#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dd5 s VAL 24 N 0.00 4.13 0.73 2.62 -7.23 -1.26 -5.04 120.40 114.35 2dd5 s VAL 24 Ca 0.00 1.87 -0.09 0.00 -1.81 0.00 0.00 61.98 61.95 2dd5 s VAL 24 Cb 0.00 -4.19 0.06 0.00 0.56 0.00 0.00 36.38 32.80 2dd5 s VAL 24 CO 0.00 0.34 1.07 -0.94 -0.31 0.00 0.00 175.10 175.25 2dd5 s SER 25 N -0.29 4.84 0.48 4.85 1.04 -1.26 -4.91 113.70 118.45 2dd5 s SER 25 Ca 0.47 0.65 0.15 0.00 0.48 0.00 0.00 55.95 57.69 2dd5 s SER 25 Cb -0.27 -1.29 1.14 0.00 0.10 0.00 0.00 66.02 65.70 2dd5 s SER 25 CO 0.33 -1.63 2.07 0.44 0.98 0.00 0.00 173.24 175.43 2dd5 h ASP 26 N -0.71 0.01 -0.30 7.02 3.32 -2.00 -2.11 116.42 121.64 2dd5 h ASP 26 Ca -0.45 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.53 2dd5 h ASP 26 Cb 1.31 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.85 2dd5 h ASP 26 CO 0.63 0.09 -0.06 -0.26 -1.72 0.00 0.00 179.24 177.92 2dd5 h PHE 27 N 0.01 0.64 -0.29 4.55 0.04 -1.99 -2.20 116.94 117.69 2dd5 h PHE 27 Ca 0.00 -0.13 -0.10 0.00 2.80 0.00 0.00 57.97 60.53 2dd5 h PHE 27 Cb 0.15 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 38.13 2dd5 h PHE 27 CO 0.00 0.75 -0.25 0.93 -0.60 0.00 0.00 178.31 179.15 2dd5 h GLU 28 N 0.35 0.57 -0.14 1.51 5.08 -1.81 -0.65 114.58 119.49 2dd5 h GLU 28 Ca 0.08 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2dd5 h GLU 28 Cb 0.54 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2dd5 h GLU 28 CO 0.03 0.77 0.07 0.82 -1.00 0.00 0.00 179.01 179.71 2dd5 h ILE 29 N 0.50 1.10 -0.43 3.13 1.08 -1.32 -2.34 117.51 119.23 2dd5 h ILE 29 Ca 0.07 -0.26 -0.13 0.00 -0.39 0.00 0.00 64.86 64.15 2dd5 h ILE 29 Cb 0.70 1.02 -0.01 0.00 -3.07 0.00 0.00 36.82 35.46 2dd5 h ILE 29 CO 0.05 0.09 -0.24 0.25 -0.69 0.00 0.00 178.15 177.61 2dd5 h LEU 30 N 0.12 0.90 -0.49 1.44 5.85 -1.20 -2.29 115.31 119.65 2dd5 h LEU 30 Ca 0.05 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.45 2dd5 h LEU 30 Cb 0.08 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 2dd5 h LEU 30 CO -0.01 1.10 0.29 -0.08 -0.34 0.00 0.00 178.44 179.40 2dd5 h GLU 31 N 0.76 0.55 -0.66 1.25 4.22 -1.05 0.45 114.58 120.11 2dd5 h GLU 31 Ca 0.10 -0.03 -0.06 0.00 0.08 0.00 0.00 59.36 59.44 2dd5 h GLU 31 Cb 0.79 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.89 2dd5 h GLU 31 CO 0.07 0.37 0.16 1.98 -2.18 0.00 0.00 179.01 179.41 2dd5 h MET 32 N 0.57 1.05 -0.30 1.92 4.05 -1.33 -0.27 114.93 120.62 2dd5 h MET 32 Ca 0.20 -0.25 -0.02 0.00 -0.28 0.00 0.00 59.70 59.35 2dd5 h MET 32 Cb 0.04 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.68 2dd5 h MET 32 CO -0.10 0.94 0.10 0.00 0.23 0.00 0.00 176.91 178.08 2dd5 h ALA 33 N 1.06 0.39 -0.11 0.39 0.00 -0.84 -1.32 119.26 118.85 2dd5 h ALA 33 Ca 0.21 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2dd5 h ALA 33 Cb 0.36 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2dd5 h ALA 33 CO 0.00 0.01 0.02 0.28 0.00 0.00 0.00 179.25 179.56 2dd5 h VAL 34 N 0.33 1.22 -0.31 0.00 2.07 -0.76 -1.62 116.25 117.17 2dd5 h VAL 34 Ca 0.10 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.94 2dd5 h VAL 34 Cb 0.22 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 2dd5 h VAL 34 CO -0.00 0.20 0.20 -0.09 0.02 0.00 0.00 177.57 177.89 2dd5 h ARG 35 N -0.06 0.42 -0.45 1.57 2.43 -1.01 -1.52 114.38 115.76 2dd5 h ARG 35 Ca 0.03 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 2dd5 h ARG 35 Cb 0.29 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2dd5 h ARG 35 CO 0.00 0.29 -0.09 0.93 -1.51 0.00 0.00 179.97 179.59 2dd5 h GLU 36 N 0.42 0.79 -0.42 0.20 5.08 -1.22 -2.07 114.58 117.36 2dd5 h GLU 36 Ca 0.11 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 2dd5 h GLU 36 Cb -0.03 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2dd5 h GLU 36 CO -0.02 0.86 0.03 -0.07 -1.00 0.00 0.00 179.01 178.81 2dd5 h LEU 37 N 0.72 0.70 -0.36 1.33 3.38 -1.10 0.00 115.31 119.98 2dd5 h LEU 37 Ca 0.12 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2dd5 h LEU 37 Cb 0.57 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2dd5 h LEU 37 CO 0.04 0.82 0.24 0.00 0.09 0.00 0.00 178.44 179.62 2dd5 h ALA 38 N 0.91 0.46 -0.33 1.53 0.00 -1.12 0.06 119.26 120.77 2dd5 h ALA 38 Ca 0.12 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2dd5 h ALA 38 Cb 0.44 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2dd5 h ALA 38 CO 0.02 -0.08 0.02 0.82 0.00 0.00 0.00 179.25 180.03 2dd5 h ILE 39 N 0.49 1.25 -0.53 0.00 2.04 -1.30 0.44 117.51 119.89 2dd5 h ILE 39 Ca 0.13 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 65.08 2dd5 h ILE 39 Cb -0.05 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2dd5 h ILE 39 CO -0.03 0.30 0.34 -0.08 0.00 0.00 0.00 178.15 178.68 2dd5 h GLU 40 N 0.39 0.71 -0.07 2.37 4.81 -0.72 -1.08 114.58 120.99 2dd5 h GLU 40 Ca 0.10 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2dd5 h GLU 40 Cb 0.41 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.64 2dd5 h GLU 40 CO 0.01 0.48 0.00 1.63 -0.73 0.00 0.00 179.01 180.41 2dd5 n LYS 41 N -4.44 1.46 -1.53 1.92 4.76 -0.01 -4.92 118.16 115.39 2dd5 n LYS 41 Ca 0.05 -0.68 -0.09 0.00 -2.87 0.00 0.00 58.31 54.71 2dd5 n LYS 41 Cb 0.06 -1.40 -0.03 0.00 -1.84 0.00 0.00 35.03 31.82 2dd5 n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dd5 n GLY 42 N 1.05 0.78 0.12 0.72 0.00 -0.41 -4.93 105.19 102.52 2dd5 n GLY 42 Ca 0.17 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 2dd5 n GLY 42 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dd5 h LEU 43 N 0.00 0.32 -7.99 0.99 3.38 -1.14 -3.46 115.31 107.41 2dd5 h LEU 43 Ca -0.20 -0.51 -0.10 0.00 0.09 0.00 0.00 57.88 57.16 2dd5 h LEU 43 Cb 0.77 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.30 2dd5 h LEU 43 CO 0.27 0.77 -0.31 0.72 0.09 0.00 0.00 178.44 179.98 2dd5 s PHE 44 N -4.17 0.31 0.33 1.13 -0.12 -1.24 -5.04 117.98 109.18 2dd5 s PHE 44 Ca -0.14 -0.69 0.07 0.00 -0.05 0.00 0.00 56.93 56.12 2dd5 s PHE 44 Cb 0.04 -0.04 -0.01 0.00 -0.63 0.00 0.00 43.02 42.39 2dd5 s PHE 44 CO 0.74 -0.69 0.46 -1.54 -0.05 0.00 0.00 175.22 174.14 2dd5 s SER 45 N -2.94 5.92 0.34 1.98 1.04 -1.26 -3.96 113.70 114.82 2dd5 s SER 45 Ca 0.14 -0.21 0.02 0.00 0.48 0.00 0.00 55.95 56.37 2dd5 s SER 45 Cb 0.03 -1.21 0.59 0.00 0.10 0.00 0.00 66.02 65.54 2dd5 s SER 45 CO -0.03 -0.43 1.97 0.00 0.98 0.00 0.00 173.24 175.73 2dd5 h ALA 46 N 0.92 1.48 -0.44 5.32 0.00 -1.98 -1.79 119.26 122.77 2dd5 h ALA 46 Ca -0.46 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 2dd5 h ALA 46 Cb 1.26 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2dd5 h ALA 46 CO 0.53 0.44 0.01 1.49 0.00 0.00 0.00 179.25 181.72 2dd5 h GLU 47 N 0.83 0.77 -0.36 0.00 4.81 -1.99 -2.10 114.58 116.54 2dd5 h GLU 47 Ca 0.21 -0.24 0.06 0.00 -0.13 0.00 0.00 59.36 59.26 2dd5 h GLU 47 Cb -0.00 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.25 2dd5 h GLU 47 CO -0.04 0.83 0.02 -0.44 -0.73 0.00 0.00 179.01 178.66 2dd5 h ASP 48 N 0.61 -0.09 -0.47 1.04 3.32 -1.73 0.46 116.42 119.55 2dd5 h ASP 48 Ca 0.13 0.07 0.02 0.00 0.02 0.00 0.00 57.03 57.27 2dd5 h ASP 48 Cb 0.48 0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 2dd5 h ASP 48 CO 0.02 -0.01 0.28 -0.74 -1.72 0.00 0.00 179.24 177.07 2dd5 h HIS 49 N 0.13 0.52 -0.52 4.55 2.76 -1.24 0.15 115.15 121.51 2dd5 h HIS 49 Ca 0.17 0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.25 2dd5 h HIS 49 Cb 0.23 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.00 