 3.30 -0.14 2.79 0.52 -0.08 -4.97 118.95 121.03 2dpp s ARG 165 Ca -0.02 -0.68 -0.09 0.00 -0.52 0.00 0.00 55.73 54.43 2dpp s ARG 165 Cb -0.14 -3.03 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 2dpp s ARG 165 CO 0.02 -0.24 0.16 0.08 0.02 0.00 0.00 175.30 175.35 2dpp s VAL 166 N 1.47 5.44 -0.29 3.52 1.01 -1.26 -1.53 120.40 128.76 2dpp s VAL 166 Ca 0.05 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.30 2dpp s VAL 166 Cb -0.15 -3.45 0.06 0.00 0.00 0.00 0.00 36.38 32.84 2dpp s VAL 166 CO -0.03 0.54 -0.04 0.26 0.00 0.00 0.00 175.10 175.83 2dpp s TRP 167 N -0.46 3.33 -0.22 5.22 0.52 -0.08 -4.96 118.94 122.28 2dpp s TRP 167 Ca 0.13 -2.21 -0.17 0.00 0.02 0.00 0.00 56.10 53.86 2dpp s TRP 167 Cb -0.12 -2.16 -0.03 0.00 -1.15 0.00 0.00 33.47 30.01 2dpp s TRP 167 CO 0.02 -0.86 0.48 0.34 0.02 0.00 0.00 176.95 176.95 2dpp s ASP 168 N 1.18 6.47 -1.55 2.95 -1.08 -1.26 -2.22 116.67 121.15 2dpp s ASP 168 Ca -0.05 0.56 -0.11 0.00 -0.52 0.00 0.00 52.55 52.44 2dpp s ASP 168 Cb -0.20 -2.27 -0.03 0.00 -1.46 0.00 0.00 42.92 38.96 2dpp s ASP 168 CO -0.04 -0.18 2.71 -1.20 0.52 0.00 0.00 175.17 176.98 2dpp n SER 169 N 4.95 7.45 0.00 -0.34 7.64 0.09 -4.68 113.62 128.73 2dpp n SER 169 Ca -0.06 -2.70 0.10 0.00 1.01 0.00 0.00 58.87 57.22 2dpp n SER 169 Cb 0.50 -1.56 0.45 0.00 -1.01 0.00 0.00 64.21 62.59 2dpp n SER 169 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dpp n SER 170 N 4.02 0.00 -0.17 6.43 3.41 -1.26 -4.80 113.62 121.26 2dpp n SER 170 Ca 0.70 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 59.81 2dpp n SER 170 Cb 0.27 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 2dpp n SER 170 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2dpp n SER 171 N -1.50 1.70 -0.06 4.04 3.41 -1.26 -5.03 113.62 114.92 2dpp n SER 171 Ca 0.05 -0.09 0.12 0.00 -0.26 0.00 0.00 58.87 58.69 2dpp n SER 171 Cb 0.25 0.00 0.30 0.00 -0.26 0.00 0.00 64.21 64.49 2dpp n SER 171 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2dpp n GLU 172 N 0.00 0.20 -1.72 4.33 -0.58 -1.26 -4.80 120.64 116.81 2dpp n GLU 172 Ca 0.00 -0.12 -0.43 0.00 -0.42 0.00 0.00 57.16 56.20 2dpp n GLU 172 Cb 0.00 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 29.35 2dpp n GLU 172 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2dpp n ILE 173 N -1.30 0.81 -4.36 -3.67 2.08 -1.26 -4.58 119.36 107.08 2dpp n ILE 173 Ca 0.07 -0.20 -0.27 0.00 0.56 0.00 0.00 62.75 62.91 2dpp n ILE 173 Cb 0.34 -1.80 -0.11 0.00 -0.75 0.00 0.00 39.64 37.32 2dpp n ILE 173 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 