#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dd4 s SER 25 N 0.00 4.88 0.39 4.52 1.04 -1.26 -4.95 113.70 118.32 2dd4 s SER 25 Ca 0.00 0.11 0.11 0.00 0.48 0.00 0.00 55.95 56.64 2dd4 s SER 25 Cb 0.00 -0.79 0.79 0.00 0.10 0.00 0.00 66.02 66.11 2dd4 s SER 25 CO 0.00 -1.48 1.90 0.44 0.98 0.00 0.00 173.24 175.08 2dd4 h ASP 26 N -0.32 0.14 -0.44 7.02 3.32 -2.05 -2.13 116.42 121.95 2dd4 h ASP 26 Ca -0.42 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 56.48 2dd4 h ASP 26 Cb 1.30 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.79 2dd4 h ASP 26 CO 0.53 0.36 -0.15 -0.26 -1.72 0.00 0.00 179.24 178.00 2dd4 h PHE 27 N 0.14 1.04 -0.21 4.55 0.04 -1.99 -1.73 116.94 118.79 2dd4 h PHE 27 Ca 0.03 -0.22 -0.17 0.00 2.80 0.00 0.00 57.97 60.40 2dd4 h PHE 27 Cb 0.45 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 38.34 2dd4 h PHE 27 CO 0.00 1.00 -0.56 0.93 -0.60 0.00 0.00 178.31 179.09 2dd4 h GLU 28 N 0.82 0.64 -0.43 1.51 5.08 -1.83 -0.15 114.58 120.22 2dd4 h GLU 28 Ca 0.12 -0.41 -0.03 0.00 -1.00 0.00 0.00 59.36 58.05 2dd4 h GLU 28 Cb 0.69 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 2dd4 h GLU 28 CO 0.05 1.03 0.16 0.82 -1.00 0.00 0.00 179.01 180.07 2dd4 h ILE 29 N 0.49 1.21 -0.22 3.13 2.04 -1.28 -1.78 117.51 121.08 2dd4 h ILE 29 Ca 0.01 -0.65 -0.14 0.00 1.00 0.00 0.00 64.86 65.08 2dd4 h ILE 29 Cb 1.12 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 2dd4 h ILE 29 CO 0.11 0.24 -0.45 0.25 0.00 0.00 0.00 178.15 178.30 2dd4 h LEU 30 N 0.55 0.61 -0.29 1.44 5.85 -1.23 -1.86 115.31 120.38 2dd4 h LEU 30 Ca 0.14 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 2dd4 h LEU 30 Cb 0.21 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 2dd4 h LEU 30 CO -0.01 0.97 0.14 -0.08 -0.34 0.00 0.00 178.44 179.12 2dd4 h GLU 31 N 0.46 0.42 -0.27 1.25 4.22 -0.85 -0.10 114.58 119.70 2dd4 h GLU 31 Ca 0.03 -0.06 0.01 0.00 0.08 0.00 0.00 59.36 59.42 2dd4 h GLU 31 Cb 0.96 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 2dd4 h GLU 31 CO 0.09 0.40 0.15 0.52 -2.18 0.00 0.00 179.01 177.98 2dd4 h MET 32 N 0.33 0.29 -0.01 1.92 2.86 -1.24 -1.52 114.93 117.56 2dd4 h MET 32 Ca 0.10 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.74 2dd4 h MET 32 Cb 0.12 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 2dd4 h MET 32 CO -0.01 0.19 -0.11 0.00 1.06 0.00 0.00 176.91 178.05 2dd4 h ALA 33 N 1.13 -0.11 -0.31 6.32 0.00 -1.03 -0.70 119.26 124.56 2dd4 h ALA 33 Ca 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2dd4 h ALA 33 Cb 0.01 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2dd4 h ALA 33 CO -0.06 -0.59 0.18 0.28 0.00 0.00 0.00 179.25 179.06 2dd4 h VAL 34 N -0.18 1.11 -0.23 0.00 2.07 -0.90 -1.52 116.25 116.60 2dd4 h VAL 34 Ca 0.04 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2dd4 h VAL 34 Cb 0.23 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 2dd4 h VAL 34 CO -0.12 0.11 0.10 -0.09 0.02 0.00 0.00 177.57 177.59 2dd4 h ARG 35 N 0.39 0.33 -0.67 1.57 2.43 -1.14 -1.03 114.38 116.26 2dd4 h ARG 35 Ca 0.11 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2dd4 h ARG 35 Cb 0.01 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 2dd4 h ARG 35 CO -0.02 0.36 0.34 0.93 -1.51 0.00 0.00 179.97 180.07 2dd4 h GLU 36 N 0.23 0.96 -0.49 0.20 5.08 -1.04 -2.02 114.58 117.49 2dd4 h GLU 36 Ca 0.08 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 2dd4 h GLU 36 Cb 0.14 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2dd4 h GLU 36 CO -0.01 0.74 0.16 -0.07 -1.00 0.00 0.00 179.01 178.83 2dd4 h LEU 37 N 0.93 0.72 -0.58 1.33 3.38 -1.10 0.81 115.31 120.80 2dd4 h LEU 37 Ca 0.23 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 58.02 2dd4 h LEU 37 Cb 0.09 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 2dd4 h LEU 37 CO -0.03 0.73 0.36 0.00 0.09 0.00 0.00 178.44 179.59 2dd4 h ALA 38 N 1.01 0.74 -0.40 1.53 0.00 -0.99 -0.42 119.26 120.73 2dd4 h ALA 38 Ca 0.16 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 2dd4 h ALA 38 Cb 0.27 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2dd4 h ALA 38 CO -0.01 0.11 -0.27 0.82 0.00 0.00 0.00 179.25 179.90 2dd4 h ILE 39 N 0.72 1.28 -0.41 0.00 2.04 -1.16 0.01 117.51 119.98 2dd4 h ILE 39 Ca 0.23 -1.43 -0.01 0.00 1.00 0.00 0.00 64.86 64.65 2dd4 h ILE 39 Cb -0.01 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 2dd4 h ILE 39 CO -0.08 0.48 0.21 -0.33 0.00 0.00 0.00 178.15 178.42 2dd4 h GLU 40 N 0.71 0.57 -0.11 2.37 5.08 -0.42 -1.86 114.58 120.92 2dd4 h GLU 40 Ca 0.08 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2dd4 h GLU 40 Cb 0.85 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2dd4 h GLU 40 CO 0.07 0.44 0.00 1.63 -1.00 0.00 0.00 179.01 180.15 2dd4 n LYS 41 N -4.41 1.68 -1.88 2.33 4.76 -0.20 -4.94 118.16 115.51 2dd4 n LYS 41 Ca 0.03 -1.02 -0.11 0.00 -2.87 0.00 0.00 58.31 54.34 2dd4 n LYS 41 Cb 0.11 -1.42 -0.02 0.00 -1.84 0.00 0.00 35.03 31.86 2dd4 n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dd4 n GLY 42 N 1.14 0.40 0.20 0.72 0.00 -0.70 -4.91 105.19 102.04 2dd4 n GLY 42 Ca 0.17 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 2dd4 n GLY 42 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dd4 h LEU 43 N 0.00 0.79 -7.33 0.99 3.38 -1.24 -3.46 115.31 108.44 2dd4 h LEU 43 Ca -0.25 -0.62 -0.05 0.00 0.09 0.00 0.00 57.88 57.05 2dd4 h LEU 43 Cb 1.01 -0.23 -0.13 0.00 0.09 0.00 0.00 40.66 41.40 2dd4 h LEU 43 CO 0.31 1.28 -0.03 0.72 0.09 0.00 0.00 178.44 180.81 2dd4 s PHE 44 N -3.78 -0.27 0.46 1.13 -0.12 -1.24 -5.05 117.98 109.10 2dd4 s PHE 44 Ca -0.12 0.02 0.05 0.00 -0.05 0.00 0.00 56.93 56.84 2dd4 s PHE 44 Cb 0.07 0.30 0.02 0.00 -0.63 0.00 0.00 43.02 42.78 2dd4 s PHE 44 CO 0.86 -0.70 0.63 -1.54 -0.05 0.00 0.00 175.22 174.43 2dd4 s SER 45 N -2.65 5.57 0.29 1.98 1.04 -1.26 -3.89 113.70 114.77 2dd4 s SER 45 Ca 0.01 -0.23 -0.02 0.00 0.48 0.00 0.00 55.95 56.19 2dd4 s SER 45 Cb 0.01 -0.82 0.41 0.00 0.10 0.00 0.00 66.02 65.72 2dd4 s SER 45 CO -0.10 -0.86 1.91 0.00 0.98 0.00 0.00 173.24 175.17 2dd4 h ALA 46 N 0.46 1.32 -0.36 5.32 0.00 -1.98 -2.13 119.26 121.90 2dd4 h ALA 46 Ca -0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 2dd4 h ALA 46 Cb 1.28 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 2dd4 h ALA 46 CO 0.49 0.55 0.18 0.93 0.00 0.00 0.00 179.25 181.39 2dd4 h GLU 47 N 1.01 0.51 -0.55 0.00 3.07 -1.99 -2.14 114.58 114.50 2dd4 h GLU 47 Ca 0.26 -0.07 0.07 0.00 -0.50 0.00 0.00 59.36 59.12 2dd4 h GLU 47 Cb 0.03 -0.09 -0.06 0.00 -0.84 0.00 0.00 28.75 27.79 2dd4 h GLU 47 CO -0.04 0.45 0.21 -0.44 -1.40 0.00 0.00 179.01 177.80 2dd4 h ASP 48 N 0.44 0.23 -0.28 1.42 3.32 -1.78 0.20 116.42 119.98 2dd4 h ASP 48 Ca 0.12 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.23 2dd4 h ASP 48 Cb 0.11 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 2dd4 h ASP 48 CO -0.02 0.16 0.17 -0.74 -1.72 0.00 0.00 179.24 177.09 2dd4 h HIS 49 N 0.40 0.36 -0.47 4.55 2.76 -1.18 -0.29 115.15 121.29 2dd4 h HIS 49 Ca 0.26 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.38 2dd4 h HIS 49 Cb 0.28 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.10 2dd4 h HIS 49 CO -0.15 0.26 0.05 0.00 -1.30 0.00 0.00 177.93 176.79 2dd4 h ARG 50 N 0.36 0.74 -0.63 5.26 3.08 -0.92 -1.95 114.38 120.33 2dd4 h ARG 50 Ca 0.10 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 