#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dd4 s VAL 24 N 0.00 4.48 0.65 6.31 1.01 -1.26 -5.04 120.40 126.56 2dd4 s VAL 24 Ca 0.00 1.82 -0.05 0.00 0.00 0.00 0.00 61.98 63.75 2dd4 s VAL 24 Cb 0.00 -4.16 0.05 0.00 0.00 0.00 0.00 36.38 32.26 2dd4 s VAL 24 CO 0.00 0.16 0.94 -0.94 0.00 0.00 0.00 175.10 175.26 2dd4 s SER 25 N 0.89 5.01 0.47 3.32 1.04 -1.26 -4.94 113.70 118.23 2dd4 s SER 25 Ca 0.54 0.37 0.18 0.00 0.48 0.00 0.00 55.95 57.52 2dd4 s SER 25 Cb -0.25 -1.12 1.16 0.00 0.10 0.00 0.00 66.02 65.91 2dd4 s SER 25 CO 0.29 -1.43 2.03 0.44 0.98 0.00 0.00 173.24 175.55 2dd4 h ASP 26 N -0.39 0.00 -0.31 7.02 3.32 -1.99 -2.19 116.42 121.89 2dd4 h ASP 26 Ca -0.44 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.48 2dd4 h ASP 26 Cb 1.30 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.85 2dd4 h ASP 26 CO 0.58 0.16 -0.34 -0.26 -1.72 0.00 0.00 179.24 177.67 2dd4 h PHE 27 N 0.00 0.93 -0.41 4.55 0.04 -1.99 -1.62 116.94 118.44 2dd4 h PHE 27 Ca -0.00 -0.29 -0.11 0.00 2.80 0.00 0.00 57.97 60.37 2dd4 h PHE 27 Cb 0.31 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.25 2dd4 h PHE 27 CO 0.00 1.06 -0.19 0.93 -0.60 0.00 0.00 178.31 179.51 2dd4 h GLU 28 N 0.53 0.80 -0.11 1.51 5.08 -1.83 0.62 114.58 121.19 2dd4 h GLU 28 Ca 0.04 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 2dd4 h GLU 28 Cb 0.92 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 2dd4 h GLU 28 CO 0.08 0.93 0.05 0.82 -1.00 0.00 0.00 179.01 179.89 2dd4 h ILE 29 N 0.71 1.13 -0.45 3.13 1.08 -1.35 -2.31 117.51 119.44 2dd4 h ILE 29 Ca 0.10 -0.39 -0.08 0.00 -0.39 0.00 0.00 64.86 64.11 2dd4 h ILE 29 Cb 0.70 1.18 -0.02 0.00 -3.07 0.00 0.00 36.82 35.61 2dd4 h ILE 29 CO 0.05 0.12 -0.05 0.25 -0.69 0.00 0.00 178.15 177.83 2dd4 h LEU 30 N 0.04 0.76 -0.30 1.44 5.85 -1.14 -1.90 115.31 120.06 2dd4 h LEU 30 Ca 0.04 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2dd4 h LEU 30 Cb 0.14 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 2dd4 h LEU 30 CO -0.00 0.86 0.19 -0.08 -0.34 0.00 0.00 178.44 179.06 2dd4 h GLU 31 N 0.72 0.39 -0.58 1.25 4.22 -0.73 -0.07 114.58 119.79 2dd4 h GLU 31 Ca 0.13 -0.03 -0.01 0.00 0.08 0.00 0.00 59.36 59.53 2dd4 h GLU 31 Cb 0.51 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 2dd4 h GLU 31 CO 0.03 0.27 0.32 0.52 -2.18 0.00 0.00 179.01 177.97 2dd4 h MET 32 N 0.39 0.81 -0.10 1.92 2.86 -1.26 -1.18 114.93 118.38 2dd4 h MET 32 Ca 0.11 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2dd4 h MET 32 Cb -0.03 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.47 2dd4 h MET 32 CO -0.02 0.63 0.06 0.00 1.06 0.00 0.00 176.91 178.64 2dd4 h ALA 33 N 1.14 0.12 -0.17 6.32 0.00 -0.92 -0.47 119.26 125.28 2dd4 h ALA 33 Ca 0.20 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2dd4 h ALA 33 Cb 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2dd4 h ALA 33 CO -0.03 -0.38 0.07 0.28 0.00 0.00 0.00 179.25 179.18 2dd4 h VAL 34 N 0.12 1.17 -0.25 0.00 2.07 -0.88 -1.41 116.25 117.06 2dd4 h VAL 34 Ca 0.03 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 2dd4 h VAL 34 Cb -0.00 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2dd4 h VAL 34 CO -0.01 0.16 0.13 -0.09 0.02 0.00 0.00 177.57 177.79 2dd4 h ARG 35 N 0.12 0.36 -0.68 1.57 2.43 -1.14 -0.74 114.38 116.30 2dd4 h ARG 35 Ca 0.06 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 2dd4 h ARG 35 Cb 0.19 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 2dd4 h ARG 35 CO -0.00 0.33 0.31 0.93 -1.51 0.00 0.00 179.97 180.03 2dd4 h GLU 36 N 0.29 1.00 -0.47 0.20 5.08 -1.04 -1.87 114.58 117.76 2dd4 h GLU 36 Ca 0.09 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 2dd4 h GLU 36 Cb 0.08 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2dd4 h GLU 36 CO -0.01 0.80 0.16 -0.07 -1.00 0.00 0.00 179.01 178.89 2dd4 h LEU 37 N 0.96 0.67 -0.79 1.33 3.38 -1.08 0.57 115.31 120.36 2dd4 h LEU 37 Ca 0.23 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2dd4 h LEU 37 Cb 0.15 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 2dd4 h LEU 37 CO -0.03 0.69 0.46 0.00 0.09 0.00 0.00 178.44 179.65 2dd4 h ALA 38 N 1.01 1.01 -0.23 1.53 0.00 -0.93 -0.60 119.26 121.05 2dd4 h ALA 38 Ca 0.15 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2dd4 h ALA 38 Cb 0.24 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2dd4 h ALA 38 CO -0.01 0.49 -0.36 0.82 0.00 0.00 0.00 179.25 180.20 2dd4 h ILE 39 N 1.08 1.32 -0.60 0.00 2.04 -1.15 0.70 117.51 120.90 2dd4 h ILE 39 Ca 0.28 -1.56 -0.01 0.00 1.00 0.00 0.00 64.86 64.58 2dd4 h ILE 39 Cb -0.01 1.