#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dd5 s SER 25 N 0.00 4.89 0.47 -1.34 1.04 -1.26 -4.94 113.70 112.56 2dd5 s SER 25 Ca 0.00 0.23 0.19 0.00 0.48 0.00 0.00 55.95 56.85 2dd5 s SER 25 Cb 0.00 -0.92 1.15 0.00 0.10 0.00 0.00 66.02 66.34 2dd5 s SER 25 CO 0.00 -1.50 2.01 0.44 0.98 0.00 0.00 173.24 175.17 2dd5 h ASP 26 N -0.40 0.00 -0.33 7.02 3.32 -2.05 -1.93 116.42 122.05 2dd5 h ASP 26 Ca -0.43 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.52 2dd5 h ASP 26 Cb 1.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.85 2dd5 h ASP 26 CO 0.55 0.18 -0.19 -0.26 -1.72 0.00 0.00 179.24 177.80 2dd5 h PHE 27 N 0.00 0.83 -0.28 4.55 0.04 -1.99 -1.88 116.94 118.22 2dd5 h PHE 27 Ca -0.00 -0.22 -0.12 0.00 2.80 0.00 0.00 57.97 60.43 2dd5 h PHE 27 Cb 0.36 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.31 2dd5 h PHE 27 CO 0.00 0.94 -0.33 0.93 -0.60 0.00 0.00 178.31 179.25 2dd5 h GLU 28 N 0.48 0.59 -0.01 1.51 5.08 -1.83 0.41 114.58 120.81 2dd5 h GLU 28 Ca 0.07 -0.27 -0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2dd5 h GLU 28 Cb 0.74 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 2dd5 h GLU 28 CO 0.06 0.84 0.01 0.82 -1.00 0.00 0.00 179.01 179.73 2dd5 h ILE 29 N 0.50 1.06 -0.21 3.13 1.08 -1.26 -2.51 117.51 119.30 2dd5 h ILE 29 Ca 0.06 -0.16 -0.12 0.00 -0.39 0.00 0.00 64.86 64.25 2dd5 h ILE 29 Cb 0.81 1.15 -0.01 0.00 -3.07 0.00 0.00 36.82 35.69 2dd5 h ILE 29 CO 0.07 0.04 -0.37 0.25 -0.69 0.00 0.00 178.15 177.46 2dd5 h LEU 30 N -0.05 0.47 -0.49 1.44 5.85 -1.20 -2.67 115.31 118.66 2dd5 h LEU 30 Ca 0.00 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 2dd5 h LEU 30 Cb 0.07 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 2dd5 h LEU 30 CO -0.00 0.80 0.25 -0.08 -0.34 0.00 0.00 178.44 179.07 2dd5 h GLU 31 N 0.38 0.69 -0.59 1.25 4.22 -0.75 -0.42 114.58 119.35 2dd5 h GLU 31 Ca 0.04 -0.09 -0.09 0.00 0.08 0.00 0.00 59.36 59.30 2dd5 h GLU 31 Cb 0.82 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 2dd5 h GLU 31 CO 0.07 0.56 0.01 0.52 -2.18 0.00 0.00 179.01 177.98 2dd5 h MET 32 N 0.64 1.04 -0.13 1.92 2.86 -1.41 -0.96 114.93 118.90 2dd5 h MET 32 Ca 0.17 -0.33 0.01 0.00 -2.06 0.00 0.00 59.70 57.50 2dd5 h MET 32 Cb 0.08 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 2dd5 h MET 32 CO -0.03 1.02 0.03 0.00 1.06 0.00 0.00 176.91 179.00 2dd5 h ALA 33 N 0.98 0.14 -0.21 6.32 0.00 -1.13 -0.02 119.26 125.34 2dd5 h ALA 33 Ca 0.17 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2dd5 h ALA 33 Cb 0.55 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2dd5 h ALA 33 CO 0.03 -0.42 0.07 0.28 0.00 0.00 0.00 179.25 179.21 2dd5 h VAL 34 N 0.09 1.19 -0.17 0.00 2.07 -0.95 -1.50 116.25 116.97 2dd5 h VAL 34 Ca 0.06 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 2dd5 h VAL 34 Cb 0.04 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2dd5 h VAL 34 CO -0.07 0.19 0.06 -0.09 0.02 0.00 0.00 177.57 177.69 2dd5 h ARG 35 N 0.17 0.26 -0.59 1.57 2.43 -1.04 -0.97 114.38 116.22 2dd5 h ARG 35 Ca 0.07 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.13 2dd5 h ARG 35 Cb 0.23 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 2dd5 h ARG 35 CO -0.00 0.35 0.13 0.93 -1.51 0.00 0.00 179.97 179.86 2dd5 h GLU 36 N 0.12 0.92 -0.06 0.20 5.08 -1.01 -2.12 114.58 117.70 2dd5 h GLU 36 Ca 0.06 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2dd5 h GLU 36 Cb 0.19 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2dd5 h GLU 36 CO -0.00 0.83 0.02 -0.07 -1.00 0.00 0.00 179.01 178.79 2dd5 h LEU 37 N 0.88 0.09 -1.00 1.33 4.07 -1.13 0.44 115.31 119.99 2dd5 h LEU 37 Ca 0.19 -0.20 0.05 0.00 0.08 0.00 0.00 57.88 58.00 2dd5 h LEU 37 Cb 0.34 -0.02 -0.06 0.00 1.08 0.00 0.00 40.66 41.99 2dd5 h LEU 37 CO 0.00 0.26 0.65 0.00 -1.08 0.00 0.00 178.44 178.27 2dd5 h ALA 38 N 0.83 1.36 -0.19 1.53 0.00 -1.02 -0.92 119.26 120.86 2dd5 h ALA 38 Ca 0.02 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 2dd5 h ALA 38 Cb 0.20 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2dd5 h ALA 38 CO -0.00 0.49 -0.57 0.82 0.00 0.00 0.00 179.25 179.99 2dd5 h ILE 39 N 1.22 1.31 -0.94 0.00 2.04 -1.25 0.11 117.51 119.99 2dd5 h ILE 39 Ca 0.42 -1.79 0.04 0.00 1.00 0.00 0.00 64.86 64.52 2dd5 h ILE 39 Cb 0.09 1.91 -0.06 0.00 -0.74 0.00 0.00 36.82 38.02 2dd5 h ILE 39 CO -0.15 0.56 0.61 -0.33 0.00 0.00 0.00 178.15 178.85 2dd5 h GLU 40 N 0.43 1.15 -0.11 2.37 5.08 -0.38 -1.13 114.58 122.00 2dd5 h GLU 40 Ca -0.02 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2dd5 h GLU 40 Cb 1.19 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2dd5 h GLU 40 CO 0.12 0.76 0.00 1.63 -1.00 0.00 0.00 179.01 180.52 2dd5 n LYS 41 N -4.49 1.36 -2.18 2.33 4.76 -0.40 -4.91 118.16 114.63 2dd5 n LYS 41 Ca 0.12 -0.55 -0.15 0.00 -2.87 0.00 0.00 58.31 54.86 2dd5 n LYS 41 Cb 0.09 -1.26 -0.01 0.00 -1.84 0.00 0.00 35.03 32.01 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 0.88 -0.03 0.20 0.72 0.00 -0.43 -4.90 105.19 101.63 2dd5 n GLY 42 Ca 0.11 -0.25 -0.14 0.00 0.00 0.00 0.00 46.02 45.74 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 0.73 -7.05 0.99 3.38 -1.01 -3.47 115.31 108.89 2dd5 h LEU 43 Ca -0.36 -0.49 -0.03 0.00 0.09 0.00 0.00 57.88 57.10 2dd5 h LEU 43 Cb 1.23 -0.22 -0.13 0.00 0.09 0.00 0.00 40.66 41.64 2dd5 h LEU 43 CO 0.43 1.26 0.17 0.72 0.09 0.00 0.00 178.44 181.12 2dd5 s PHE 44 N -3.65 -0.52 0.38 1.13 -0.12 -1.23 -5.05 117.98 108.92 2dd5 s PHE 44 Ca -0.08 0.39 0.02 0.00 -0.05 0.00 0.00 56.93 57.21 2dd5 s PHE 44 Cb 0.09 0.50 -0.02 0.00 -0.63 0.00 0.00 43.02 42.97 2dd5 s PHE 44 CO 0.88 -0.80 0.57 -1.54 -0.05 0.00 0.00 175.22 174.28 2dd5 s SER 45 N -2.53 6.07 0.37 1.98 1.04 -1.26 -3.99 113.70 115.38 2dd5 s SER 45 Ca -0.01 0.26 0.05 0.00 0.48 0.00 0.00 55.95 56.73 2dd5 s SER 45 Cb -0.01 -1.70 0.74 0.00 0.10 0.00 0.00 66.02 65.15 2dd5 s SER 45 CO -0.10 -0.46 2.00 0.00 0.98 0.00 0.00 173.24 175.66 2dd5 h ALA 46 N 0.67 1.67 -0.45 5.32 0.00 -1.97 -1.18 119.26 123.31 2dd5 h ALA 46 Ca -0.48 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 2dd5 h ALA 46 Cb 1.24 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2dd5 h ALA 46 CO 0.58 0.26 0.21 1.49 0.00 0.00 0.00 179.25 181.79 2dd5 h GLU 47 N 0.74 0.66 -0.56 0.00 4.57 -1.99 -1.43 114.58 116.57 2dd5 h GLU 47 Ca 0.25 -0.11 0.05 0.00 -1.18 0.00 0.00 59.36 58.38 2dd5 h GLU 47 Cb 0.09 -0.12 -0.05 0.00 -0.16 0.00 0.00 28.75 28.52 2dd5 h GLU 47 CO -0.07 0.58 0.29 -0.44 -1.18 0.00 0.00 179.01 178.19 2dd5 h ASP 48 N 0.59 0.41 -0.32 1.04 3.32 -1.61 0.15 116.42 119.99 2dd5 h ASP 48 Ca 0.15 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.23 2dd5 h ASP 48 Cb 0.14 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 2dd5 h ASP 48 CO -0.02 0.27 0.18 -0.74 -1.72 0.00 0.00 179.24 177.22 2dd5 h HIS 49 N 0.55 0.44 -0.69 4.55 2.76 -1.07 0.03 115.15 121.71 2dd5 h HIS 49 Ca 0.25 -0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.36 2dd5 h HIS 49 Cb 0.17 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 28.96 2dd5 h HIS 49 CO -0.10 0.34 0.22 0.00 -1.30 0.00 0.00 177.93 177.09 2dd5 h ARG 50 N 0.40 1.07 -0.74 5.26 3.08 -0.80 -1.92 114.38 120.73 