2dpp s ARG 174 N -0.18 1.77 -0.04 0.38 1.81 -0.06 -4.81 118.95 117.82 2dpp s ARG 174 Ca 0.68 -1.41 0.05 0.00 -1.72 0.00 0.00 55.73 53.32 2dpp s ARG 174 Cb -0.55 -1.99 -0.01 0.00 -0.45 0.00 0.00 34.95 31.95 2dpp s ARG 174 CO 0.46 0.42 -0.18 -0.06 -0.68 0.00 0.00 175.30 175.26 2dpp s PHE 175 N -1.69 1.74 0.06 -0.53 0.40 -1.26 -0.09 117.98 116.61 2dpp s PHE 175 Ca 0.23 -0.45 0.09 0.00 -0.60 0.00 0.00 56.93 56.20 2dpp s PHE 175 Cb -0.08 -1.16 -0.03 0.00 0.51 0.00 0.00 43.02 42.26 2dpp s PHE 175 CO 0.12 -0.13 -0.26 1.41 0.70 0.00 0.00 175.22 177.06 2dpp s MET 176 N -0.12 1.73 -0.13 0.44 1.75 0.34 -4.79 119.30 118.52 2dpp s MET 176 Ca -0.00 -1.14 -0.13 0.00 -1.25 0.00 0.00 55.69 53.17 2dpp s MET 176 Cb -0.10 -1.95 -0.05 0.00 2.84 0.00 0.00 34.83 35.57 2dpp s MET 176 CO 0.01 0.50 0.27 0.08 -0.65 0.00 0.00 175.02 175.23 2dpp s VAL 177 N -0.84 5.30 -0.54 10.11 1.01 -0.57 -1.48 120.40 133.40 2dpp s VAL 177 Ca 0.12 0.51 -0.19 0.00 0.00 0.00 0.00 61.98 62.42 2dpp s VAL 177 Cb -0.10 -3.59 0.08 0.00 0.00 0.00 0.00 36.38 32.76 2dpp s VAL 177 CO 0.03 0.46 0.65 -0.22 0.00 0.00 0.00 175.10 176.01 2dpp s LEU 178 N -0.01 5.17 0.65 3.92 2.96 0.01 -4.43 118.68 126.94 2dpp s LEU 178 Ca 0.17 -1.14 -0.15 0.00 -0.22 0.00 0.00 54.13 52.79 2dpp s LEU 178 Cb -0.13 -2.38 -0.00 0.00 0.50 0.00 0.00 46.19 44.18 2dpp s LEU 178 CO 0.05 -0.97 1.10 -2.16 -1.32 0.00 0.00 176.35 173.04 2dpp s PRO 179 N 2.61 2.88 0.26 0.98 0.04 -1.26 -1.63 135.00 138.87 2dpp s PRO 179 Ca 0.13 1.33 -0.29 0.00 0.04 0.00 0.00 61.00 62.20 2dpp s PRO 179 Cb -0.21 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 2dpp s PRO 179 CO 0.09 -1.17 1.17 -0.65 0.04 0.00 0.00 177.00 176.48 2dpp s GLN 180 N -4.16 4.54 0.14 4.56 -0.21 -1.26 -4.91 119.66 118.34 2dpp s GLN 180 Ca 0.66 1.91 -0.31 0.00 0.02 0.00 0.00 55.36 57.64 2dpp s GLN 180 Cb -0.19 -3.18 -0.10 0.00 1.00 0.00 0.00 33.01 30.53 2dpp s GLN 180 CO 0.42 0.04 1.78 0.50 -2.12 0.00 0.00 175.29 175.91 2dpp s ARG 181 N -1.14 4.14 0.93 2.91 3.52 -1.26 -4.65 118.95 123.41 2dpp s ARG 181 Ca 0.48 2.57 -0.12 0.00 -0.13 0.00 0.00 55.73 58.52 2dpp s ARG 181 Cb -0.34 -3.48 0.15 0.00 -1.56 0.00 0.00 34.95 29.72 2dpp s ARG 181 CO 0.42 -0.81 1.12 -1.25 -0.81 0.00 0.00 175.30 173.97 2dpp s PRO 182 N 2.38 0.99 0.94 5.12 0.04 -1.26 -5.04 135.00 138.17 2dpp s PRO 182 Ca 0.79 0.39 -0.11 0.00 0.04 0.00 0.00 61.00 62.11 2dpp s PRO 182 Cb -0.46 -1.81 0.13 0.00 0.04 0.00 0.00 34.50 32.39 2dpp s PRO 182 CO 0.35 -2.32 0.94 -1.91 0.04 0.00 0.00 177.00 174.10 2dpp n GLU 183 N -3.87 -0.55 -1.14 4.56 