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 2dd4 h ILE 39 CO -0.05 0.49 0.35 -0.33 0.00 0.00 0.00 178.15 178.61 2dd4 h GLU 40 N 0.36 0.82 -0.01 2.37 5.08 -0.64 -1.28 114.58 121.29 2dd4 h GLU 40 Ca 0.02 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2dd4 h GLU 40 Cb 0.94 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2dd4 h GLU 40 CO 0.08 0.59 -0.06 1.63 -1.00 0.00 0.00 179.01 180.25 2dd4 n LYS 41 N -4.40 1.12 -1.91 2.33 4.76 -0.25 -4.94 118.16 114.87 2dd4 n LYS 41 Ca 0.06 -0.46 -0.10 0.00 -2.87 0.00 0.00 58.31 54.94 2dd4 n LYS 41 Cb 0.08 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 31.77 2dd4 n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dd4 n GLY 42 N 1.18 0.31 0.21 0.72 0.00 -0.48 -4.93 105.19 102.20 2dd4 n GLY 42 Ca 0.18 -0.52 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 2dd4 n GLY 42 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dd4 h LEU 43 N 0.00 0.76 -7.59 0.99 3.38 -1.12 -3.46 115.31 108.27 2dd4 h LEU 43 Ca -0.22 -0.54 -0.09 0.00 0.09 0.00 0.00 57.88 57.12 2dd4 h LEU 43 Cb 1.01 -0.22 -0.16 0.00 0.09 0.00 0.00 40.66 41.38 2dd4 h LEU 43 CO 0.28 1.15 -0.26 0.72 0.09 0.00 0.00 178.44 180.42 2dd4 s PHE 44 N -4.10 -0.07 0.48 1.13 -0.12 -1.25 -5.06 117.98 108.99 2dd4 s PHE 44 Ca -0.12 -0.12 -0.01 0.00 -0.05 0.00 0.00 56.93 56.63 2dd4 s PHE 44 Cb 0.08 0.08 0.00 0.00 -0.63 0.00 0.00 43.02 42.55 2dd4 s PHE 44 CO 0.84 -0.52 0.72 -1.54 -0.05 0.00 0.00 175.22 174.68 2dd4 s SER 45 N -2.21 5.76 0.35 1.98 1.04 -1.26 -4.13 113.70 115.23 2dd4 s SER 45 Ca -0.03 0.35 0.03 0.00 0.48 0.00 0.00 55.95 56.78 2dd4 s SER 45 Cb -0.00 -1.53 0.65 0.00 0.10 0.00 0.00 66.02 65.24 2dd4 s SER 45 CO -0.05 -0.80 1.98 0.00 0.98 0.00 0.00 173.24 175.35 2dd4 h ALA 46 N 0.27 1.52 -0.43 5.32 0.00 -1.98 -1.73 119.26 122.22 2dd4 h ALA 46 Ca -0.46 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 2dd4 h ALA 46 Cb 1.26 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2dd4 h ALA 46 CO 0.58 0.41 0.13 1.49 0.00 0.00 0.00 179.25 181.86 2dd4 h GLU 47 N 0.73 0.67 -0.67 0.00 4.57 -1.99 -1.90 114.58 115.99 2dd4 h GLU 47 Ca 0.19 -0.14 0.08 0.00 -1.18 0.00 0.00 59.36 58.30 2dd4 h GLU 47 Cb 0.02 -0.10 -0.06 0.00 -0.16 0.00 0.00 28.75 28.45 2dd4 h GLU 47 CO -0.03 0.65 0.34 -0.44 -1.18 0.00 0.00 179.01 178.35 2dd4 h ASP 48 N 0.55 0.47 -0.26 1.04 3.32 -1.71 0.18 116.42 120.01 2dd4 h ASP 48 Ca 0.14 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 2dd4 h ASP 48 Cb 0.26 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2dd4 h ASP 48 CO -0.00 0.29 0.06 -0.74 -1.72 0.00 0.00 179.24 177.12 2dd4 h HIS 49 N 0.61 0.45 -0.58 4.55 2.76 -1.17 -0.51 115.15 121.25 2dd4 h HIS 49 Ca 0.32 -0.06 -0.03 0.00 -2.20 0.00 0.00 60.37 58.41 2dd4 h HIS 49 Cb 0.29 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 29.09 2dd4 h HIS 49 CO -0.10 0.51 0.26 0.00 -1.30 0.00 0.00 177.93 177.30 2dd4 h ARG 50 N 0.25 0.84 -0.87 5.26 3.08 -0.93 -1.79 114.38 120.22 2dd4 h ARG 50 Ca 0.08 -0.14 0.01 0.00 0.07 0.00 0.00 59.98 60.00 2dd4 h ARG 50 Cb 0.30 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.16 2dd4 h ARG 50 CO 0.00 0.71 0.57 0.28 -1.07 0.00 0.00 179.97 180.46 2dd4 h VAL 51 N 0.79 1.23 -0.37 2.04 2.07 -0.45 -0.25 116.25 121.31 2dd4 h VAL 51 Ca 0.20 -0.41 -0.11 0.00 0.82 0.00 0.00 66.70 67.20 2dd4 h VAL 51 Cb 0.16 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 2dd4 h VAL 51 CO -0.02 0.22 -0.18 -0.25 0.02 0.00 0.00 177.57 177.35 2dd4 h TRP 52 N 1.18 0.89 -0.84 1.57 2.91 -0.81 -0.81 115.95 120.04 2dd4 h TRP 52 Ca 0.32 -0.22 -0.03 0.00 1.13 0.00 0.00 58.89 60.09 2dd4 h TRP 52 Cb -0.13 -0.20 -0.04 0.00 -0.51 0.00 0.00 29.16 28.27 2dd4 h TRP 52 CO -0.01 0.96 0.43 0.87 -1.03 0.00 0.00 178.44 179.66 2dd4 h LYS 53 N 0.56 1.20 -0.50 2.65 1.57 -1.02 0.20 116.57 121.23 2dd4 h LYS 53 Ca 0.08 -0.16 -0.11 0.00 -1.87 0.00 0.00 60.65 58.59 2dd4 h LYS 53 Cb 0.73 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 2dd4 h LYS 53 CO 0.06 0.90 -0.14 -0.44 -0.57 0.00 0.00 179.45 179.26 2dd4 h ASP 54 N 1.19 0.96 0.06 0.86 3.32 -0.88 -1.01 116.42 120.93 2dd4 h ASP 54 Ca 0.29 -0.32 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 2dd4 h ASP 54 Cb 0.08 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.37 2dd4 h ASP 54 CO -0.04 1.09 -0.03 0.22 -1.72 0.00 0.00 179.24 178.76 2dd4 h TYR 55 N 0.85 -0.08 -0.96 4.55 3.20 -0.56 -2.43 116.97 121.54 2dd4 h TYR 55 Ca 0.13 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.08 2dd4 h TYR 55 Cb 0.69 0.03 -0.07 0.00 1.54 0.00 0.00 36.73 38.92 2dd4 h TYR 55 CO 0.04 -0.01 0.62 0.28 -1.64 0.00 0.00 178.16 177.45 2dd4 h VAL 56 N -0.13 1.04 0.00 1.81 2.07 -0.82 -0.88 116.25 119.34 2dd4 h VAL 56 Ca -0.01 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 2dd4 h VAL 56 Cb 0.10 -0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 29.75 2dd4 h VAL 56 CO 0.01 0.19 -0.07 -0.74 0.02 0.00 0.00 177.57 176.99 2dd4 h HIS 57 N 1.07 0.00 0.00 1.57 -0.00 -0.72 -1.20 115.15 115.87 2dd4 h HIS 57 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.80 2dd4 h HIS 57 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.67 2dd4 h HIS 57 CO -0.00 0.07 -0.22 0.25 -0.00 0.00 0.00 177.93 178.03 2dd4 n THR 58 N -3.64 0.08 -2.42 6.26 -2.24 -0.35 -4.90 114.28 107.07 2dd4 n THR 58 Ca -0.02 -0.05 -0.33 0.00 -2.27 0.00 0.00 64.05 61.38 2dd4 n THR 58 Cb 0.18 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.15 2dd4 n THR 58 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dd4 s LEU 59 N -3.23 3.69 0.00 3.22 1.43 -0.46 -5.04 118.68 118.29 2dd4 s LEU 59 Ca 0.12 1.70 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 2dd4 s LEU 59 Cb 0.17 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.87 2dd4 s LEU 59 CO 0.61 -0.71 0.00 0.61 0.23 0.00 0.00 176.35 177.09 2dd4 n GLY 60 N -1.06 -1.24 0.19 -3.19 0.00 -1.26 -4.79 105.19 93.85 2dd4 n GLY 60 Ca 0.08 -0.96 0.13 0.00 0.00 0.00 0.00 46.02 45.26 2dd4 n GLY 60 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dd4 n PRO 61 N -0.05 0.73 -0.13 1.61 -0.04 -0.97 -2.89 135.00 133.27 2dd4 n PRO 61 Ca 0.00 -0.38 -0.06 0.00 -0.04 0.00 0.00 63.50 63.02 2dd4 n PRO 61 Cb 0.00 -1.49 0.03 0.00 -0.04 0.00 0.00 33.50 31.99 2dd4 n PRO 61 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2dd4 h LEU 62 N 0.93 0.25 -0.69 1.53 3.38 -1.88 -1.43 115.31 117.41 2dd4 h LEU 62 Ca 0.00 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.02 2dd4 h LEU 62 Cb 0.47 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 2dd4 h LEU 62 CO 0.00 0.18 0.43 -0.65 0.09 0.00 0.00 178.44 178.50 2dd4 h PRO 63 N 0.38 0.83 -0.65 1.13 0.11 -1.78 0.10 132.00 132.12 2dd4 h PRO 63 Ca 0.18 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.17 2dd4 h PRO 63 Cb 0.11 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.01 2dd4 h PRO 63 CO -0.14 0.55 0.14 0.00 -0.21 0.00 0.00 178.00 178.34 2dd4 h ALA 64 N 1.28 0.85 -0.55 -0.75 0.00 -1.28 -0.75 119.26 118.06 2dd4 h ALA 64 Ca 0.27 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2dd4 h ALA 64 Cb -0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2dd4 h ALA 64 CO -0.10 0.58 0.07 0.00 0.00 0.00 0.00 179.25 179.80 2dd4 h ALA 65 N 1.05 1.09 -0.70 0.00 0.00 -0.86 -2.26 119.26 117.58 2dd4 h ALA 65 Ca 0.20 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2dd4 h ALA 65 Cb 0.38 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2dd4 h ALA 65 CO 0.00 0.59 0.15 -0.09 0.00 0.00 0.00 179.25 179.91 2dd4 h ARG 66 N 0.84 1.14 -0.75 0.00 9.65 -0.56 -1.14 114.38 123.56 2dd4 h ARG 66 Ca 0.17 -0.28 -0.05 0.00 -1.10 0.00 0.00 59.98 58.72 2dd4 h ARG 66 Cb 0.40 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 28.80 2dd4 h ARG 66 CO 0.01 1.01 0.27 1.25 2.80 0.00 0.00 179.97 185.31 2dd4 h LEU 67 N 1.07 1.05 -0.27 3.80 6.46 -0.73 -0.03 115.31 126.66 2dd4 h LEU 67 Ca 0.22 -0.18 -0.04 0.00 -0.12 0.00 0.00 57.88 57.77 2dd4 h LEU 67 Cb 0.40 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.04 2dd4 h LEU 67 CO 0.01 0.95 0.02 0.58 -0.62 0.00 0.00 178.44 179.38 2dd4 h VAL 68 N 1.10 1.24 -0.28 1.05 2.07 -1.06 -0.45 116.25 119.91 2dd4 h VAL 68 Ca 0.25 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.94 2dd4 h VAL 68 Cb 0.25 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2dd4 h VAL 68 CO -0.01 0.27 0.16 0.00 0.02 0.00 0.00 177.57 178.00 2dd4 h ALA 69 N 0.84 0.35 -0.91 1.67 0.00 -0.92 0.01 119.26 120.31 2dd4 h ALA 69 Ca 0.08 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2dd4 h ALA 69 Cb 0.37 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2dd4 h ALA 69 CO 0.01 -0.22 0.50 0.87 0.00 0.00 0.00 179.25 180.41 2dd4 h LYS 70 N 0.33 1.26 -0.74 0.00 1.57 -0.91 -1.05 116.57 117.02 2dd4 h LYS 70 Ca 0.11 -0.14 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 2dd4 h LYS 70 Cb 0.01 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.04 2dd4 h LYS 70 CO -0.06 0.92 0.33 0.00 -0.57 0.00 0.00 179.45 180.06 2dd4 h ALA 71 N 1.27 0.96 -0.23 3.86 0.00 -0.52 -0.53 119.26 124.07 2dd4 h ALA 71 Ca 0.32 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2dd4 h ALA 71 Cb 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2dd4 h ALA 71 CO -0.05 0.55 -0.17 -1.49 0.00 0.00 0.00 179.25 178.09 2dd4 h TRP 72 N 1.05 0.43 -0.14 0.00 6.55 -0.45 -2.91 115.95 120.47 2dd4 h TRP 72 Ca 0.25 -0.07 0.00 0.00 0.95 0.00 0.00 58.89 60.02 2dd4 h TRP 72 Cb 0.17 -0.11 0.00 0.00 -0.86 0.00 0.00 29.16 28.35 2dd4 h TRP 72 CO 0.01 0.55 0.00 1.28 -1.05 0.00 0.00 178.44 179.23 2dd4 n LEU 73 N -4.19 1.83 -3.22 -4.49 4.77 -0.45 -4.72 117.00 106.53 2dd4 n LEU 73 Ca -0.00 -0.73 -0.02 0.00 -0.03 0.00 0.00 56.01 55.24 2dd4 n LEU 73 Cb 0.33 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.31 2dd4 n LEU 73 CO 0.40 0.36 0.03 -0.62 -1.33 0.00 0.00 177.39 176.24 2dd4 s ASP 74 N -1.69 -0.87 0.49 -1.43 -1.08 -0.27 -5.03 116.67 106.78 2dd4 s ASP 74 Ca 0.34 -0.32 0.27 0.00 -0.52 0.00 0.00 52.55 52.32 2dd4 s ASP 74 Cb 0.19 1.67 1.34 0.00 -1.46 0.00 0.00 42.92 44.65 2dd4 s ASP 74 CO 0.29 -0.28 1.84 -0.65 0.52 0.00 0.00 175.17 176.89 2dd4 h PRO 75 N 7.74 0.16 -0.20 4.34 0.11 -1.85 -0.08 132.00 142.23 2dd4 h PRO 75 Ca -0.01 -0.01 -0.19 0.00 0.11 0.00 0.00 66.00 65.90 2dd4 h PRO 75 Cb 1.16 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2dd4 h PRO 75 CO 0.17 0.11 -0.63 0.93 -0.21 0.00 0.00 178.00 178.37 2dd4 h GLU 76 N 0.16 0.69 -0.21 1.05 4.39 -1.96 -1.90 114.58 116.80 2dd4 h GLU 76 Ca 0.50 -0.48 -0.14 0.00 0.34 0.00 0.00 59.36 59.58 2dd4 h GLU 76 Cb 1.67 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 30.38 2dd4 h GLU 76 CO -0.10 1.10 -0.44 -0.92 -1.16 0.00 0.00 179.01 177.49 2dd4 h TYR 77 N 0.51 0.64 -0.73 4.33 3.20 -1.41 -2.62 116.97 120.89 2dd4 h TYR 77 Ca -0.01 -0.20 0.01 0.00 3.14 0.00 0.00 58.73 61.67 2dd4 h TYR 77 Cb 1.22 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 39.32 2dd4 h TYR 77 CO 0.06 0.88 0.49 -0.22 -1.64 0.00 0.00 178.16 177.73 2dd4 h LYS 78 N 0.43 0.97 -0.61 1.82 3.64 -1.01 0.34 116.57 122.15 2dd4 h LYS 78 Ca 0.03 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2dd4 