2dd5 h HIS 49 CO -0.23 0.29 -0.10 0.00 -1.30 0.00 0.00 177.93 176.59 2dd5 h ARG 50 N 0.55 0.96 -0.81 5.26 3.08 -0.82 -2.08 114.38 120.52 2dd5 h ARG 50 Ca 0.19 -0.34 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 2dd5 h ARG 50 Cb 0.03 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 2dd5 h ARG 50 CO -0.09 1.01 0.41 0.28 -1.07 0.00 0.00 179.97 180.51 2dd5 h VAL 51 N 0.86 1.25 -0.32 2.04 2.07 0.64 -1.29 116.25 121.48 2dd5 h VAL 51 Ca 0.14 -0.65 -0.15 0.00 0.82 0.00 0.00 66.70 66.85 2dd5 h VAL 51 Cb 0.65 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2dd5 h VAL 51 CO 0.04 0.29 -0.39 -0.25 0.02 0.00 0.00 177.57 177.29 2dd5 h TRP 52 N 1.14 1.01 -0.53 1.57 2.91 -0.44 -2.09 115.95 119.51 2dd5 h TRP 52 Ca 0.28 -0.32 -0.05 0.00 1.13 0.00 0.00 58.89 59.93 2dd5 h TRP 52 Cb 0.08 -0.21 -0.02 0.00 -0.51 0.00 0.00 29.16 28.50 2dd5 h TRP 52 CO 0.01 1.12 0.12 0.87 -1.03 0.00 0.00 178.44 179.53 2dd5 h LYS 53 N 0.61 0.82 -0.68 2.65 1.57 -1.16 -0.90 116.57 119.48 2dd5 h LYS 53 Ca 0.04 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.61 2dd5 h LYS 53 Cb 0.98 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 33.14 2dd5 h LYS 53 CO 0.09 0.74 0.23 -0.44 -0.57 0.00 0.00 179.45 179.50 2dd5 h ASP 54 N 0.79 0.97 -0.17 0.86 3.32 -1.11 -1.02 116.42 120.06 2dd5 h ASP 54 Ca 0.17 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 2dd5 h ASP 54 Cb 0.30 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2dd5 h ASP 54 CO -0.00 0.90 0.09 0.22 -1.72 0.00 0.00 179.24 178.73 2dd5 h TYR 55 N 0.98 0.23 -0.97 4.55 3.20 -0.70 -2.46 116.97 121.80 2dd5 h TYR 55 Ca 0.22 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.15 2dd5 h TYR 55 Cb 0.27 -0.07 -0.07 0.00 1.54 0.00 0.00 36.73 38.40 2dd5 h TYR 55 CO 0.02 0.22 0.62 0.28 -1.64 0.00 0.00 178.16 177.66 2dd5 h VAL 56 N 0.17 1.07 0.00 1.81 2.07 -0.91 -0.85 116.25 119.61 2dd5 h VAL 56 Ca 0.06 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2dd5 h VAL 56 Cb 0.07 -0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 29.69 2dd5 h VAL 56 CO -0.01 0.21 -0.03 -0.74 0.02 0.00 0.00 177.57 177.01 2dd5 h HIS 57 N 1.12 0.00 0.00 1.57 -0.00 -0.74 -1.35 115.15 115.76 2dd5 h HIS 57 Ca 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.79 2dd5 h HIS 57 Cb 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.59 2dd5 h HIS 57 CO -0.01 0.03 -0.11 0.25 -0.00 0.00 0.00 177.93 178.09 2dd5 n THR 58 N -3.98 0.02 -2.43 6.26 -2.24 -0.33 -4.89 114.28 106.69 2dd5 n THR 58 Ca -0.03 -0.01 -0.32 0.00 -2.27 0.00 0.00 64.05 61.42 2dd5 n THR 58 Cb 0.12 -0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 67.98 2dd5 n THR 58 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dd5 s LEU 59 N -3.06 3.63 0.00 3.22 1.43 -0.51 -5.05 118.68 118.33 2dd5 s LEU 59 Ca 0.13 1.49 0.00 0.00 -1.03 0.00 0.00 54.13 54.72 2dd5 s LEU 59 Cb 0.18 -4.43 0.00 0.00 0.03 0.00 0.00 46.19 41.98 2dd5 s LEU 59 CO 0.57 -0.58 0.00 0.61 0.23 0.00 0.00 176.35 177.18 2dd5 n GLY 60 N -1.62 -0.96 0.02 -3.19 0.00 -1.26 -4.79 105.19 93.39 2dd5 n GLY 60 Ca 0.06 -1.06 0.14 0.00 0.00 0.00 0.00 46.02 45.16 2dd5 n GLY 60 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dd5 n PRO 61 N -0.18 0.15 -0.04 1.61 -0.04 -0.92 -3.15 135.00 132.44 2dd5 n PRO 61 Ca 0.00 -0.03 -0.08 0.00 -0.04 0.00 0.00 63.50 63.34 2dd5 n PRO 61 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 2dd5 n PRO 61 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2dd5 h LEU 62 N 0.08 -0.25 -0.49 1.53 3.38 -1.88 -2.05 115.31 115.64 2dd5 h LEU 62 Ca 0.00 0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.10 2dd5 h LEU 62 Cb 0.45 0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 2dd5 h LEU 62 CO 0.00 -0.09 0.20 -0.65 0.09 0.00 0.00 178.44 177.99 2dd5 h PRO 63 N -0.03 0.38 -0.67 1.13 0.11 -1.76 -0.95 132.00 130.21 2dd5 h PRO 63 Ca 0.11 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.17 2dd5 h PRO 63 Cb 0.19 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.18 2dd5 h PRO 63 CO -0.23 0.25 0.32 0.00 -0.21 0.00 0.00 178.00 178.13 2dd5 h ALA 64 N 1.30 1.29 -0.38 -0.75 0.00 -1.32 -1.23 119.26 118.17 2dd5 h ALA 64 Ca 0.23 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2dd5 h ALA 64 Cb 0.20 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2dd5 h ALA 64 CO -0.21 0.55 -0.14 0.00 0.00 0.00 0.00 179.25 179.45 2dd5 h ALA 65 N 1.40 1.05 -0.30 0.00 0.00 -0.72 -2.43 119.26 118.25 2dd5 h ALA 65 Ca 0.23 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 2dd5 h ALA 65 Cb 0.11 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2dd5 h ALA 65 CO -0.03 0.58 -0.37 0.00 0.00 0.00 0.00 179.25 179.43 2dd5 h ARG 66 N 0.62 0.69 -0.85 0.00 3.08 -0.56 -1.30 114.38 116.06 2dd5 h ARG 66 Ca 0.10 -0.34 0.01 0.00 0.07 0.00 0.00 59.98 59.83 2dd5 h ARG 66 Cb 0.59 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.60 2dd5 h ARG 66 CO 0.04 0.95 0.56 1.25 -1.07 0.00 0.00 179.97 181.70 2dd5 h LEU 67 N 0.57 0.97 -0.26 3.04 6.46 -0.93 0.15 115.31 125.32 2dd5 h LEU 67 Ca 0.05 -0.02 -0.06 0.00 -0.12 0.00 0.00 57.88 57.73 2dd5 h LEU 67 Cb 0.89 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.58 2dd5 h LEU 67 CO 0.08 0.70 -0.09 0.58 -0.62 0.00 0.00 178.44 179.08 2dd5 h VAL 68 N 1.14 1.29 -0.45 1.05 2.07 -1.18 -1.25 116.25 118.92 2dd5 h VAL 68 Ca 0.31 -1.14 0.02 0.00 0.82 0.00 0.00 66.70 66.72 2dd5 h VAL 68 Cb -0.12 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 2dd5 h VAL 68 CO -0.07 0.36 0.26 0.00 0.02 0.00 0.00 177.57 178.13 2dd5 h ALA 69 N 0.75 0.57 -0.71 1.67 0.00 -0.76 -0.68 119.26 120.10 2dd5 h ALA 69 Ca 0.06 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2dd5 h ALA 69 Cb 0.58 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2dd5 h ALA 69 CO 0.03 -0.06 0.32 0.87 0.00 0.00 0.00 179.25 180.41 2dd5 h LYS 70 N 0.52 1.05 -0.35 0.00 1.57 -0.64 -2.49 116.57 116.23 2dd5 h LYS 70 Ca 0.18 -0.17 -0.07 0.00 -1.87 0.00 0.00 60.65 58.73 2dd5 h LYS 70 Cb 0.03 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 2dd5 h LYS 70 CO -0.09 0.84 -0.07 0.00 -0.57 0.00 0.00 179.45 179.56 2dd5 h ALA 71 N 1.15 1.24 -0.01 3.86 0.00 -0.78 -0.13 119.26 124.59 2dd5 h ALA 71 Ca 0.24 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2dd5 h ALA 71 Cb 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2dd5 h ALA 71 CO -0.03 0.50 -0.28 -1.49 0.00 0.00 0.00 179.25 177.95 2dd5 h TRP 72 N 0.54 0.02 -0.02 0.00 6.55 -0.71 -3.04 115.95 119.30 2dd5 h TRP 72 Ca 0.10 -0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.94 2dd5 h TRP 72 Cb 0.44 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 28.74 2dd5 h TRP 72 CO 0.02 0.30 -0.40 1.28 -1.05 0.00 0.00 178.44 178.59 2dd5 n LEU 73 N -4.19 2.20 -3.53 -4.49 4.77 -0.83 -4.81 117.00 106.12 2dd5 n LEU 73 Ca -0.02 -0.80 -0.29 0.00 -0.03 0.00 0.00 56.01 54.87 2dd5 n LEU 73 Cb 0.34 -0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.28 2dd5 n LEU 73 CO 0.38 0.40 -0.32 -0.62 -1.33 0.00 0.00 177.39 175.90 2dd5 s ASP 74 N -2.40 3.40 0.42 -1.43 -1.08 -0.12 -5.01 116.67 110.45 2dd5 s ASP 74 Ca 0.20 -1.38 0.17 0.00 -0.52 0.00 0.00 52.55 51.02 2dd5 s ASP 74 Cb 0.18 -0.32 1.07 0.00 -1.46 0.00 0.00 42.92 42.39 2dd5 s ASP 74 CO 0.53 -0.42 1.87 -0.65 0.52 0.00 0.00 175.17 177.01 2dd5 h PRO 75 N 8.24 0.41 -0.26 4.34 0.11 -1.87 -0.61 132.00 142.35 2dd5 h PRO 75 Ca -0.17 