2dd4 h ARG 50 Cb 0.00 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 2dd4 h ARG 50 CO -0.02 0.72 0.37 0.28 -1.07 0.00 0.00 179.97 180.25 2dd4 h VAL 51 N 0.70 1.19 -0.43 2.04 2.07 0.07 -0.35 116.25 121.54 2dd4 h VAL 51 Ca 0.15 -0.44 -0.14 0.00 0.82 0.00 0.00 66.70 67.09 2dd4 h VAL 51 Cb 0.36 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 2dd4 h VAL 51 CO 0.01 0.20 -0.28 -0.25 0.02 0.00 0.00 177.57 177.26 2dd4 h TRP 52 N 0.85 1.12 -0.63 1.57 2.91 -0.70 -1.69 115.95 119.38 2dd4 h TRP 52 Ca 0.22 -0.30 -0.06 0.00 1.13 0.00 0.00 58.89 59.89 2dd4 h TRP 52 Cb -0.00 -0.25 -0.03 0.00 -0.51 0.00 0.00 29.16 28.37 2dd4 h TRP 52 CO -0.02 1.13 0.17 0.87 -1.03 0.00 0.00 178.44 179.56 2dd4 h LYS 53 N 0.80 0.98 -0.61 2.65 1.57 -1.15 -0.76 116.57 120.04 2dd4 h LYS 53 Ca 0.09 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.57 2dd4 h LYS 53 Cb 0.87 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 2dd4 h LYS 53 CO 0.08 0.86 0.05 -0.44 -0.57 0.00 0.00 179.45 179.43 2dd4 h ASP 54 N 0.94 1.00 -0.03 0.86 3.32 -0.86 -1.45 116.42 120.20 2dd4 h ASP 54 Ca 0.20 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 2dd4 h ASP 54 Cb 0.31 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 2dd4 h ASP 54 CO -0.00 1.02 0.02 0.22 -1.72 0.00 0.00 179.24 178.78 2dd4 h TYR 55 N 0.96 0.04 -0.98 4.55 3.20 -0.86 -2.27 116.97 121.61 2dd4 h TYR 55 Ca 0.18 -0.00 0.14 0.00 3.14 0.00 0.00 58.73 62.19 2dd4 h TYR 55 Cb 0.49 -0.01 -0.09 0.00 1.54 0.00 0.00 36.73 38.66 2dd4 h TYR 55 CO 0.03 0.12 0.62 0.28 -1.64 0.00 0.00 178.16 177.57 2dd4 h VAL 56 N -0.05 0.85 0.00 1.81 2.07 -0.93 0.18 116.25 120.19 2dd4 h VAL 56 Ca 0.01 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2dd4 h VAL 56 Cb 0.09 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 2dd4 h VAL 56 CO -0.00 0.16 0.00 -0.74 0.02 0.00 0.00 177.57 177.01 2dd4 h HIS 57 N 0.87 0.00 0.00 1.57 -0.00 -0.69 -1.74 115.15 115.16 2dd4 h HIS 57 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.87 2dd4 h HIS 57 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.05 2dd4 h HIS 57 CO -0.00 0.00 -0.49 0.25 -0.00 0.00 0.00 177.93 177.69 2dd4 n THR 58 N -2.49 0.18 -2.35 6.26 -2.24 0.63 -4.92 114.28 109.35 2dd4 n THR 58 Ca 0.01 -0.13 -0.32 0.00 -2.27 0.00 0.00 64.05 61.34 2dd4 n THR 58 Cb 0.20 -0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.38 2dd4 n THR 58 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dd4 s LEU 59 N -3.60 3.57 -0.09 3.22 1.43 -0.66 -5.06 118.68 117.50 2dd4 s LEU 59 Ca 0.09 1.50 -0.32 0.00 -1.03 0.00 0.00 54.13 54.37 2dd4 s LEU 59 Cb 0.16 -4.45 0.12 0.00 0.03 0.00 0.00 46.19 42.05 2dd4 s LEU 59 CO 0.69 -0.62 1.40 -0.83 0.23 0.00 0.00 176.35 177.22 2dd4 s GLY 60 N -3.28 -0.36 0.00 -3.19 0.00 -1.26 -4.83 107.32 94.39 2dd4 s GLY 60 Ca 0.57 0.57 0.28 0.00 0.00 0.00 0.00 44.72 46.15 2dd4 s GLY 60 CO 0.35 3.25 1.86 -1.55 0.00 0.00 0.00 173.10 177.01 2dd4 n PRO 61 N -0.72 0.05 -0.24 2.90 -0.04 -1.03 -3.25 135.00 132.68 2dd4 n PRO 61 Ca -0.02 -0.01 -0.04 0.00 -0.04 0.00 0.00 63.50 63.39 2dd4 n PRO 61 Cb 0.61 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.64 2dd4 n PRO 61 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2dd4 h LEU 62 N 0.02 0.73 -0.58 1.53 5.85 -1.88 -2.33 115.31 118.65 2dd4 h LEU 62 Ca 0.00 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.78 2dd4 h LEU 62 Cb 0.48 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.29 2dd4 h LEU 62 CO 0.00 0.51 0.28 -0.65 -0.34 0.00 0.00 178.44 178.24 2dd4 h PRO 63 N 0.86 0.50 -0.82 5.25 0.11 -1.75 0.61 132.00 136.77 2dd4 h PRO 63 Ca 0.26 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.31 2dd4 h PRO 63 Cb -0.03 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 30.93 2dd4 h PRO 63 CO -0.09 0.33 0.36 0.00 -0.21 0.00 0.00 178.00 178.40 2dd4 h ALA 64 N 1.34 1.09 -0.65 -0.75 0.00 -1.29 -1.25 119.26 117.75 2dd4 h ALA 64 Ca 0.27 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2dd4 h ALA 64 Cb 0.22 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2dd4 h ALA 64 CO -0.21 0.66 0.12 0.00 0.00 0.00 0.00 179.25 179.82 2dd4 h ALA 65 N 1.21 0.99 -0.22 0.00 0.00 -0.79 -2.44 119.26 118.02 2dd4 h ALA 65 Ca 0.28 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 2dd4 h ALA 65 Cb 0.17 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2dd4 h ALA 65 CO -0.03 0.64 -0.32 0.00 0.00 0.00 0.00 179.25 179.55 2dd4 h ARG 66 N 0.99 0.44 -0.73 0.00 3.08 -0.44 -1.57 114.38 116.14 2dd4 h ARG 66 Ca 0.20 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 2dd4 h ARG 66 Cb 0.41 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 2dd4 h ARG 66 CO 0.01 0.71 0.31 1.25 -1.07 0.00 0.00 179.97 181.18 2dd4 h LEU 67 N 0.38 0.98 -0.24 3.04 6.46 -0.88 0.53 115.31 125.58 2dd4 h LEU 67 Ca 0.05 -0.16 -0.03 0.00 -0.12 0.00 0.00 57.88 57.62 2dd4 h LEU 67 Cb 0.74 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 40.41 2dd4 h LEU 67 CO 0.06 0.87 0.04 0.58 -0.62 0.00 0.00 178.44 179.37 2dd4 h VAL 68 N 1.03 1.23 -0.43 1.05 2.07 -1.10 -1.10 116.25 119.00 2dd4 h VAL 68 Ca 0.24 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 67.01 2dd4 h VAL 68 Cb 0.18 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 2dd4 h VAL 68 CO -0.02 0.24 0.26 0.00 0.02 0.00 0.00 177.57 178.07 2dd4 h ALA 69 N 0.85 0.54 -0.91 1.67 0.00 -1.01 -0.41 119.26 120.00 2dd4 h ALA 69 Ca 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2dd4 h ALA 69 Cb 0.33 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2dd4 h ALA 69 CO 0.00 -0.05 0.54 0.87 0.00 0.00 0.00 179.25 180.61 2dd4 h LYS 70 N 0.54 1.24 -0.41 0.00 1.57 -0.78 -2.11 116.57 116.61 2dd4 h LYS 70 Ca 0.17 -0.12 -0.09 0.00 -1.87 0.00 0.00 60.65 58.73 2dd4 h LYS 70 Cb -0.02 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.02 2dd4 h LYS 70 CO -0.06 0.88 -0.12 0.00 -0.57 0.00 0.00 179.45 179.58 2dd4 h ALA 71 N 1.33 1.02 -0.09 3.86 0.00 -0.56 -0.61 119.26 124.21 2dd4 h ALA 71 Ca 0.32 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2dd4 h ALA 71 Cb -0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2dd4 h ALA 71 CO -0.06 0.59 -0.27 -1.49 0.00 0.00 0.00 179.25 178.02 2dd4 h TRP 72 N 0.67 0.17 -0.01 0.00 6.55 -0.56 -3.05 115.95 119.72 2dd4 h TRP 72 Ca 0.11 -0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.92 2dd4 h TRP 72 Cb 0.59 -0.04 0.00 0.00 -0.86 0.00 0.00 29.16 28.84 2dd4 h TRP 72 CO 0.03 0.42 -0.53 1.28 -1.05 0.00 0.00 178.44 178.58 2dd4 n LEU 73 N -4.17 1.06 -3.50 -4.49 4.77 -0.84 -4.79 117.00 105.03 2dd4 n LEU 73 Ca -0.01 -0.33 -0.25 0.00 -0.03 0.00 0.00 56.01 55.38 2dd4 n LEU 73 Cb 0.35 -0.11 -0.14 0.00 -2.33 0.00 0.00 43.42 41.20 2dd4 n LEU 73 CO 0.39 0.22 -0.28 -0.62 -1.33 0.00 0.00 177.39 175.77 2dd4 s ASP 74 N -2.75 2.86 0.36 -1.43 -1.08 -0.28 -5.02 116.67 109.32 2dd4 s ASP 74 Ca 0.16 -1.05 0.11 0.00 -0.52 0.00 0.00 52.55 51.25 2dd4 s ASP 74 Cb 0.18 -0.08 0.90 0.00 -1.46 0.00 0.00 42.92 42.46 2dd4 s ASP 74 CO 0.66 -0.42 1.82 -0.65 0.52 0.00 0.00 175.17 177.10 2dd4 h PRO 75 N 8.37 0.59 -0.43 4.34 0.11 -1.87 -0.21 132.00 142.90 2dd4 h PRO 75 Ca -0.18 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.76 2dd4 h PRO 75 Cb 1.04 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 2dd4 h PRO 75 CO 0.39 0.39 -0.28 0.93 -0.21 0.00 0.00 178.00 179.22 2dd4 h GLU 76 N 0.61 