h LYS 78 Cb 0.95 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 32.52 2dd4 h LYS 78 CO 0.08 0.64 0.39 0.87 -2.27 0.00 0.00 179.45 179.16 2dd4 h LYS 79 N 1.00 0.76 -0.31 1.90 1.57 -1.13 -1.57 116.57 118.78 2dd4 h LYS 79 Ca 0.27 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 59.01 2dd4 h LYS 79 Cb -0.11 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.01 2dd4 h LYS 79 CO -0.06 0.50 0.20 1.25 -0.57 0.00 0.00 179.45 180.77 2dd4 h LEU 80 N 0.78 0.34 -0.53 2.94 5.85 -0.97 -1.84 115.31 121.88 2dd4 h LEU 80 Ca 0.23 -0.00 0.08 0.00 0.84 0.00 0.00 57.88 59.03 2dd4 h LEU 80 Cb -0.04 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 40.84 2dd4 h LEU 80 CO -0.07 0.24 0.15 0.00 -0.34 0.00 0.00 178.44 178.42 2dd4 h ILE 82 N 0.30 1.25 0.04 0.00 1.08 -0.97 -3.14 117.51 116.07 2dd4 h ILE 82 Ca 0.26 -1.10 -0.32 0.00 -0.39 0.00 0.00 64.86 63.32 2dd4 h ILE 82 Cb 0.33 0.96 -0.04 0.00 -3.07 0.00 0.00 36.82 35.00 2dd4 h ILE 82 CO -0.31 0.38 -1.83 1.21 -0.69 0.00 0.00 178.15 176.92 2dd4 n GLU 83 N -4.19 0.67 -3.32 2.37 4.07 -0.72 -4.69 120.64 114.84 2dd4 n GLU 83 Ca 0.02 0.28 -0.25 0.00 -0.06 0.00 0.00 57.16 57.15 2dd4 n GLU 83 Cb 0.34 -1.76 -0.09 0.00 -0.06 0.00 0.00 31.44 29.87 2dd4 n GLU 83 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2dd4 n ASP 84 N -3.17 -0.73 -0.32 4.31 -0.08 0.22 -4.99 116.55 111.78 2dd4 n ASP 84 Ca -0.22 -2.45 0.05 0.00 -1.51 0.00 0.00 54.79 50.66 2dd4 n ASP 84 Cb 1.05 -0.34 0.25 0.00 2.34 0.00 0.00 41.12 44.42 2dd4 n ASP 84 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2dd4 h GLY 85 N 5.45 1.41 1.00 0.27 0.00 -1.53 -1.07 103.07 108.60 2dd4 h GLY 85 Ca 0.24 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.15 2dd4 h GLY 85 CO 0.34 0.25 0.09 -2.08 0.00 0.00 0.00 176.54 175.15 2dd4 h VAL 86 N 1.01 1.04 -0.45 4.60 2.07 -1.90 0.05 116.25 122.66 2dd4 h VAL 86 Ca 0.43 -0.07 -0.08 0.00 0.82 0.00 0.00 66.70 67.80 2dd4 h VAL 86 Cb 0.32 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 2dd4 h VAL 86 CO -0.18 0.04 -0.02 -0.08 0.02 0.00 0.00 177.57 177.34 2dd4 h GLU 87 N 0.19 0.82 -0.23 1.57 4.57 -1.82 -2.95 114.58 116.73 2dd4 h GLU 87 Ca 0.05 -0.27 -0.05 0.00 -1.18 0.00 0.00 59.36 57.91 2dd4 h GLU 87 Cb -0.02 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 2dd4 h GLU 87 CO -0.01 0.89 -0.09 0.00 -1.18 0.00 0.00 179.01 178.62 2dd4 h ALA 88 N 0.90 1.43 -0.11 2.92 0.00 -1.04 -2.68 119.26 120.69 2dd4 h ALA 88 Ca 0.13 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2dd4 h ALA 88 Cb 0.53 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2dd4 h ALA 88 CO 0.03 0.40 0.06 1.03 0.00 0.00 0.00 179.25 180.76 2dd4 h SER 89 N 0.34 0.13 -0.32 0.00 0.87 -0.80 -1.86 113.55 111.91 2dd4 h SER 89 Ca 0.07 -0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.69 2dd4 h SER 89 Cb 0.37 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 2dd4 h SER 89 CO 0.02 0.10 0.22 0.11 -0.53 0.00 0.00 176.83 176.75 2dd4 h LYS 90 N 0.15 0.14 0.00 2.24 1.57 -1.40 -1.47 116.57 117.80 2dd4 h LYS 90 Ca 0.04 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2dd4 h LYS 90 Cb 0.00 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 2dd4 h LYS 90 CO -0.01 0.09 -0.03 0.00 -0.57 0.00 0.00 179.45 178.93 2dd4 h ALA 91 N 1.83 1.11 -0.42 3.86 0.00 -1.49 -2.07 119.26 122.07 2dd4 h ALA 91 Ca 0.15 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 2dd4 h ALA 91 Cb 0.40 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 2dd4 h ALA 91 CO -0.02 0.04 0.06 1.33 0.00 0.00 0.00 179.25 180.66 2dd4 n VAL 92 N -3.27 2.54 -0.99 0.00 0.24 -0.58 -4.94 118.33 111.34 2dd4 n VAL 92 Ca -0.02 -2.05 0.00 0.00 -2.04 0.00 0.00 64.34 60.23 2dd4 n VAL 92 Cb 0.17 -0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.24 2dd4 n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dd4 n GLY 93 N -0.60 0.61 3.15 7.63 0.00 -0.78 -4.82 105.19 110.38 2dd4 n GLY 93 Ca 0.30 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.96 2dd4 n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dd4 s VAL 94 N -2.50 3.41 -0.41 1.61 1.01 -1.06 -5.00 120.40 117.46 2dd4 s VAL 94 Ca 0.00 -1.89 -0.16 0.00 0.00 0.00 0.00 61.98 59.92 2dd4 s VAL 94 Cb 0.00 -3.26 0.02 0.00 0.00 0.00 0.00 36.38 33.14 2dd4 s VAL 94 CO 0.00 -0.61 0.38 0.21 0.00 0.00 0.00 175.10 175.08 2dd4 s ASN 95 N 1.85 6.16 0.66 3.32 3.84 -1.26 -3.06 114.94 126.45 2dd4 s ASN 95 Ca 0.06 -0.73 0.43 0.00 0.21 0.00 0.00 52.86 52.82 2dd4 s ASN 95 Cb -0.23 -2.20 2.33 0.00 -0.55 0.00 0.00 41.25 40.61 2dd4 s ASN 95 CO -0.03 -0.52 2.33 -0.50 -2.79 0.00 0.00 177.10 175.59 2dd4 h TRP 96 N 8.68 0.00 0.01 0.43 4.06 -1.94 0.13 115.95 127.32 2dd4 h TRP 96 Ca -0.27 0.00 -0.32 0.00 2.06 0.00 0.00 58.89 60.36 2dd4 h TRP 96 Cb 1.12 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.23 2dd4 h TRP 96 CO 0.60 0.00 -1.75 0.28 -3.56 0.00 0.00 178.44 174.01 2dd4 n VAL 97 N -3.13 1.55 0.47 1.49 0.31 -1.26 -3.58 118.33 114.18 2dd4 n VAL 97 Ca -0.03 -0.20 0.11 0.00 -0.01 0.00 0.00 64.34 64.20 2dd4 n VAL 97 Cb 0.10 -1.95 -0.09 0.00 -0.91 0.00 0.00 33.84 30.99 2dd4 n VAL 97 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2dd4 n THR 98 N -4.26 0.07 -0.17 