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.73 2dd5 h PRO 75 Cb 1.01 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.03 2dd5 h PRO 75 CO 0.41 0.27 -0.57 0.93 -0.21 0.00 0.00 178.00 178.83 2dd5 h GLU 76 N 0.42 0.82 -0.23 1.05 5.08 -1.95 -2.45 114.58 117.31 2dd5 h GLU 76 Ca 0.45 -0.53 -0.11 0.00 -1.00 0.00 0.00 59.36 58.17 2dd5 h GLU 76 Cb 1.10 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 2dd5 h GLU 76 CO -0.17 1.16 -0.33 -0.92 -1.00 0.00 0.00 179.01 177.76 2dd5 h TYR 77 N 0.62 0.55 -0.69 4.33 3.20 -1.53 -2.50 116.97 120.96 2dd5 h TYR 77 Ca 0.01 -0.14 -0.06 0.00 3.14 0.00 0.00 58.73 61.68 2dd5 h TYR 77 Cb 1.17 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 39.28 2dd5 h TYR 77 CO 0.07 0.75 0.21 -0.22 -1.64 0.00 0.00 178.16 177.34 2dd5 h LYS 78 N 0.41 1.08 -0.86 1.82 3.64 -1.06 -0.31 116.57 121.29 2dd5 h LYS 78 Ca 0.05 -0.23 -0.02 0.00 -1.27 0.00 0.00 60.65 59.18 2dd5 h LYS 78 Cb 0.77 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.40 2dd5 h LYS 78 CO 0.06 0.93 0.47 0.87 -2.27 0.00 0.00 179.45 179.52 2dd5 h LYS 79 N 1.02 1.19 -0.41 1.90 1.57 -1.22 -1.46 116.57 119.16 2dd5 h LYS 79 Ca 0.22 -0.14 -0.05 0.00 -1.87 0.00 0.00 60.65 58.82 2dd5 h LYS 79 Cb 0.31 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2dd5 h LYS 79 CO -0.01 0.87 0.06 1.25 -0.57 0.00 0.00 179.45 181.06 2dd5 h LEU 80 N 1.19 0.66 -0.17 2.94 5.85 -0.99 -1.46 115.31 123.33 2dd5 h LEU 80 Ca 0.30 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.80 2dd5 h LEU 80 Cb 0.02 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 2dd5 h LEU 80 CO -0.05 0.76 -0.11 0.00 -0.34 0.00 0.00 178.44 178.69 2dd5 h ILE 82 N -0.11 1.23 0.05 0.00 2.04 -1.19 -3.02 117.51 116.51 2dd5 h ILE 82 Ca 0.10 -0.89 -0.32 0.00 1.00 0.00 0.00 64.86 64.76 2dd5 h ILE 82 Cb 0.26 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 2dd5 h ILE 82 CO -0.24 0.32 -1.77 -0.08 0.00 0.00 0.00 178.15 176.38 2dd5 h GLU 83 N 0.79 0.11 -2.12 2.37 4.57 -0.91 -3.44 114.58 115.95 2dd5 h GLU 83 Ca 0.17 -0.19 -0.51 0.00 -1.18 0.00 0.00 59.36 57.65 2dd5 h GLU 83 Cb 0.35 0.07 -0.34 0.00 -0.16 0.00 0.00 28.75 28.67 2dd5 h GLU 83 CO 0.01 0.79 -0.90 -3.47 -1.18 0.00 0.00 179.01 174.26 2dd5 n ASP 84 N -3.23 -1.01 -0.28 1.04 -0.08 0.26 -5.00 116.55 108.25 2dd5 n ASP 84 Ca -0.21 -2.47 0.07 0.00 -1.51 0.00 0.00 54.79 50.67 2dd5 n ASP 84 Cb 1.05 -0.15 0.30 0.00 2.34 0.00 0.00 41.12 44.65 2dd5 n ASP 84 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2dd5 h GLY 85 N 5.50 1.28 0.99 0.27 0.00 -1.52 -1.62 103.07 107.97 2dd5 h GLY 85 Ca 0.23 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 2dd5 h GLY 85 CO 0.31 0.21 0.21 -2.08 0.00 0.00 0.00 176.54 175.19 2dd5 h VAL 86 N 0.89 1.11 -0.41 4.60 2.07 -1.89 -0.28 116.25 122.34 2dd5 h VAL 86 Ca 0.41 -0.24 -0.09 0.00 0.82 0.00 0.00 66.70 67.61 2dd5 h VAL 86 Cb 0.40 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 2dd5 h VAL 86 CO -0.17 0.11 -0.08 -0.08 0.02 0.00 0.00 177.57 177.36 2dd5 h GLU 87 N 0.45 0.78 -0.53 1.57 4.57 -1.81 -2.93 114.58 116.68 2dd5 h GLU 87 Ca 0.12 -0.29 -0.02 0.00 -1.18 0.00 0.00 59.36 57.99 2dd5 h GLU 87 Cb -0.01 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 2dd5 h GLU 87 CO -0.02 0.90 0.24 0.00 -1.18 0.00 0.00 179.01 178.94 2dd5 h ALA 88 N 0.86 1.42 -0.27 2.92 0.00 -1.11 -2.47 119.26 120.62 2dd5 h ALA 88 Ca 0.11 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2dd5 h ALA 88 Cb 0.60 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2dd5 h ALA 88 CO 0.04 0.45 0.18 1.03 0.00 0.00 0.00 179.25 180.95 2dd5 h SER 89 N 0.75 0.18 -0.73 0.00 0.87 -0.85 -1.63 113.55 112.14 2dd5 h SER 89 Ca 0.18 -0.00 0.06 0.00 -1.23 0.00 0.00 61.79 60.80 2dd5 h SER 89 Cb 0.11 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 61.98 2dd5 h SER 89 CO -0.02 0.13 0.48 0.11 -0.53 0.00 0.00 176.83 177.00 2dd5 h LYS 90 N 0.21 0.77 -0.07 2.24 1.57 -1.41 -1.43 116.57 118.44 2dd5 h LYS 90 Ca 0.11 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.87 2dd5 h LYS 90 Cb 0.18 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 2dd5 h LYS 90 CO -0.02 0.51 0.12 0.00 -0.57 0.00 0.00 179.45 179.48 2dd5 h ALA 91 N 1.60 1.50 -0.37 3.86 0.00 -1.43 -0.64 119.26 123.79 2dd5 h ALA 91 Ca 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2dd5 h ALA 91 Cb 0.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2dd5 h ALA 91 CO -0.10 -0.15 0.00 1.33 0.00 0.00 0.00 179.25 180.32 2dd5 n VAL 92 N -3.56 2.42 -0.98 0.00 0.24 -0.57 -4.95 118.33 110.93 2dd5 n VAL 92 Ca -0.01 -1.71 0.00 0.00 -2.04 0.00 0.00 64.34 60.58 2dd5 n VAL 92 Cb 0.21 -0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.33 2dd5 n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dd5 n GLY 93 N -0.11 0.50 3.10 7.63 0.00 -0.25 -4.85 105.19 111.21 2dd5 n GLY 93 Ca 0.23 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2dd5 n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dd5 s VAL 94 N -2.00 2.81 -0.48 1.61 1.01 -1.01 -5.01 120.40 117.33 2dd5 s VAL 94 Ca 0.00 -1.95 -0.17 0.00 0.00 0.00 0.00 61.98 59.86 2dd5 s VAL 94 Cb 0.00 -2.87 0.06 0.00 0.00 0.00 0.00 36.38 33.57 2dd5 s VAL 94 CO 0.00 -0.47 0.50 0.21 0.00 0.00 0.00 175.10 175.34 2dd5 s ASN 95 N 1.35 6.18 0.59 3.32 3.84 -1.26 -3.23 114.94 125.73 2dd5 s ASN 95 Ca 0.04 -1.08 0.29 0.00 0.21 0.00 0.00 52.86 52.32 2dd5 s ASN 95 Cb -0.21 -2.23 1.55 0.00 -0.55 0.00 0.00 41.25 39.81 2dd5 s ASN 95 CO -0.05 -0.74 1.97 -0.50 -2.79 0.00 0.00 177.10 174.99 2dd5 h TRP 96 N 8.86 0.00 0.03 0.43 4.06 -1.94 0.22 115.95 127.60 2dd5 h TRP 96 Ca -0.28 0.00 -0.26 0.00 2.06 0.00 0.00 58.89 60.41 2dd5 h TRP 96 Cb 1.10 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.23 2dd5 h TRP 96 CO 0.68 0.00 -1.42 0.28 -3.56 0.00 0.00 178.44 174.42 2dd5 h VAL 97 N 0.00 0.85 -0.00 1.49 2.07 -1.91 -3.28 116.25 115.47 2dd5 h VAL 97 Ca 0.16 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.46 2dd5 h VAL 97 Cb 0.91 2.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.97 2dd5 h VAL 97 CO -0.00 0.44 -0.82 0.35 0.02 0.00 0.00 177.57 177.56 2dd5 n THR 98 N -4.22 0.00 -0.13 2.57 -2.24 -1.08 -1.54 114.28 107.64 2dd5 n THR 98 Ca -0.32 -0.09 -0.12 0.00 -2.27 0.00 0.00 64.05 61.25 2dd5 n THR 98 Cb 0.77 1.05 -0.02 0.00 -2.10 0.00 0.00 70.33 70.02 2dd5 n THR 98 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2dd5 h SER 99 N 0.42 0.83 -4.18 3.42 0.02 -0.83 -3.44 113.55 109.80 2dd5 h SER 99 Ca 0.00 -0.40 -0.51 0.00 -0.84 0.00 0.00 61.79 60.04 2dd5 h SER 99 Cb 0.50 -0.23 0.11 0.00 0.14 0.00 0.00 62.40 62.92 2dd5 h SER 99 CO 0.00 1.04 0.39 -2.84 -1.14 0.00 0.00 176.83 174.28 2dd5 s PRO 100 N -4.66 2.74 0.62 3.45 0.02 -1.26 -4.91 135.00 131.00 2dd5 s PRO 100 Ca -0.12 1.51 0.32 0.00 0.02 0.00 0.00 61.00 62.72 2dd5 s PRO 100 Cb 0.10 -1.93 1.76 0.00 0.02 0.00 0.00 34.50 34.45 2dd5 s PRO 100 CO 0.83 -1.32 2.09 -1.35 -0.33 0.00 0.00 177.00 176.92 2dd5 h PRO 101 N 0.14 0.00 -0.04 5.54 0.11 -1.93 -2.78 132.00 133.04 2dd5 h PRO 101 Ca -0.47 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.48 2dd5 h PRO 101 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2dd5 h PRO 101 CO 0.54 0.00 -0.66 1.79 -0.21 0.00 0.00 178.00 179.45 2dd5 h THR 102 N 0.00 1.43 -0.19 -1.15 1.35 -1.90 -3.47 112.91 108.98 2dd5 h THR 102 Ca 0.06 -2.16 -0.08 0.00 -0.55 0.00 0.00 66.41 63.69 2dd5 h THR 102 Cb 0.51 2.13 -0.03 0.00 -1.73 0.00 0.00 68.15 69.03 2dd5 h THR 