2dd5 h ARG 50 Ca 0.11 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2dd5 h ARG 50 Cb 0.04 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 2dd5 h ARG 50 CO -0.02 0.92 0.42 0.28 -1.07 0.00 0.00 179.97 180.50 2dd5 h VAL 51 N 1.01 1.22 -0.42 2.04 2.07 -0.34 -1.13 116.25 120.70 2dd5 h VAL 51 Ca 0.22 -0.54 -0.15 0.00 0.82 0.00 0.00 66.70 67.06 2dd5 h VAL 51 Cb 0.29 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2dd5 h VAL 51 CO -0.01 0.24 -0.32 -0.25 0.02 0.00 0.00 177.57 177.25 2dd5 h TRP 52 N 1.02 1.13 -0.45 1.57 2.91 -0.73 -1.58 115.95 119.81 2dd5 h TRP 52 Ca 0.26 -0.32 -0.05 0.00 1.13 0.00 0.00 58.89 59.92 2dd5 h TRP 52 Cb 0.02 -0.25 -0.02 0.00 -0.51 0.00 0.00 29.16 28.40 2dd5 h TRP 52 CO -0.00 1.14 0.07 0.87 -1.03 0.00 0.00 178.44 179.49 2dd5 h LYS 53 N 0.79 0.70 -0.19 2.65 1.57 -1.14 -0.47 116.57 120.48 2dd5 h LYS 53 Ca 0.08 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2dd5 h LYS 53 Cb 0.91 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.11 2dd5 h LYS 53 CO 0.08 0.67 0.07 -0.44 -0.57 0.00 0.00 179.45 179.26 2dd5 h ASP 54 N 0.67 0.27 -0.25 0.86 3.32 -0.97 -0.01 116.42 120.31 2dd5 h ASP 54 Ca 0.15 -0.19 0.03 0.00 0.02 0.00 0.00 57.03 57.04 2dd5 h ASP 54 Cb 0.31 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 2dd5 h ASP 54 CO 0.00 0.38 0.05 0.22 -1.72 0.00 0.00 179.24 178.18 2dd5 h TYR 55 N 0.14 0.08 -0.87 4.55 3.20 -0.87 -1.97 116.97 121.24 2dd5 h TYR 55 Ca 0.06 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.98 2dd5 h TYR 55 Cb 0.21 -0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.43 2dd5 h TYR 55 CO -0.00 0.02 0.57 0.28 -1.64 0.00 0.00 178.16 177.39 2dd5 h VAL 56 N 0.15 1.16 0.00 1.81 2.07 -0.91 -1.80 116.25 118.74 2dd5 h VAL 56 Ca 0.11 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 2dd5 h VAL 56 Cb 0.11 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 29.84 2dd5 h VAL 56 CO -0.15 0.20 -0.09 -0.74 0.02 0.00 0.00 177.57 176.81 2dd5 h HIS 57 N 1.11 0.00 0.00 1.57 -0.00 -0.24 -2.33 115.15 115.25 2dd5 h HIS 57 Ca 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.71 2dd5 h HIS 57 Cb -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.39 2dd5 h HIS 57 CO -0.00 0.09 0.00 1.79 -0.00 0.00 0.00 177.93 179.81 2dd5 h THR 58 N 0.00 0.00 -3.89 6.26 1.35 -0.90 -3.46 112.91 112.27 2dd5 h THR 58 Ca -0.00 -0.60 -0.51 0.00 -0.55 0.00 0.00 66.41 64.75 2dd5 h THR 58 Cb 0.17 1.59 0.04 0.00 -1.73 0.00 0.00 68.15 68.22 2dd5 h THR 58 CO 0.01 0.00 0.52 -0.76 -0.25 0.00 0.00 175.52 175.04 2dd5 s LEU 59 N -5.01 4.35 0.26 3.87 1.43 -0.88 -5.02 118.68 117.66 2dd5 s LEU 59 Ca 0.09 2.37 -0.20 0.00 -1.03 0.00 0.00 54.13 55.36 2dd5 s LEU 59 Cb 0.10 -3.84 0.06 0.00 0.03 0.00 0.00 46.19 42.55 2dd5 s LEU 59 CO 0.60 -0.47 0.93 -0.83 0.23 0.00 0.00 176.35 176.81 2dd5 s GLY 60 N -0.96 0.15 0.00 -3.19 0.00 -1.26 -4.74 107.32 97.32 2dd5 s GLY 60 Ca 0.52 -0.42 0.27 0.00 0.00 0.00 0.00 44.72 45.08 2dd5 s GLY 60 CO 0.41 1.06 1.64 -1.55 0.00 0.00 0.00 173.10 174.67 2dd5 n PRO 61 N -0.60 0.55 -0.07 2.90 -0.04 -0.94 -3.35 135.00 133.45 2dd5 n PRO 61 Ca -0.05 -0.27 -0.07 0.00 -0.04 0.00 0.00 63.50 63.06 2dd5 n PRO 61 Cb 0.60 -1.49 -0.01 0.00 -0.04 0.00 0.00 33.50 32.55 2dd5 n PRO 61 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2dd5 h LEU 62 N 0.66 -0.08 -0.93 1.53 5.85 -1.88 -1.89 115.31 118.57 2dd5 h LEU 62 Ca 0.00 0.06 0.14 0.00 0.84 0.00 0.00 57.88 58.92 2dd5 h LEU 62 Cb 0.46 0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.50 2dd5 h LEU 62 CO 0.00 -0.01 0.55 -0.65 -0.34 0.00 0.00 178.44 177.99 2dd5 h PRO 63 N 0.09 0.78 -0.57 5.25 0.11 -1.78 0.11 132.00 136.00 2dd5 h PRO 63 Ca 0.13 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.11 2dd5 h PRO 63 Cb 0.16 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 2dd5 h PRO 63 CO -0.20 0.52 0.03 0.00 -0.21 0.00 0.00 178.00 178.14 2dd5 h ALA 64 N 1.56 0.76 -0.55 -0.75 0.00 -1.31 -1.35 119.26 117.62 2dd5 h ALA 64 Ca 0.49 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2dd5 h ALA 64 Cb 0.62 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2dd5 h ALA 64 CO -0.32 0.57 0.19 0.00 0.00 0.00 0.00 179.25 179.69 2dd5 h ALA 65 N 0.98 0.72 -0.33 0.00 0.00 -0.40 -2.32 119.26 117.92 2dd5 h ALA 65 Ca 0.17 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2dd5 h ALA 65 Cb 0.50 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2dd5 h ALA 65 CO 0.02 0.37 0.00 0.00 0.00 0.00 0.00 179.25 179.64 2dd5 h ARG 66 N 0.76 0.50 -0.64 0.00 3.08 -0.63 -1.05 114.38 116.40 2dd5 h ARG 66 Ca 0.18 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 2dd5 h ARG 66 Cb 0.25 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 2dd5 h ARG 66 CO -0.01 0.53 0.14 1.25 -1.07 0.00 0.00 179.97 180.81 2dd5 h LEU 67 N 0.48 1.00 -0.35 3.04 6.46 -0.80 -0.45 115.31 124.70 2dd5 h LEU 67 Ca 0.11 -0.24 -0.09 0.00 -0.12 0.00 0.00 57.88 57.53 2dd5 h LEU 67 Cb 0.31 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.97 2dd5 h LEU 67 CO 0.01 0.99 -0.12 0.58 -0.62 0.00 0.00 178.44 179.27 2dd5 h VAL 68 N 0.97 1.28 0.00 1.05 2.07 -0.93 -1.89 116.25 118.80 2dd5 h VAL 68 Ca 0.20 -1.21 0.01 0.00 0.82 0.00 0.00 66.70 66.52 2dd5 h VAL 68 Cb 0.39 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 2dd5 h VAL 68 CO 0.01 0.40 -0.05 0.00 0.02 0.00 0.00 177.57 177.95 2dd5 h ALA 69 N 0.80 -0.05 -1.01 1.67 0.00 -0.98 -0.66 119.26 119.03 2dd5 h ALA 69 Ca 0.08 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.04 2dd5 h ALA 69 Cb 0.64 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.45 2dd5 h ALA 69 CO 0.04 -0.54 0.66 0.87 0.00 0.00 0.00 179.25 180.28 2dd5 h LYS 70 N -0.08 1.23 -0.35 0.00 1.57 -1.06 -1.77 116.57 116.11 2dd5 h LYS 70 Ca 0.02 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 2dd5 h LYS 70 Cb 0.11 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 2dd5 h LYS 70 CO -0.05 0.81 -0.09 0.00 -0.57 0.00 0.00 179.45 179.55 2dd5 h ALA 71 N 1.42 1.19 0.00 3.86 0.00 -0.85 0.17 119.26 125.04 2dd5 h ALA 71 Ca 0.40 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 2dd5 h ALA 71 Cb 0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2dd5 h ALA 71 CO -0.13 0.52 -0.30 -1.49 0.00 0.00 0.00 179.25 177.86 2dd5 h TRP 72 N 0.55 0.00 0.00 0.00 6.55 -0.25 -3.12 115.95 119.69 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 0.49 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.79 2dd5 h TRP 72 CO 0.02 0.30 -1.07 1.28 -1.05 0.00 0.00 178.44 177.91 2dd5 n LEU 73 N -4.06 0.77 -3.73 -4.49 4.77 -0.94 -4.83 117.00 104.49 2dd5 n LEU 73 Ca -0.02 -0.42 -0.30 0.00 -0.03 0.00 0.00 56.01 55.24 2dd5 n LEU 73 Cb 0.35 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.30 2dd5 n LEU 73 CO 0.37 0.19 -0.32 -0.62 -1.33 0.00 0.00 177.39 175.69 2dd5 s ASP 74 N -3.06 3.95 0.49 -1.43 -1.08 0.56 -5.00 116.67 111.10 2dd5 s ASP 74 Ca 0.05 -1.85 0.22 0.00 -0.52 0.00 0.00 52.55 50.45 2dd5 s ASP 74 Cb 0.14 -0.90 1.27 0.00 -1.46 0.00 0.00 42.92 41.98 2dd5 s ASP 74 CO 0.80 -0.38 1.97 -0.65 0.52 0.00 0.00 175.17 177.42 2dd5 h PRO 75 N 7.80 0.15 -0.23 4.34 0.11 -1.86 -0.90 132.00 141.40 2dd5 h PRO 75 Ca -0.10 