4.07 -1.26 -4.35 120.64 118.11 2dpp n GLU 183 Ca 0.06 -0.10 -0.02 0.00 -0.06 0.00 0.00 57.16 57.04 2dpp n GLU 183 Cb 0.58 -2.23 -0.01 0.00 -0.06 0.00 0.00 31.44 29.73 2dpp n GLU 183 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2dpp n GLY 184 N 0.65 0.50 0.08 8.31 0.00 -1.26 -4.48 105.19 108.98 2dpp n GLY 184 Ca 0.10 -0.99 0.08 0.00 0.00 0.00 0.00 46.02 45.21 2dpp n GLY 184 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dpp n THR 185 N -3.04 1.69 -1.63 2.61 -2.24 -1.26 -4.63 114.28 105.78 2dpp n THR 185 Ca -0.02 -2.00 -0.47 0.00 -2.27 0.00 0.00 64.05 59.29 2dpp n THR 185 Cb 0.10 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.18 2dpp n THR 185 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2dpp n GLU 186 N -1.25 1.62 -0.90 -0.78 0.00 -1.26 -2.70 120.64 115.37 2dpp n GLU 186 Ca 0.13 0.58 0.00 0.00 0.00 0.00 0.00 57.16 57.87 2dpp n GLU 186 Cb 0.59 -2.17 0.00 0.00 0.00 0.00 0.00 31.44 29.86 2dpp n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2dpp n GLY 187 N 2.17 0.29 3.87 -1.84 0.00 -1.26 -4.99 105.19 103.43 2dpp n GLY 187 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 2dpp n GLY 187 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2dpp s MET 188 N -0.94 3.82 0.82 1.61 0.23 -1.10 -5.07 119.30 118.67 2dpp s MET 188 Ca 0.00 0.46 -0.10 0.00 -1.03 0.00 0.00 55.69 55.02 2dpp s MET 188 Cb 0.00 -2.44 0.13 0.00 -1.53 0.00 0.00 34.83 30.99 2dpp s MET 188 CO 0.00 0.05 1.15 0.95 -2.03 0.00 0.00 175.02 175.15 2dpp s THR 189 N -2.22 2.10 0.17 3.16 -4.23 -1.26 -4.83 115.64 108.53 2dpp s THR 189 Ca 0.51 -0.18 -0.16 0.00 -1.18 0.00 0.00 61.69 60.68 2dpp s THR 189 Cb -0.10 -2.92 0.11 0.00 1.34 0.00 0.00 72.50 70.92 2dpp s THR 189 CO 0.27 0.00 1.67 -0.08 -0.54 0.00 0.00 174.62 175.95 2dpp h GLU 190 N -1.05 0.04 -0.04 3.99 4.81 -1.98 -0.38 114.58 119.97 2dpp h GLU 190 Ca -0.43 -0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.71 2dpp h GLU 190 Cb 1.28 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.64 2dpp h GLU 190 CO 0.50 0.03 -0.36 0.93 -0.73 0.00 0.00 179.01 179.37 2dpp h GLU 191 N 0.04 0.08 -0.05 1.92 5.08 -1.96 -1.73 114.58 117.96 2dpp h GLU 191 Ca 0.21 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.47 2dpp h GLU 191 Cb 0.32 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2dpp h GLU 191 CO -0.42 0.44 -0.27 0.93 -1.00 0.00 0.00 179.01 178.69 2dpp h GLU 192 N 0.07 0.27 -0.35 2.33 5.08 -1.77 -3.20 114.58 117.01 2dpp h GLU 192 Ca 0.01 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 2dpp h GLU 192 Cb 0.68 