102 CO -0.00 0.63 -0.07 0.00 -0.25 0.00 0.00 175.52 175.83 2dd5 n GLN 103 N -3.81 -0.44 -1.24 4.72 1.13 -1.05 -4.82 117.38 111.88 2dd5 n GLN 103 Ca -0.02 0.52 0.00 0.00 -1.94 0.00 0.00 57.00 55.57 2dd5 n GLN 103 Cb 0.66 -4.16 -0.01 0.00 0.11 0.00 0.00 30.24 26.84 2dd5 n GLN 103 CO 0.00 0.00 0.00 1.97 -1.44 0.00 0.00 177.06 177.59 2dd5 n PHE 104 N -2.80 0.00 -0.16 1.08 1.16 -0.93 -4.71 117.46 111.09 2dd5 n PHE 104 Ca -0.04 -0.44 0.02 0.00 -1.87 0.00 0.00 57.45 55.12 2dd5 n PHE 104 Cb 0.17 0.06 -0.01 0.00 -1.61 0.00 0.00 39.48 38.09 2dd5 n PHE 104 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2dd5 n GLY 105 N 0.30 -2.44 3.77 4.97 0.00 -0.59 -4.85 105.19 106.35 2dd5 n GLY 105 Ca -0.04 -1.42 -0.37 0.00 0.00 0.00 0.00 46.02 44.19 2dd5 n GLY 105 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dd5 s THR 106 N -2.76 3.24 0.30 2.61 -4.23 -1.26 -4.70 115.64 108.84 2dd5 s THR 106 Ca 0.00 0.92 0.01 0.00 -1.18 0.00 0.00 61.69 61.44 2dd5 s THR 106 Cb 0.00 -3.46 0.28 0.00 1.34 0.00 0.00 72.50 70.66 2dd5 s THR 106 CO 0.00 -0.02 1.90 -0.65 -0.54 0.00 0.00 174.62 175.31 2dd5 h PRO 107 N 2.07 0.98 0.00 3.99 0.11 -1.95 -2.51 132.00 134.69 2dd5 h PRO 107 Ca -0.49 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 65.43 2dd5 h PRO 107 Cb 1.24 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 2dd5 h PRO 107 CO 0.60 0.65 -1.34 0.43 -0.21 0.00 0.00 178.00 178.13 2dd5 n SER 108 N -4.51 0.85 0.03 -2.05 7.64 -1.26 -4.35 113.62 109.97 2dd5 n SER 108 Ca 0.15 0.36 0.11 0.00 1.01 0.00 0.00 58.87 60.50 2dd5 n SER 108 Cb 0.24 0.24 -0.10 0.00 -1.01 0.00 0.00 64.21 63.58 2dd5 n SER 108 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2dd5 n ASP 109 N -2.84 0.34 -0.65 6.43 8.00 -1.21 -4.95 116.55 121.68 2dd5 n ASP 109 Ca -0.08 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.46 2dd5 n ASP 109 Cb 0.78 1.40 0.00 0.00 -0.02 0.00 0.00 41.12 43.28 2dd5 n ASP 109 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2dd5 n TYR 110 N -2.33 -1.61 -2.52 1.24 4.01 -0.95 -4.59 117.16 110.41 2dd5 n TYR 110 Ca -0.02 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.51 2dd5 n TYR 110 Cb 0.54 0.23 0.01 0.00 -0.31 0.00 0.00 39.34 39.82 2dd5 n TYR 110 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dd5 n ASN 112 N -0.36 0.15 -4.73 0.00 5.15 -1.26 -4.94 115.26 109.26 2dd5 n ASN 112 Ca 0.30 -2.66 -0.41 0.00 -0.60 0.00 0.00 54.58 51.21 2dd5 n ASN 112 Cb 0.72 -0.63 -0.04 0.00 -0.53 0.00 0.00 39.78 39.30 2dd5 n ASN 112 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2dd5 s LEU 113 N -1.00 4.51 -0.03 1.20 2.96 -1.26 -2.25 118.68 122.81 2dd5 s LEU 113 Ca 0.35 1.89 0.05 0.00 -0.22 0.00 0.00 54.13 56.21 2dd5 s LEU 113 Cb 0.15 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.23 2dd5 s LEU 113 CO -0.12 -0.10 -0.20 -0.13 -1.32 0.00 0.00 176.35 174.49 2dd5 s ARG 114 N -0.19 1.79 -0.21 1.98 0.52 0.14 -3.18 118.95 119.81 2dd5 s ARG 114 Ca 0.47 -0.70 -0.07 0.00 -0.52 0.00 0.00 55.73 54.91 2dd5 s ARG 114 Cb -0.25 -1.64 -0.04 0.00 0.52 0.00 0.00 34.95 33.54 2dd5 s ARG 114 CO 0.31 0.36 0.07 0.08 0.02 0.00 0.00 175.30 176.14 2dd5 s VAL 115 N -0.25 4.65 -0.34 3.52 1.01 -1.25 -2.69 120.40 125.05 2dd5 s VAL 115 Ca 0.02 -0.07 -0.14 0.00 0.00 0.00 0.00 61.98 61.79 2dd5 s VAL 115 Cb -0.10 -3.13 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 2dd5 s VAL 115 CO 0.01 0.41 0.29 -0.76 0.00 0.00 0.00 175.10 175.05 2dd5 s LEU 116 N 0.83 4.51 -0.31 3.92 1.43 -0.64 -4.53 118.68 123.90 2dd5 s LEU 116 Ca 0.04 -0.37 -0.18 0.00 -1.03 0.00 0.00 54.13 52.59 2dd5 s LEU 116 Cb -0.14 -2.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.86 2dd5 s LEU 116 CO 0.02 -0.28 0.52 0.00 0.23 0.00 0.00 176.35 176.84 2dd5 s ALA 117 N 1.83 3.53 0.82 4.21 0.00 -1.26 0.03 121.76 130.93 2dd5 s ALA 117 Ca 0.08 -0.80 -0.11 0.00 0.00 0.00 0.00 51.96 51.13 2dd5 s ALA 117 Cb -0.17 -2.96 0.09 0.00 0.00 0.00 0.00 23.12 20.07 2dd5 s ALA 117 CO 0.11 -0.99 1.09 -0.51 0.00 0.00 0.00 175.76 175.46 2dd5 s ASP 118 N 1.66 4.15 0.29 0.00 1.01 0.04 -4.93 116.67 118.89 2dd5 s ASP 118 Ca 0.20 1.53 -0.07 0.00 0.71 0.00 0.00 52.55 54.93 2dd5 s ASP 118 Cb -0.15 -2.25 -0.00 0.00 1.01 0.00 0.00 42.92 41.52 2dd5 s ASP 118 CO 0.11 -2.22 0.44 -0.94 0.21 0.00 0.00 175.17 172.77 2dd5 s SER 119 N -3.57 0.39 0.65 0.27 1.04 0.86 -4.56 113.70 108.78 2dd5 s SER 119 Ca 0.62 -1.24 0.37 0.00 0.48 0.00 0.00 55.95 56.17 2dd5 s SER 119 Cb -0.16 0.60 2.02 0.00 0.10 0.00 0.00 66.02 68.58 2dd5 s SER 119 CO 0.56 -1.19 2.17 -0.65 0.98 0.00 0.00 173.24 175.11 2dd5 h PRO 120 N 2.23 0.00 -0.10 4.02 0.11 -2.02 -1.60 132.00 134.63 2dd5 h PRO 120 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2dd5 h PRO 120 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2dd5 h PRO 120 CO 0.39 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.43 2dd5 n THR 121 N -3.13 1.01 -3.73 -1.15 -2.24 -1.26 -4.89 114.28 98.89 2dd5 n THR 121 Ca -0.02 -1.01 -0.13 0.00 -2.27 0.00 0.00 64.05 60.62 2dd5 n THR 121 Cb 0.22 0.49 -0.14 0.00 -2.10 0.00 0.00 70.33 68.81 2dd5 n THR 121 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2dd5 s LEU 122 N -1.02 0.52 -0.05 3.22 2.96 -0.60 -0.64 118.68 123.07 2dd5 s LEU 122 Ca 0.07 0.41 -0.01 0.00 -0.22 0.00 0.00 54.13 54.39 2dd5 s LEU 122 Cb 0.04 0.54 0.03 0.00 0.50 0.00 0.00 46.19 47.30 2dd5 s LEU 122 CO 0.05 -0.16 0.01 -0.75 -1.32 0.00 0.00 176.35 174.17 2dd5 s LYS 123 N 1.29 0.38 0.13 1.98 2.36 0.08 -0.10 119.74 125.86 2dd5 s LYS 123 Ca -0.09 0.14 0.02 0.00 -2.55 0.00 0.00 55.97 53.49 2dd5 s LYS 123 Cb -0.11 -0.70 -0.04 0.00 -1.05 0.00 0.00 37.83 35.93 2dd5 s LYS 123 CO -0.07 -0.23 0.24 -1.01 1.55 0.00 0.00 175.35 175.82 2dd5 s HIS 124 N 1.60 3.43 -0.10 4.03 3.76 -1.26 -0.87 115.29 125.88 2dd5 s HIS 124 Ca -0.01 0.12 -0.08 0.00 -0.15 0.00 0.00 55.06 54.93 2dd5 s HIS 124 Cb -0.13 -1.66 0.03 0.00 1.11 0.00 0.00 32.58 31.93 2dd5 s HIS 124 CO -0.03 0.53 0.26 0.54 -0.85 0.00 0.00 174.74 175.19 2dd5 s VAL 125 N -1.68 -0.01 0.17 -0.90 0.11 -0.86 -4.45 120.40 112.79 2dd5 s VAL 125 Ca 0.34 0.03 0.08 0.00 -2.93 0.00 0.00 61.98 59.50 2dd5 s VAL 125 Cb -0.11 -0.38 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 2dd5 s VAL 125 CO 0.27 0.01 -0.05 -0.69 -3.33 0.00 0.00 175.10 171.32 2dd5 s VAL 126 N 0.36 3.48 0.16 2.04 1.01 0.01 -1.19 120.40 126.28 2dd5 s VAL 126 Ca -0.02 -1.51 -0.24 0.00 0.00 0.00 0.00 61.98 60.21 2dd5 s VAL 126 Cb -0.03 -2.74 0.06 0.00 0.00 0.00 0.00 36.38 33.67 2dd5 s VAL 126 CO -0.02 -0.10 0.72 0.54 0.00 0.00 0.00 175.10 176.24 2dd5 s VAL 127 N -1.70 0.00 -0.39 2.92 0.11 -0.64 -4.93 120.40 115.77 2dd5 s VAL 127 Ca 0.26 -0.33 0.02 0.00 -2.93 0.00 0.00 61.98 59.00 2dd5 s VAL 127 Cb -0.09 -1.37 0.12 0.00 -1.53 0.00 0.00 36.38 33.51 2dd5 s VAL 127 CO 0.17 0.00 0.16 0.00 -3.33 0.00 0.00 175.10 172.10 2dd5 h THR 129 N 5.93 0.94 0.03 0.00 1.35 -1.86 -3.35 112.91 115.95 2dd5 h THR 129 Ca -0.06 -0.48 -0.22 0.00 -0.55 0.00 0.00 66.41 65.10 2dd5 h THR 129 Cb 0.97 1.27 -0.02 0.00 -1.73 0.00 0.00 68.15 68.64 2dd5 h THR 129 CO 0.52 0.13 -1.03 -0.07 -0.25 0.00 0.00 175.52 174.82 2dd5 h LEU 130 N 0.00 0.13 -9.41 3.87 3.38 -1.91 -3.47 115.31 107.90 2dd5 h LEU 130 Ca -0.00 -0.14 -0.60 0.00 0.09 0.00 0.00 57.88 57.23 2dd5 h LEU 130 Cb 0.26 -0.04 -0.12 0.00 0.09 0.00 0.00 40.66 40.84 2dd5 h LEU 130 CO 0.02 1.07 -0.69 -0.94 0.09 0.00 0.00 178.44 177.99 2dd5 s SER 132 