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.89 2dd5 h PRO 75 Cb 1.00 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.07 2dd5 h PRO 75 CO 0.47 0.10 -0.27 1.49 -0.21 0.00 0.00 178.00 179.57 2dd5 h GLU 76 N 0.15 0.59 -0.54 1.05 4.22 -1.94 -2.49 114.58 115.62 2dd5 h GLU 76 Ca 0.30 -0.33 -0.07 0.00 0.08 0.00 0.00 59.36 59.34 2dd5 h GLU 76 Cb 0.96 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 2dd5 h GLU 76 CO -0.04 0.93 0.06 -0.92 -2.18 0.00 0.00 179.01 176.85 2dd5 h TYR 77 N 0.29 0.98 -0.81 0.92 3.20 -1.65 -2.43 116.97 117.47 2dd5 h TYR 77 Ca 0.03 -0.15 0.06 0.00 3.14 0.00 0.00 58.73 61.82 2dd5 h TYR 77 Cb 0.84 -0.26 -0.06 0.00 1.54 0.00 0.00 36.73 38.78 2dd5 h TYR 77 CO 0.08 0.88 0.49 -0.22 -1.64 0.00 0.00 178.16 177.75 2dd5 h LYS 78 N 0.80 0.87 -0.87 1.82 3.64 -1.17 0.20 116.57 121.86 2dd5 h LYS 78 Ca 0.16 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 2dd5 h LYS 78 Cb 0.45 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 2dd5 h LYS 78 CO 0.02 0.57 0.47 0.87 -2.27 0.00 0.00 179.45 179.11 2dd5 h LYS 79 N 0.89 1.21 -0.54 1.90 1.57 -1.13 -1.30 116.57 119.17 2dd5 h LYS 79 Ca 0.36 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.90 2dd5 h LYS 79 Cb 0.19 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 2dd5 h LYS 79 CO -0.18 0.89 -0.05 1.25 -0.57 0.00 0.00 179.45 180.79 2dd5 h LEU 80 N 1.22 0.98 -0.19 2.94 5.85 -0.70 -1.93 115.31 123.49 2dd5 h LEU 80 Ca 0.31 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.72 2dd5 h LEU 80 Cb 0.03 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 2dd5 h LEU 80 CO -0.05 1.08 0.05 0.00 -0.34 0.00 0.00 178.44 179.18 2dd5 h ILE 82 N 0.13 1.23 0.08 0.00 2.04 -1.16 -3.12 117.51 116.72 2dd5 h ILE 82 Ca 0.08 -1.06 -0.36 0.00 1.00 0.00 0.00 64.86 64.53 2dd5 h ILE 82 Cb 0.07 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 2dd5 h ILE 82 CO -0.10 0.34 -2.03 1.21 0.00 0.00 0.00 178.15 177.57 2dd5 n GLU 83 N -4.19 0.72 -3.33 2.37 4.07 -0.73 -4.74 120.64 114.81 2dd5 n GLU 83 Ca 0.00 0.24 -0.26 0.00 -0.06 0.00 0.00 57.16 57.08 2dd5 n GLU 83 Cb 0.34 -1.69 -0.09 0.00 -0.06 0.00 0.00 31.44 29.94 2dd5 n GLU 83 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2dd5 n ASP 84 N -3.34 -0.41 -0.36 4.31 -0.08 0.21 -5.00 116.55 111.89 2dd5 n ASP 84 Ca -0.31 -2.46 0.11 0.00 -1.51 0.00 0.00 54.79 50.62 2dd5 n ASP 84 Cb 1.05 -0.52 0.29 0.00 2.34 0.00 0.00 41.12 44.28 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 5.22 1.74 0.94 0.27 0.00 -1.56 -1.49 103.07 108.19 2dd5 h GLY 85 Ca 0.22 -0.39 0.02 0.00 0.00 0.00 0.00 47.33 47.18 2dd5 h GLY 85 CO 0.38 0.02 0.58 -2.08 0.00 0.00 0.00 176.54 175.44 2dd5 h VAL 86 N 0.85 1.18 -0.08 4.60 2.07 -1.90 0.08 116.25 123.06 2dd5 h VAL 86 Ca 0.55 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.64 2dd5 h VAL 86 Cb 0.75 -0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2dd5 h VAL 86 CO -0.34 0.21 -0.07 -0.08 0.02 0.00 0.00 177.57 177.31 2dd5 h GLU 87 N 1.15 0.19 -0.77 1.57 4.57 -1.66 -3.16 114.58 116.47 2dd5 h GLU 87 Ca 0.34 -0.10 0.05 0.00 -1.18 0.00 0.00 59.36 58.48 2dd5 h GLU 87 Cb -0.06 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.48 2dd5 h GLU 87 CO -0.10 0.61 0.51 0.00 -1.18 0.00 0.00 179.01 178.85 2dd5 h ALA 88 N 0.57 1.62 -0.42 2.92 0.00 -1.07 -1.95 119.26 120.94 2dd5 h ALA 88 Ca 0.01 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.98 2dd5 h ALA 88 Cb 0.58 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2dd5 h ALA 88 CO 0.02 0.28 0.29 1.03 0.00 0.00 0.00 179.25 180.86 2dd5 h SER 89 N 0.86 0.18 -0.51 0.00 0.87 -0.95 -1.09 113.55 112.93 2dd5 h SER 89 Ca 0.32 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.93 2dd5 h SER 89 Cb 0.18 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 2dd5 h SER 89 CO -0.11 0.12 0.34 0.11 -0.53 0.00 0.00 176.83 176.76 2dd5 h LYS 90 N 0.21 0.50 0.00 2.24 1.57 -1.33 -1.57 116.57 118.18 2dd5 h LYS 90 Ca 0.19 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2dd5 h LYS 90 Cb 0.49 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 2dd5 h LYS 90 CO -0.03 0.33 -0.04 0.00 -0.57 0.00 0.00 179.45 179.14 2dd5 h ALA 91 N 1.72 1.42 -0.46 3.86 0.00 -1.32 -1.82 119.26 122.66 2dd5 h ALA 91 Ca 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2dd5 h ALA 91 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2dd5 h ALA 91 CO -0.06 0.04 0.00 1.33 0.00 0.00 0.00 179.25 180.57 2dd5 n VAL 92 N -3.74 2.35 -0.91 0.00 0.24 -0.63 -4.95 118.33 110.70 2dd5 n VAL 92 Ca -0.03 -1.54 0.00 0.00 -2.04 0.00 0.00 64.34 60.74 2dd5 n VAL 92 Cb 0.13 -0.16 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 0.27 0.54 3.10 7.63 0.00 -0.68 -4.82 105.19 111.22 2dd5 n GLY 93 Ca 0.24 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 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 2.79 -0.49 1.61 1.01 -1.00 -5.01 120.40 117.31 2dd5 s VAL 94 Ca 0.00 -1.94 -0.17 0.00 0.00 0.00 0.00 61.98 59.87 2dd5 s VAL 94 Cb 0.00 -2.85 0.08 0.00 0.00 0.00 0.00 36.38 33.60 2dd5 s VAL 94 CO 0.00 -0.45 0.48 0.21 0.00 0.00 0.00 175.10 175.33 2dd5 s ASN 95 N 1.33 6.17 0.62 3.32 3.84 -1.26 -3.29 114.94 125.67 2dd5 s ASN 95 Ca 0.04 -1.28 0.28 0.00 0.21 0.00 0.00 52.86 52.11 2dd5 s ASN 95 Cb -0.21 -2.22 1.48 0.00 -0.55 0.00 0.00 41.25 39.75 2dd5 s ASN 95 CO -0.05 -0.75 1.87 -0.50 -2.79 0.00 0.00 177.10 174.88 2dd5 h TRP 96 N 8.85 0.00 0.02 0.43 4.06 -1.95 0.28 115.95 127.64 2dd5 h TRP 96 Ca -0.28 0.00 -0.34 0.00 2.06 0.00 0.00 58.89 60.33 2dd5 h TRP 96 Cb 1.10 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 29.22 2dd5 h TRP 96 CO 0.68 0.00 -1.86 0.28 -3.56 0.00 0.00 178.44 173.98 2dd5 n VAL 97 N -3.38 1.57 0.05 1.49 0.31 -1.26 -3.68 118.33 113.43 2dd5 n VAL 97 Ca 0.05 -0.27 0.11 0.00 -0.01 0.00 0.00 64.34 64.22 2dd5 n VAL 97 Cb 0.59 -1.90 -0.10 0.00 -0.91 0.00 0.00 33.84 31.53 2dd5 n VAL 97 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2dd5 n THR 98 N -4.15 0.25 -0.18 2.52 -2.24 -1.03 -1.99 114.28 107.47 2dd5 n THR 98 Ca -0.40 -0.51 -0.08 0.00 -2.27 0.00 0.00 64.05 60.79 2dd5 n THR 98 Cb 0.82 -0.13 0.02 0.00 -2.10 0.00 0.00 70.33 68.94 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 0.00 0.66 -4.24 3.42 0.02 -0.73 -3.44 113.55 109.24 2dd5 h SER 99 Ca 0.00 -0.11 -0.51 0.00 -0.84 0.00 0.00 61.79 60.33 2dd5 h SER 99 Cb 0.99 -0.17 0.12 0.00 0.14 0.00 0.00 62.40 63.49 2dd5 h SER 99 CO 0.00 0.58 0.35 -2.84 -1.14 0.00 0.00 176.83 173.78 2dd5 s PRO 100 N -5.79 2.42 0.59 3.45 0.02 -1.26 -4.92 135.00 129.51 2dd5 s PRO 100 Ca -0.13 1.36 0.40 0.00 0.02 0.00 0.00 61.00 62.64 2dd5 s PRO 100 Cb 0.12 -1.90 2.13 0.00 0.02 0.00 0.00 34.50 34.86 2dd5 s PRO 100 CO 0.76 -1.54 2.21 -1.35 -0.33 0.00 0.00 177.00 176.75 2dd5 h PRO 101 N -0.55 0.00 0.01 5.54 0.11 -1.93 -3.04 132.00 132.15 2dd5 h PRO 101 Ca -0.45 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.45 2dd5 h PRO 101 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 2dd5 h PRO 101 CO 0.52 0.00 -0.94 1.79 -0.21 0.00 0.00 178.00 179.15 2dd5 h THR 102 N 0.00 1.62 -0.09 -1.15 1.35 -1.90 -3.48 112.91 109.26 2dd5 h THR 102 Ca 0.00 -3.06 -0.04 0.00 -0.55 0.00 0.00 66.41 62.76 