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 2dpp h GLU 192 CO 0.05 0.88 0.14 -0.07 -1.00 0.00 0.00 179.01 179.01 2dpp h LEU 193 N -0.26 0.44 -1.58 1.33 3.38 -0.76 -2.43 115.31 115.42 2dpp h LEU 193 Ca -0.02 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2dpp h LEU 193 Cb 0.94 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 2dpp h LEU 193 CO 0.06 0.40 -0.19 0.00 0.09 0.00 0.00 178.44 178.80 2dpp h ALA 194 N 1.67 1.66 0.00 1.53 0.00 -1.34 -1.97 119.26 120.81 2dpp h ALA 194 Ca 0.12 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2dpp h ALA 194 Cb 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2dpp h ALA 194 CO -0.01 0.26 0.00 1.63 0.00 0.00 0.00 179.25 181.12 2dpp n LYS 195 N -4.30 0.16 0.14 0.00 5.02 -0.92 -2.74 118.16 115.51 2dpp n LYS 195 Ca -0.02 0.31 0.04 0.00 -2.02 0.00 0.00 58.31 56.62 2dpp n LYS 195 Cb 0.26 -1.76 0.03 0.00 -0.02 0.00 0.00 35.03 33.54 2dpp n LYS 195 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2dpp h LEU 196 N 0.00 0.00 -8.84 -0.35 3.38 -1.39 -3.46 115.31 104.64 2dpp h LEU 196 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2dpp h LEU 196 Cb 0.43 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 2dpp h LEU 196 CO 0.00 0.44 1.04 -0.69 0.09 0.00 0.00 178.44 179.31 2dpp s VAL 197 N -3.00 3.98 0.27 1.22 1.01 -1.11 -4.90 120.40 117.87 2dpp s VAL 197 Ca 0.04 1.04 -0.09 0.00 0.00 0.00 0.00 61.98 62.96 2dpp s VAL 197 Cb 0.07 -4.19 -0.07 0.00 0.00 0.00 0.00 36.38 32.20 2dpp s VAL 197 CO 0.74 -0.67 0.58 0.42 0.00 0.00 0.00 175.10 176.18 2dpp s THR 198 N 5.07 4.93 0.27 3.92 -4.23 -1.26 -4.89 115.64 119.44 2dpp s THR 198 Ca 0.60 0.41 -0.10 0.00 -1.18 0.00 0.00 61.69 61.42 2dpp s THR 198 Cb -0.15 -3.65 0.42 0.00 1.34 0.00 0.00 72.50 70.45 2dpp s THR 198 CO 0.30 -0.18 1.54 -1.14 -0.54 0.00 0.00 174.62 174.60 2dpp n ARG 199 N -0.45 -0.12 -0.15 3.99 0.63 -1.26 -2.01 116.66 117.29 2dpp n ARG 199 Ca 0.00 1.54 -0.02 0.00 -0.92 0.00 0.00 57.85 58.46 2dpp n ARG 199 Cb 0.53 -2.30 0.22 0.00 0.45 0.00 0.00 32.46 31.36 2dpp n ARG 199 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 2dpp h ASP 200 N 0.00 0.78 0.39 6.15 3.45 -1.94 -2.56 116.42 122.69 2dpp h ASP 200 Ca 0.45 -0.10 -0.02 0.00 0.43 0.00 0.00 57.03 57.79 2dpp h ASP 200 Cb 0.70 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 39.26 2dpp h ASP 200 CO -1.01 0.70 -0.08 0.77 -1.57 0.00 0.00 179.24 178.05 2dpp h SER 201 N 0.85 0.00 0.32 6.45 4.64 -1.52 -0.64 113.55 123.64 2dpp h SER 201 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2dpp h SER 201 