2.52 -2.24 -1.15 -1.56 114.28 107.49 2dd4 n THR 98 Ca -0.39 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.02 2dd4 n THR 98 Cb 0.78 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.38 2dd4 n THR 98 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2dd4 h SER 99 N 0.00 0.86 -4.23 3.42 0.02 -1.02 -3.44 113.55 109.16 2dd4 h SER 99 Ca 0.00 -0.31 -0.52 0.00 -0.84 0.00 0.00 61.79 60.12 2dd4 h SER 99 Cb 0.77 -0.23 0.13 0.00 0.14 0.00 0.00 62.40 63.20 2dd4 h SER 99 CO 0.00 0.97 0.35 -2.84 -1.14 0.00 0.00 176.83 174.16 2dd4 s PRO 100 N -4.99 2.34 0.61 3.45 0.02 -1.26 -4.91 135.00 130.25 2dd4 s PRO 100 Ca -0.12 1.41 0.32 0.00 0.02 0.00 0.00 61.00 62.63 2dd4 s PRO 100 Cb 0.12 -1.89 1.87 0.00 0.02 0.00 0.00 34.50 34.62 2dd4 s PRO 100 CO 0.83 -1.61 2.22 -1.35 -0.33 0.00 0.00 177.00 176.75 2dd4 h PRO 101 N -0.55 0.00 -0.10 5.54 0.11 -1.93 -3.03 132.00 132.04 2dd4 h PRO 101 Ca -0.46 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.50 2dd4 h PRO 101 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2dd4 h PRO 101 CO 0.51 0.00 -0.60 1.79 -0.21 0.00 0.00 178.00 179.50 2dd4 h THR 102 N 0.00 1.36 -0.06 -1.15 1.35 -1.90 -3.47 112.91 109.04 2dd4 h THR 102 Ca 0.02 -1.93 -0.02 0.00 -0.55 0.00 0.00 66.41 63.93 2dd4 h THR 102 Cb 0.16 1.94 -0.01 0.00 -1.73 0.00 0.00 68.15 68.51 2dd4 h THR 102 CO -0.00 0.58 -0.02 0.00 -0.25 0.00 0.00 175.52 175.83 2dd4 n GLN 103 N -3.90 -0.16 -0.97 4.72 1.13 -1.15 -4.82 117.38 112.24 2dd4 n GLN 103 Ca -0.03 0.36 0.00 0.00 -1.94 0.00 0.00 57.00 55.40 2dd4 n GLN 103 Cb 0.62 -3.77 -0.00 0.00 0.11 0.00 0.00 30.24 27.19 2dd4 n GLN 103 CO 0.00 0.00 0.00 1.97 -1.44 0.00 0.00 177.06 177.59 2dd4 n PHE 104 N -2.93 0.00 0.00 1.08 1.16 -1.00 -4.72 117.46 111.04 2dd4 n PHE 104 Ca -0.01 -0.28 0.00 0.00 -1.87 0.00 0.00 57.45 55.29 2dd4 n PHE 104 Cb 0.06 0.05 0.00 0.00 -1.61 0.00 0.00 39.48 37.97 2dd4 n PHE 104 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2dd4 n GLY 105 N 0.19 -2.29 3.77 4.97 0.00 -0.60 -4.87 105.19 106.36 2dd4 n GLY 105 Ca -0.02 -1.48 -0.37 0.00 0.00 0.00 0.00 46.02 44.15 2dd4 n GLY 105 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dd4 s THR 106 N -2.55 2.88 0.37 2.61 -4.23 -1.26 -4.68 115.64 108.78 2dd4 s THR 106 Ca 0.00 0.64 0.05 0.00 -1.18 0.00 0.00 61.69 61.19 2dd4 s THR 106 Cb 0.00 -3.31 0.23 0.00 1.34 0.00 0.00 72.50 70.76 2dd4 s THR 106 CO 0.00 -0.03 1.99 -0.65 -0.54 0.00 0.00 174.62 175.38 2dd4 h PRO 107 N 1.73 0.62 0.00 3.99 0.11 -1.95 -2.76 132.00 133.74 2dd4 h PRO 107 Ca -0.50 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 65.52 2dd4 h PRO 107 Cb 1.26 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2dd4 h PRO 107 CO 0.59 0.48 -1.50 0.43 -0.21 0.00 0.00 178.00 177.78 2dd4 n SER 108 N -4.40 0.46 -0.00 -2.05 7.64 -1.26 -4.40 113.62 109.61 2dd4 n SER 108 Ca 0.03 0.18 0.11 0.00 1.01 0.00 0.00 58.87 60.20 2dd4 n SER 108 Cb 0.11 1.11 -0.14 0.00 -1.01 0.00 0.00 64.21 64.28 2dd4 n SER 108 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2dd4 n ASP 109 N -2.52 0.38 -0.67 6.43 8.00 -1.23 -4.93 116.55 122.01 2dd4 n ASP 109 Ca -0.03 -0.33 0.00 0.00 0.71 0.00 0.00 54.79 55.14 2dd4 n ASP 109 Cb 0.60 1.57 0.00 0.00 -0.02 0.00 0.00 41.12 43.27 2dd4 n ASP 109 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2dd4 n TYR 110 N -2.00 -1.67 -2.54 1.24 4.01 -1.04 -4.58 117.16 110.58 2dd4 n TYR 110 Ca -0.01 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.54 2dd4 n TYR 110 Cb 0.48 0.27 0.01 0.00 -0.31 0.00 0.00 39.34 39.79 2dd4 n TYR 110 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dd4 n ASN 112 N -0.33 0.23 -4.74 0.00 2.85 -1.26 -4.93 115.26 107.07 2dd4 n ASN 112 Ca 0.27 -2.64 -0.40 0.00 -0.11 0.00 0.00 54.58 51.70 2dd4 n ASN 112 Cb 0.73 -0.62 -0.05 0.00 1.24 0.00 0.00 39.78 41.09 2dd4 n ASN 112 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 2dd4 s LEU 113 N -0.85 4.50 -0.03 1.20 2.96 -1.26 -2.34 118.68 122.86 2dd4 s LEU 113 Ca 0.34 1.67 0.06 0.00 -0.22 0.00 0.00 54.13 55.98 2dd4 s LEU 113 Cb 0.12 -3.45 -0.01 0.00 0.50 0.00 0.00 46.19 43.35 2dd4 s LEU 113 CO -0.14 -0.00 -0.20 -0.13 -1.32 0.00 0.00 176.35 174.56 2dd4 s ARG 114 N -0.18 1.84 -0.24 1.98 0.52 -0.34 -3.24 118.95 119.28 2dd4 s ARG 114 Ca 0.43 -0.73 -0.08 0.00 -0.52 0.00 0.00 55.73 54.83 2dd4 s ARG 114 Cb -0.22 -1.68 -0.04 0.00 0.52 0.00 0.00 34.95 33.53 2dd4 s ARG 114 CO 0.27 0.38 0.10 0.08 0.02 0.00 0.00 175.30 176.15 2dd4 s VAL 115 N -0.28 4.71 -0.37 3.52 1.01 -1.25 -2.81 120.40 124.92 2dd4 s VAL 115 Ca 0.03 -0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.79 2dd4 s VAL 115 Cb -0.10 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.09 2dd4 s VAL 115 CO 0.01 0.35 0.46 -0.76 0.00 0.00 0.00 175.10 175.16 2dd4 s LEU 116 N 1.29 4.49 -0.27 3.92 1.43 -0.73 -4.50 118.68 124.31 2dd4 s LEU 116 Ca 0.06 -0.24 -0.20 0.00 -1.03 0.00 0.00 54.13 52.71 2dd4 s LEU 116 Cb -0.15 -2.48 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 2dd4 s LEU 116 CO 0.05 -0.48 0.64 0.00 0.23 0.00 0.00 176.35 176.78 2dd4 s ALA 117 N 2.26 3.58 0.79 4.21 0.00 -1.26 -0.66 121.76 130.68 2dd4 s ALA 117 Ca 0.16 -0.50 -0.11 0.00 0.00 0.00 0.00 51.96 51.50 2dd4 s ALA 117 Cb -0.16 -3.06 0.06 0.00 0.00 0.00 0.00 23.12 19.96 2dd4 s ALA 117 CO 0.13 -0.91 1.09 -0.51 0.00 0.00 0.00 175.76 175.57 2dd4 s ASP 118 N 1.53 4.57 0.33 0.00 1.01 -0.16 -4.93 116.67 119.03 2dd4 s ASP 118 Ca 0.26 1.39 -0.08 0.00 0.71 0.00 0.00 52.55 54.83 2dd4 s ASP 118 Cb -0.15 -2.14 0.01 0.00 1.01 0.00 0.00 42.92 41.65 2dd4 s ASP 118 CO 0.10 -1.93 0.55 -0.94 0.21 0.00 0.00 175.17 173.16 2dd4 s SER 119 N -3.84 0.46 0.40 0.27 1.04 0.81 -4.60 113.70 108.25 2dd4 s SER 119 Ca 0.60 -1.27 0.27 0.00 0.48 0.00 0.00 55.95 56.03 2dd4 s SER 119 Cb -0.15 0.69 1.45 0.00 0.10 0.00 0.00 66.02 68.12 2dd4 s SER 119 CO 0.55 -1.35 1.82 -0.65 0.98 0.00 0.00 173.24 174.58 2dd4 h PRO 120 N 2.12 0.00 0.00 4.02 0.11 -2.02 -2.12 132.00 134.10 2dd4 h PRO 120 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2dd4 h PRO 120 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2dd4 h PRO 120 CO 0.38 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.42 2dd4 n THR 121 N -2.44 0.78 -3.72 -1.15 -2.24 -1.26 -4.89 114.28 99.36 2dd4 n THR 121 Ca -0.02 -0.87 -0.13 0.00 -2.27 0.00 0.00 64.05 60.76 2dd4 n THR 121 Cb 0.05 0.62 -0.13 0.00 -2.10 0.00 0.00 70.33 68.76 2dd4 n THR 121 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2dd4 s LEU 122 N -0.78 0.34 -0.08 3.22 2.96 -0.80 -1.23 118.68 122.31 2dd4 s LEU 122 Ca 0.00 0.48 -0.00 0.00 -0.22 0.00 0.00 54.13 54.39 2dd4 s LEU 122 Cb 0.00 0.63 0.02 0.00 0.50 0.00 0.00 46.19 47.35 2dd4 s LEU 122 CO 0.00 -0.18 -0.04 -0.75 -1.32 0.00 0.00 176.35 174.07 2dd4 s LYS 123 N 1.47 0.96 0.05 1.98 2.47 -0.07 -0.13 119.74 126.47 2dd4 s LYS 123 Ca -0.07 -0.07 -0.00 0.00 -1.56 0.00 0.00 55.97 54.27 2dd4 s LYS 123 Cb -0.11 -1.12 -0.04 0.00 -1.46 0.00 0.00 37.83 35.10 2dd4 s LYS 123 CO -0.08 -0.22 0.19 -1.01 0.16 0.00 0.00 175.35 174.39 2dd4 s HIS 124 N 1.57 3.49 -0.06 4.03 3.76 -1.26 -0.48 115.29 126.33 2dd4 s HIS 124 Ca -0.00 0.25 -0.03 0.00 -0.15 0.00 0.00 55.06 55.13 2dd4 s HIS 124 Cb -0.13 -1.76 0.03 0.00 1.11 0.00 0.00 32.58 31.83 2dd4 s HIS 124 CO -0.04 0.59 0.14 0.54 -0.85 0.00 0.00 174.74 175.12 2dd4 s VAL 125 N -1.46 -0.03 0.00 -0.90 0.11 -0.82 -4.48 120.40 112.83 2dd4 s VAL 125 Ca 0.33 0.12 0.01 0.00 -2.93 0.00 0.00 61.98 59.51 2dd4 s VAL 125 Cb -0.13 -0.22 -0.04 0.00 -1.53 0.00 0.00 36.38 34.46 2dd4 s VAL 125 CO 0.25 0.05 0.02 -0.69 -3.33 0.00 0.00 175.10 171.41 2dd4 s VAL 126 N 0.81 4.29 0.18 2.04 1.01 0.20 -1.47 120.40 127.46 2dd4 s VAL 126 Ca -0.06 -0.57 -0.16 0.00 0.00 0.00 0.00 61.98 61.19 2dd4 s VAL 126 Cb -0.08 -2.93 0.02 0.00 0.00 0.00 0.00 36.38 33.39 2dd4 s VAL 126 CO -0.04 0.36 0.46 0.54 0.00 0.00 0.00 175.10 176.42 2dd4 s VAL 127 N -1.12 0.04 -0.41 2.92 0.11 -0.59 -4.92 120.40 116.42 2dd4 s VAL 127 Ca 0.21 -0.90 0.01 0.00 -2.93 0.00 0.00 61.98 58.37 2dd4 s VAL 127 Cb -0.12 -1.61 0.13 0.00 -1.53 0.00 0.00 36.38 33.26 2dd4 s VAL 127 CO 0.12 -0.17 0.22 0.00 -3.33 0.00 0.00 175.10 171.93 2dd4 h THR 129 N 5.30 0.89 0.00 0.00 1.35 -1.86 -2.32 112.91 116.27 2dd4 h THR 129 Ca -0.01 -0.04 -0.04 0.00 -0.55 0.00 0.00 66.41 65.77 2dd4 h THR 129 Cb 0.94 0.75 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 2dd4 h THR 129 CO 0.44 0.02 -0.17 -0.07 -0.25 0.00 0.00 175.52 175.49 2dd4 h LEU 130 N 0.13 0.00 0.00 3.87 3.38 -1.91 -3.47 115.31 117.32 2dd4 h LEU 130 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2dd4 h LEU 130 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2dd4 h LEU 130 CO -0.02 0.17 0.00 0.00 0.09 0.00 0.00 178.44 178.68 2dd4 n SER 132 N 0.00 0.91 -4.55 0.00 3.41 -1.26 -4.60 113.62 107.53 2dd4 n SER 132 Ca 0.00 -2.02 -0.50 0.00 -0.26 0.00 0.00 58.87 56.08 2dd4 n SER 132 Cb 0.00 -0.26 -0.05 0.00 -0.26 0.00 0.00 64.21 63.64 2dd4 n SER 132 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dd4 s TYR 134 N -0.21 -0.35 -1.07 0.00 5.04 -1.26 -4.68 117.35 114.82 2dd4 s TYR 134 Ca 0.76 0.68 -0.08 0.00 -2.44 0.00 0.00 57.07 55.99 2dd4 s TYR 134 Cb -0.93 0.17 -0.11 0.00 0.35 0.00 0.00 41.96 41.43 2dd4 s TYR 134 CO 0.53 -0.38 2.81 -0.35 -1.34 0.00 0.00 175.55 176.82 2dd4 n PRO 135 N 1.68 2.84 -0.29 4.97 -0.04 -1.26 -4.78 135.00 138.11 2dd4 n PRO 135 Ca -0.19 -1.70 0.03 0.00 -0.04 0.00 0.00 63.50 61.60 2dd4 n PRO 135 Cb 0.56 -2.51 0.10 0.00 -0.04 0.00 0.00 33.50 31.62 2dd4 n PRO 135 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dd4 h ARG 136 N 4.95 -0.00 -1.01 0.54 3.08 -1.94 -0.36 114.38 119.63 2dd4 h ARG 136 Ca 0.62 0.00 0.24 0.00 0.07 0.00 0.00 59.98 60.91 2dd4 h ARG 136 Cb 0.49 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.43 2dd4 h ARG 136 CO 1.34 -0.00 0.62 -1.35 -1.07 0.00 0.00 179.97 179.51 2dd4 h PRO 137 N -0.00 0.53 0.00 0.04 0.11 -1.86 0.11 132.00 130.93 2dd4 h PRO 137 Ca 0.40 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.48 2dd4 h PRO 137 Cb 0.61 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.60 2dd4 h PRO 137 CO -0.86 0.35 -1.13 1.51 -0.21 0.00 0.00 178.00 177.66 2dd4 n ILE 138 N -4.78 0.00 0.01 4.15 3.06 -0.79 -4.71 119.36 116.29 2dd4 n ILE 138 Ca 0.26 -0.24 0.01 0.00 -2.50 0.00 0.00 62.75 60.28 2dd4 n ILE 138 Cb 0.76 0.62 -0.01 0.00 0.54 0.00 0.00 39.64 41.55 2dd4 n ILE 138 CO 0.00 0.00 0.00 -0.11 -2.50 0.00 0.00 176.55 