2dd5 h THR 102 Cb 0.03 2.69 -0.02 0.00 -1.73 0.00 0.00 68.15 69.12 2dd5 h THR 102 CO 0.00 0.88 -0.04 0.00 -0.25 0.00 0.00 175.52 176.11 2dd5 n GLN 103 N -3.49 -0.30 -0.91 4.72 1.13 -1.15 -4.81 117.38 112.57 2dd5 n GLN 103 Ca -0.02 0.37 0.00 0.00 -1.94 0.00 0.00 57.00 55.41 2dd5 n GLN 103 Cb 0.88 -3.83 -0.00 0.00 0.11 0.00 0.00 30.24 27.39 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 -2.86 0.00 0.00 1.08 1.16 -1.01 -4.71 117.46 111.12 2dd5 n PHE 104 Ca -0.02 -0.25 0.00 0.00 -1.87 0.00 0.00 57.45 55.32 2dd5 n PHE 104 Cb 0.11 0.06 0.00 0.00 -1.61 0.00 0.00 39.48 38.03 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 0.16 -1.41 3.77 4.97 0.00 -0.84 -4.86 105.19 106.99 2dd5 n GLY 105 Ca -0.03 -1.57 -0.36 0.00 0.00 0.00 0.00 46.02 44.06 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 -2.71 3.16 0.29 2.61 -4.23 -1.26 -4.68 115.64 108.82 2dd5 s THR 106 Ca 0.00 0.81 -0.02 0.00 -1.18 0.00 0.00 61.69 61.30 2dd5 s THR 106 Cb 0.00 -3.38 0.27 0.00 1.34 0.00 0.00 72.50 70.73 2dd5 s THR 106 CO 0.00 -0.07 1.93 -0.65 -0.54 0.00 0.00 174.62 175.29 2dd5 h PRO 107 N 1.74 1.11 0.00 3.99 0.11 -1.95 -2.60 132.00 134.40 2dd5 h PRO 107 Ca -0.50 -0.07 -0.16 0.00 0.11 0.00 0.00 66.00 65.39 2dd5 h PRO 107 Cb 1.25 -0.25 -0.03 0.00 0.11 0.00 0.00 31.00 32.08 2dd5 h PRO 107 CO 0.59 0.74 -1.35 0.77 -0.21 0.00 0.00 178.00 178.54 2dd5 h SER 108 N 1.15 0.00 0.50 -2.05 0.02 -2.01 -3.38 113.55 107.78 2dd5 h SER 108 Ca 0.36 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.24 2dd5 h SER 108 Cb 0.01 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2dd5 h SER 108 CO -0.11 0.56 -1.56 0.47 -1.14 0.00 0.00 176.83 175.05 2dd5 n ASP 109 N -2.90 0.48 -0.57 3.07 8.00 -1.22 -4.96 116.55 118.44 2dd5 n ASP 109 Ca -0.09 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.61 2dd5 n ASP 109 Cb 0.83 0.99 0.00 0.00 -0.02 0.00 0.00 41.12 42.91 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 -2.58 -1.51 -2.61 1.24 4.01 -0.98 -4.59 117.16 110.14 2dd5 n TYR 110 Ca -0.06 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.48 2dd5 n TYR 110 Cb 0.67 0.20 0.01 0.00 -0.31 0.00 0.00 39.34 39.91 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 -0.28 0.07 -4.73 0.00 5.15 -1.26 -4.95 115.26 109.26 2dd5 n ASN 112 Ca 0.27 -2.66 -0.41 0.00 -0.60 0.00 0.00 54.58 51.18 2dd5 n ASN 112 Cb 0.70 -0.61 -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 -1.05 4.50 -0.00 1.20 2.96 -1.26 -2.46 118.68 122.57 2dd5 s LEU 113 Ca 0.35 1.93 0.06 0.00 -0.22 0.00 0.00 54.13 56.25 2dd5 s LEU 113 Cb 0.16 -3.60 -0.02 0.00 0.50 0.00 0.00 46.19 43.23 2dd5 s LEU 113 CO -0.12 -0.12 -0.20 -0.13 -1.32 0.00 0.00 176.35 174.46 2dd5 s ARG 114 N -0.21 1.58 -0.21 1.98 0.52 -0.17 -3.18 118.95 119.27 2dd5 s ARG 114 Ca 0.48 -0.78 -0.06 0.00 -0.52 0.00 0.00 55.73 54.86 2dd5 s ARG 114 Cb -0.26 -1.57 -0.03 0.00 0.52 0.00 0.00 34.95 33.62 2dd5 s ARG 114 CO 0.32 0.42 0.02 0.08 0.02 0.00 0.00 175.30 176.16 2dd5 s VAL 115 N -0.55 4.08 -0.37 3.52 1.01 -1.25 -2.70 120.40 124.13 2dd5 s VAL 115 Ca 0.08 -0.27 -0.16 0.00 0.00 0.00 0.00 61.98 61.63 2dd5 s VAL 115 Cb -0.08 -2.85 0.00 0.00 0.00 0.00 0.00 36.38 33.45 2dd5 s VAL 115 CO -0.00 0.42 0.40 -0.76 0.00 0.00 0.00 175.10 175.16 2dd5 s LEU 116 N 1.04 4.60 -0.32 3.92 1.43 -0.65 -4.54 118.68 124.16 2dd5 s LEU 116 Ca 0.02 -0.39 -0.19 0.00 -1.03 0.00 0.00 54.13 52.54 2dd5 s LEU 116 Cb -0.14 -2.38 -0.01 0.00 0.03 0.00 0.00 46.19 43.69 2dd5 s LEU 116 CO 0.02 -0.44 0.58 0.00 0.23 0.00 0.00 176.35 176.74 2dd5 s ALA 117 N 2.09 3.52 0.81 4.21 0.00 -1.26 -0.24 121.76 130.88 2dd5 s ALA 117 Ca 0.12 -0.76 -0.11 0.00 0.00 0.00 0.00 51.96 51.21 2dd5 s ALA 117 Cb -0.17 -3.05 0.08 0.00 0.00 0.00 0.00 23.12 19.98 2dd5 s ALA 117 CO 0.12 -1.09 1.09 -0.51 0.00 0.00 0.00 175.76 175.38 2dd5 s ASP 118 N 1.68 4.33 0.34 0.00 1.01 0.00 -4.92 116.67 119.11 2dd5 s ASP 118 Ca 0.23 1.49 -0.04 0.00 0.71 0.00 0.00 52.55 54.94 2dd5 s ASP 118 Cb -0.15 -2.22 0.01 0.00 1.01 0.00 0.00 42.92 41.56 2dd5 s ASP 118 CO 0.12 -2.10 0.50 -0.94 0.21 0.00 0.00 175.17 172.96 2dd5 s SER 119 N -3.66 0.80 0.64 0.27 1.04 0.13 -4.55 113.70 108.36 2dd5 s SER 119 Ca 0.61 -1.44 0.43 0.00 0.48 0.00 0.00 55.95 56.04 2dd5 s SER 119 Cb -0.16 0.67 2.35 0.00 0.10 0.00 0.00 66.02 68.98 2dd5 s SER 119 CO 0.55 -1.32 2.32 -0.65 0.98 0.00 0.00 173.24 175.13 2dd5 h PRO 120 N 2.11 0.00 0.00 4.02 0.11 -2.02 -2.24 132.00 133.97 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 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2dd5 h PRO 120 CO 0.39 0.00 -0.01 0.25 -0.21 0.00 0.00 178.00 178.42 2dd5 n THR 121 N -3.02 1.31 -3.70 -1.15 -2.24 -1.26 -4.89 114.28 99.33 2dd5 n THR 121 Ca -0.03 -1.46 -0.11 0.00 -2.27 0.00 0.00 64.05 60.18 2dd5 n THR 121 Cb 0.07 0.22 -0.12 0.00 -2.10 0.00 0.00 70.33 68.40 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 -1.70 0.05 -0.04 3.22 2.96 -0.84 -1.14 118.68 121.18 2dd5 s LEU 122 Ca 0.13 0.74 -0.00 0.00 -0.22 0.00 0.00 54.13 54.77 2dd5 s LEU 122 Cb 0.11 1.07 0.03 0.00 0.50 0.00 0.00 46.19 47.90 2dd5 s LEU 122 CO 0.01 -0.19 0.01 -0.75 -1.32 0.00 0.00 176.35 174.11 2dd5 s LYS 123 N 1.48 0.33 0.18 1.98 2.36 -0.25 0.17 119.74 125.99 2dd5 s LYS 123 Ca -0.08 0.13 0.04 0.00 -2.55 0.00 0.00 55.97 53.50 2dd5 s LYS 123 Cb -0.10 -0.61 -0.03 0.00 -1.05 0.00 0.00 37.83 36.04 2dd5 s LYS 123 CO -0.11 -0.21 0.28 -1.01 1.55 0.00 0.00 175.35 175.86 2dd5 s HIS 124 N 1.44 3.43 -0.15 4.03 3.76 -1.26 -0.83 115.29 125.71 2dd5 s HIS 124 Ca -0.04 0.06 -0.10 0.00 -0.15 0.00 0.00 55.06 54.83 2dd5 s HIS 124 Cb -0.13 -1.62 0.05 0.00 1.11 0.00 0.00 32.58 31.99 2dd5 s HIS 124 CO -0.03 0.50 0.37 0.54 -0.85 0.00 0.00 174.74 175.27 2dd5 s VAL 125 N -1.82 -0.02 0.15 -0.90 0.11 -0.93 -4.44 120.40 112.56 2dd5 s VAL 125 Ca 0.34 0.07 0.06 0.00 -2.93 0.00 0.00 61.98 59.51 2dd5 s VAL 125 Cb -0.10 -0.54 -0.04 0.00 -1.53 0.00 0.00 36.38 34.17 2dd5 s VAL 125 CO 0.28 0.03 0.07 -0.69 -3.33 0.00 0.00 175.10 171.46 2dd5 s VAL 126 N 0.93 4.20 0.11 2.04 1.01 0.37 -1.53 120.40 127.53 2dd5 s VAL 126 Ca -0.06 -1.15 -0.25 0.00 0.00 0.00 0.00 61.98 60.52 2dd5 s VAL 126 Cb -0.07 -3.11 0.08 0.00 0.00 0.00 0.00 36.38 33.28 2dd5 s VAL 126 CO -0.07 -0.06 0.72 0.54 0.00 0.00 0.00 175.10 176.23 2dd5 s VAL 127 N -1.66 0.00 -0.44 2.92 0.11 -0.68 -4.93 120.40 115.72 2dd5 s VAL 127 Ca 0.29 -0.10 0.03 0.00 -2.93 0.00 0.00 61.98 59.26 2dd5 s VAL 127 Cb -0.10 -1.12 0.13 0.00 -1.53 0.00 0.00 36.38 33.75 2dd5 s VAL 127 CO 0.21 0.00 0.21 0.00 -3.33 0.00 0.00 175.10 172.19 2dd5 h THR 129 N 5.61 0.70 0.04 0.00 1.35 -1.87 -3.35 112.91 115.40 2dd5 h THR 129 Ca -0.05 -0.15 -0.24 0.00 -0.55 0.00 0.00 66.41 65.42 2dd5 h THR 129 Cb 0.94 1.09 -0.02 0.00 -1.73 0.00 0.00 68.15 68.42 2dd5 h THR 129 CO 0.55 0.04 -1.19 -0.07 -0.25 0.00 0.00 175.52 174.60 2dd5 h LEU 130 N 0.00 0.14 -9.46 3.87 3.38 -1.91 -3.47 115.31 107.86 2dd5 h LEU 130 Ca -0.00 -0.16 -0.57 0.00 0.09 0.00 0.00 57.88 57.23 2dd5 h LEU 130 Cb 0.09 -0.05 -0.11 0.00 0.09 0.00 0.00 40.66 40.68 2dd5 h LEU 130 CO 0.00 1.13 -0.68 -0.94 0.09 0.00 0.00 178.44 178.05 2dd5 s SER 132 N -6.77 4.24 0.00 -0.43 1.04 -1.26 -5.20 