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2dpp h SER 201 CO -0.02 0.08 -0.45 0.23 -0.87 0.00 0.00 176.83 175.81 2dpp n MET 202 N -3.50 0.41 0.05 4.77 2.81 -0.97 -2.58 117.12 118.11 2dpp n MET 202 Ca -0.02 -0.26 0.11 0.00 -1.81 0.00 0.00 57.70 55.72 2dpp n MET 202 Cb 0.22 -1.49 -0.05 0.00 -0.71 0.00 0.00 33.22 31.18 2dpp n MET 202 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 2dpp n ILE 203 N -1.07 0.31 -0.25 2.02 5.41 -0.71 -1.51 119.36 123.56 2dpp n ILE 203 Ca 0.08 -0.46 0.00 0.00 1.00 0.00 0.00 62.75 63.38 2dpp n ILE 203 Cb 0.35 -0.09 0.00 0.00 -0.71 0.00 0.00 39.64 39.19 2dpp n ILE 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2dpp n GLY 204 N 1.25 0.77 0.21 7.39 0.00 -0.33 -1.14 105.19 113.35 2dpp n GLY 204 Ca -0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.13 2dpp n GLY 204 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dpp n VAL 205 N -2.15 0.05 -3.64 1.61 0.24 -0.99 -4.69 118.33 108.76 2dpp n VAL 205 Ca 0.00 -0.13 -0.15 0.00 -2.04 0.00 0.00 64.34 62.02 2dpp n VAL 205 Cb 0.00 -0.05 -0.08 0.00 -1.47 0.00 0.00 33.84 32.25 2dpp n VAL 205 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dpp s ALA 206 N -1.95 -1.34 0.74 2.33 0.00 -1.24 -4.70 121.76 115.59 2dpp s ALA 206 Ca 0.35 1.09 -0.05 0.00 0.00 0.00 0.00 51.96 53.35 2dpp s ALA 206 Cb 0.17 -0.25 0.11 0.00 0.00 0.00 0.00 23.12 23.15 2dpp s ALA 206 CO 0.28 -0.30 1.03 0.15 0.00 0.00 0.00 175.76 176.92 2dpp s LYS 207 N -0.78 1.75 -0.19 0.00 1.02 -1.26 -3.91 119.74 116.38 2dpp s LYS 207 Ca -0.08 -0.71 -0.09 0.00 0.02 0.00 0.00 55.97 55.10 2dpp s LYS 207 Cb -0.03 -2.22 -0.05 0.00 -0.52 0.00 0.00 37.83 35.01 2dpp s LYS 207 CO 0.05 -1.46 0.12 0.42 -0.92 0.00 0.00 175.35 173.56 2dpp s ILE 208 N -3.25 5.34 0.42 2.17 1.01 -1.26 -4.83 121.20 120.79 2dpp s ILE 208 Ca 0.65 0.16 -0.22 0.00 0.00 0.00 0.00 60.65 61.24 2dpp s ILE 208 Cb -0.07 -3.42 -0.10 0.00 0.01 0.00 0.00 42.46 38.87 2dpp s ILE 208 CO 0.45 0.47 0.96 -1.61 0.00 0.00 0.00 174.94 175.21 2dpp s GLU 209 N 0.18 4.24 0.48 2.79 0.41 -1.26 -4.61 118.70 120.94 2dpp s GLU 209 Ca 0.08 1.20 -0.24 0.00 -0.41 0.00 0.00 54.97 55.60 2dpp s GLU 209 Cb -0.11 -2.29 -0.07 0.00 -1.78 0.00 0.00 34.13 29.88 2dpp s GLU 209 CO -0.01 -0.03 1.42 -2.30 -0.49 0.00 0.00 175.26 173.85 2dpp n PRO 210 N -0.45 2.09 0.00 0.39 -0.02 -1.26 -4.87 135.00 130.88 2dpp n PRO 210 Ca 0.06 0.75 0.09 0.00 -2.02 0.00 0.00 63.50 62.38 2dpp n PRO 210 Cb 0.53 -2.62 0.51 0.00 -0.02 0.00 0.00 33.50 31.89 2dpp n PRO 210 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13