173.94 2dd4 n LEU 139 N -1.65 0.01 0.00 9.51 7.94 -0.21 -2.69 117.00 129.91 2dd4 n LEU 139 Ca 0.00 -0.04 0.00 0.00 -1.11 0.00 0.00 56.01 54.87 2dd4 n LEU 139 Cb 0.30 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.25 2dd4 n LEU 139 CO 0.30 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.20 2dd4 n GLY 140 N 2.30 -1.82 3.81 -3.96 0.00 0.34 -2.29 105.19 103.57 2dd4 n GLY 140 Ca -0.00 -2.02 -0.34 0.00 0.00 0.00 0.00 46.02 43.65 2dd4 n GLY 140 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dd4 s GLN 141 N 0.00 4.29 0.51 1.61 2.00 -1.26 -3.92 119.66 122.88 2dd4 s GLN 141 Ca 0.00 1.13 -0.20 0.00 -2.00 0.00 0.00 55.36 54.29 2dd4 s GLN 141 Cb 0.00 -2.34 -0.07 0.00 0.80 0.00 0.00 33.01 31.40 2dd4 s GLN 141 CO 0.00 0.05 1.09 -1.54 -0.50 0.00 0.00 175.29 174.39 2dd4 s SER 142 N -2.06 6.08 0.60 6.67 1.04 -1.26 -5.02 113.70 119.74 2dd4 s SER 142 Ca 0.59 2.06 -0.18 0.00 0.48 0.00 0.00 55.95 58.91 2dd4 s SER 142 Cb -0.11 -2.57 -0.03 0.00 0.10 0.00 0.00 66.02 63.40 2dd4 s SER 142 CO 0.16 -0.97 1.13 -2.84 0.98 0.00 0.00 173.24 171.70 2dd4 s PRO 143 N -3.19 3.09 0.16 4.02 0.02 -1.26 -4.95 135.00 132.89 2dd4 s PRO 143 Ca 0.69 1.54 -0.15 0.00 0.02 0.00 0.00 61.00 63.10 2dd4 s PRO 143 Cb -0.21 -1.98 0.07 0.00 0.02 0.00 0.00 34.50 32.41 2dd4 s PRO 143 CO 0.24 -1.05 1.78 1.49 -0.33 0.00 0.00 177.00 179.13 2dd4 h GLU 144 N 0.69 0.40 0.00 5.54 4.57 -2.01 -2.41 114.58 121.37 2dd4 h GLU 144 Ca -0.49 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 57.63 2dd4 h GLU 144 Cb 1.26 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.75 2dd4 h GLU 144 CO 0.56 0.26 -0.17 0.11 -1.18 0.00 0.00 179.01 178.59 2dd4 h TRP 145 N 0.41 0.00 0.00 0.92 5.08 -1.98 -2.13 115.95 118.25 2dd4 h TRP 145 Ca 0.17 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.10 2dd4 h TRP 145 Cb 0.08 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.24 2dd4 h TRP 145 CO -0.10 0.17 -0.22 -0.92 -1.28 0.00 0.00 178.44 176.08 2dd4 h TYR 146 N 0.00 0.00 0.00 0.12 3.20 -1.81 -1.97 116.97 116.51 2dd4 h TYR 146 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2dd4 h TYR 146 Cb 0.32 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.59 2dd4 h TYR 146 CO 0.00 0.22 -0.39 0.54 -1.64 0.00 0.00 178.16 176.89 2dd4 n ARG 147 N -4.16 0.18 -2.07 1.82 1.74 -0.81 -4.72 116.66 108.65 2dd4 n ARG 147 Ca -0.02 0.08 -0.40 0.00 -0.77 0.00 0.00 57.85 56.74 2dd4 n ARG 147 Cb 0.28 -1.64 -0.01 0.00 -1.02 0.00 0.00 32.46 30.07 2dd4 n ARG 147 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2dd4 s SER 148 N -3.85 6.39 0.41 0.55 1.04 -0.74 -4.91 113.70 112.60 2dd4 s SER 148 Ca 0.09 2.65 0.09 0.00 0.48 0.00 0.00 55.95 59.26 2dd4 s SER 148 Cb 0.15 -2.64 0.89 0.00 0.10 0.00 0.00 66.02 64.52 2dd4 s SER 148 CO 0.67 -0.79 2.02 -0.65 0.98 0.00 0.00 173.24 175.46 2dd4 h PRO 149 N 2.78 0.53 0.35 4.02 0.11 -1.92 -1.67 132.00 136.21 2dd4 h PRO 149 Ca -0.49 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 2dd4 h PRO 149 Cb 1.24 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2dd4 h PRO 149 CO 0.63 0.35 -0.17 -0.97 -0.21 0.00 0.00 178.00 177.63 2dd4 h ASN 150 N 0.54 -0.40 -0.84 -2.05 -0.73 -1.91 0.29 115.58 110.49 2dd4 h ASN 150 Ca 0.21 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.36 2dd4 h ASN 150 Cb 0.15 0.10 -0.04 0.00 0.27 0.00 0.00 38.32 38.81 2dd4 h ASN 150 CO -0.05 -0.28 0.44 0.22 -0.37 0.00 0.00 177.43 177.39 2dd4 h TYR 151 N -0.49 1.17 0.00 0.67 3.20 -1.71 -1.85 116.97 117.96 2dd4 h TYR 151 Ca -0.05 -0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.71 2dd4 h TYR 151 Cb 0.37 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 2dd4 h TYR 151 CO -0.05 0.82 -0.34 0.00 -1.64 0.00 0.00 178.16 176.95 2dd4 h ARG 152 N 1.17 0.00 0.13 1.82 3.08 -1.01 -2.44 114.38 117.13 2dd4 h ARG 152 Ca 0.29 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.13 2dd4 h ARG 152 Cb 0.06 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.12 2dd4 h ARG 152 CO -0.04 0.34 -1.02 0.00 -1.07 0.00 0.00 179.97 178.18 2dd4 h ARG 153 N 0.00 0.28 0.17 0.04 3.08 -0.08 -3.42 114.38 114.44 2dd4 h ARG 153 Ca -0.00 -0.47 -0.31 0.00 0.07 0.00 0.00 59.98 59.26 2dd4 h ARG 153 Cb 0.71 0.18 0.01 0.00 0.08 0.00 0.00 29.97 30.94 2dd4 h ARG 153 CO 0.04 1.23 -1.53 0.00 -1.07 0.00 0.00 179.97 178.64 2dd4 h ARG 154 N -0.36 0.37 -0.70 0.04 3.08 -1.35 -3.41 114.38 112.05 2dd4 h ARG 154 Ca -0.20 -0.63 0.14 0.00 0.07 0.00 0.00 59.98 59.36 2dd4 h ARG 154 Cb 1.68 0.23 -0.10 0.00 0.08 0.00 0.00 29.97 31.86 2dd4 h ARG 154 CO 0.11 1.30 0.17 1.25 -1.07 0.00 0.00 179.97 181.74 2dd4 h LEU 155 N -0.05 0.04 -1.93 3.04 5.85 -1.67 0.21 115.31 120.80 2dd4 h LEU 155 Ca -0.30 0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 2dd4 h LEU 155 Cb 1.97 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 43.17 2dd4 h LEU 155 CO 0.16 -0.01 -0.12 -0.37 -0.34 0.00 0.00 178.44 177.76 2dd4 h VAL 156 N 0.29 0.73 0.00 1.05 -1.51 -1.83 -2.63 116.25 112.34 2dd4 h VAL 156 Ca 0.38 -0.47 -0.33 0.00 -1.23 0.00 0.00 66.70 65.06 2dd4 h VAL 156 Cb 0.62 1.28 -0.06 0.00 -2.13 0.00 0.00 31.29 31.00 2dd4 h VAL 156 CO -0.47 0.11 -2.24 -1.14 -1.23 0.00 0.00 177.57 172.61 2dd4 n ARG 157 N -3.88 0.75 -2.81 5.19 