113.70 105.32 2dd5 s SER 132 Ca -0.02 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.63 2dd5 s SER 132 Cb 0.09 -0.66 0.00 0.00 0.10 0.00 0.00 66.02 65.55 2dd5 s SER 132 CO 0.84 -0.00 0.00 0.00 0.98 0.00 0.00 173.24 175.05 2dd5 n TYR 134 N -0.82 0.00 -1.18 5.02 9.36 -1.26 -4.92 117.16 123.35 2dd5 n TYR 134 Ca -0.06 0.00 -0.35 0.00 3.32 0.00 0.00 57.90 60.81 2dd5 n TYR 134 Cb 0.59 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.28 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 -1.06 3.28 -0.27 2.98 -0.04 -1.26 -4.78 135.00 133.85 2dd5 n PRO 135 Ca 0.00 -2.03 0.06 0.00 -0.04 0.00 0.00 63.50 61.49 2dd5 n PRO 135 Cb 0.00 -2.73 0.17 0.00 -0.04 0.00 0.00 33.50 30.90 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 5.37 0.08 -0.94 0.54 3.08 -1.94 -0.84 114.38 119.71 2dd5 h ARG 136 Ca 0.78 -0.00 0.21 0.00 0.07 0.00 0.00 59.98 61.04 2dd5 h ARG 136 Cb 0.26 -0.02 -0.12 0.00 0.08 0.00 0.00 29.97 30.18 2dd5 h ARG 136 CO 1.71 0.05 0.50 -1.35 -1.07 0.00 0.00 179.97 179.81 2dd5 h PRO 137 N 0.08 0.53 -0.00 0.04 0.11 -1.86 0.88 132.00 131.78 2dd5 h PRO 137 Ca 0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.51 2dd5 h PRO 137 Cb 0.77 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.76 2dd5 h PRO 137 CO -0.72 0.35 -0.67 1.51 -0.21 0.00 0.00 178.00 178.26 2dd5 n ILE 138 N -4.92 0.00 0.00 4.15 3.06 -0.92 -4.70 119.36 116.02 2dd5 n ILE 138 Ca 0.23 -0.16 0.00 0.00 -2.50 0.00 0.00 62.75 60.32 2dd5 n ILE 138 Cb 0.64 1.01 0.00 0.00 0.54 0.00 0.00 39.64 41.83 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 -1.27 0.00 0.00 9.51 7.94 -0.37 -2.89 117.00 129.92 2dd5 n LEU 139 Ca 0.03 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.93 2dd5 n LEU 139 Cb 0.23 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.18 2dd5 n LEU 139 CO 0.29 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.18 2dd5 n GLY 140 N 2.55 -1.47 3.84 -3.96 0.00 0.28 -2.22 105.19 104.21 2dd5 n GLY 140 Ca 0.00 -2.04 -0.33 0.00 0.00 0.00 0.00 46.02 43.66 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 4.10 0.53 1.61 -0.21 -1.26 -3.93 119.66 120.50 2dd5 s GLN 141 Ca 0.00 0.86 -0.20 0.00 0.02 0.00 0.00 55.36 56.04 2dd5 s GLN 141 Cb 0.00 -2.33 -0.07 0.00 1.00 0.00 0.00 33.01 31.62 2dd5 s GLN 141 CO 0.00 0.08 1.11 -1.54 -2.12 0.00 0.00 175.29 172.82 2dd5 s SER 142 N -2.23 5.89 0.58 5.90 1.04 -1.26 -5.01 113.70 118.61 2dd5 s SER 142 Ca 0.57 2.12 -0.18 0.00 0.48 0.00 0.00 55.95 58.94 2dd5 s SER 142 Cb -0.10 -2.58 -0.04 0.00 0.10 0.00 0.00 66.02 63.41 2dd5 s SER 142 CO 0.16 -1.10 1.14 -2.84 0.98 0.00 0.00 173.24 171.58 2dd5 s PRO 143 N -3.25 3.13 0.19 4.02 0.02 -1.26 -4.94 135.00 132.90 2dd5 s PRO 143 Ca 0.71 1.60 -0.12 0.00 0.02 0.00 0.00 61.00 63.21 2dd5 s PRO 143 Cb -0.22 -1.98 0.18 0.00 0.02 0.00 0.00 34.50 32.50 2dd5 s PRO 143 CO 0.25 -1.03 1.78 1.49 -0.33 0.00 0.00 177.00 179.17 2dd5 h GLU 144 N 0.83 0.50 0.00 5.54 4.57 -2.00 -2.06 114.58 121.96 2dd5 h GLU 144 Ca -0.49 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 57.63 2dd5 h GLU 144 Cb 1.27 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.74 2dd5 h GLU 144 CO 0.56 0.33 -0.15 0.11 -1.18 0.00 0.00 179.01 178.68 2dd5 h TRP 145 N 0.52 0.00 0.00 0.92 5.08 -1.97 -2.06 115.95 118.44 2dd5 h TRP 145 Ca 0.25 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 60.14 2dd5 h TRP 145 Cb 0.18 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.33 2dd5 h TRP 145 CO -0.11 0.15 -0.38 -0.92 -1.28 0.00 0.00 178.44 175.90 2dd5 h TYR 146 N 0.00 0.00 -0.01 0.12 3.20 -1.74 -2.45 116.97 116.09 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 0.37 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.64 2dd5 h TYR 146 CO 0.00 0.38 -0.27 0.54 -1.64 0.00 0.00 178.16 177.18 2dd5 n ARG 147 N -4.07 0.64 -2.32 1.82 1.74 -0.79 -4.68 116.66 109.01 2dd5 n ARG 147 Ca -0.02 -0.35 -0.39 0.00 -0.77 0.00 0.00 57.85 56.32 2dd5 n ARG 147 Cb 0.42 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.34 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 -2.60 6.85 0.42 0.55 1.04 -0.92 -4.92 113.70 114.12 2dd5 s SER 148 Ca 0.22 2.40 0.10 0.00 0.48 0.00 0.00 55.95 59.15 2dd5 s SER 148 Cb 0.19 -2.63 0.93 0.00 0.10 0.00 0.00 66.02 64.61 2dd5 s SER 148 CO 0.54 -0.45 2.03 -0.65 0.98 0.00 0.00 173.24 175.69 2dd5 h PRO 149 N 3.22 0.48 0.14 4.02 0.11 -1.92 -1.75 132.00 136.29 2dd5 h PRO 149 Ca -0.48 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 2dd5 h PRO 149 Cb 1.22 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 2dd5 h PRO 149 CO 0.65 0.32 -0.08 -0.97 -0.21 0.00 0.00 178.00 177.70 2dd5 h ASN 150 N 0.49 -0.20 -0.62 -2.05 -0.73 -1.91 0.14 115.58 110.70 2dd5 h ASN 150 Ca 0.20 0.01 -0.03 0.00 1.87 0.00 0.00 56.30 58.35 2dd5 h ASN 150 Cb 0.17 0.06 -0.03 0.00 0.27 0.00 0.00 38.32 38.79 2dd5 h ASN 150 CO -0.05 -0.13 0.28 0.22 -0.37 0.00 0.00 177.43 177.38 2dd5 h TYR 151 N -0.21 0.91 0.00 0.67 3.20 -1.68 -1.58 116.97 118.28 2dd5 h TYR 151 Ca -0.01 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.76 2dd5 h TYR 151 Cb 0.17 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 2dd5 h TYR 151 CO -0.08 0.70 -0.20 0.00 -1.64 0.00 0.00 178.16 176.94 2dd5 h ARG 152 N 0.85 0.00 0.08 1.82 3.08 -1.04 -2.35 114.38 116.82 2dd5 h ARG 152 Ca 0.21 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.11 2dd5 h ARG 152 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 2dd5 h ARG 152 CO -0.02 0.20 -0.72 0.00 -1.07 0.00 0.00 179.97 178.36 2dd5 h ARG 153 N 0.00 0.16 0.22 0.04 3.08 -0.37 -3.43 114.38 114.08 2dd5 h ARG 153 Ca -0.00 -0.28 -0.34 0.00 0.07 0.00 0.00 59.98 59.43 2dd5 h ARG 153 Cb 0.38 0.10 0.02 0.00 0.08 0.00 0.00 29.97 30.56 2dd5 h ARG 153 CO 0.03 1.13 -1.60 0.00 -1.07 0.00 0.00 179.97 178.46 2dd5 h ARG 154 N -0.63 0.47 -0.46 0.04 3.08 -1.27 -3.41 114.38 112.21 2dd5 h ARG 154 Ca -0.15 -0.80 0.09 0.00 0.07 0.00 0.00 59.98 59.19 2dd5 h ARG 154 Cb 1.43 0.30 -0.08 0.00 0.08 0.00 0.00 29.97 31.69 2dd5 h ARG 154 CO 0.05 1.38 -0.08 1.25 -1.07 0.00 0.00 179.97 181.50 2dd5 h LEU 155 N 0.13 -0.35 -2.28 3.04 5.85 -1.65 0.12 115.31 120.15 2dd5 h LEU 155 Ca -0.29 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 2dd5 h LEU 155 Cb 2.14 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 43.42 2dd5 h LEU 155 CO 0.23 -0.13 -0.05 -0.37 -0.34 0.00 0.00 178.44 177.79 2dd5 h VAL 156 N 0.03 0.45 0.00 1.05 -1.51 -1.83 -2.39 116.25 112.05 2dd5 h VAL 156 Ca 0.23 -0.24 -0.29 0.00 -1.23 0.00 0.00 66.70 65.17 2dd5 h VAL 156 Cb 0.35 1.16 -0.05 0.00 -2.13 0.00 0.00 31.29 30.61 2dd5 h VAL 156 CO -0.45 0.05 -2.10 -1.14 -1.23 0.00 0.00 177.57 172.70 2dd5 n ARG 157 N -3.62 0.98 -2.77 5.19 0.63 -0.79 -4.72 116.66 111.56 2dd5 n ARG 157 Ca -0.02 0.05 -0.21 0.00 -0.92 0.00 0.00 57.85 56.75 2dd5 n ARG 157 Cb 0.15 -1.40 -0.01 0.00 0.45 0.00 0.00 32.46 31.66 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 -2.83 2.48 -0.21 -0.14 8.01 0.34 -4.94 117.44 120.15 2dd5 n TRP 158 Ca -0.30 -3.40 -0.01 0.00 -1.31 0.00 0.00 57.50 52.49 2dd5 n TRP 158 Cb 0.94 -0.32 0.10 0.00 -2.01 0.00 0.00 31.31 30.03 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 2.86 0.52 -0.84 -0.99 0.13 -1.59 -1.43 132.00 130.66 2dd5 h PRO 159 Ca 0.13 -0.03 0.07 0.00 -0.87 0.00 0.00 66.00 65.30 2dd5 h PRO 159 Cb 0.88 -0.12 -0.07 0.00 0.13 0.00 0.00 31.00 31.83 2dd5 h PRO 159 CO 0.70 0.34 0.50 0.00 -0.23 0.00 0.00 178.00 179.32 2dd5 h ARG 160 N 0.54 0.87 -0.19 0.86 2.47 -1.92 0.81 114.38 117.81 2dd5 h ARG 160 Ca 0.30 -0.05 -0.07 0.00 -1.26 0.00 0.00 59.98 58.90 2dd5 h ARG 160 Cb 0.29 -0.20 -0.00 0.00 -1.65 0.00 0.00 29.97 28.41 2dd5 h ARG 160 CO -0.24 0.57 -0.15 1.96 0.56 0.00 0.00 179.97 182.67 2dd5 h GLN 161 N 0.89 0.44 -0.31 0.04 7.50 -1.79 -1.40 115.11 120.47 2dd5 h GLN 161 Ca 0.38 -0.22 -0.03 0.00 0.50 0.00 0.00 58.65 59.29 2dd5 h GLN 161 Cb 0.24 -0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.76 2dd5 h GLN 161 CO -0.20 0.77 0.09 0.28 -1.50 0.00 0.00 178.83 178.27 2dd5 h VAL 162 N 0.11 1.21 -0.78 -0.54 2.07 -0.95 -2.12 116.25 115.26 2dd5 h VAL 162 Ca 0.04 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 2dd5 h VAL 162 Cb 0.67 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 2dd5 h VAL 162 CO 0.04 0.23 0.42 -0.07 0.02 0.00 0.00 177.57 178.21 2dd5 h LEU 163 N 0.35 0.97 -1.24 2.57 3.38 -0.87 -1.44 115.31 119.02 2dd5 h LEU 163 Ca 0.10 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2dd5 h LEU 163 Cb 0.26 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2dd5 h LEU 163 CO -0.00 0.78 0.31 0.00 0.09 0.00 0.00 178.44 179.63 2dd5 h ALA 164 N 1.37 1.42 -0.16 1.53 0.00 -0.97 0.73 119.26 123.18 2dd5 h ALA 164 Ca 0.27 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 2dd5 h ALA 164 Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2dd5 h ALA 164 CO -0.04 0.47 -0.08 0.93 0.00 0.00 0.00 179.25 180.53 2dd5 h GLU 165 N 0.84 0.24 -0.00 0.00 5.08 -0.60 0.44 114.58 120.59 2dd5 h GLU 165 Ca 0.21 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2dd5 h GLU 165 Cb 0.05 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2dd5 h GLU 165 CO -0.03 0.34 -0.01 1.19 -1.00 0.00 0.00 179.01 179.49 2dd5 n PHE 166 N -4.32 0.00 -0.72 4.33 3.72 -0.14 -4.89 117.46 115.45 2dd5 n PHE 166 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2dd5 n PHE 166 Cb 0.23 -0.07 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 2dd5 n PHE 166 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dd5 n GLY 167 N 1.10 0.57 3.26 1.37 0.00 0.14 -4.94 105.19 106.70 2dd5 n GLY 167 Ca 0.21 -0.65 -0.33 0.00 0.00 0.00 0.00 46.02 45.25 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 2.42 0.00 0.99 2.96 0.06 -4.97 118.68 120.14 2dd5 s LEU 168 Ca 0.00 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.46 2dd5 s LEU 168 Cb 0.00 -1.54 -0.01 0.00 0.50 0.00 0.00 46.19 45.15 2dd5 s LEU 168 CO 0.00 0.11 -0.07 -1.58 -1.32 0.00 0.00 176.35 173.48 2dd5 s GLN 169 N 0.68 0.58 0.14 1.98 0.74 -1.26 -2.56 119.66 119.96 2dd5 s GLN 169 Ca -0.08 -0.32 0.06 0.00 0.05 0.00 0.00 55.36 55.07 2dd5 s GLN 169 Cb -0.16 -0.54 -0.04 0.00 1.10 0.00 0.00 33.01 33.37 2dd5 s GLN 169 CO 0.02 0.15 -0.13 -0.51 -0.55 0.00 0.00 175.29 174.26 2dd5 s LEU 170 N -0.33 2.46 0.50 3.68 1.43 -1.26 -5.12 118.68 120.03 2dd5 s LEU 170 Ca 0.02 -0.90 -0.21 0.00 -1.03 0.00 0.00 54.13 52.01 2dd5 s LEU 170 Cb -0.04 -0.53 -0.09 0.00 0.03 0.00 0.00 46.19 45.56 2dd5 s LEU 170 CO -0.00 -0.19 0.84 -2.65 0.23 0.00 0.00 176.35 174.58 2dd5 n PRO 171 N 0.20 0.96 0.25 1.29 -0.02 -1.26 -4.86 135.00 131.56 2dd5 n PRO 171 Ca -0.13 0.36 0.11 0.00 -2.02 0.00 0.00 63.50 61.82 2dd5 n PRO 171 Cb 0.58 -1.93 0.67 0.00 -0.02 0.00 0.00 33.50 32.80 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 0.92 0.00 1.75 2.55 4.64 -2.04 -2.21 113.55 119.16 2dd5 h SER 172 Ca -0.45 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.83 2dd5 h SER 172 Cb 1.36 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.45 2dd5 h SER 172 CO 0.53 0.14 -0.25 -0.33 -0.87 0.00 0.00 176.83 176.05 2dd5 h GLU 173 N 0.00 0.00 -6.77 4.77 3.07 -2.00 -3.45 114.58 110.20 2dd5 h GLU 173 Ca -0.00 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.33 2dd5 h GLU 173 Cb 0.35 0.00 0.05 0.00 -0.84 0.00 0.00 28.75 28.31 2dd5 h GLU 173 CO 0.02 0.20 0.70 0.08 -1.40 0.00 0.00 179.01 178.61 2dd5 s VAL 174 N -3.11 2.81 -0.48 3.13 1.01 -0.83 -4.95 120.40 117.98 2dd5 s VAL 174 Ca 0.05 0.71 -0.28 0.00 0.00 0.00 0.00 61.98 62.46 2dd5 s VAL 174 Cb 0.06 -3.45 0.03 0.00 0.00 0.00 0.00 36.38 33.02 2dd5 s VAL 174 CO 0.71 0.13 1.09 -1.58 0.00 0.00 0.00 175.10 175.44 2dd5 s GLN 175 N -0.69 3.67 -0.21 2.72 0.74 -0.29 -4.91 119.66 120.69 2dd5 s GLN 175 Ca 0.56 0.46 -0.20 0.00 0.05 0.00 0.00 55.36 56.22 2dd5 s GLN 175 Cb -0.40 -3.91 -0.02 0.00 1.10 0.00 0.00 33.01 29.77 2dd5 s GLN 175 CO 0.45 -1.35 0.62 0.42 -0.55 0.00 0.00 175.29 174.87 2dd5 s ILE 176 N 4.29 5.02 -0.19 -2.34 1.01 -1.26 -1.09 121.20 126.64 2dd5 s ILE 176 Ca 0.45 1.15 -0.02 0.00 0.00 0.00 0.00 60.65 62.23 2dd5 s ILE 176 Cb -0.08 -3.93 -0.00 0.00 0.01 0.00 0.00 42.46 38.46 2dd5 s ILE 176 CO 0.31 0.10 -0.10 -0.60 0.00 0.00 0.00 174.94 174.65 2dd5 s ARG 177 N 1.99 3.27 -0.13 2.79 3.52 -0.01 -4.95 118.95 125.43 2dd5 s ARG 177 Ca 0.28 -0.69 -0.15 0.00 -0.13 0.00 0.00 55.73 55.04 2dd5 s ARG 177 Cb -0.16 -2.83 -0.05 0.00 -1.56 0.00 0.00 34.95 30.36 2dd5 s ARG 177 CO 0.10 -0.14 0.35 0.08 -0.81 0.00 0.00 175.30 174.88 2dd5 s VAL 178 N 1.25 5.25 -0.22 7.11 1.01 -1.26 -2.19 120.40 131.35 2dd5 s VAL 178 Ca 0.03 0.67 -0.05 0.00 0.00 0.00 0.00 61.98 62.63 2dd5 s VAL 178 Cb -0.14 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 2dd5 s VAL 178 CO -0.04 0.41 -0.02 0.00 0.00 0.00 0.00 175.10 175.45 2dd5 s ALA 179 N 0.25 2.92 -0.39 5.51 0.00 -0.58 -4.97 121.76 124.49 2dd5 s ALA 179 Ca 0.20 -1.12 -0.14 0.00 0.00 0.00 0.00 51.96 50.90 2dd5 s ALA 179 Cb -0.14 -1.77 0.01 0.00 0.00 0.00 0.00 23.12 21.22 2dd5 s ALA 179 CO 0.07 -0.37 0.27 0.34 0.00 0.00 0.00 175.76 176.07 2dd5 s ASP 180 N 1.38 6.01 -1.38 0.00 -1.08 -1.26 -1.68 116.67 118.66 2dd5 s ASP 180 Ca 0.05 -0.83 -0.16 0.00 -0.52 0.00 0.00 52.55 51.09 2dd5 s ASP 180 Cb -0.14 -2.13 0.06 0.00 -1.46 0.00 0.00 42.92 39.25 2dd5 s ASP 180 CO -0.01 -0.39 1.98 -1.20 0.52 0.00 0.00 175.17 176.07 2dd5 n SER 181 N 5.11 4.42 -0.21 -0.34 7.64 0.46 -4.71 113.62 125.99 2dd5 n SER 181 Ca -0.11 -2.88 0.12 0.00 1.01 0.00 0.00 58.87 57.00 2dd5 n SER 181 Cb 0.47 -1.71 0.21 0.00 -1.01 0.00 0.00 64.21 62.18 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 7.27 1.11 0.00 6.43 6.94 -1.26 -4.75 115.26 131.00 2dd5 n ASN 182 Ca 0.50 -0.89 0.00 0.00 -0.02 0.00 0.00 54.58 54.18 2dd5 n ASN 182 Cb 0.43 0.33 0.00 0.00 -2.36 0.00 0.00 39.78 38.18 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 -0.81 0.00 0.00 -3.83 1.13 -1.26 -5.03 117.38 107.57 2dd5 n GLN 183 Ca 0.09 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.28 2dd5 n GLN 183 Cb 0.37 0.00 0.26 0.00 0.11 0.00 0.00 30.24 30.98 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 1.31 -3.25 -1.09 5.02 -1.26 -4.91 118.16 113.98 2dd5 n LYS 184 Ca 0.00 -0.93 -0.38 0.00 -2.02 0.00 0.00 58.31 54.98 2dd5 n LYS 184 Cb 0.00 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.47 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 -2.33 4.71 -0.00 -0.18 2.01 -1.26 -4.25 115.64 114.34 2dd5 s THR 185 Ca 0.26 1.23 0.08 0.00 0.31 0.00 0.00 61.69 63.57 2dd5 s THR 185 Cb 0.19 -3.90 -0.02 0.00 0.01 0.00 0.00 72.50 68.78 2dd5 s THR 185 CO 0.47 0.51 -0.25 -0.13 -0.69 0.00 0.00 174.62 174.53 2dd5 s ARG 186 N -1.22 1.96 0.20 4.92 1.81 -1.03 -4.75 118.95 120.85 2dd5 s ARG 186 Ca 0.31 -0.96 0.11 0.00 -1.72 0.00 0.00 55.73 53.47 2dd5 s ARG 186 Cb -0.19 -1.97 -0.04 0.00 -0.45 0.00 0.00 34.95 32.30 2dd5 s ARG 186 CO 0.20 0.53 -0.20 0.71 -0.68 0.00 0.00 175.30 175.85 2dd5 s TYR 187 N -0.66 2.37 0.02 -0.53 2.02 -1.26 -0.99 117.35 118.32 2dd5 s TYR 187 Ca 0.10 -0.33 0.02 0.00 -0.37 0.00 0.00 57.07 56.49 2dd5 s TYR 187 Cb -0.10 -1.15 -0.01 0.00 -0.40 0.00 0.00 41.96 40.30 2dd5 s TYR 187 CO -0.00 0.54 -0.06 0.96 -1.57 0.00 0.00 175.55 175.42 2dd5 s ILE 188 N -1.81 0.42 -0.18 2.71 -4.36 -1.10 -4.52 121.20 112.36 2dd5 s ILE 188 Ca 0.23 -0.68 -0.11 0.00 -0.26 0.00 0.00 60.65 59.83 2dd5 s ILE 188 Cb -0.08 -0.45 -0.05 0.00 1.25 0.00 0.00 42.46 43.14 2dd5 s ILE 188 CO 0.12 -0.18 0.18 -0.69 0.24 0.00 0.00 174.94 174.60 2dd5 s VAL 189 N -0.83 5.39 -0.59 8.37 1.01 0.87 -1.63 120.40 132.98 2dd5 s VAL 189 Ca -0.05 0.29 -0.15 0.00 0.00 0.00 0.00 61.98 62.07 2dd5 s VAL 189 Cb -0.06 -3.51 0.15 0.00 0.00 0.00 0.00 36.38 32.95 2dd5 s VAL 189 CO 0.00 0.44 0.54 -0.32 0.00 0.00 0.00 175.10 175.76 2dd5 s MET 190 N 0.28 3.06 0.77 2.72 1.75 0.67 -4.37 119.30 124.18 2dd5 s MET 190 Ca 0.11 -1.88 -0.11 0.00 -1.25 0.00 0.00 55.69 52.56 2dd5 s MET 190 Cb -0.12 -4.28 0.05 0.00 2.84 0.00 0.00 34.83 33.32 2dd5 s MET 190 CO 0.00 -1.31 1.08 -1.25 -0.65 0.00 0.00 175.02 172.89 2dd5 s PRO 191 N 1.26 2.34 0.51 4.11 0.04 -1.26 -0.81 135.00 141.18 2dd5 s PRO 191 Ca 0.07 0.95 -0.20 0.00 0.04 0.00 0.00 61.00 61.86 2dd5 s PRO 191 Cb -0.25 -1.92 -0.07 0.00 0.04 0.00 0.00 34.50 32.29 2dd5 s PRO 191 CO 0.00 -1.52 1.07 0.14 0.04 0.00 0.00 177.00 176.73 2dd5 s VAL 192 N -3.00 3.56 0.11 -0.36 -7.23 -1.26 -4.79 120.40 107.42 2dd5 s VAL 192 Ca 0.60 0.96 -0.31 0.00 -1.81 0.00 0.00 61.98 61.42 2dd5 s VAL 192 Cb -0.16 -3.39 -0.09 0.00 0.56 0.00 0.00 36.38 33.31 2dd5 s VAL 192 CO 0.55 -0.22 1.53 -0.60 -0.31 0.00 0.00 175.10 176.06 2dd5 s ARG 193 N -3.29 4.24 0.62 4.82 3.52 -1.26 -4.83 118.95 122.78 2dd5 s ARG 193 Ca 0.69 2.24 -0.12 0.00 -0.13 0.00 0.00 55.73 58.41 2dd5 s ARG 193 Cb -0.19 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 29.82 2dd5 s ARG 193 CO 0.23 -0.60 1.03 -1.25 -0.81 0.00 0.00 175.30 173.90 2dd5 s PRO 194 N 1.67 3.50 0.82 5.12 0.04 -1.26 -5.04 135.00 139.85 2dd5 s PRO 194 Ca 0.69 0.87 -0.11 0.00 0.04 0.00 0.00 61.00 62.49 2dd5 s PRO 194 Cb -0.40 -2.07 0.09 0.00 0.04 0.00 0.00 34.50 32.17 2dd5 s PRO 194 CO 0.31 -0.65 1.12 -1.21 0.04 0.00 0.00 177.00 176.60 2dd5 s GLU 195 N -4.87 1.79 0.00 4.56 0.41 -1.26 -3.78 118.70 115.55 2dd5 s GLU 195 Ca 0.57 1.34 0.00 0.00 -0.41 0.00 0.00 54.97 56.47 2dd5 s GLU 195 Cb -0.12 -1.83 0.00 0.00 -1.78 0.00 0.00 34.13 30.40 2dd5 s GLU 195 CO 0.49 -2.02 0.00 0.41 -0.49 0.00 0.00 175.26 173.65 2dd5 n GLY 196 N -0.60 0.44 0.20 -1.39 0.00 -1.26 -4.72 105.19 97.86 2dd5 n GLY 196 Ca 0.10 -0.99 0.07 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.93 1.25 -1.76 2.61 -2.24 -1.25 -4.89 114.28 105.08 2dd5 n THR 197 Ca 0.00 -1.50 -0.42 0.00 -2.27 0.00 0.00 64.05 59.86 2dd5 n THR 197 Cb 0.02 0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.24 2dd5 n THR 197 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2dd5 s ASP 198 N -2.21 6.40 0.00 3.42 1.01 -1.26 -1.72 116.67 122.30 2dd5 s ASP 198 Ca 0.21 2.85 0.00 0.00 0.71 0.00 0.00 52.55 56.32 2dd5 s ASP 198 Cb 0.18 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.51 2dd5 s ASP 198 CO 0.02 -0.95 0.00 0.61 0.21 0.00 0.00 175.17 175.06 2dd5 n GLY 199 N 3.69 0.69 3.79 0.21 0.00 -1.26 -5.02 105.19 107.30 2dd5 n GLY 199 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.84 3.05 0.70 1.61 0.52 -0.70 -5.05 118.94 116.22 2dd5 s TRP 200 Ca 0.00 1.59 -0.05 0.00 0.02 0.00 0.00 56.10 57.66 2dd5 s TRP 200 Cb 0.00 -3.15 0.07 0.00 -1.15 0.00 0.00 33.47 29.24 2dd5 s TRP 200 CO 0.00 -0.91 0.99 0.95 0.02 0.00 0.00 176.95 178.00 2dd5 s THR 201 N -1.78 2.31 0.21 2.01 -4.23 -1.26 -4.88 115.64 108.01 2dd5 s THR 201 Ca 0.64 -0.36 -0.10 0.00 -1.18 0.00 0.00 61.69 60.69 2dd5 s THR 201 Cb -0.21 -2.95 0.14 0.00 1.34 0.00 0.00 72.50 70.82 2dd5 s THR 201 CO 0.25 0.00 1.86 -0.08 -0.54 0.00 0.00 174.62 176.11 2dd5 h GLU 202 N -0.54 0.89 -0.54 3.99 4.81 -1.97 -1.11 114.58 120.11 2dd5 h GLU 202 Ca -0.43 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 58.77 2dd5 h GLU 202 Cb 1.30 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 30.45 2dd5 h GLU 202 CO 0.55 0.59 0.31 -0.44 -0.73 0.00 0.00 179.01 179.29 2dd5 h ASP 203 N 0.91 0.50 -0.28 1.04 5.19 -1.98 -0.79 116.42 121.02 2dd5 h ASP 203 Ca 0.27 0.01 -0.13 0.00 -0.62 0.00 0.00 57.03 56.56 2dd5 h ASP 203 Cb -0.04 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.36 2dd5 h ASP 203 CO -0.08 0.35 -0.32 1.56 -3.12 0.00 0.00 179.24 177.63 2dd5 h GLN 204 N 0.62 0.79 -0.36 3.56 4.20 -1.84 -2.95 115.11 119.13 2dd5 h GLN 204 Ca 0.22 -0.37 -0.11 0.00 0.06 0.00 0.00 58.65 58.45 2dd5 h GLN 204 Cb 0.04 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2dd5 h GLN 204 CO -0.11 1.00 -0.22 -0.07 -0.67 0.00 0.00 178.83 178.76 2dd5 h LEU 205 N 0.67 0.72 -1.12 1.46 3.38 -0.92 -3.03 115.31 116.46 2dd5 h LEU 205 Ca 0.07 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 2dd5 h LEU 205 Cb 0.86 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 2dd5 h LEU 205 CO 0.08 0.93 0.02 0.00 0.09 0.00 0.00 178.44 179.56 2dd5 h ALA 206 N 1.13 1.28 -0.06 1.53 0.00 -1.04 -2.95 119.26 119.15 2dd5 h ALA 206 Ca 0.09 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.80 2dd5 h ALA 206 Cb 0.71 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2dd5 h ALA 206 CO 0.05 0.49 0.05 0.93 0.00 0.00 0.00 179.25 180.77 2dd5 h GLU 207 N 0.61 0.00 -0.02 0.00 5.08 -1.39 -2.24 114.58 116.62 2dd5 h GLU 207 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2dd5 h GLU 207 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2dd5 h GLU 207 CO 0.01 0.00 -0.06 0.44 -1.00 0.00 0.00 179.01 178.40 2dd5 n ILE 208 N -4.39 0.00 -3.09 3.13 -5.35 -1.12 -4.32 119.36 104.22 2dd5 n ILE 208 Ca -0.01 -0.31 -0.45 0.00 -0.27 0.00 0.00 62.75 61.70 2dd5 n ILE 208 Cb 0.15 0.84 -0.03 0.00 -1.74 0.00 0.00 39.64 38.87 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 -2.09 5.06 0.80 7.28 1.01 -0.84 -4.26 120.40 127.35 2dd5 s VAL 209 Ca 0.32 -1.82 -0.10 0.00 0.00 0.00 0.00 61.98 60.38 2dd5 s VAL 209 Cb 0.20 -4.63 0.11 0.00 0.00 0.00 0.00 36.38 32.05 2dd5 s VAL 209 CO 0.36 -1.29 1.14 0.42 0.00 0.00 0.00 175.10 175.73 2dd5 s THR 210 N 1.78 2.11 0.20 3.92 -4.23 -1.26 -4.65 115.64 113.52 2dd5 s THR 210 Ca 0.25 -0.15 -0.10 0.00 -1.18 0.00 0.00 61.69 60.51 2dd5 s THR 210 Cb -0.09 -2.96 0.13 0.00 1.34 0.00 0.00 72.50 70.92 2dd5 s THR 210 CO -0.07 0.00 1.80 -0.09 -0.54 0.00 0.00 174.62 175.72 2dd5 h ARG 211 N -0.98 0.63 -0.06 3.99 2.43 -1.95 -1.57 114.38 116.86 2dd5 h