N -6.85 4.37 0.00 -0.43 1.04 -1.26 -5.20 113.70 105.37 2dd5 s SER 132 Ca -0.01 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.82 2dd5 s SER 132 Cb 0.09 -0.77 0.00 0.00 0.10 0.00 0.00 66.02 65.44 2dd5 s SER 132 CO 0.83 0.06 0.00 0.00 0.98 0.00 0.00 173.24 175.12 2dd5 n TYR 134 N -0.32 0.00 -0.93 5.02 9.36 -1.26 -4.92 117.16 124.11 2dd5 n TYR 134 Ca -0.09 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 60.88 2dd5 n TYR 134 Cb 0.57 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.24 2dd5 n TYR 134 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2dd5 n PRO 135 N -1.11 2.52 -0.30 2.98 -0.04 -1.26 -4.76 135.00 133.03 2dd5 n PRO 135 Ca 0.00 -1.58 0.06 0.00 -0.04 0.00 0.00 63.50 61.94 2dd5 n PRO 135 Cb 0.00 -2.47 0.16 0.00 -0.04 0.00 0.00 33.50 31.15 2dd5 n PRO 135 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dd5 h ARG 136 N 5.46 0.03 -0.99 0.54 3.08 -1.94 -0.32 114.38 120.24 2dd5 h ARG 136 Ca 0.56 -0.00 0.21 0.00 0.07 0.00 0.00 59.98 60.82 2dd5 h ARG 136 Cb 0.36 -0.01 -0.10 0.00 0.08 0.00 0.00 29.97 30.30 2dd5 h ARG 136 CO 1.37 0.02 0.62 -1.35 -1.07 0.00 0.00 179.97 179.56 2dd5 h PRO 137 N 0.03 0.60 0.00 0.04 0.11 -1.85 0.92 132.00 131.85 2dd5 h PRO 137 Ca 0.44 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.52 2dd5 h PRO 137 Cb 0.76 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.74 2dd5 h PRO 137 CO -0.82 0.40 -1.02 1.51 -0.21 0.00 0.00 178.00 177.85 2dd5 n ILE 138 N -4.69 0.00 0.00 4.15 3.06 -0.79 -4.70 119.36 116.39 2dd5 n ILE 138 Ca 0.23 -0.22 0.00 0.00 -2.50 0.00 0.00 62.75 60.26 2dd5 n ILE 138 Cb 0.66 0.71 -0.00 0.00 0.54 0.00 0.00 39.64 41.54 2dd5 n ILE 138 CO 0.00 0.00 0.00 -0.11 -2.50 0.00 0.00 176.55 173.94 2dd5 n LEU 139 N -1.57 0.00 0.00 9.51 7.94 -0.20 -2.73 117.00 129.95 2dd5 n LEU 139 Ca 0.01 -0.12 0.00 0.00 -1.11 0.00 0.00 56.01 54.79 2dd5 n LEU 139 Cb 0.28 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.23 2dd5 n LEU 139 CO 0.30 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.19 2dd5 n GLY 140 N 2.15 -1.46 3.81 -3.96 0.00 0.30 -2.16 105.19 103.86 2dd5 n GLY 140 Ca -0.00 -1.89 -0.35 0.00 0.00 0.00 0.00 46.02 43.78 2dd5 n GLY 140 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dd5 s GLN 141 N 0.00 4.32 0.56 1.61 -0.21 -1.26 -3.96 119.66 120.72 2dd5 s GLN 141 Ca 0.00 1.05 -0.19 0.00 0.02 0.00 0.00 55.36 56.24 2dd5 s GLN 141 Cb 0.00 -2.63 -0.05 0.00 1.00 0.00 0.00 33.01 31.33 2dd5 s GLN 141 CO 0.00 0.22 1.11 -1.54 -2.12 0.00 0.00 175.29 172.96 2dd5 s SER 142 N -1.86 5.71 0.57 5.90 1.04 -1.26 -5.01 113.70 118.79 2dd5 s SER 142 Ca 0.51 2.09 -0.18 0.00 0.48 0.00 0.00 55.95 58.85 2dd5 s SER 142 Cb -0.15 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.36 2dd5 s SER 142 CO 0.20 -1.22 1.10 -2.84 0.98 0.00 0.00 173.24 171.45 2dd5 s PRO 143 N -3.47 3.30 0.15 4.02 0.02 -1.26 -4.95 135.00 132.81 2dd5 s PRO 143 Ca 0.70 1.45 -0.17 0.00 0.02 0.00 0.00 61.00 63.01 2dd5 s PRO 143 Cb -0.22 -2.01 0.05 0.00 0.02 0.00 0.00 34.50 32.35 2dd5 s PRO 143 CO 0.29 -0.86 1.73 1.49 -0.33 0.00 0.00 177.00 179.32 2dd5 h GLU 144 N 0.87 0.19 0.00 5.54 4.57 -2.00 -2.04 114.58 121.70 2dd5 h GLU 144 Ca -0.49 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 57.66 2dd5 h GLU 144 Cb 1.24 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.79 2dd5 h GLU 144 CO 0.57 0.12 -0.11 0.11 -1.18 0.00 0.00 179.01 178.52 2dd5 h TRP 145 N 0.19 0.00 0.00 0.92 5.08 -1.98 -1.97 115.95 118.19 2dd5 h TRP 145 Ca 0.16 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 60.07 2dd5 h TRP 145 Cb 0.17 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.32 2dd5 h TRP 145 CO -0.18 0.11 -0.27 -0.92 -1.28 0.00 0.00 178.44 175.91 2dd5 h TYR 146 N 0.00 0.00 -0.00 0.12 3.20 -1.74 -2.33 116.97 116.22 2dd5 h TYR 146 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2dd5 h TYR 146 Cb 0.22 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.49 2dd5 h TYR 146 CO 0.00 0.27 -0.32 0.54 -1.64 0.00 0.00 178.16 177.01 2dd5 n ARG 147 N -4.06 0.35 -2.24 1.82 1.74 -0.75 -4.69 116.66 108.84 2dd5 n ARG 147 Ca -0.02 -0.18 -0.39 0.00 -0.77 0.00 0.00 57.85 56.49 2dd5 n ARG 147 Cb 0.33 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.25 2dd5 n ARG 147 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2dd5 s SER 148 N -2.77 6.68 0.45 0.55 1.04 -0.88 -4.91 113.70 113.87 2dd5 s SER 148 Ca 0.18 2.48 0.13 0.00 0.48 0.00 0.00 55.95 59.22 2dd5 s SER 148 Cb 0.19 -2.63 1.05 0.00 0.10 0.00 0.00 66.02 64.73 2dd5 s SER 148 CO 0.60 -0.57 2.04 -0.65 0.98 0.00 0.00 173.24 175.63 2dd5 h PRO 149 N 3.05 0.33 0.19 4.02 0.11 -1.92 -1.88 132.00 135.91 2dd5 h PRO 149 Ca -0.49 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2dd5 h PRO 149 Cb 1.23 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2dd5 h PRO 149 CO 0.64 0.22 -0.09 -0.97 -0.21 0.00 0.00 178.00 177.59 2dd5 h ASN 150 N 0.34 -0.22 -0.60 -2.05 -0.73 -1.91 0.27 115.58 110.68 2dd5 h ASN 150 Ca 0.18 0.00 -0.04 0.00 1.87 0.00 0.00 56.30 58.31 2dd5 h ASN 150 Cb 0.27 0.06 -0.03 0.00 0.27 0.00 0.00 38.32 38.89 2dd5 h ASN 150 CO -0.04 -0.15 0.22 0.22 -0.37 0.00 0.00 177.43 177.31 2dd5 h TYR 151 N -0.27 0.93 0.00 0.67 3.20 -1.68 -1.60 116.97 118.22 2dd5 h TYR 151 Ca -0.03 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.72 2dd5 h TYR 151 Cb 0.21 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 2dd5 h TYR 151 CO -0.06 0.75 -0.21 0.00 -1.64 0.00 0.00 178.16 177.00 2dd5 h ARG 152 N 0.83 0.00 0.08 1.82 3.08 -1.18 -2.50 114.38 116.52 2dd5 h ARG 152 Ca 0.20 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 60.07 2dd5 h ARG 152 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2dd5 h ARG 152 CO -0.01 0.21 -0.86 0.00 -1.07 0.00 0.00 179.97 178.24 2dd5 h ARG 153 N 0.00 0.18 0.21 0.04 3.08 -0.62 -3.43 114.38 113.84 2dd5 h ARG 153 Ca -0.00 -0.30 -0.34 0.00 0.07 0.00 0.00 59.98 59.40 2dd5 h ARG 153 Cb 0.46 0.11 0.02 0.00 0.08 0.00 0.00 29.97 30.64 2dd5 h ARG 153 CO 0.03 1.14 -1.62 0.00 -1.07 0.00 0.00 179.97 178.45 2dd5 h ARG 154 N -0.57 0.44 -0.30 0.04 3.08 -1.26 -3.40 114.38 112.40 2dd5 h ARG 154 Ca -0.18 -0.75 0.07 0.00 0.07 0.00 0.00 59.98 59.19 2dd5 h ARG 154 Cb 1.49 0.28 -0.08 0.00 0.08 0.00 0.00 29.97 31.74 2dd5 h ARG 154 CO 0.04 1.35 -0.23 1.25 -1.07 0.00 0.00 179.97 181.31 2dd5 h LEU 155 N 0.12 -0.77 -2.69 3.04 5.85 -1.69 0.18 115.31 119.35 2dd5 h LEU 155 Ca -0.30 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 2dd5 h LEU 155 Cb 2.12 0.37 -0.00 0.00 0.37 0.00 0.00 40.66 43.52 2dd5 h LEU 155 CO 0.22 -0.27 -0.00 -0.37 -0.34 0.00 0.00 178.44 177.68 2dd5 h VAL 156 N -0.21 0.29 0.00 1.05 -1.51 -1.83 -1.98 116.25 112.05 2dd5 h VAL 156 Ca 0.16 -0.01 -0.27 0.00 -1.23 0.00 0.00 66.70 65.34 2dd5 h VAL 156 Cb 0.45 1.01 -0.05 0.00 -2.13 0.00 0.00 31.29 30.57 2dd5 h VAL 156 CO -0.42 0.00 -2.01 -1.14 -1.23 0.00 0.00 177.57 172.77 2dd5 n ARG 157 N -3.49 1.10 -2.67 5.19 0.63 -0.77 -4.73 116.66 111.91 2dd5 n ARG 157 Ca -0.03 0.05 -0.20 0.00 -0.92 0.00 0.00 57.85 56.74 2dd5 n ARG 157 Cb 0.08 -1.37 0.00 0.00 0.45 0.00 0.00 32.46 31.62 2dd5 n ARG 157 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2dd5 n TRP 158 N -2.77 2.49 -0.27 -0.14 8.01 0.54 -4.93 117.44 120.37 2dd5 n TRP 158 Ca -0.28 -3.20 0.02 0.00 -1.31 0.00 0.00 57.50 52.73 2dd5 n TRP 158 Cb 0.91 -0.26 0.15 0.00 -2.01 0.00 0.00 31.31 30.10 2dd5 n TRP 158 