0.94 -0.32 1.05 4.39 -1.95 -2.01 114.58 117.28 2dd4 h GLU 76 Ca 0.52 -0.44 -0.11 0.00 0.34 0.00 0.00 59.36 59.66 2dd4 h GLU 76 Cb 1.00 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.63 2dd4 h GLU 76 CO -0.27 1.10 -0.27 -0.92 -1.16 0.00 0.00 179.01 177.50 2dd4 h TYR 77 N 0.77 0.75 -0.84 4.33 3.20 -1.57 -2.05 116.97 121.57 2dd4 h TYR 77 Ca 0.09 -0.18 -0.02 0.00 3.14 0.00 0.00 58.73 61.76 2dd4 h TYR 77 Cb 0.86 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.92 2dd4 h TYR 77 CO 0.06 0.86 0.46 -0.22 -1.64 0.00 0.00 178.16 177.68 2dd4 h LYS 78 N 0.57 1.17 -0.68 1.82 3.64 -0.91 0.27 116.57 122.44 2dd4 h LYS 78 Ca 0.07 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2dd4 h LYS 78 Cb 0.75 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 2dd4 h LYS 78 CO 0.06 0.86 0.44 0.87 -2.27 0.00 0.00 179.45 179.40 2dd4 h LYS 79 N 1.17 0.91 -0.62 1.90 1.57 -1.00 -1.84 116.57 118.65 2dd4 h LYS 79 Ca 0.30 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.99 2dd4 h LYS 79 Cb 0.03 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.11 2dd4 h LYS 79 CO -0.05 0.62 0.30 1.25 -0.57 0.00 0.00 179.45 181.00 2dd4 h LEU 80 N 0.93 0.82 -0.41 2.94 5.85 -0.64 -1.90 115.31 122.90 2dd4 h LEU 80 Ca 0.25 -0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.88 2dd4 h LEU 80 Cb -0.08 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.70 2dd4 h LEU 80 CO -0.05 0.72 0.15 0.00 -0.34 0.00 0.00 178.44 178.92 2dd4 h ILE 82 N 0.32 1.26 0.07 0.00 1.08 -1.14 -3.11 117.51 115.99 2dd4 h ILE 82 Ca 0.19 -1.19 -0.31 0.00 -0.39 0.00 0.00 64.86 63.16 2dd4 h ILE 82 Cb 0.17 1.00 -0.03 0.00 -3.07 0.00 0.00 36.82 34.89 2dd4 h ILE 82 CO -0.19 0.41 -1.67 -0.08 -0.69 0.00 0.00 178.15 175.94 2dd4 h GLU 83 N 0.78 0.14 -1.99 2.37 4.57 -1.07 -3.44 114.58 115.94 2dd4 h GLU 83 Ca 0.13 -0.24 -0.46 0.00 -1.18 0.00 0.00 59.36 57.60 2dd4 h GLU 83 Cb 0.61 0.09 -0.32 0.00 -0.16 0.00 0.00 28.75 28.97 2dd4 h GLU 83 CO 0.04 0.89 -0.83 0.34 -1.18 0.00 0.00 179.01 178.27 2dd4 s ASP 84 N -6.64 0.70 0.39 1.04 -1.08 0.12 -4.99 116.67 106.21 2dd4 s ASP 84 Ca -0.10 -2.61 0.09 0.00 -0.52 0.00 0.00 52.55 49.41 2dd4 s ASP 84 Cb 0.07 0.23 0.86 0.00 -1.46 0.00 0.00 42.92 42.62 2dd4 s ASP 84 CO 0.82 -0.15 1.98 1.23 0.52 0.00 0.00 175.17 179.57 2dd4 h GLY 85 N 5.60 0.78 0.95 2.66 0.00 -1.53 -1.53 103.07 110.00 2dd4 h GLY 85 Ca 0.20 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 2dd4 h GLY 85 CO 0.26 0.18 0.14 -2.08 0.00 0.00 0.00 176.54 175.04 2dd4 h VAL 86 N 0.61 1.12 -0.44 4.60 2.07 -1.89 -0.57 116.25 121.74 2dd4 h VAL 86 Ca 0.28 -0.30 -0.11 0.00 0.82 0.00 0.00 66.70 67.39 2dd4 h VAL 86 Cb 0.32 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2dd4 h VAL 86 CO -0.09 0.11 -0.15 -0.08 0.02 0.00 0.00 177.57 177.39 2dd4 h GLU 87 N 0.30 0.87 -0.58 1.57 4.57 -1.81 -3.04 114.58 116.46 2dd4 h GLU 87 Ca 0.09 -0.35 -0.02 0.00 -1.18 0.00 0.00 59.36 57.90 2dd4 h GLU 87 Cb 0.06 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.58 2dd4 h GLU 87 CO -0.01 1.00 0.29 0.00 -1.18 0.00 0.00 179.01 179.10 2dd4 h ALA 88 N 0.85 1.42 -0.07 2.92 0.00 -1.11 -2.65 119.26 120.63 2dd4 h ALA 88 Ca 0.11 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2dd4 h ALA 88 Cb 0.70 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2dd4 h ALA 88 CO 0.05 0.47 0.06 1.03 0.00 0.00 0.00 179.25 180.86 2dd4 h SER 89 N 0.81 0.00 0.07 0.00 0.87 -0.98 -1.67 113.55 112.65 2dd4 h SER 89 Ca 0.20 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.75 2dd4 h SER 89 Cb 0.07 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.03 2dd4 h SER 89 CO -0.03 0.00 -0.05 0.11 -0.53 0.00 0.00 176.83 176.33 2dd4 h LYS 90 N 0.00 0.00 0.00 2.24 1.57 -1.51 -1.80 116.57 117.06 2dd4 h LYS 90 Ca 0.03 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2dd4 h LYS 90 Cb 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 2dd4 h LYS 90 CO -0.00 0.05 -0.09 0.00 -0.57 0.00 0.00 179.45 178.85 2dd4 h ALA 91 N 1.95 1.46 -0.43 3.86 0.00 -1.47 -1.65 119.26 122.98 2dd4 h ALA 91 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2dd4 h ALA 91 Cb 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2dd4 h ALA 91 CO 0.01 0.11 0.00 1.33 0.00 0.00 0.00 179.25 180.70 2dd4 n VAL 92 N -3.85 2.55 -0.99 0.00 0.24 -0.71 -4.95 118.33 110.62 2dd4 n VAL 92 Ca -0.02 -1.63 0.00 0.00 -2.04 0.00 0.00 64.34 60.65 2dd4 n VAL 92 Cb 0.18 -0.27 0.00 0.00 -1.47 0.00 0.00 33.84 32.29 2dd4 n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dd4 n GLY 93 N 0.10 0.89 3.23 7.63 0.00 -0.62 -4.90 105.19 111.52 2dd4 n GLY 93 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 2dd4 n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dd4 s VAL 94 N -3.58 4.43 -0.42 1.61 1.01 -1.04 -4.97 120.40 117.44 2dd4 s VAL 94 Ca 0.00 -1.77 -0.20 0.00 0.00 0.00 0.00 61.98 60.01 2dd4 s VAL 94 Cb 0.00 -3.90 0.02 0.00 0.00 0.00 0.00 36.38 32.50 2dd4 s VAL 94 CO 0.00 -0.80 0.58 0.21 0.00 0.00 0.00 175.10 175.09 2dd4 s ASN 95 N 2.81 6.30 0.64 3.32 3.84 -1.26 -3.54 114.94 127.04 2dd4 s ASN 95 Ca 0.06 -0.34 0.35 0.00 0.21 0.00 0.00 52.86 53.14 2dd4 s ASN 95 Cb -0.26 -2.29 1.93 0.00 -0.55 0.00 0.00 41.25 40.08 2dd4 s ASN 95 CO -0.00 -0.69 2.15 -0.50 -2.79 0.00 0.00 177.10 175.27 2dd4 h TRP 96 N 8.76 0.00 0.00 0.43 4.06 -1.94 0.66 115.95 127.92 2dd4 h TRP 96 Ca -0.26 0.00 -0.29 0.00 2.06 0.00 0.00 58.89 60.40 2dd4 h TRP 96 Cb 1.10 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.22 2dd4 h TRP 96 CO 0.71 0.00 -1.65 0.28 -3.56 0.00 0.00 178.44 174.21 2dd4 n VAL 97 N -3.28 1.53 0.90 1.49 0.31 -1.26 -3.35 118.33 114.67 2dd4 n VAL 97 Ca -0.01 -0.13 0.11 0.00 -0.01 0.00 0.00 64.34 64.30 2dd4 n VAL 97 Cb 0.25 -2.02 0.03 0.00 -0.91 0.00 0.00 33.84 31.19 2dd4 n VAL 97 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2dd4 n THR 98 N -4.38 0.03 -0.04 2.52 -2.24 -1.15 -1.77 114.28 107.25 2dd4 n THR 98 Ca -0.38 -0.05 -0.17 0.00 -2.27 0.00 0.00 64.05 61.18 2dd4 n THR 98 Cb 0.73 0.59 -0.07 0.00 -2.10 0.00 0.00 70.33 69.47 2dd4 n THR 98 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2dd4 h SER 99 N 0.00 0.87 -4.13 3.42 0.02 -1.14 -3.44 113.55 109.15 2dd4 h SER 99 Ca 0.00 -0.61 -0.51 0.00 -0.84 0.00 0.00 61.79 59.83 2dd4 h SER 99 Cb 0.55 -0.25 0.10 0.00 0.14 0.00 0.00 62.40 62.93 2dd4 h SER 99 CO 0.00 1.33 0.42 -2.84 -1.14 0.00 0.00 176.83 174.61 2dd4 s PRO 100 N -3.81 3.03 0.51 3.45 0.02 -1.26 -4.91 135.00 132.03 2dd4 s PRO 100 Ca -0.11 1.61 0.27 0.00 0.02 0.00 0.00 61.00 62.79 2dd4 s PRO 100 Cb 0.08 -1.96 1.37 0.00 0.02 0.00 0.00 34.50 34.01 2dd4 s PRO 100 CO 0.88 -1.11 1.90 -1.35 -0.33 0.00 0.00 177.00 176.99 2dd4 h PRO 101 N 0.70 0.10 -0.05 5.54 0.11 -1.93 -2.04 132.00 134.42 2dd4 h PRO 101 Ca -0.49 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 2dd4 h PRO 101 Cb 1.27 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2dd4 h PRO 101 CO 0.55 0.06 -0.27 1.79 -0.21 0.00 0.00 178.00 179.93 2dd4 h THR 102 N 0.10 1.22 -0.55 -1.15 1.35 -1.91 -3.47 112.91 108.50 2dd4 h THR 102 Ca 0.41 -1.02 -0.19 0.00 -0.55 0.00 0.00 66.41 65.05 2dd4 h THR 102 Cb 1.47 1.48 -0.07 0.00 -1.73 0.00 0.00 68.15 69.31 2dd4 h THR 102 CO -0.05 0.30 -0.18 1.67 -0.25 0.00 0.00 175.52 177.01 2dd4 n GLN 103 N -4.19 -0.67 -1.29 4.72 7.27 -0.77 -4.82 117.38 117.63 2dd4 n GLN 103 Ca -0.02 0.79 -0.01 0.00 0.07 