ARG 211 Ca -0.44 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 58.66 2dd5 h ARG 211 Cb 1.30 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 2dd5 h ARG 211 CO 0.55 0.42 -0.11 -0.44 -1.51 0.00 0.00 179.97 178.88 2dd5 h ASP 212 N 0.65 0.09 -0.05 -3.80 3.32 -1.94 -1.71 116.42 112.98 2dd5 h ASP 212 Ca 0.29 -0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.18 2dd5 h ASP 212 Cb 0.18 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 2dd5 h ASP 212 CO -0.18 0.21 -0.46 0.00 -1.72 0.00 0.00 179.24 177.09 2dd5 h LEU 214 N 0.48 0.00 0.07 0.00 3.38 -0.80 -2.87 115.31 115.57 2dd5 h LEU 214 Ca 0.03 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.66 2dd5 h LEU 214 Cb 0.99 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 2dd5 h LEU 214 CO 0.09 0.00 -1.91 -0.38 0.09 0.00 0.00 178.44 176.33 2dd5 n ILE 215 N -2.81 1.70 0.00 1.22 5.41 -0.87 -0.09 119.36 123.92 2dd5 n ILE 215 Ca 0.02 -0.71 0.00 0.00 1.00 0.00 0.00 62.75 63.06 2dd5 n ILE 215 Cb 0.34 -1.42 0.00 0.00 -0.71 0.00 0.00 39.64 37.85 2dd5 n ILE 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2dd5 n GLY 216 N 1.83 0.85 0.11 7.39 0.00 -0.42 -0.48 105.19 114.46 2dd5 n GLY 216 Ca -0.27 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.65 0.00 -3.94 1.61 0.24 -0.95 -4.63 118.33 110.00 2dd5 n VAL 217 Ca 0.00 -0.06 -0.09 0.00 -2.04 0.00 0.00 64.34 62.15 2dd5 n VAL 217 Cb 0.00 -0.05 -0.07 0.00 -1.47 0.00 0.00 33.84 32.25 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 -2.57 0.02 0.10 2.33 0.00 -1.15 -4.65 121.76 115.83 2dd5 s ALA 218 Ca 0.25 -0.85 0.10 0.00 0.00 0.00 0.00 51.96 51.46 2dd5 s ALA 218 Cb 0.20 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.98 2dd5 s ALA 218 CO 0.50 -0.57 -0.25 0.14 0.00 0.00 0.00 175.76 175.58 2dd5 s VAL 219 N -3.93 2.10 0.36 0.00 -7.23 -1.26 -4.09 120.40 106.34 2dd5 s VAL 219 Ca 0.13 -1.58 -0.28 0.00 -1.81 0.00 0.00 61.98 58.44 2dd5 s VAL 219 Cb 0.04 -1.84 -0.11 0.00 0.56 0.00 0.00 36.38 35.04 2dd5 s VAL 219 CO -0.04 0.15 1.41 -2.16 -0.31 0.00 0.00 175.10 174.15 2dd5 s PRO 220 N -1.74 4.21 -0.02 4.82 0.04 -1.26 -4.97 135.00 136.08 2dd5 s PRO 220 Ca 0.12 2.42 0.00 0.00 0.04 0.00 0.00 61.00 63.58 2dd5 s PRO 220 Cb -0.10 -3.01 0.03 0.00 0.04 0.00 0.00 34.50 31.46 2dd5 s PRO 220 CO 0.04 -0.39 0.02 0.15 0.04 0.00 0.00 177.00 176.87 2dd5 s LYS 221 N -1.95 -0.00 0.18 4.56 1.02 -1.26 -4.66 119.74 117.62 2dd5 s LYS 221 Ca 0.51 0.16 -0.33 0.00 0.02 0.00 0.00 55.97 56.33 2dd5 s LYS 221 Cb -0.44 -0.25 -0.15 0.00 -0.52 0.00 0.00 37.83 36.48 2dd5 s LYS 221 CO 0.59 -0.15 1.37 -2.30 -0.92 0.00 0.00 175.35 173.94 2dd5 n PRO 222 N 4.08 1.67 0.00 -1.68 -0.02 -1.26 -0.99 135.00 136.80 2dd5 n PRO 222 Ca -0.26 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 2dd5 n PRO 222 Cb 0.51 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 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 2.47 2.41 3.36 -1.23 0.00 -1.26 -5.00 105.19 105.95 2dd5 n GLY 223 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.25 4.81 -0.38 -0.61 -1.09 -0.16 -4.91 121.20 116.61 2dd5 s ILE 224 Ca 0.00 -1.06 0.08 0.00 -2.23 0.00 0.00 60.65 57.45 2dd5 s ILE 224 Cb 0.00 -3.82 0.21 0.00 -1.58 0.00 0.00 42.46 37.27 2dd5 s ILE 224 CO 0.00 -0.44 1.16 0.35 -1.23 0.00 0.00 174.94 174.78 2dd5 n THR 225 N 5.07 1.27 -4.00 2.92 -2.24 -1.26 -4.34 114.28 111.69 2dd5 n THR 225 Ca -0.11 -1.26 -0.08 0.00 -2.27 0.00 0.00 64.05 60.32 2dd5 n THR 225 Cb 0.44 0.32 -0.10 0.00 -2.10 0.00 0.00 70.33 68.89 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 -1.45 0.16 0.67 2.28 -7.23 -1.26 -4.88 120.40 108.69 2dd5 s VAL 226 Ca 0.18 -1.34 -0.17 0.00 -1.81 0.00 0.00 61.98 58.84 2dd5 s VAL 226 Cb 0.12 -0.99 0.00 0.00 0.56 0.00 0.00 36.38 36.07 2dd5 s VAL 226 CO 0.07 -0.74 1.26 0.20 -0.31 0.00 0.00 175.10 175.58 2dd5 s ASN 227 N -2.30 4.50 0.28 4.85 0.01 -1.26 -4.89 114.94 116.13 2dd5 s ASN 227 Ca -0.03 2.52 -0.30 0.00 -0.71 0.00 0.00 52.86 54.34 2dd5 s ASN 227 Cb 0.00 -2.61 -0.13 0.00 0.41 0.00 0.00 41.25 38.93 2dd5 s ASN 227 CO -0.06 -2.07 1.45 0.00 -1.51 0.00 0.00 177.10 174.91 2dd5 n ALA 228 N -2.15 1.65 -1.88 0.60 0.00 -1.26 -4.88 120.51 112.58 2dd5 n ALA 228 Ca 0.15 0.39 -0.41 0.00 0.00 0.00 0.00 53.44 53.56 2dd5 n ALA 228 Cb 0.49 -2.34 -0.02 0.00 0.00 0.00 0.00 19.45 17.58 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 -0.71 4.25 0.13 0.00 2.20 -1.26 -5.01 119.74 119.34 2dd5 s LYS 229 Ca 0.64 2.32 -0.09 0.00 -0.36 0.00 0.00 55.97 58.49 2dd5 s LYS 229 Cb -0.58 -3.11 -0.01 0.00 -1.51 0.00 0.00 37.83 32.62 2dd5 s LYS 229 CO 0.52 -0.45 0.24 -0.98 -0.36 0.00 0.00 175.35 174.31 2dd5 s ARG 230 N -0.20 1.01 0.41 4.03 1.70 -1.26 -5.13 118.95 119.50 2dd5 s ARG 230 Ca 0.61 -1.08 -0.24 0.00 -0.47 0.00 0.00 55.73 54.54 2dd5 s ARG 230 Cb -0.42 0.36 -0.11 0.00 -0.57 0.00 0.00 34.95 34.20 2dd5 s ARG 230 CO 0.42 -0.35 0.92 -2.30 -1.08 0.00 0.00 175.30 172.91 2dd5 n PRO 231 N -0.14 1.18 -4.01 3.89 -0.02 -1.26 -4.98 135.00 129.66 2dd5 n PRO 231 Ca -0.11 0.42 -0.31 0.00 -2.02 0.00 0.00 63.50 61.48 2dd5 n PRO 231 Cb 0.63 -1.91 -0.15 0.00 -0.02 0.00 0.00 33.50 32.05 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 -1.29 1.87 -0.16 -1.45 1.01 -1.26 -5.09 120.40 114.03 2dd5 s VAL 232 Ca 0.63 -1.44 -0.29 0.00 0.00 0.00 0.00 61.98 60.88 2dd5 s VAL 232 Cb -0.58 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 2dd5 s VAL 232 CO 0.57 -0.06 1.16 -0.22 0.00 0.00 0.00 175.10 176.55 2dd5 s LEU 233 N 1.24 4.18 0.42 3.92 2.96 -1.26 -5.01 118.68 125.13 2dd5 s LEU 233 Ca -0.07 1.61 -0.22 0.00 -0.22 0.00 0.00 54.13 55.22 2dd5 s LEU 233 Cb -0.19 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.85 2dd5 s LEU 233 CO -0.06 -0.67 0.96 -0.54 -1.32 0.00 0.00 176.35 174.73 2dd5 s LYS 234 N 3.03 4.24 0.52 1.98 1.02 -1.26 -5.06 119.74 124.20 2dd5 s LYS 234 Ca 0.51 1.20 -0.04 0.00 0.02 0.00 0.00 55.97 57.67 2dd5 s LYS 234 Cb -0.20 -2.30 -0.01 0.00 -0.52 0.00 0.00 37.83 34.81 2dd5 s LYS 234 CO 0.14 -0.03 0.80 0.00 -0.92 0.00 0.00 175.35 175.34 2dd5 s ALA 235 N -2.03 3.47 0.05 5.17 0.00 -1.26 -5.01 121.76 122.16 2dd5 s ALA 235 Ca 0.60 -0.77 -0.19 0.00 0.00 0.00 0.00 51.96 51.60 2dd5 s ALA 235 Cb -0.12 -2.45 -0.13 0.00 0.00 0.00 0.00 23.12 20.42 2dd5 s ALA 235 CO 0.16 -0.56 1.36 -0.97 0.00 0.00 0.00 175.76 175.75 2dd5 h ASN 236 N 0.10 0.49 -2.41 0.00 -1.24 -2.07 -3.39 115.58 107.06 2dd5 h ASN 236 Ca -0.46 -0.49 -0.58 0.00 0.71 0.00 0.00 56.30 55.48 2dd5 h ASN 236 Cb 1.24 -0.14 -0.38 0.00 0.73 0.00 0.00 38.32 39.78 2dd5 h ASN 236 CO 0.60 0.88 -0.94 -0.60 -1.29 0.00 0.00 177.43 176.08 2dd5 s ARG 237 N -4.27 0.80 0.84 6.67 3.52 -1.26 -5.14 118.95 120.10 2dd5 s ARG 237 Ca -0.14 -1.86 -0.14 0.00 -0.13 0.00 0.00 55.73 53.46 2dd5 s ARG 237 Cb 0.06 -1.36 0.19 0.00 -1.56 0.00 0.00 34.95 32.29 2dd5 s ARG 237 CO 0.78 -1.34 1.15 -0.35 -0.81 0.00 0.00 175.30 174.73 2dd5 n PRO 238 N 3.20 -1.08 0.00 5.12 -0.04 -1.26 -5.25 135.00 135.70 2dd5 n PRO 238 Ca 0.25 -1.83 0.00 0.00 -0.04 0.00 0.00 63.50 61.88 2dd5 n PRO 238 Cb 0.45 -1.16 0.00 0.00 -0.04 0.00 0.00 33.50 32.75 2dd5 n PRO 238 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74