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2dd5 h PRO 159 N 2.81 0.70 -0.36 -0.99 0.13 -1.50 -0.83 132.00 131.96 2dd5 h PRO 159 Ca 0.13 -0.04 0.05 0.00 -0.87 0.00 0.00 66.00 65.27 2dd5 h PRO 159 Cb 0.95 -0.16 -0.04 0.00 0.13 0.00 0.00 31.00 31.88 2dd5 h PRO 159 CO 0.70 0.46 0.10 0.00 -0.23 0.00 0.00 178.00 179.03 2dd5 h ARG 160 N 0.72 0.22 -0.42 0.86 2.47 -1.91 0.16 114.38 116.48 2dd5 h ARG 160 Ca 0.38 -0.01 -0.10 0.00 -1.26 0.00 0.00 59.98 58.98 2dd5 h ARG 160 Cb 0.36 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.62 2dd5 h ARG 160 CO -0.25 0.15 -0.15 1.96 0.56 0.00 0.00 179.97 182.24 2dd5 h GLN 161 N 0.23 0.83 -0.26 0.04 7.50 -1.82 -1.41 115.11 120.22 2dd5 h GLN 161 Ca 0.17 -0.34 -0.04 0.00 0.50 0.00 0.00 58.65 58.94 2dd5 h GLN 161 Cb 0.17 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 27.65 2dd5 h GLN 161 CO -0.20 0.97 0.01 0.28 -1.50 0.00 0.00 178.83 178.40 2dd5 h VAL 162 N 0.65 1.25 -0.78 -0.54 2.07 -0.88 -2.23 116.25 115.80 2dd5 h VAL 162 Ca 0.10 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 2dd5 h VAL 162 Cb 0.69 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 2dd5 h VAL 162 CO 0.05 0.28 0.39 -0.07 0.02 0.00 0.00 177.57 178.24 2dd5 h LEU 163 N 0.24 0.99 -1.36 2.57 3.38 -0.67 -1.59 115.31 118.87 2dd5 h LEU 163 Ca 0.07 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2dd5 h LEU 163 Cb 0.40 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2dd5 h LEU 163 CO 0.01 0.83 0.26 0.00 0.09 0.00 0.00 178.44 179.63 2dd5 h ALA 164 N 1.33 1.51 -0.39 1.53 0.00 -0.93 0.10 119.26 122.41 2dd5 h ALA 164 Ca 0.27 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 2dd5 h ALA 164 Cb 0.08 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2dd5 h ALA 164 CO -0.04 0.40 0.09 0.93 0.00 0.00 0.00 179.25 180.64 2dd5 h GLU 165 N 0.71 0.57 0.00 0.00 5.08 -0.68 0.15 114.58 120.41 2dd5 h GLU 165 Ca 0.18 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2dd5 h GLU 165 Cb 0.04 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2dd5 h GLU 165 CO -0.03 0.53 0.00 1.19 -1.00 0.00 0.00 179.01 179.71 2dd5 n PHE 166 N -4.33 0.00 -0.63 4.33 3.01 -0.15 -4.88 117.46 114.81 2dd5 n PHE 166 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 2dd5 n PHE 166 Cb 0.19 -0.13 0.00 0.00 -0.01 0.00 0.00 39.48 39.53 2dd5 n PHE 166 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dd5 n GLY 167 N 1.13 0.61 3.21 1.37 0.00 0.52 -4.95 105.19 107.08 2dd5 n GLY 167 Ca 0.19 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 2dd5 n GLY 167 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dd5 s LEU 168 N 0.00 2.39 0.01 0.99 2.96 0.17 -4.96 118.68 120.24 2dd5 s LEU 168 Ca 0.00 -0.53 0.04 0.00 -0.22 0.00 0.00 54.13 53.41 2dd5 s LEU 168 Cb 0.00 -1.55 -0.01 0.00 0.50 0.00 0.00 46.19 45.12 2dd5 s LEU 168 CO 0.00 0.03 -0.12 -1.58 -1.32 0.00 0.00 176.35 173.36 2dd5 s GLN 169 N 1.11 0.94 0.12 1.98 0.74 -1.26 -2.47 119.66 120.81 2dd5 s GLN 169 Ca 0.00 -0.53 0.05 0.00 0.05 0.00 0.00 55.36 54.93 2dd5 s GLN 169 Cb -0.14 -0.91 -0.04 0.00 1.10 0.00 0.00 33.01 33.02 2dd5 s GLN 169 CO -0.05 0.24 -0.12 -0.51 -0.55 0.00 0.00 175.29 174.30 2dd5 s LEU 170 N -0.57 2.42 0.43 3.68 1.43 -1.26 -5.12 118.68 119.69 2dd5 s LEU 170 Ca 0.03 -0.84 -0.23 0.00 -1.03 0.00 0.00 54.13 52.06 2dd5 s LEU 170 Cb -0.06 -0.44 -0.11 0.00 0.03 0.00 0.00 46.19 45.61 2dd5 s LEU 170 CO 0.00 -0.21 0.83 -2.65 0.23 0.00 0.00 176.35 174.56 2dd5 n PRO 171 N 0.45 1.02 0.30 1.29 -0.02 -1.26 -4.84 135.00 131.93 2dd5 n PRO 171 Ca -0.15 0.37 0.16 0.00 -2.02 0.00 0.00 63.50 61.86 2dd5 n PRO 171 Cb 0.58 -1.84 0.92 0.00 -0.02 0.00 0.00 33.50 33.13 2dd5 n PRO 171 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2dd5 h SER 172 N 1.19 0.00 0.86 2.55 4.64 -2.04 -1.94 113.55 118.82 2dd5 h SER 172 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2dd5 h SER 172 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2dd5 h SER 172 CO 0.55 0.03 -0.55 -1.84 -0.87 0.00 0.00 176.83 174.14 2dd5 n GLU 173 N -3.64 0.24 -2.26 4.77 0.28 -1.26 -4.85 120.64 113.92 2dd5 n GLU 173 Ca -0.03 0.08 -0.41 0.00 -0.16 0.00 0.00 57.16 56.65 2dd5 n GLU 173 Cb 0.13 -1.66 -0.03 0.00 1.43 0.00 0.00 31.44 31.30 2dd5 n GLU 173 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 2dd5 s VAL 174 N -3.14 3.05 -0.39 3.84 1.01 -0.73 -4.95 120.40 119.09 2dd5 s VAL 174 Ca 0.07 1.04 -0.27 0.00 0.00 0.00 0.00 61.98 62.82 2dd5 s VAL 174 Cb 0.14 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.88 2dd5 s VAL 174 CO 0.70 0.24 1.01 -1.58 0.00 0.00 0.00 175.10 175.47 2dd5 s GLN 175 N -1.54 3.84 -0.22 2.72 0.74 0.18 -4.93 119.66 120.45 2dd5 s GLN 175 Ca 0.48 0.65 -0.19 0.00 0.05 0.00 0.00 55.36 56.35 2dd5 s GLN 175 Cb -0.37 -3.82 -0.03 0.00 1.10 0.00 0.00 33.01 29.89 2dd5 s GLN 175 CO 0.47 -1.06 0.54 0.42 -0.55 0.00 0.00 175.29 175.11 2dd5 s ILE 176 N 3.75 5.08 -0.17 -2.34 -1.09 -1.26 -0.74 121.20 124.43 2dd5 s ILE 176 Ca 0.42 0.98 0.01 0.00 -2.23 0.00 0.00 60.65 59.82 2dd5 s ILE 176 Cb -0.11 -3.86 0.01 0.00 -1.58 0.00 0.00 42.46 36.92 2dd5 s ILE 176 CO 0.21 0.14 -0.18 -0.60 -1.23 0.00 0.00 174.94 173.29 2dd5 s ARG 177 N 1.88 3.10 -0.13 2.79 3.52 -0.05 -4.96 118.95 125.10 2dd5 s ARG 177 Ca 0.24 -0.79 -0.15 0.00 -0.13 0.00 0.00 55.73 54.90 2dd5 s ARG 177 Cb -0.15 -2.60 -0.05 0.00 -1.56 0.00 0.00 34.95 30.59 2dd5 s ARG 177 CO 0.09 -0.11 0.35 0.08 -0.81 0.00 0.00 175.30 174.91 2dd5 s VAL 178 N 1.08 5.25 -0.24 7.11 1.01 -1.26 -2.02 120.40 131.34 2dd5 s VAL 178 Ca -0.00 0.68 -0.06 0.00 0.00 0.00 0.00 61.98 62.60 2dd5 s VAL 178 Cb -0.14 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 2dd5 s VAL 178 CO -0.06 0.39 0.03 0.00 0.00 0.00 0.00 175.10 175.46 2dd5 s ALA 179 N 0.36 3.04 -0.38 5.51 0.00 -0.33 -4.97 121.76 124.99 2dd5 s ALA 179 Ca 0.20 -1.13 -0.13 0.00 0.00 0.00 0.00 51.96 50.90 2dd5 s ALA 179 Cb -0.14 -1.94 0.02 0.00 0.00 0.00 0.00 23.12 21.06 2dd5 s ALA 179 CO 0.06 -0.44 0.25 0.34 0.00 0.00 0.00 175.76 175.98 2dd5 s ASP 180 N 1.52 5.95 -1.30 0.00 -1.08 -1.26 -1.62 116.67 118.88 2dd5 s ASP 180 Ca 0.06 -0.84 -0.18 0.00 -0.52 0.00 0.00 52.55 51.07 2dd5 s ASP 180 Cb -0.15 -2.10 0.07 0.00 -1.46 0.00 0.00 42.92 39.28 2dd5 s ASP 180 CO 0.01 -0.38 1.74 -1.20 0.52 0.00 0.00 175.17 175.86 2dd5 n SER 181 N 5.09 4.94 -0.51 -0.34 7.64 0.50 -4.73 113.62 126.20 2dd5 n SER 181 Ca -0.12 -2.92 0.11 0.00 1.01 0.00 0.00 58.87 56.95 2dd5 n SER 181 Cb 0.47 -1.75 0.00 0.00 -1.01 0.00 0.00 64.21 61.92 2dd5 n SER 181 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2dd5 n ASN 182 N 8.38 2.05 0.00 6.43 6.94 -1.26 -4.71 115.26 133.10 2dd5 n ASN 182 Ca 0.49 -1.53 0.00 0.00 -0.02 0.00 0.00 54.58 53.52 2dd5 n ASN 182 Cb 0.46 0.45 0.00 0.00 -2.36 0.00 0.00 39.78 38.33 2dd5 n ASN 182 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dd5 n GLN 183 N 0.04 0.25 0.00 -3.83 1.13 -1.26 -5.04 117.38 108.67 2dd5 n GLN 183 Ca 0.09 0.00 0.13 0.00 -1.94 0.00 0.00 57.00 55.28 2dd5 n GLN 183 Cb 0.47 0.00 0.29 0.00 0.11 0.00 0.00 30.24 31.10 2dd5 n GLN 183 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2dd5 n LYS 184 N 0.00 1.86 -3.28 -1.09 5.02 -1.26 -4.92 118.16 114.50 2dd5 n LYS 184 Ca 0.00 -1.36 -0.37 0.00 -2.02 0.00 0.00 58.31 54.56 2dd5 n LYS 184 Cb 0.00 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.48 2dd5 n LYS 184 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2dd5 s THR 185 N -2.07 4.75 0.07 -0.18 2.01 -1.26 -4.19 115.64 114.77 2dd5 s THR 185 Ca 0.31 1.10 0.08 0.00 0.31 0.00 0.00 61.69 63.50 2dd5 s THR 185 Cb 0.20 -3.84 -0.03 0.00 0.01 0.00 0.00 72.50 68.84 2dd5 s THR 185 CO 0.35 0.41 -0.23 -0.13 -0.69 0.00 0.00 174.62 174.33 2dd5 s ARG 186 N -1.50 1.41 0.14 4.92 1.81 -0.95 -4.74 118.95 120.04 2dd5 s ARG 186 Ca 0.34 -1.09 0.09 0.00 -1.72 0.00 0.00 55.73 53.34 2dd5 s ARG 186 Cb -0.18 -1.63 -0.04 0.00 -0.45 0.00 0.00 34.95 32.65 2dd5 s ARG 186 CO 0.19 0.40 -0.21 0.71 -0.68 0.00 0.00 175.30 175.72 2dd5 s TYR 187 N -0.93 1.95 0.03 -0.53 2.02 -1.26 -0.68 117.35 117.94 2dd5 s TYR 187 Ca 0.09 -0.42 0.03 0.00 -0.37 0.00 0.00 57.07 56.40 2dd5 s TYR 187 Cb -0.10 -1.01 -0.02 0.00 -0.40 0.00 0.00 41.96 40.44 2dd5 s TYR 187 CO 0.03 0.31 -0.10 0.96 -1.57 0.00 0.00 175.55 175.19 2dd5 s ILE 188 N -1.55 0.73 -0.18 2.71 -4.36 -1.09 -4.54 121.20 112.91 2dd5 s ILE 188 Ca 0.13 -0.78 -0.12 0.00 -0.26 0.00 0.00 60.65 59.62 2dd5 s ILE 188 Cb -0.08 -0.69 -0.05 0.00 1.25 0.00 0.00 42.46 42.89 2dd5 s ILE 188 CO 0.06 -0.07 0.23 -0.69 0.24 0.00 0.00 174.94 174.72 2dd5 s VAL 189 N -0.77 5.34 -0.59 8.37 1.01 0.53 -1.62 120.40 132.66 2dd5 s VAL 189 Ca -0.02 0.40 -0.16 0.00 0.00 0.00 0.00 61.98 62.21 2dd5 s VAL 189 Cb -0.07 -3.57 0.14 0.00 0.00 0.00 0.00 36.38 32.88 2dd5 s VAL 189 CO 0.00 0.39 0.57 -0.32 0.00 0.00 0.00 175.10 175.74 2dd5 s MET 190 N 0.56 3.08 0.75 2.72 1.75 0.11 -4.39 119.30 123.87 2dd5 s MET 190 Ca 0.13 -1.76 -0.11 0.00 -1.25 0.00 0.00 55.69 52.70 2dd5 s MET 190 Cb -0.12 -4.32 0.04 0.00 2.84 0.00 0.00 34.83 33.26 2dd5 s MET 190 CO 0.02 -1.36 1.08 -1.25 -0.65 0.00 0.00 175.02 172.86 2dd5 s PRO 191 N 1.55 2.50 0.38 4.11 0.04 -1.26 -0.78 135.00 141.55 2dd5 s PRO 191 Ca 0.06 0.96 -0.26 0.00 0.04 0.00 0.00 61.00 61.80 2dd5 s PRO 191 Cb -0.26 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 2dd5 s PRO 191 CO 0.02 -1.41 1.18 0.14 0.04 0.00 0.00 177.00 176.97 2dd5 s VAL 192 N -3.01 3.11 0.10 -0.36 -7.23 -1.26 -4.80 120.40 106.94 2dd5 s VAL 192 Ca 0.60 0.97 -0.31 0.00 -1.81 0.00 0.00 61.98 61.43 2dd5 s VAL 192 Cb -0.15 -3.56 -0.09 0.00 0.56 0.00 0.00 36.38 33.14 2dd5 s VAL 192 CO 0.55 0.12 1.72 -0.60 -0.31 0.00 0.00 175.10 176.58 2dd5 s ARG 193 N -2.17 4.17 0.74 4.82 3.52 -1.26 -4.84 118.95 123.94 2dd5 s ARG 193 Ca 0.55 2.44 -0.12 0.00 -0.13 0.00 0.00 55.73 58.47 2dd5 s ARG 193 Cb -0.32 -3.57 0.04 0.00 -1.56 0.00 0.00 34.95 29.54 2dd5 s ARG 193 CO 0.41 -0.77 1.09 -1.25 -0.81 0.00 0.00 175.30 173.97 2dd5 s PRO 194 N 2.58 2.47 0.64 5.12 0.04 -1.26 -5.02 135.00 139.57 2dd5 s PRO 194 Ca 0.76 1.18 -0.15 0.00 0.04 0.00 0.00 61.00 62.84 2dd5 s PRO 194 Cb -0.42 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.19 2dd5 s PRO 194 CO 0.34 -1.48 1.09 -2.00 0.04 0.00 0.00 177.00 174.99 2dd5 s GLU 195 N -4.75 2.93 -0.10 4.56 2.56 -1.26 -3.86 118.70 118.79 2dd5 s GLU 195 Ca 0.62 1.32 0.00 0.00 0.00 0.00 0.00 54.97 56.91 2dd5 s GLU 195 Cb -0.17 -1.97 0.00 0.00 2.00 0.00 0.00 34.13 33.98 2dd5 s GLU 195 CO 0.53 -1.14 0.00 0.41 -0.56 0.00 0.00 175.26 174.50 2dd5 n GLY 196 N -0.71 0.39 0.04 -1.50 0.00 -1.26 -4.74 105.19 97.42 2dd5 n GLY 196 Ca 0.10 -0.94 0.06 0.00 0.00 0.00 0.00 46.02 45.23 2dd5 n GLY 196 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dd5 n THR 197 N -3.49 1.54 -1.67 2.61 -2.24 -1.25 -4.95 114.28 104.83 2dd5 n THR 197 Ca -0.01 -1.77 -0.49 0.00 -2.27 0.00 0.00 64.05 59.51 2dd5 n THR 197 Cb 0.28 0.05 -0.05 0.00 -2.10 0.00 0.00 70.33 68.51 2dd5 n THR 197 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dd5 n ASP 198 N -1.07 3.00 0.00 3.42 5.75 -1.26 -1.52 116.55 124.87 2dd5 n ASP 198 Ca 0.10 1.04 0.00 0.00 -0.01 0.00 0.00 54.79 55.92 2dd5 n ASP 198 Cb 0.49 -1.34 0.00 0.00 -1.03 0.00 0.00 41.12 39.24 2dd5 n ASP 198 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dd5 n GLY 199 N 3.83 0.80 3.76 6.12 0.00 -1.26 -5.01 105.19 113.43 2dd5 n GLY 199 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2dd5 n GLY 199 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dd5 s TRP 200 N -3.29 2.51 0.81 1.61 0.52 -0.57 -5.02 118.94 115.51 2dd5 s TRP 200 Ca 0.00 1.44 -0.11 0.00 0.02 0.00 0.00 56.10 57.45 2dd5 s TRP 200 Cb 0.00 -3.63 0.10 0.00 -1.15 0.00 0.00 33.47 28.79 2dd5 s TRP 200 CO 0.00 -2.35 1.16 0.95 0.02 0.00 0.00 176.95 176.73 2dd5 s THR 201 N -1.41 2.07 0.16 2.01 -4.23 -1.26 -4.85 115.64 108.13 2dd5 s THR 201 Ca 0.69 -0.09 -0.16 0.00 -1.18 0.00 0.00 61.69 60.95 2dd5 s THR 201 Cb -0.36 -2.98 0.02 0.00 1.34 0.00 0.00 72.50 70.52 2dd5 s THR 201 CO 0.42 0.00 1.77 -0.08 -0.54 0.00 0.00 174.62 176.19 2dd5 h GLU 202 N -1.05 0.36 -0.70 3.99 4.81 -1.95 -1.73 114.58 118.31 2dd5 h GLU 202 Ca -0.45 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.75 2dd5 h GLU 202 Cb 1.31 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.57 2dd5 h GLU 202 CO 0.58 0.24 0.39 -0.44 -0.73 0.00 0.00 179.01 179.05 2dd5 h ASP 203 N 0.37 0.87 -0.41 1.04 3.32 -1.98 -0.05 116.42 119.58 2dd5 h ASP 203 Ca 0.16 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 2dd5 h ASP 203 Cb 0.08 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2dd5 h ASP 203 CO -0.12 0.71 0.24 1.56 -1.72 0.00 0.00 179.24 179.91 2dd5 h GLN 204 N 0.96 0.56 -0.22 3.56 4.20 -1.84 -1.54 115.11 120.79 2dd5 h GLN 204 Ca 0.25 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.87 2dd5 h GLN 204 Cb 0.03 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 2dd5 h GLN 204 CO -0.04 0.42 -0.01 -0.07 -0.67 0.00 0.00 178.83 178.46 2dd5 h LEU 205 N 0.54 0.39 -1.86 1.46 3.38 -1.09 -3.01 115.31 115.12 2dd5 h LEU 205 Ca 0.15 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2dd5 h LEU 205 Cb 0.01 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2dd5 h LEU 205 CO -0.03 0.62 -0.02 0.00 0.09 0.00 0.00 178.44 179.11 2dd5 h ALA 206 N 0.78 1.89 0.00 1.53 0.00 -0.91 -2.56 119.26 119.99 2dd5 h ALA 206 Ca 0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2dd5 h ALA 206 Cb 0.43 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2dd5 h ALA 206 CO 0.01 0.09 -0.11 1.49 0.00 0.00 0.00 179.25 180.73 2dd5 h GLU 207 N 0.06 0.00 -0.09 0.00 4.81 -1.13 -2.32 114.58 115.91 2dd5 h GLU 207 Ca 0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2dd5 h GLU 207 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 2dd5 h GLU 207 CO 0.00 0.11 0.00 0.44 -0.73 0.00 0.00 179.01 178.83 2dd5 n ILE 208 N -4.24 0.09 -3.17 2.32 -5.35 -0.97 -4.48 119.36 103.57 2dd5 n ILE 208 Ca -0.03 -0.41 -0.45 0.00 -0.27 0.00 0.00 62.75 61.59 2dd5 n ILE 208 Cb 0.19 0.89 -0.02 0.00 -1.74 0.00 0.00 39.64 38.96 2dd5 n ILE 208 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2dd5 s VAL 209 N -1.91 5.33 0.83 7.28 1.01 -0.87 -4.21 120.40 127.86 2dd5 s VAL 209 Ca 0.34 -2.32 -0.12 0.00 0.00 0.00 0.00 61.98 59.88 2dd5 s VAL 209 Cb 0.20 -4.62 0.09 0.00 0.00 0.00 0.00 36.38 32.05 2dd5 s VAL 209 CO 0.31 -1.25 1.19 0.42 0.00 0.00 0.00 175.10 175.77 2dd5 s THR 210 N 0.92 2.00 0.22 3.92 -4.23 -1.26 -4.67 115.64 112.53 2dd5 s THR 210 Ca 0.26 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.69 2dd5 s THR 210 Cb -0.08 -2.99 0.16 0.00 1.34 0.00 0.00 72.50 70.93 2dd5 s THR 210 CO -0.08 0.00 1.74 -0.09 -0.54 0.00 0.00 174.62 175.65 2dd5 h ARG 211 N -1.13 0.42 -0.17 3.99 2.43 -1.96 -0.82 114.38 117.16 2dd5 h ARG 211 Ca -0.46 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 58.67 2dd5 