0.00 0.00 57.00 57.84 2dd4 n GLN 103 Cb 0.34 -4.71 -0.02 0.00 2.41 0.00 0.00 30.24 28.26 2dd4 n GLN 103 CO 0.00 0.00 0.00 1.97 0.07 0.00 0.00 177.06 179.10 2dd4 n PHE 104 N -2.86 -0.00 -0.02 3.69 1.16 -0.76 -4.65 117.46 114.00 2dd4 n PHE 104 Ca -0.10 -0.52 0.00 0.00 -1.87 0.00 0.00 57.45 54.96 2dd4 n PHE 104 Cb 0.34 0.16 -0.00 0.00 -1.61 0.00 0.00 39.48 38.37 2dd4 n PHE 104 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2dd4 n GLY 105 N 0.25 -2.68 3.74 4.97 0.00 -0.73 -4.86 105.19 105.88 2dd4 n GLY 105 Ca -0.10 -1.40 -0.36 0.00 0.00 0.00 0.00 46.02 44.16 2dd4 n GLY 105 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dd4 s THR 106 N -3.29 2.44 0.39 2.61 -4.23 -1.26 -4.73 115.64 107.56 2dd4 s THR 106 Ca 0.00 0.26 0.07 0.00 -1.18 0.00 0.00 61.69 60.83 2dd4 s THR 106 Cb 0.00 -3.04 0.22 0.00 1.34 0.00 0.00 72.50 71.03 2dd4 s THR 106 CO 0.00 -0.07 1.99 -0.65 -0.54 0.00 0.00 174.62 175.35 2dd4 h PRO 107 N 0.55 0.50 0.00 3.99 0.11 -1.95 -2.86 132.00 132.34 2dd4 h PRO 107 Ca -0.50 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.55 2dd4 h PRO 107 Cb 1.31 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2dd4 h PRO 107 CO 0.54 0.41 -1.58 0.43 -0.21 0.00 0.00 178.00 177.59 2dd4 n SER 108 N -4.40 0.34 -0.01 -2.05 7.64 -1.26 -4.44 113.62 109.44 2dd4 n SER 108 Ca 0.02 -0.02 0.11 0.00 1.01 0.00 0.00 58.87 59.99 2dd4 n SER 108 Cb 0.14 1.42 -0.16 0.00 -1.01 0.00 0.00 64.21 64.59 2dd4 n SER 108 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2dd4 n ASP 109 N -2.27 0.12 -0.42 6.43 8.00 -1.23 -4.93 116.55 122.26 2dd4 n ASP 109 Ca -0.02 -0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.36 2dd4 n ASP 109 Cb 0.53 1.88 0.00 0.00 -0.02 0.00 0.00 41.12 43.51 2dd4 n ASP 109 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2dd4 n TYR 110 N -2.17 -1.34 -2.53 1.24 4.02 -1.08 -4.58 117.16 110.72 2dd4 n TYR 110 Ca -0.03 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.67 2dd4 n TYR 110 Cb 0.54 0.21 0.02 0.00 -0.02 0.00 0.00 39.34 40.09 2dd4 n TYR 110 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dd4 n ASN 112 N -0.36 0.36 -4.74 0.00 2.85 -1.26 -4.95 115.26 107.17 2dd4 n ASN 112 Ca 0.27 -2.66 -0.41 0.00 -0.11 0.00 0.00 54.58 51.67 2dd4 n ASN 112 Cb 0.75 -0.62 -0.05 0.00 1.24 0.00 0.00 39.78 41.11 2dd4 n ASN 112 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 2dd4 s LEU 113 N -0.83 4.48 -0.04 1.20 2.96 -1.26 -2.20 118.68 122.99 2dd4 s LEU 113 Ca 0.34 1.67 0.05 0.00 -0.22 0.00 0.00 54.13 55.97 2dd4 s LEU 113 Cb 0.11 -3.46 -0.01 0.00 0.50 0.00 0.00 46.19 43.33 2dd4 s LEU 113 CO -0.14 -0.03 -0.20 -0.13 -1.32 0.00 0.00 176.35 174.53 2dd4 s ARG 114 N -0.05 1.96 -0.23 1.98 0.52 -0.24 -3.23 118.95 119.67 2dd4 s ARG 114 Ca 0.44 -0.73 -0.08 0.00 -0.52 0.00 0.00 55.73 54.84 2dd4 s ARG 114 Cb -0.22 -1.74 -0.04 0.00 0.52 0.00 0.00 34.95 33.47 2dd4 s ARG 114 CO 0.27 0.35 0.08 0.08 0.02 0.00 0.00 175.30 176.10 2dd4 s VAL 115 N -0.18 4.61 -0.37 3.52 1.01 -1.25 -2.71 120.40 125.03 2dd4 s VAL 115 Ca -0.00 -0.08 -0.16 0.00 0.00 0.00 0.00 61.98 61.74 2dd4 s VAL 115 Cb -0.11 -3.13 -0.00 0.00 0.00 0.00 0.00 36.38 33.14 2dd4 s VAL 115 CO 0.02 0.38 0.41 -0.76 0.00 0.00 0.00 175.10 175.15 2dd4 s LEU 116 N 1.13 4.54 -0.37 3.92 1.43 -0.66 -4.52 118.68 124.14 2dd4 s LEU 116 Ca 0.05 -0.31 -0.21 0.00 -1.03 0.00 0.00 54.13 52.62 2dd4 s LEU 116 Cb -0.14 -2.40 0.01 0.00 0.03 0.00 0.00 46.19 43.68 2dd4 s LEU 116 CO 0.04 -0.44 0.67 0.00 0.23 0.00 0.00 176.35 176.85 2dd4 s ALA 117 N 2.13 3.43 0.85 4.21 0.00 -1.26 -0.52 121.76 130.60 2dd4 s ALA 117 Ca 0.13 -0.88 -0.11 0.00 0.00 0.00 0.00 51.96 51.10 2dd4 s ALA 117 Cb -0.16 -3.24 0.10 0.00 0.00 0.00 0.00 23.12 19.82 2dd4 s ALA 117 CO 0.13 -1.46 1.09 -0.51 0.00 0.00 0.00 175.76 175.01 2dd4 s ASP 118 N 1.85 3.88 0.34 0.00 1.01 -0.30 -4.92 116.67 118.52 2dd4 s ASP 118 Ca 0.25 1.49 -0.11 0.00 0.71 0.00 0.00 52.55 54.89 2dd4 s ASP 118 Cb -0.14 -2.19 0.03 0.00 1.01 0.00 0.00 42.92 41.62 2dd4 s ASP 118 CO 0.16 -2.39 0.64 -0.94 0.21 0.00 0.00 175.17 172.85 2dd4 s SER 119 N -3.53 0.26 0.64 0.27 1.04 0.90 -4.60 113.70 108.68 2dd4 s SER 119 Ca 0.62 -1.17 0.38 0.00 0.48 0.00 0.00 55.95 56.26 2dd4 s SER 119 Cb -0.17 0.74 2.07 0.00 0.10 0.00 0.00 66.02 68.76 2dd4 s SER 119 CO 0.56 -1.45 2.16 -0.65 0.98 0.00 0.00 173.24 174.84 2dd4 h PRO 120 N 2.07 0.00 -0.02 4.02 0.11 -2.02 -2.00 132.00 134.15 2dd4 h PRO 120 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2dd4 h PRO 120 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2dd4 h PRO 120 CO 0.37 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.41 2dd4 n THR 121 N -2.95 0.72 -3.73 -1.15 -2.24 -1.26 -4.88 114.28 98.79 2dd4 n THR 121 Ca -0.03 -0.86 -0.13 0.00 -2.27 0.00 0.00 64.05 60.76 2dd4 n THR 121 Cb 0.18 0.64 -0.14 0.00 -2.10 0.00 0.00 70.33 68.91 2dd4 n THR 121 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2dd4 s LEU 122 N -0.75 0.53 -0.07 3.22 2.96 -0.75 -1.14 118.68 122.67 2dd4 s LEU 122 Ca 0.02 0.41 -0.01 0.00 -0.22 0.00 0.00 54.13 54.33 2dd4 s LEU 122 Cb 0.01 0.54 0.03 0.00 0.50 0.00 0.00 46.19 47.26 2dd4 s LEU 122 CO 0.01 -0.16 0.00 -0.75 -1.32 0.00 0.00 176.35 174.14 2dd4 s LYS 123 N 1.28 0.58 0.15 1.98 2.47 -0.04 -0.07 119.74 126.09 2dd4 s LYS 123 Ca -0.09 0.12 0.01 0.00 -1.56 0.00 0.00 55.97 54.46 2dd4 s LYS 123 Cb -0.11 -0.94 -0.04 0.00 -1.46 0.00 0.00 37.83 35.28 2dd4 s LYS 123 CO -0.07 -0.30 0.30 -1.01 0.16 0.00 0.00 175.35 174.43 2dd4 s HIS 124 N 1.96 3.49 -0.09 4.03 3.76 -1.26 -0.89 115.29 126.28 2dd4 s HIS 124 Ca 0.05 0.19 -0.07 0.00 -0.15 0.00 0.00 55.06 55.07 2dd4 s HIS 124 Cb -0.12 -1.72 0.03 0.00 1.11 0.00 0.00 32.58 31.87 2dd4 s HIS 124 CO -0.05 0.49 0.24 0.54 -0.85 0.00 0.00 174.74 175.11 2dd4 s VAL 125 N -1.74 -0.01 0.05 -0.90 0.11 -0.78 -4.50 120.40 112.62 2dd4 s VAL 125 Ca 0.36 0.04 0.04 0.00 -2.93 0.00 0.00 61.98 59.48 2dd4 s VAL 125 Cb -0.11 -0.35 -0.04 0.00 -1.53 0.00 0.00 36.38 34.35 2dd4 s VAL 125 CO 0.29 0.02 -0.03 -0.69 -3.33 0.00 0.00 175.10 171.35 2dd4 s VAL 126 N 0.42 3.84 0.18 2.04 1.01 -0.06 -1.07 120.40 126.76 2dd4 s VAL 126 Ca -0.02 -0.90 -0.16 0.00 0.00 0.00 0.00 61.98 60.89 2dd4 s VAL 126 Cb -0.04 -2.76 0.03 0.00 0.00 0.00 0.00 36.38 33.60 2dd4 s VAL 126 CO -0.02 0.24 0.47 0.54 0.00 0.00 0.00 175.10 176.33 2dd4 s VAL 127 N -1.17 0.04 -0.35 2.92 0.11 -0.41 -4.93 120.40 116.60 2dd4 s VAL 127 Ca 0.22 -0.79 0.00 0.00 -2.93 0.00 0.00 61.98 58.48 2dd4 s VAL 127 Cb -0.11 -1.51 0.11 0.00 -1.53 0.00 0.00 36.38 33.34 2dd4 s VAL 127 CO 0.13 -0.18 0.15 0.00 -3.33 0.00 0.00 175.10 171.88 2dd4 h THR 129 N 5.97 0.73 0.00 0.00 1.35 -1.87 -2.75 112.91 116.34 2dd4 h THR 129 Ca -0.08 -0.53 -0.02 0.00 -0.55 0.00 0.00 66.41 65.23 2dd4 h THR 129 Cb 0.98 1.32 -0.00 0.00 -1.73 0.00 0.00 68.15 68.72 2dd4 h THR 129 CO 0.45 0.13 -0.27 -0.07 -0.25 0.00 0.00 175.52 175.51 2dd4 h LEU 130 N 0.00 0.00 0.00 3.87 3.38 -1.91 -3.47 115.31 117.18 2dd4 h LEU 130 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dd4 h LEU 130 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2dd4 h LEU 130 CO 0.02 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.64 2dd4 n SER 132 N 0.00 0.99 -4.64 0.00 3.41 -1.26 -4.57 113.62 107.55 2dd4 n SER 132 Ca 0.00 -2.12 -0.47 0.00 -0.26 0.00 0.00 58.87 56.02 2dd4 n SER 132 Cb 0.00 -0.26 -0.04 0.00 -0.26 0.00 0.00 64.21 63.65 2dd4 n SER 132 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dd4 s TYR 134 N 0.38 -0.21 -1.43 0.00 5.04 -1.26 -4.69 117.35 115.18 2dd4 s TYR 134 Ca 0.76 0.41 -0.10 0.00 -2.44 0.00 0.00 57.07 55.70 2dd4 s TYR 134 Cb -0.76 0.09 -0.07 0.00 0.35 0.00 0.00 41.96 41.58 2dd4 s TYR 134 CO 0.45 -0.31 2.64 -0.35 -1.34 0.00 0.00 175.55 176.64 2dd4 n PRO 135 N 1.80 3.17 -0.26 4.97 -0.04 -1.26 -4.76 135.00 138.60 2dd4 n PRO 135 Ca -0.19 -2.10 0.07 0.00 -0.04 0.00 0.00 63.50 61.24 2dd4 n PRO 135 Cb 0.56 -2.81 0.20 0.00 -0.04 0.00 0.00 33.50 31.42 2dd4 n PRO 135 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dd4 h ARG 136 N 5.53 0.30 -0.94 0.54 3.08 -1.94 -0.06 114.38 120.89 2dd4 h ARG 136 Ca 0.74 -0.02 0.19 0.00 0.07 0.00 0.00 59.98 60.96 2dd4 h ARG 136 Cb 0.33 -0.07 -0.08 0.00 0.08 0.00 0.00 29.97 30.23 2dd4 h ARG 136 CO 1.74 0.20 0.60 -1.35 -1.07 0.00 0.00 179.97 180.10 2dd4 h PRO 137 N 0.31 0.57 0.00 0.04 0.11 -1.86 0.97 132.00 132.14 2dd4 h PRO 137 Ca 0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.52 2dd4 h PRO 137 Cb 0.77 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.75 2dd4 h PRO 137 CO -0.51 0.38 -0.84 1.51 -0.21 0.00 0.00 178.00 178.33 2dd4 n ILE 138 N -4.60 0.00 0.00 4.15 3.06 -0.97 -4.72 119.36 116.28 2dd4 n ILE 138 Ca 0.20 -0.24 0.00 0.00 -2.50 0.00 0.00 62.75 60.22 2dd4 n ILE 138 Cb 0.62 0.78 -0.00 0.00 0.54 0.00 0.00 39.64 41.58 2dd4 n ILE 138 CO 0.00 0.00 0.00 -0.11 -2.50 0.00 0.00 176.55 173.94 2dd4 n LEU 139 N -1.46 0.00 0.00 9.51 7.94 -0.07 -2.49 117.00 130.43 2dd4 n LEU 139 Ca 0.01 -0.13 0.00 0.00 -1.11 0.00 0.00 56.01 54.78 2dd4 n LEU 139 Cb 0.22 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.17 2dd4 n LEU 139 CO 0.25 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.14 2dd4 n GLY 140 N 2.10 -1.83 3.82 -3.96 0.00 0.32 -2.46 105.19 103.18 2dd4 n GLY 140 Ca -0.00 -1.96 -0.33 0.00 0.00 0.00 0.00 46.02 43.73 2dd4 n GLY 140 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dd4 s GLN 141 N 0.00 4.06 0.48 1.61 2.00 -1.26 -3.95 119.66 122.59 2dd4 s GLN 141 Ca 0.00 1.10 -0.20 0.00 -2.00 0.00 0.00 55.36 54.26 2dd4 s GLN 141 Cb 0.00 -2.15 -0.09 0.00 0.80 0.00 0.00 33.01 31.57 2dd4 s GLN 141 CO 0.00 -0.18 1.04 -1.54 -0.50 0.00 0.00 175.29 174.11 2dd4 s SER 142 N -2.44 6.37 0.52 6.67 1.04 -1.26 -5.03 113.70 119.56 2dd4 s SER 142 Ca 0.62 1.94 -0.20 0.00 0.48 0.00 0.00 55.95 58.79 2dd4 s SER 142 Cb -0.10 -2.56 -0.07 0.00 0.10 0.00 0.00 66.02 63.38 2dd4 s SER 142 CO 0.20 -0.76 1.09 -2.84 0.98 0.00 0.00 173.24 171.91 2dd4 s PRO 143 N -3.19 3.57 0.20 4.02 0.02 -1.26 -4.95 135.00 133.41 2dd4 s PRO 143 Ca 0.67 1.49 -0.11 0.00 0.02 0.00 0.00 61.00 63.07 2dd4 s PRO 143 Cb -0.17 -2.05 0.20 0.00 0.02 0.00 0.00 34.50 32.51 2dd4 s PRO 143 CO 0.20 -0.65 1.79 1.49 -0.33 0.00 0.00 177.00 179.50 2dd4 h GLU 144 N 1.37 0.54 0.00 5.54 4.57 -2.00 -2.02 114.58 122.59 2dd4 h GLU 144 Ca -0.50 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 57.60 2dd4 h GLU 144 Cb 1.24 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.70 2dd4 h GLU 144 CO 0.58 0.36 -0.24 0.11 -1.18 0.00 0.00 179.01 178.64 2dd4 h TRP 145 N 0.56 0.00 0.00 0.92 5.08 -1.98 -2.23 115.95 118.30 2dd4 h TRP 145 Ca 0.27 0.00 -0.04 0.00 1.08 0.00 0.00 58.89 60.20 2dd4 h TRP 145 Cb 0.20 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.35 2dd4 h TRP 145 CO -0.10 0.24 -0.20 -0.92 -1.28 0.00 0.00 178.44 176.18 2dd4 h TYR 146 N 0.00 0.00 -0.01 0.12 3.20 -1.74 -2.34 116.97 116.20 2dd4 h TYR 146 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2dd4 h TYR 146 Cb 0.45 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.72 2dd4 h TYR 146 CO 0.00 0.20 -0.28 0.54 -1.64 0.00 0.00 178.16 176.98 2dd4 n ARG 147 N -4.04 0.88 -2.35 1.82 1.74 -0.85 -4.72 116.66 109.14 2dd4 n ARG 147 Ca -0.02 -0.55 -0.39 0.00 -0.77 0.00 0.00 57.85 56.12 2dd4 n ARG 147 Cb 0.28 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.20 2dd4 n ARG 147 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2dd4 s SER 148 N -2.50 6.71 0.41 0.55 1.04 -0.88 -4.92 113.70 114.13 2dd4 s SER 148 Ca 0.24 2.32 0.10 0.00 0.48 0.00 0.00 55.95 59.09 2dd4 s SER 148 Cb 0.19 -2.62 0.93 0.00 0.10 0.00 0.00 66.02 64.63 2dd4 s SER 148 CO 0.53 -0.54 2.00 -0.65 0.98 0.00 0.00 173.24 175.56 2dd4 h PRO 149 N 2.90 0.50 0.50 4.02 0.11 -1.92 -2.15 132.00 135.95 2dd4 h PRO 149 Ca -0.48 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2dd4 h PRO 149 Cb 1.23 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2dd4 h PRO 149 CO 0.63 0.33 -0.34 -0.97 -0.21 0.00 0.00 178.00 177.44 2dd4 h ASN 150 N 0.51 -0.88 -0.99 -2.05 -0.73 -1.91 0.99 115.58 110.52 2dd4 h ASN 150 Ca 0.25 0.06 0.00 0.00 1.87 0.00 0.00 56.30 58.48 2dd4 h ASN 150 Cb 0.32 0.27 -0.05 0.00 0.27 0.00 0.00 38.32 39.13 2dd4 h ASN 150 CO -0.07 -0.52 0.64 0.22 -0.37 0.00 0.00 177.43 177.33 2dd4 h TYR 151 N -0.81 1.26 0.00 0.67 3.20 -1.73 -1.70 116.97 117.86 2dd4 h TYR 151 Ca -0.05 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.77 2dd4 h TYR 151 Cb 0.68 -0.42 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 2dd4 h TYR 151 CO -0.12 0.81 -0.33 0.00 -1.64 0.00 0.00 178.16 176.87 2dd4 h ARG 152 N 1.35 0.00 0.09 1.82 3.08 -1.12 -2.39 114.38 117.21 2dd4 h ARG 152 Ca 0.36 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.26 2dd4 h ARG 152 Cb -0.12 0.00 0.01 0.00 0.08 0.00 0.00 29.97 29.93 2dd4 h ARG 152 CO -0.07 0.33 -0.70 0.00 -1.07 0.00 0.00 179.97 178.45 2dd4 h ARG 153 N 0.00 0.19 0.19 0.04 3.08 -0.35 -3.42 114.38 114.11 2dd4 h ARG 153 Ca -0.00 -0.32 -0.30 0.00 0.07 0.00 0.00 59.98 59.42 2dd4 h ARG 153 Cb 0.62 0.12 0.02 0.00 0.08 0.00 0.00 29.97 30.81 2dd4 h ARG 153 CO 0.04 1.15 -1.41 0.00 -1.07 0.00 0.00 179.97 178.69 2dd4 h ARG 154 N -0.58 0.41 -0.53 0.04 3.08 -1.32 -3.41 114.38 112.07 2dd4 h ARG 154 Ca -0.14 -0.70 0.11 0.00 0.07 0.00 0.00 59.98 59.32 2dd4 h ARG 154 Cb 1.46 0.26 -0.09 0.00 0.08 0.00 0.00 29.97 31.68 2dd4 h ARG 154 CO 0.07 1.33 -0.04 1.25 -1.07 0.00 0.00 179.97 181.51 2dd4 h LEU 155 N -0.04 -0.32 -2.18 3.04 5.85 -1.67 0.18 115.31 120.17 2dd4 h LEU 155 Ca -0.27 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 2dd4 h LEU 155 Cb 1.98 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 43.27 2dd4 h LEU 155 CO 0.19 -0.12 -0.05 -0.37 -0.34 0.00 0.00 178.44 177.75 2dd4 h VAL 156 N 0.07 0.68 0.00 1.05 -1.51 -1.83 -2.45 116.25 112.27 2dd4 h VAL 156 Ca 0.27 -0.20 -0.37 0.00 -1.23 0.00 0.00 66.70 65.17 2dd4 h VAL 156 Cb 0.42 1.12 -0.07 0.00 -2.13 0.00 0.00 31.29 30.63 2dd4 h VAL 156 CO -0.48 0.05 -2.38 -1.14 -1.23 0.00 0.00 177.57 172.38 2dd4 n ARG 157 N -3.95 0.69 -2.91 5.19 0.63 -0.63 -4.70 116.66 110.98 2dd4 n ARG 157 Ca -0.03 0.10 -0.23 0.00 -0.92 0.00 0.00 57.85 56.77 2dd4 n ARG 157 Cb 0.14 -1.49 -0.02 0.00 0.45 0.00 0.00 32.46 31.53 2dd4 n ARG 157 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2dd4 n TRP 158 N -3.08 2.66 -0.33 -0.14 8.01 0.52 -4.93 117.44 120.16 2dd4 n TRP 158 Ca -0.40 -3.70 -0.02 0.00 -1.31 0.00 0.00 57.50 52.07 2dd4 n TRP 158 Cb 1.01 -0.40 0.11 0.00 -2.01 0.00 0.00 31.31 30.02 2dd4 n TRP 158 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2dd4 h PRO 159 N 2.92 1.14 -0.28 -0.99 0.13 -1.61 -0.70 132.00 132.61 2dd4 h PRO 159 Ca 0.13 -0.07 0.01 0.00 -0.87 0.00 