h ARG 211 Cb 1.32 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 2dd5 h ARG 211 CO 0.63 0.28 0.04 -0.44 -1.51 0.00 0.00 179.97 178.97 2dd5 h ASP 212 N 0.44 0.21 0.09 -3.80 5.19 -1.93 -1.64 116.42 114.97 2dd5 h ASP 212 Ca 0.33 -0.02 -0.14 0.00 -0.62 0.00 0.00 57.03 56.59 2dd5 h ASP 212 Cb 0.42 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 39.87 2dd5 h ASP 212 CO -0.32 0.22 -0.48 0.00 -3.12 0.00 0.00 179.24 175.54 2dd5 h LEU 214 N 0.36 0.00 0.08 0.00 3.38 -0.79 -2.99 115.31 115.36 2dd5 h LEU 214 Ca 0.02 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.66 2dd5 h LEU 214 Cb 0.98 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.70 2dd5 h LEU 214 CO 0.09 0.02 -1.81 0.40 0.09 0.00 0.00 178.44 177.23 2dd5 h ILE 215 N 0.00 0.81 0.00 1.22 2.04 -1.23 0.15 117.51 120.50 2dd5 h ILE 215 Ca -0.00 -2.55 0.00 0.00 1.00 0.00 0.00 64.86 63.31 2dd5 h ILE 215 Cb 0.75 2.53 0.00 0.00 -0.74 0.00 0.00 36.82 39.36 2dd5 h ILE 215 CO 0.00 0.75 0.00 0.61 0.00 0.00 0.00 178.15 179.51 2dd5 n GLY 216 N 1.78 0.90 0.24 5.37 0.00 -0.32 -0.81 105.19 112.36 2dd5 n GLY 216 Ca -0.24 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.92 2dd5 n GLY 216 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dd5 n VAL 217 N -0.78 0.00 -3.79 1.61 0.24 -0.88 -4.63 118.33 110.11 2dd5 n VAL 217 Ca 0.00 -0.13 -0.10 0.00 -2.04 0.00 0.00 64.34 62.08 2dd5 n VAL 217 Cb 0.00 0.13 -0.07 0.00 -1.47 0.00 0.00 33.84 32.43 2dd5 n VAL 217 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dd5 s ALA 218 N -2.24 -0.46 0.08 2.33 0.00 -1.13 -4.63 121.76 115.70 2dd5 s ALA 218 Ca 0.34 -0.39 0.09 0.00 0.00 0.00 0.00 51.96 52.00 2dd5 s ALA 218 Cb 0.21 0.50 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 2dd5 s ALA 218 CO 0.42 -0.52 -0.22 0.14 0.00 0.00 0.00 175.76 175.58 2dd5 s VAL 219 N -3.61 2.55 0.45 0.00 -7.23 -1.26 -3.96 120.40 107.33 2dd5 s VAL 219 Ca 0.03 -1.43 -0.25 0.00 -1.81 0.00 0.00 61.98 58.52 2dd5 s VAL 219 Cb 0.03 -2.09 -0.08 0.00 0.56 0.00 0.00 36.38 34.80 2dd5 s VAL 219 CO -0.10 0.23 1.35 -2.16 -0.31 0.00 0.00 175.10 174.11 2dd5 s PRO 220 N -1.70 3.71 -0.04 4.82 0.04 -1.26 -4.97 135.00 135.60 2dd5 s PRO 220 Ca 0.15 2.23 -0.03 0.00 0.04 0.00 0.00 61.00 63.39 2dd5 s PRO 220 Cb -0.10 -2.61 0.02 0.00 0.04 0.00 0.00 34.50 31.85 2dd5 s PRO 220 CO 0.06 -0.73 0.10 0.15 0.04 0.00 0.00 177.00 176.62 2dd5 s LYS 221 N -2.46 0.09 0.23 4.56 1.02 -1.26 -4.68 119.74 117.23 2dd5 s LYS 221 Ca 0.61 0.20 -0.32 0.00 0.02 0.00 0.00 55.97 56.49 2dd5 s LYS 221 Cb -0.40 -0.04 -0.13 0.00 -0.52 0.00 0.00 37.83 36.75 2dd5 s LYS 221 CO 0.50 -0.07 1.57 -2.30 -0.92 0.00 0.00 175.35 174.13 2dd5 n PRO 222 N 3.46 2.40 0.00 -1.68 -0.02 -1.26 -1.39 135.00 136.52 2dd5 n PRO 222 Ca -0.18 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2dd5 n PRO 222 Cb 0.56 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 2dd5 n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dd5 n GLY 223 N 2.89 1.97 3.33 -1.23 0.00 -1.26 -5.00 105.19 105.89 2dd5 n GLY 223 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2dd5 n GLY 223 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dd5 s ILE 224 N -2.33 4.62 -0.50 -0.61 -1.09 -0.48 -4.91 121.20 115.90 2dd5 s ILE 224 Ca 0.00 -1.17 0.08 0.00 -2.23 0.00 0.00 60.65 57.33 2dd5 s ILE 224 Cb 0.00 -3.75 0.21 0.00 -1.58 0.00 0.00 42.46 37.34 2dd5 s ILE 224 CO 0.00 -0.46 1.17 0.35 -1.23 0.00 0.00 174.94 174.76 2dd5 n THR 225 N 5.02 1.14 -3.95 2.92 -2.24 -1.26 -4.41 114.28 111.50 2dd5 n THR 225 Ca -0.11 -1.12 -0.09 0.00 -2.27 0.00 0.00 64.05 60.45 2dd5 n THR 225 Cb 0.44 0.41 -0.10 0.00 -2.10 0.00 0.00 70.33 68.98 2dd5 n THR 225 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2dd5 s VAL 226 N -1.22 0.12 0.63 2.28 -7.23 -1.26 -4.91 120.40 108.81 2dd5 s VAL 226 Ca 0.17 -0.98 -0.19 0.00 -1.81 0.00 0.00 61.98 59.16 2dd5 s VAL 226 Cb 0.10 -0.56 -0.02 0.00 0.56 0.00 0.00 36.38 36.46 2dd5 s VAL 226 CO 0.09 -0.54 1.26 0.59 -0.31 0.00 0.00 175.10 176.19 2dd5 n ASN 227 N 1.23 2.00 -4.61 4.85 3.02 -1.26 -4.88 115.26 115.61 2dd5 n ASN 227 Ca -0.22 0.85 -0.42 0.00 -0.03 0.00 0.00 54.58 54.77 2dd5 n ASN 227 Cb 0.56 -1.54 0.01 0.00 -0.61 0.00 0.00 39.78 38.20 2dd5 n ASN 227 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dd5 n ALA 228 N -1.77 0.17 -2.25 5.41 0.00 -1.26 -4.88 120.51 115.93 2dd5 n ALA 228 Ca 0.15 0.24 -0.41 0.00 0.00 0.00 0.00 53.44 53.42 2dd5 n ALA 228 Cb 0.47 -2.08 -0.03 0.00 0.00 0.00 0.00 19.45 17.81 2dd5 n ALA 228 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dd5 s LYS 229 N -1.98 4.51 0.06 0.00 2.20 -1.26 -5.03 119.74 118.25 2dd5 s LYS 229 Ca 0.63 1.74 -0.04 0.00 -0.36 0.00 0.00 55.97 57.93 2dd5 s LYS 229 Cb -0.57 -3.31 -0.02 0.00 -1.51 0.00 0.00 37.83 32.42 2dd5 s LYS 229 CO 0.57 -0.09 0.06 -0.98 -0.36 0.00 0.00 175.35 174.55 2dd5 s ARG 230 N 0.33 0.70 0.45 4.03 1.70 -1.26 -5.13 118.95 119.77 2dd5 s ARG 230 Ca 0.54 -1.10 -0.23 0.00 -0.47 0.00 0.00 55.73 54.47 2dd5 s ARG 230 Cb -0.29 0.26 -0.11 0.00 -0.57 0.00 0.00 34.95 34.24 2dd5 s ARG 230 CO 0.32 -0.17 0.78 -2.30 -1.08 0.00 0.00 175.30 172.85 2dd5 n PRO 231 N 0.07 0.93 -4.02 3.89 -0.02 -1.26 -4.98 135.00 129.61 2dd5 n PRO 231 Ca -0.15 0.34 -0.31 0.00 -2.02 0.00 0.00 63.50 61.36 2dd5 n PRO 231 Cb 0.61 -1.81 -0.16 0.00 -0.02 0.00 0.00 33.50 32.13 2dd5 n PRO 231 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2dd5 s VAL 232 N -1.40 1.77 -0.16 -1.45 1.01 -1.26 -5.09 120.40 113.82 2dd5 s VAL 232 Ca 0.65 -1.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.22 2dd5 s VAL 232 Cb -0.56 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.98 2dd5 s VAL 232 CO 0.56 0.17 1.09 -0.22 0.00 0.00 0.00 175.10 176.69 2dd5 s LEU 233 N 1.33 4.18 0.37 3.92 2.96 -1.26 -5.01 118.68 125.17 2dd5 s LEU 233 Ca -0.02 1.53 -0.24 0.00 -0.22 0.00 0.00 54.13 55.18 2dd5 s LEU 233 Cb -0.17 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 42.88 2dd5 s LEU 233 CO -0.08 -0.61 0.99 -0.54 -1.32 0.00 0.00 176.35 174.79 2dd5 s LYS 234 N 2.76 4.35 0.41 1.98 1.02 -1.26 -5.06 119.74 123.96 2dd5 s LYS 234 Ca 0.49 1.37 -0.07 0.00 0.02 0.00 0.00 55.97 57.78 2dd5 s LYS 234 Cb -0.18 -2.59 -0.05 0.00 -0.52 0.00 0.00 37.83 34.49 2dd5 s LYS 234 CO 0.13 0.05 0.73 0.00 -0.92 0.00 0.00 175.35 175.34 2dd5 s ALA 235 N -1.73 3.44 0.11 5.17 0.00 -1.26 -5.00 121.76 122.49 2dd5 s ALA 235 Ca 0.55 -0.43 -0.15 0.00 0.00 0.00 0.00 51.96 51.93 2dd5 s ALA 235 Cb -0.18 -2.55 -0.06 0.00 0.00 0.00 0.00 23.12 20.32 2dd5 s ALA 235 CO 0.24 -0.11 1.48 -0.97 0.00 0.00 0.00 175.76 176.39 2dd5 h ASN 236 N 0.86 0.70 -2.37 0.00 -1.24 -2.04 -3.37 115.58 108.12 2dd5 h ASN 236 Ca -0.47 -0.40 -0.59 0.00 0.71 0.00 0.00 56.30 55.55 2dd5 h ASN 236 Cb 1.20 -0.19 -0.39 0.00 0.73 0.00 0.00 38.32 39.67 2dd5 h ASN 236 CO 0.63 0.95 -0.95 -1.14 -1.29 0.00 0.00 177.43 175.63 2dd5 n ARG 237 N -4.36 0.46 -1.51 6.67 0.63 -1.26 -5.14 116.66 112.15 2dd5 n ARG 237 Ca -0.03 -3.33 -0.36 0.00 -0.92 0.00 0.00 57.85 53.21 2dd5 n ARG 237 Cb 0.38 -1.67 0.09 0.00 0.45 0.00 0.00 32.46 31.71 2dd5 n ARG 237 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2dd5 s PRO 238 N -0.32 2.22 0.00 -0.14 0.04 -1.26 -5.26 135.00 130.28 2dd5 s PRO 238 Ca 0.33 1.94 0.18 0.00 0.04 0.00 0.00 61.00 63.49 2dd5 s PRO 238 Cb 0.05 -1.82 1.06 0.00 0.04 0.00 0.00 34.50 33.83 2dd5 s PRO 238 CO -0.18 -1.82 1.46 0.28 0.04 0.00 0.00 177.00 176.77