0.00 66.00 65.20 2dd4 h PRO 159 Cb 0.76 -0.26 -0.02 0.00 0.13 0.00 0.00 31.00 31.61 2dd4 h PRO 159 CO 0.71 0.75 0.17 0.00 -0.23 0.00 0.00 178.00 179.40 2dd4 h ARG 160 N 1.17 0.34 -0.23 0.86 2.47 -1.91 0.62 114.38 117.69 2dd4 h ARG 160 Ca 0.35 -0.02 -0.04 0.00 -1.26 0.00 0.00 59.98 59.01 2dd4 h ARG 160 Cb -0.06 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.18 2dd4 h ARG 160 CO -0.10 0.22 0.00 1.96 0.56 0.00 0.00 179.97 182.62 2dd4 h GLN 161 N 0.35 0.41 -0.23 0.04 7.50 -1.88 -1.45 115.11 119.84 2dd4 h GLN 161 Ca 0.11 -0.13 -0.01 0.00 0.50 0.00 0.00 58.65 59.12 2dd4 h GLN 161 Cb -0.01 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 27.47 2dd4 h GLN 161 CO -0.05 0.59 0.11 0.28 -1.50 0.00 0.00 178.83 178.27 2dd4 h VAL 162 N 0.18 1.14 -0.86 -0.54 2.07 -1.02 -2.15 116.25 115.07 2dd4 h VAL 162 Ca 0.07 -0.40 0.04 0.00 0.82 0.00 0.00 66.70 67.23 2dd4 h VAL 162 Cb 0.41 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 2dd4 h VAL 162 CO 0.01 0.14 0.57 -0.07 0.02 0.00 0.00 177.57 178.24 2dd4 h LEU 163 N 0.24 0.90 -1.00 2.57 3.38 -0.84 -1.12 115.31 119.45 2dd4 h LEU 163 Ca 0.08 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2dd4 h LEU 163 Cb 0.12 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 2dd4 h LEU 163 CO -0.01 0.61 0.42 0.00 0.09 0.00 0.00 178.44 179.55 2dd4 h ALA 164 N 1.51 1.23 -0.52 1.53 0.00 -0.89 0.15 119.26 122.27 2dd4 h ALA 164 Ca 0.35 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2dd4 h ALA 164 Cb 0.08 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2dd4 h ALA 164 CO -0.11 0.61 0.33 0.93 0.00 0.00 0.00 179.25 181.01 2dd4 h GLU 165 N 1.13 0.69 0.00 0.00 5.08 -0.58 0.18 114.58 121.08 2dd4 h GLU 165 Ca 0.28 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2dd4 h GLU 165 Cb 0.06 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.15 2dd4 h GLU 165 CO -0.04 0.47 0.00 1.19 -1.00 0.00 0.00 179.01 179.63 2dd4 n PHE 166 N -4.44 0.00 -0.62 4.33 3.72 -0.37 -4.89 117.46 115.19 2dd4 n PHE 166 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2dd4 n PHE 166 Cb 0.06 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.42 2dd4 n PHE 166 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dd4 n GLY 167 N 1.16 0.62 3.25 1.37 0.00 0.64 -4.94 105.19 107.30 2dd4 n GLY 167 Ca 0.17 -0.61 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 2dd4 n GLY 167 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dd4 s LEU 168 N 0.00 2.28 -0.00 0.99 2.96 0.38 -4.97 118.68 120.32 2dd4 s LEU 168 Ca 0.00 -0.50 0.01 0.00 -0.22 0.00 0.00 54.13 53.42 2dd4 s LEU 168 Cb 0.00 -1.48 -0.00 0.00 0.50 0.00 0.00 46.19 45.21 2dd4 s LEU 168 CO 0.00 0.14 -0.04 -1.58 -1.32 0.00 0.00 176.35 173.55 2dd4 s GLN 169 N 0.46 0.35 0.16 1.98 0.74 -1.26 -2.51 119.66 119.57 2dd4 s GLN 169 Ca -0.14 -0.16 0.07 0.00 0.05 0.00 0.00 55.36 55.18 2dd4 s GLN 169 Cb -0.17 -0.33 -0.04 0.00 1.10 0.00 0.00 33.01 33.57 2dd4 s GLN 169 CO 0.06 0.09 -0.15 -0.51 -0.55 0.00 0.00 175.29 174.23 2dd4 s LEU 170 N -0.12 2.46 0.43 3.68 1.02 -1.26 -5.12 118.68 119.78 2dd4 s LEU 170 Ca 0.01 -0.89 -0.23 0.00 0.02 0.00 0.00 54.13 53.04 2dd4 s LEU 170 Cb -0.02 -0.66 -0.11 0.00 0.02 0.00 0.00 46.19 45.42 2dd4 s LEU 170 CO -0.00 -0.13 0.78 -2.65 0.02 0.00 0.00 176.35 174.37 2dd4 n PRO 171 N 0.17 0.92 0.26 1.29 -0.02 -1.26 -4.85 135.00 131.52 2dd4 n PRO 171 Ca -0.12 0.34 0.11 0.00 -2.02 0.00 0.00 63.50 61.80 2dd4 n PRO 171 Cb 0.58 -1.79 0.72 0.00 -0.02 0.00 0.00 33.50 32.99 2dd4 n PRO 171 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2dd4 h SER 172 N 1.08 0.00 1.74 2.55 4.64 -2.04 -2.18 113.55 119.35 2dd4 h SER 172 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2dd4 h SER 172 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2dd4 h SER 172 CO 0.54 0.08 -0.24 1.05 -0.87 0.00 0.00 176.83 177.39 2dd4 h GLU 173 N 0.00 0.00 -6.90 4.77 9.09 -2.01 -3.46 114.58 116.07 2dd4 h GLU 173 Ca -0.00 0.00 -0.52 0.00 0.05 0.00 0.00 59.36 58.89 2dd4 h GLU 173 Cb 0.17 0.00 0.07 0.00 -1.65 0.00 0.00 28.75 27.34 2dd4 h GLU 173 CO 0.01 0.00 0.63 0.08 0.05 0.00 0.00 179.01 179.78 2dd4 s VAL 174 N -3.24 2.67 -0.36 -1.06 1.01 -0.82 -4.95 120.40 113.65 2dd4 s VAL 174 Ca 0.05 0.65 -0.27 0.00 0.00 0.00 0.00 61.98 62.42 2dd4 s VAL 174 Cb 0.06 -3.41 0.02 0.00 0.00 0.00 0.00 36.38 33.05 2dd4 s VAL 174 CO 0.70 0.14 0.99 -1.58 0.00 0.00 0.00 175.10 175.34 2dd4 s GLN 175 N -1.95 3.91 -0.23 2.72 0.74 -0.29 -4.92 119.66 119.64 2dd4 s GLN 175 Ca 0.52 0.75 -0.16 0.00 0.05 0.00 0.00 55.36 56.51 2dd4 s GLN 175 Cb -0.39 -3.79 -0.04 0.00 1.10 0.00 0.00 33.01 29.90 2dd4 s GLN 175 CO 0.52 -0.96 0.43 0.42 -0.55 0.00 0.00 175.29 175.15 2dd4 s ILE 176 N 3.60 5.16 -0.19 -2.34 1.01 -1.26 -0.86 121.20 126.32 2dd4 s ILE 176 Ca 0.41 0.73 -0.01 0.00 0.00 0.00 0.00 60.65 61.78 2dd4 s ILE 176 Cb -0.12 -3.75 0.00 0.00 0.01 0.00 0.00 42.46 38.60 2dd4 s ILE 176 CO 0.18 0.19 -0.12 -0.60 0.00 0.00 0.00 174.94 174.60 2dd4 s ARG 177 N 1.70 3.24 -0.18 2.79 3.52 -0.07 -4.96 118.95 124.99 2dd4 s ARG 177 Ca 0.19 -0.71 -0.16 0.00 -0.13 0.00 0.00 55.73 54.92 2dd4 s ARG 177 Cb -0.15 -2.78 -0.04 0.00 -1.56 0.00 0.00 34.95 30.42 2dd4 s ARG 177 CO 0.09 -0.12 0.40 0.08 -0.81 0.00 0.00 175.30 174.93 2dd4 s VAL 178 N 1.20 5.21 -0.26 7.11 1.01 -1.26 -1.87 120.40 131.54 2dd4 s VAL 178 Ca 0.02 0.73 -0.09 0.00 0.00 0.00 0.00 61.98 62.64 2dd4 s VAL 178 Cb -0.14 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 2dd4 s VAL 178 CO -0.05 0.28 0.12 0.00 0.00 0.00 0.00 175.10 175.45 2dd4 s ALA 179 N 1.11 3.31 -0.44 5.51 0.00 -0.24 -4.97 121.76 126.05 2dd4 s ALA 179 Ca 0.20 -1.11 -0.13 0.00 0.00 0.00 0.00 51.96 50.92 2dd4 s ALA 179 Cb -0.15 -2.24 0.06 0.00 0.00 0.00 0.00 23.12 20.80 2dd4 s ALA 179 CO 0.08 -0.51 0.32 0.34 0.00 0.00 0.00 175.76 175.99 2dd4 s ASP 180 N 1.66 5.95 -1.18 0.00 -1.08 -1.26 -1.29 116.67 119.48 2dd4 s ASP 180 Ca 0.07 -1.28 -0.19 0.00 -0.52 0.00 0.00 52.55 50.62 2dd4 s ASP 180 Cb -0.15 -2.11 0.08 0.00 -1.46 0.00 0.00 42.92 39.28 2dd4 s ASP 180 CO 0.07 -0.56 1.57 -0.94 0.52 0.00 0.00 175.17 175.83 2dd4 s SER 181 N 2.23 6.76 0.00 -0.34 1.04 -0.03 -4.72 113.70 118.63 2dd4 s SER 181 Ca 0.04 -2.20 0.23 0.00 0.48 0.00 0.00 55.95 54.49 2dd4 s SER 181 Cb -0.23 -2.54 0.06 0.00 0.10 0.00 0.00 66.02 63.42 2dd4 s SER 181 CO 0.06 -1.21 1.11 -0.46 0.98 0.00 0.00 173.24 173.72 2dd4 n ASN 182 N 8.05 1.25 0.00 7.02 6.94 -1.26 -4.70 115.26 132.55 2dd4 n ASN 182 Ca 0.41 -1.03 0.00 0.00 -0.02 0.00 0.00 54.58 53.94 2dd4 n ASN 182 Cb 0.47 0.63 0.00 0.00 -2.36 0.00 0.00 39.78 38.52 2dd4 n ASN 182 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dd4 n GLN 183 N -0.95 1.43 0.00 -3.83 1.13 -1.26 -5.03 117.38 108.87 2dd4 n GLN 183 Ca 0.07 0.00 0.13 0.00 -1.94 0.00 0.00 57.00 55.26 2dd4 n GLN 183 Cb 0.38 0.00 0.41 0.00 0.11 0.00 0.00 30.24 31.13 2dd4 n GLN 183 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2dd4 n LYS 184 N 0.00 0.70 -2.95 -1.09 5.02 -1.26 -4.89 118.16 113.69 2dd4 n LYS 184 Ca 0.00 -0.38 -0.39 0.00 -2.02 0.00 0.00 58.31 55.52 2dd4 n LYS 184 Cb 0.00 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.46 2dd4 n LYS 184 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2dd4 s THR 185 N -2.56 4.34 0.04 -0.18 2.01 -1.26 -4.31 115.64 113.72 2dd4 s THR 185 Ca 0.23 1.72 0.09 0.00 0.31 0.00 0.00 61.69 64.04 2dd4 s THR 185 Cb 0.19 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 2dd4 s THR 185 CO 0.53 0.46 -0.25 -0.13 -0.69 0.00 0.00 174.62 174.55 2dd4 s ARG 186 N -1.30 1.68 0.22 4.92 1.81 -0.94 -4.73 118.95 120.61 2dd4 s ARG 186 Ca 0.38 -1.05 0.11 0.00 -1.72 0.00 0.00 55.73 53.44 2dd4 s ARG 186 Cb -0.23 -1.83 -0.05 0.00 -0.45 0.00 0.00 34.95 32.40 2dd4 s ARG 186 CO 0.26 0.47 -0.20 0.71 -0.68 0.00 0.00 175.30 175.87 2dd4 s TYR 187 N -0.79 2.12 0.01 -0.53 2.02 -1.26 -1.07 117.35 117.84 2dd4 s TYR 187 Ca 0.10 -0.40 0.01 0.00 -0.37 0.00 0.00 57.07 56.41 2dd4 s TYR 187 Cb -0.10 -0.99 -0.01 0.00 -0.40 0.00 0.00 41.96 40.47 2dd4 s TYR 187 CO 0.02 0.53 -0.03 0.96 -1.57 0.00 0.00 175.55 175.46 2dd4 s ILE 188 N -2.23 0.19 -0.16 2.71 -4.36 -1.10 -4.56 121.20 111.70 2dd4 s ILE 188 Ca 0.23 -0.40 -0.14 0.00 -0.26 0.00 0.00 60.65 60.09 2dd4 s ILE 188 Cb -0.05 -0.22 -0.05 0.00 1.25 0.00 0.00 42.46 43.38 2dd4 s ILE 188 CO 0.11 -0.13 0.30 -0.69 0.24 0.00 0.00 174.94 174.76 2dd4 s VAL 189 N -0.54 5.30 -0.56 8.37 1.01 0.29 -1.66 120.40 132.61 2dd4 s VAL 189 Ca -0.04 0.57 -0.16 0.00 0.00 0.00 0.00 61.98 62.34 2dd4 s VAL 189 Cb -0.04 -3.64 0.14 0.00 0.00 0.00 0.00 36.38 32.84 2dd4 s VAL 189 CO -0.00 0.39 0.52 -0.32 0.00 0.00 0.00 175.10 175.69 2dd4 s MET 190 N 0.46 3.04 0.96 2.72 1.75 0.33 -4.43 119.30 124.12 2dd4 s MET 190 Ca 0.17 -1.77 -0.12 0.00 -1.25 0.00 0.00 55.69 52.72 2dd4 s MET 190 Cb -0.13 -4.31 0.17 0.00 2.84 0.00 0.00 34.83 33.40 2dd4 s MET 190 CO 0.04 -1.33 1.09 -2.14 -0.65 0.00 0.00 175.02 172.03 2dd4 s PRO 191 N 1.48 0.74 0.39 4.11 0.02 -1.26 -1.15 135.00 139.32 2dd4 s PRO 191 Ca 0.04 0.79 -0.24 0.00 0.02 0.00 0.00 61.00 61.62 2dd4 s PRO 191 Cb -0.28 -1.75 -0.09 0.00 0.02 0.00 0.00 34.50 32.39 2dd4 s PRO 191 CO 0.02 -2.59 1.02 0.14 -0.33 0.00 0.00 177.00 175.25 2dd4 s VAL 192 N -2.86 3.90 0.07 3.83 -7.23 -1.26 -4.75 120.40 112.10 2dd4 s VAL 192 Ca 0.65 1.44 -0.31 0.00 -1.81 0.00 0.00 61.98 61.95 2dd4 s VAL 192 Cb -0.19 -3.73 -0.08 0.00 0.56 0.00 0.00 36.38 32.93 2dd4 s VAL 192 CO 0.58 -0.01 1.60 -0.60 -0.31 0.00 0.00 175.10 176.36 2dd4 s ARG 193 N -2.50 4.21 0.64 4.82 3.52 -1.26 -4.83 118.95 123.55 2dd4 s ARG 193 Ca 0.57 2.27 -0.13 0.00 -0.13 0.00 0.00 55.73 58.31 2dd4 s ARG 193 Cb -0.20 -3.55 -0.02 0.00 -1.56 0.00 0.00 34.95 29.63 2dd4 s ARG 193 CO 0.25 -0.69 1.05 -1.25 -0.81 0.00 0.00 175.30 173.85 2dd4 s PRO 194 N 2.43 3.20 0.70 5.12 0.04 -1.26 -5.03 135.00 140.21 2dd4 s PRO 194 Ca 0.72 1.02 -0.14 0.00 0.04 0.00 0.00 61.00 62.63 2dd4 s PRO 194 Cb -0.39 -2.02 0.02 0.00 0.04 0.00 0.00 34.50 32.15 2dd4 s PRO 194 CO 0.31 -0.89 1.14 -1.21 0.04 0.00 0.00 177.00 176.39 2dd4 s GLU 195 N -4.66 2.48 0.00 4.56 0.41 -1.26 -3.97 118.70 116.25 2dd4 s GLU 195 Ca 0.60 1.48 0.00 0.00 -0.41 0.00 0.00 54.97 56.63 2dd4 s GLU 195 Cb -0.14 -1.90 0.00 0.00 -1.78 0.00 0.00 34.13 30.31 2dd4 s GLU 195 CO 0.47 -1.52 0.00 0.41 -0.49 0.00 0.00 175.26 174.14 2dd4 n GLY 196 N -0.30 0.57 0.43 -1.39 0.00 -1.26 -4.75 105.19 98.49 2dd4 n GLY 196 Ca 0.11 -0.81 0.05 0.00 0.00 0.00 0.00 46.02 45.37 2dd4 n GLY 196 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dd4 n THR 197 N -3.37 0.98 -1.73 2.61 -2.24 -1.25 -4.93 114.28 104.35 2dd4 n THR 197 Ca 0.00 -1.33 -0.42 0.00 -2.27 0.00 0.00 64.05 60.03 2dd4 n THR 197 Cb 0.31 0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.69 2dd4 n THR 197 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2dd4 n ASP 198 N -0.64 3.99 0.00 3.42 10.43 -1.26 -1.76 116.55 130.72 2dd4 n ASP 198 Ca 0.09 1.09 0.00 0.00 2.57 0.00 0.00 54.79 58.54 2dd4 n ASP 198 Cb 0.72 -1.59 0.00 0.00 1.84 0.00 0.00 41.12 42.09 2dd4 n ASP 198 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2dd4 n GLY 199 N 3.44 0.75 3.76 0.44 0.00 -1.26 -5.00 105.19 107.31 2dd4 n GLY 199 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 2dd4 n GLY 199 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dd4 s TRP 200 N -3.16 2.55 0.68 1.61 0.52 -0.72 -5.02 118.94 115.40 2dd4 s TRP 200 Ca 0.00 1.46 -0.08 0.00 0.02 0.00 0.00 56.10 57.50 2dd4 s TRP 200 Cb 0.00 -3.58 0.04 0.00 -1.15 0.00 0.00 33.47 28.77 2dd4 s TRP 200 CO 0.00 -2.22 1.02 0.95 0.02 0.00 0.00 176.95 176.72 2dd4 s THR 201 N -1.44 2.97 0.23 2.01 -4.23 -1.26 -4.87 115.64 109.06 2dd4 s THR 201 Ca 0.69 0.03 -0.06 0.00 -1.18 0.00 0.00 61.69 61.17 2dd4 s THR 201 Cb -0.34 -3.26 0.19 0.00 1.34 0.00 0.00 72.50 70.43 2dd4 s THR 201 CO 0.41 -0.30 1.79 -0.08 -0.54 0.00 0.00 174.62 175.89 2dd4 h GLU 202 N -0.53 0.64 -0.65 3.99 4.81 -1.95 -1.18 114.58 119.70 2dd4 h GLU 202 Ca -0.45 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 58.66 2dd4 h GLU 202 Cb 1.28 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.49 2dd4 h GLU 202 CO 0.62 0.42 0.09 -0.44 -0.73 0.00 0.00 179.01 178.97 2dd4 h ASP 203 N 0.66 1.05 -0.42 1.04 3.32 -1.98 -0.57 116.42 119.50 2dd4 h ASP 203 Ca 0.37 -0.26 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 2dd4 h ASP 203 Cb 0.37 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2dd4 h ASP 203 CO -0.26 1.05 -0.07 1.56 -1.72 0.00 0.00 179.24 179.79 2dd4 h GLN 204 N 1.01 0.87 -0.15 3.56 4.20 -1.75 -1.87 115.11 120.98 2dd4 h GLN 204 Ca 0.20 -0.28 -0.06 0.00 0.06 0.00 0.00 58.65 58.56 2dd4 h GLN 204 Cb 0.46 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 2dd4 h GLN 204 CO 0.02 0.91 -0.15 -0.07 -0.67 0.00 0.00 178.83 178.86 2dd4 h LEU 205 N 0.79 0.40 -1.41 1.46 3.38 -1.05 -3.16 115.31 115.71 2dd4 h LEU 205 Ca 0.14 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 2dd4 h LEU 205 Cb 0.58 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2dd4 h LEU 205 CO 0.04 0.80 0.29 0.00 0.09 0.00 0.00 178.44 179.65 2dd4 h ALA 206 N 0.61 1.56 -0.28 1.53 0.00 -1.04 -2.72 119.26 118.91 2dd4 h ALA 206 Ca 0.02 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.94 2dd4 h ALA 206 Cb 0.69 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2dd4 h ALA 206 CO 0.04 0.38 0.21 1.49 0.00 0.00 0.00 179.25 181.36 2dd4 h GLU 207 N 0.70 0.00 -0.02 0.00 4.81 -1.30 -1.58 114.58 117.19 2dd4 h GLU 207 Ca 0.18 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2dd4 h GLU 207 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2dd4 h GLU 207 CO -0.03 0.00 -0.03 0.44 -0.73 0.00 0.00 179.01 178.65 2dd4 n ILE 208 N -4.43 0.00 -3.11 2.32 -6.64 -1.03 -4.47 119.36 102.00 2dd4 n ILE 208 Ca 0.04 -0.38 -0.45 0.00 -1.77 0.00 0.00 62.75 60.19 2dd4 n ILE 208 Cb 0.37 1.08 -0.01 0.00 -1.44 0.00 0.00 39.64 39.64 2dd4 n ILE 208 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 2dd4 s VAL 209 N -2.04 5.34 0.92 7.28 1.01 -0.59 -4.28 120.40 128.03 2dd4 s VAL 209 Ca 0.31 -2.64 -0.13 0.00 0.00 0.00 0.00 61.98 59.52 2dd4 s VAL 209 Cb 0.20 -4.74 0.14 0.00 0.00 0.00 0.00 36.38 31.99 2dd4 s VAL 209 CO 0.34 -1.39 1.15 0.42 0.00 0.00 0.00 175.10 175.62 2dd4 s THR 210 N 0.76 1.98 0.17 3.92 -4.23 -1.26 -4.62 115.64 112.36 2dd4 s THR 210 Ca 0.34 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.70 2dd4 s THR 210 Cb -0.06 -2.77 0.07 0.00 1.34 0.00 0.00 72.50 71.08 2dd4 s THR 210 CO -0.05 0.00 1.73 -0.09 -0.54 0.00 0.00 174.62 175.66 2dd4 h ARG 211 N -1.52 0.22 -0.27 3.99 2.43 -1.95 -1.05 114.38 116.23 2dd4 h ARG 211 Ca -0.49 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 58.67 2dd4 h ARG 211 Cb 1.32 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.81 2dd4 h ARG 211 CO 0.59 0.15 0.18 -0.44 -1.51 0.00 0.00 179.97 178.94 2dd4 h ASP 212 N 0.23 0.28 -0.12 -3.80 3.32 -1.94 -0.68 116.42 113.70 2dd4 h ASP 212 Ca 0.21 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.12 2dd4 h ASP 212 Cb 0.25 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2dd4 h ASP 212 CO -0.27 0.20 -0.36 0.00 -1.72 0.00 0.00 179.24 177.09 2dd4 h LEU 214 N 0.53 0.00 0.08 0.00 3.38 -0.34 -2.77 115.31 116.20 2dd4 h LEU 214 Ca 0.05 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.71 2dd4 h LEU 214 Cb 0.87 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 2dd4 h LEU 214 CO 0.07 0.09 -1.66 0.40 0.09 0.00 0.00 178.44 177.44 2dd4 h ILE 215 N 0.00 0.98 0.00 1.22 1.08 -1.03 0.86 117.51 120.61 2dd4 h ILE 215 Ca -0.00 -2.70 0.00 0.00 -0.39 0.00 0.00 64.86 61.77 2dd4 h ILE 215 Cb 0.76 2.62 0.00 0.00 -3.07 0.00 0.00 36.82 37.13 2dd4 h ILE 215 CO 0.01 0.76 0.00 0.61 -0.69 0.00 0.00 178.15 178.84 2dd4 n GLY 216 N 1.69 0.78 0.28 5.37 0.00 0.15 -0.88 105.19 112.59 2dd4 n GLY 216 Ca -0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.95 2dd4 n GLY 216 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dd4 n VAL 217 N -1.11 0.07 -3.72 1.61 0.24 -0.79 -4.65 118.33 109.99 2dd4 n VAL 217 Ca 0.00 -0.17 -0.10 0.00 -2.04 0.00 0.00 64.34 62.04 2dd4 n VAL 217 Cb 0.00 0.05 -0.04 0.00 -1.47 0.00 0.00 33.84 32.38 2dd4 n VAL 217 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dd4 s ALA 218 N -1.93 -0.90 0.14 2.33 0.00 -1.18 -4.64 121.76 115.58 2dd4 s ALA 218 Ca 0.35 -0.20 0.10 0.00 0.00 0.00 0.00 51.96 52.21 2dd4 s ALA 218 Cb 0.18 0.82 -0.04 0.00 0.00 0.00 0.00 23.12 24.08 2dd4 s ALA 218 CO 0.28 -0.76 -0.23 0.14 0.00 0.00 0.00 175.76 175.19 2dd4 s VAL 219 N -3.86 2.07 0.33 0.00 -7.23 -1.26 -4.11 120.40 106.34 2dd4 s VAL 219 Ca 0.08 -1.79 -0.29 0.00 -1.81 0.00 0.00 61.98 58.18 2dd4 s VAL 219 Cb -0.00 -1.89 -0.10 0.00 0.56 0.00 0.00 36.38 34.95 2dd4 s VAL 219 CO -0.05 -0.05 1.36 -2.16 -0.31 0.00 0.00 175.10 173.88 2dd4 s PRO 220 N -2.26 4.30 -0.02 4.82 0.04 -1.26 -4.96 135.00 135.65 2dd4 s PRO 220 Ca 0.14 2.29 -0.01 0.00 0.04 0.00 0.00 61.00 63.46 2dd4 s PRO 220 Cb -0.09 -3.06 0.02 0.00 0.04 0.00 0.00 34.50 31.41 2dd4 s PRO 220 CO 0.06 -0.28 0.05 0.15 0.04 0.00 0.00 177.00 177.02 2dd4 s LYS 221 N -1.62 0.00 0.27 4.56 1.02 -1.26 -4.65 119.74 118.07 2dd4 s LYS 221 Ca 0.51 0.17 -0.30 0.00 0.02 0.00 0.00 55.97 56.38 2dd4 s LYS 221 Cb -0.41 -0.16 -0.13 0.00 -0.52 0.00 0.00 37.83 36.61 2dd4 s LYS 221 CO 0.53 -0.12 1.27 -2.30 -0.92 0.00 0.00 175.35 173.81 2dd4 n PRO 222 N 3.84 1.82 0.00 -1.68 -0.02 -1.26 -1.54 135.00 136.17 2dd4 n PRO 222 Ca -0.23 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2dd4 n PRO 222 Cb 0.53 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 2dd4 n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dd4 n GLY 223 N 1.59 3.10 3.45 -1.23 0.00 -1.26 -4.99 105.19 105.85 2dd4 n GLY 223 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2dd4 n GLY 223 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dd4 s ILE 224 N -1.98 5.01 -0.06 -0.61 1.01 -0.59 -4.92 121.20 119.06 2dd4 s ILE 224 Ca 0.00 -0.58 0.01 0.00 0.00 0.00 0.00 60.65 60.07 2dd4 s ILE 224 Cb 0.00 -3.72 0.02 0.00 0.01 0.00 0.00 42.46 38.77 2dd4 s ILE 224 CO 0.00 -0.18 1.01 0.35 0.00 0.00 0.00 174.94 176.12 2dd4 n THR 225 N 5.09 0.98 -4.04 2.92 -2.24 -1.26 -4.43 114.28 111.30 2dd4 n THR 225 Ca -0.12 -0.99 -0.08 0.00 -2.27 0.00 0.00 64.05 60.59 2dd4 n THR 225 Cb 0.48 0.51 -0.10 0.00 -2.10 0.00 0.00 70.33 69.11 2dd4 n THR 225 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2dd4 s VAL 226 N -0.98 0.18 0.63 2.28 -7.23 -1.26 -4.87 120.40 109.15 2dd4 s VAL 226 Ca 0.01 -1.48 -0.18 0.00 -1.81 0.00 0.00 61.98 58.53 2dd4 s VAL 226 Cb 0.01 -1.10 -0.02 0.00 0.56 0.00 0.00 36.38 35.83 2dd4 s VAL 226 CO 0.01 -0.82 1.26 0.20 -0.31 0.00 0.00 175.10 175.44 2dd4 s ASN 227 N -2.43 4.78 0.31 4.85 0.01 -1.26 -4.90 114.94 116.30 2dd4 s ASN 227 Ca -0.01 2.53 -0.29 0.00 -0.71 0.00 0.00 52.86 54.38 2dd4 s ASN 227 Cb 0.02 -2.61 -0.13 0.00 0.41 0.00 0.00 41.25 38.94 2dd4 s ASN 227 CO -0.07 -1.88 1.26 0.00 -1.51 0.00 0.00 177.10 174.90 2dd4 n ALA 228 N -1.85 0.97 -1.89 0.60 0.00 -1.26 -4.87 120.51 112.22 2dd4 n ALA 228 Ca 0.15 0.38 -0.42 0.00 0.00 0.00 0.00 53.44 53.55 2dd4 n ALA 228 Cb 0.49 -2.21 -0.02 0.00 0.00 0.00 0.00 19.45 17.70 2dd4 n ALA 228 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dd4 s LYS 229 N -1.54 4.24 0.11 0.00 2.20 -1.26 -5.01 119.74 118.48 2dd4 s LYS 229 Ca 0.58 2.34 0.00 0.00 -0.36 0.00 0.00 55.97 58.54 2dd4 s LYS 229 Cb -0.61 -3.11 -0.04 0.00 -1.51 0.00 0.00 37.83 32.55 2dd4 s LYS 229 CO 0.59 -0.49 -0.01 1.03 -0.36 0.00 0.00 175.35 176.11 2dd4 s ARG 230 N 0.02 0.86 0.54 4.03 0.52 -1.26 -5.13 118.95 118.53 2dd4 s ARG 230 Ca 0.63 -1.38 -0.22 0.00 -0.52 0.00 0.00 55.73 54.24 2dd4 s ARG 230 Cb -0.43 0.00 -0.05 0.00 0.52 0.00 0.00 34.95 34.99 2dd4 s ARG 230 CO 0.40 -0.13 1.38 -2.14 0.02 0.00 0.00 175.30 174.84 2dd4 s PRO 231 N -3.93 3.19 -0.22 3.54 0.02 -1.26 -4.98 135.00 131.36 2dd4 s PRO 231 Ca 0.16 2.30 0.02 0.00 0.02 0.00 0.00 61.00 63.50 2dd4 s PRO 231 Cb 0.07 -2.32 0.04 0.00 0.02 0.00 0.00 34.50 32.31 2dd4 s PRO 231 CO -0.03 -1.17 -0.15 0.08 -0.33 0.00 0.00 177.00 175.40 2dd4 s VAL 232 N -1.27 2.12 -0.14 3.83 1.01 -1.26 -5.09 120.40 119.59 2dd4 s VAL 232 Ca 0.70 -1.32 -0.29 0.00 0.00 0.00 0.00 61.98 61.07 2dd4 s VAL 232 Cb -0.42 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 2dd4 s VAL 232 CO 0.50 0.23 1.07 -0.22 0.00 0.00 0.00 175.10 176.69 2dd4 s LEU 233 N 1.19 4.20 0.42 3.92 2.96 -1.26 -5.01 118.68 125.10 2dd4 s LEU 233 Ca -0.03 1.54 -0.22 0.00 -0.22 0.00 0.00 54.13 55.20 2dd4 s LEU 233 Cb -0.17 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 42.88 2dd4 s LEU 233 CO -0.09 -0.57 1.01 -0.54 -1.32 0.00 0.00 176.35 174.84 2dd4 s LYS 234 N 2.57 4.12 0.31 1.98 -0.14 -1.26 -5.05 119.74 122.27 2dd4 s LYS 234 Ca 0.49 1.35 -0.07 0.00 -1.36 0.00 0.00 55.97 56.37 2dd4 s LYS 234 Cb -0.19 -2.35 -0.06 0.00 -1.68 0.00 0.00 37.83 33.55 2dd4 s LYS 234 CO 0.14 -0.15 0.62 0.00 -0.76 0.00 0.00 175.35 175.20 2dd4 s ALA 235 N -1.87 3.53 0.16 5.17 0.00 -1.26 -4.99 121.76 122.49 2dd4 s ALA 235 Ca 0.61 -0.40 -0.11 0.00 0.00 0.00 0.00 51.96 52.06 2dd4 s ALA 235 Cb -0.17 -2.45 0.02 0.00 0.00 0.00 0.00 23.12 20.52 2dd4 s ALA 235 CO 0.21 0.22 1.58 -0.97 0.00 0.00 0.00 175.76 176.80 2dd4 h ASN 236 N 1.71 0.95 -2.15 0.00 -1.24 -2.07 -3.38 115.58 109.41 2dd4 h ASN 236 Ca -0.47 -0.35 -0.51 0.00 0.71 0.00 0.00 56.30 55.67 2dd4 h ASN 236 Cb 1.19 -0.26 -0.34 0.00 0.73 0.00 0.00 38.32 39.63 2dd4 h ASN 236 CO 0.66 1.08 -0.88 -0.60 -1.29 0.00 0.00 177.43 176.39 2dd4 s ARG 237 N -4.85 0.89 0.69 6.67 3.52 -1.26 -5.15 118.95 119.46 2dd4 s ARG 237 Ca -0.12 -1.84 -0.15 0.00 -0.13 0.00 0.00 55.73 53.49 2dd4 s ARG 237 Cb 0.12 -1.17 0.02 0.00 -1.56 0.00 0.00 34.95 32.36 2dd4 s ARG 237 CO 0.85 -1.36 1.17 -1.25 -0.81 0.00 0.00 175.30 173.90 2dd4 s PRO 238 N 0.32 2.47 0.00 5.12 0.04 -1.26 -5.25 135.00 136.43 2dd4 s PRO 238 Ca 0.31 1.63 0.18 0.00 0.04 0.00 0.00 61.00 63.16 2dd4 s PRO 238 Cb 0.01 -1.89 1.10 0.00 0.04 0.00 0.00 34.50 33.76 2dd4 s PRO 238 CO -0.15 -1.55 1.50 0.28 0.04 0.00 0.00 177.00 177.11