0.63 -0.62 -4.71 116.66 111.20 2dd4 n ARG 157 Ca -0.02 0.09 -0.24 0.00 -0.92 0.00 0.00 57.85 56.76 2dd4 n ARG 157 Cb 0.21 -1.45 -0.02 0.00 0.45 0.00 0.00 32.46 31.66 2dd4 n ARG 157 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2dd4 n TRP 158 N -2.99 2.94 -0.15 -0.14 8.01 0.64 -4.93 117.44 120.82 2dd4 n TRP 158 Ca -0.36 -3.58 -0.05 0.00 -1.31 0.00 0.00 57.50 52.20 2dd4 n TRP 158 Cb 0.96 -0.35 0.04 0.00 -2.01 0.00 0.00 31.31 29.96 2dd4 n TRP 158 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2dd4 h PRO 159 N 2.87 0.43 -0.43 -0.99 0.13 -1.63 -0.81 132.00 131.56 2dd4 h PRO 159 Ca 0.15 -0.03 0.07 0.00 -0.87 0.00 0.00 66.00 65.33 2dd4 h PRO 159 Cb 0.77 -0.10 -0.06 0.00 0.13 0.00 0.00 31.00 31.74 2dd4 h PRO 159 CO 0.74 0.28 0.05 0.00 -0.23 0.00 0.00 178.00 178.84 2dd4 h ARG 160 N 0.44 0.16 -0.29 0.86 2.47 -1.91 0.24 114.38 116.35 2dd4 h ARG 160 Ca 0.20 -0.01 -0.04 0.00 -1.26 0.00 0.00 59.98 58.87 2dd4 h ARG 160 Cb 0.13 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.40 2dd4 h ARG 160 CO -0.16 0.11 0.01 1.96 0.56 0.00 0.00 179.97 182.45 2dd4 h GLN 161 N 0.17 0.50 -0.48 0.04 7.50 -1.87 -1.46 115.11 119.51 2dd4 h GLN 161 Ca 0.21 -0.16 -0.04 0.00 0.50 0.00 0.00 58.65 59.17 2dd4 h GLN 161 Cb 0.29 -0.05 -0.02 0.00 0.05 0.00 0.00 27.48 27.75 2dd4 h GLN 161 CO -0.31 0.65 0.14 0.28 -1.50 0.00 0.00 178.83 178.09 2dd4 h VAL 162 N 0.30 1.23 -0.77 -0.54 2.07 -0.82 -2.28 116.25 115.43 2dd4 h VAL 162 Ca 0.08 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 2dd4 h VAL 162 Cb 0.42 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 2dd4 h VAL 162 CO 0.01 0.28 0.39 -0.07 0.02 0.00 0.00 177.57 178.21 2dd4 h LEU 163 N 0.64 0.98 -1.03 2.57 3.38 -0.48 -1.89 115.31 119.47 2dd4 h LEU 163 Ca 0.15 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2dd4 h LEU 163 Cb 0.28 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 2dd4 h LEU 163 CO -0.00 0.81 0.37 0.00 0.09 0.00 0.00 178.44 179.71 2dd4 h ALA 164 N 1.34 1.25 -0.81 1.53 0.00 -0.92 0.18 119.26 121.83 2dd4 h ALA 164 Ca 0.27 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2dd4 h ALA 164 Cb 0.07 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 2dd4 h ALA 164 CO -0.04 0.59 0.54 0.93 0.00 0.00 0.00 179.25 181.27 2dd4 h GLU 165 N 1.05 1.07 0.00 0.00 5.08 -0.78 0.22 114.58 121.21 2dd4 h GLU 165 Ca 0.26 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2dd4 h GLU 165 Cb 0.09 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.10 2dd4 h GLU 165 CO -0.04 0.71 0.00 1.19 -1.00 0.00 0.00 179.01 179.87 2dd4 n PHE 166 N -4.41 0.00 -0.67 4.33 3.72 -0.53 -4.88 117.46 115.02 2dd4 n PHE 166 Ca 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.49 2dd4 n PHE 166 Cb 0.03 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.27 2dd4 n PHE 166 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dd4 n GLY 167 N 0.86 0.79 3.18 1.37 0.00 0.76 -4.95 105.19 107.21 2dd4 n GLY 167 Ca 0.11 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 2dd4 n GLY 167 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dd4 s LEU 168 N 0.00 2.06 -0.01 0.99 2.96 0.51 -4.97 118.68 120.22 2dd4 s LEU 168 Ca 0.00 -0.56 0.01 0.00 -0.22 0.00 0.00 54.13 53.36 2dd4 s LEU 168 Cb 0.00 -1.38 0.00 0.00 0.50 0.00 0.00 46.19 45.31 2dd4 s LEU 168 CO 0.00 0.12 -0.04 -1.58 -1.32 0.00 0.00 176.35 173.53 2dd4 s GLN 169 N 0.56 0.41 0.22 1.98 0.74 -1.26 -2.43 119.66 119.88 2dd4 s GLN 169 Ca -0.14 -0.14 0.10 0.00 0.05 0.00 0.00 55.36 55.24 2dd4 s GLN 169 Cb -0.17 -0.42 -0.05 0.00 1.10 0.00 0.00 33.01 33.47 2dd4 s GLN 169 CO 0.04 0.06 -0.19 -0.51 -0.55 0.00 0.00 175.29 174.14 2dd4 s LEU 170 N 0.10 2.52 0.47 3.68 2.01 -1.26 -5.11 118.68 121.09 2dd4 s LEU 170 Ca -0.01 -0.95 -0.23 0.00 0.01 0.00 0.00 54.13 52.95 2dd4 s LEU 170 Cb -0.04 -0.97 -0.09 0.00 0.01 0.00 0.00 46.19 45.10 2dd4 s LEU 170 CO -0.00 0.00 1.12 -2.65 1.01 0.00 0.00 176.35 175.83 2dd4 n PRO 171 N -0.17 1.49 0.21 1.29 -0.02 -1.26 -4.86 135.00 131.69 2dd4 n PRO 171 Ca -0.09 0.54 0.11 0.00 -2.02 0.00 0.00 63.50 62.04 2dd4 n PRO 171 Cb 0.58 -2.23 0.67 0.00 -0.02 0.00 0.00 33.50 32.50 2dd4 n PRO 171 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2dd4 h SER 172 N 1.51 0.00 1.83 2.55 4.64 -2.04 -1.67 113.55 120.38 2dd4 h SER 172 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2dd4 h SER 172 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 2dd4 h SER 172 CO 0.57 0.00 0.00 1.05 -0.87 0.00 0.00 176.83 177.58 2dd4 h GLU 173 N 0.00 0.00 -6.85 4.77 9.09 -2.01 -3.45 114.58 116.14 2dd4 h GLU 173 Ca 0.05 0.00 -0.52 0.00 0.05 0.00 0.00 59.36 58.94 2dd4 h GLU 173 Cb 0.20 0.00 0.05 0.00 -1.65 0.00 0.00 28.75 27.35 2dd4 h GLU 173 CO -0.00 0.00 0.60 0.08 0.05 0.00 0.00 179.01 179.74 2dd4 s VAL 174 N -3.25 2.93 -0.34 -1.06 1.01 -0.63 -4.96 120.40 114.10 2dd4 s VAL 174 Ca 0.07 0.92 -0.29 0.00 0.00 0.00 0.00 61.98 62.68 2dd4 s VAL 174 Cb 0.06 -3.58 0.02 0.00 0.00 0.00 0.00 36.38 32.88 2dd4 s VAL 174 CO 0.65 0.21 1.06 -1.58 0.00 0.00 0.00 175.10 175.44 2dd4 s GLN 175 N -1.57 4.00 -0.21 2.72 0.74 -0.37 -4.92 119.66 120.06 2dd4 s GLN 175 Ca 0.49 0.95 -0.17 0.00 0.05 0.00 0.00 55.36 56.68 2dd4 s GLN 175 Cb -0.38 -3.76 -0.04 0.00 1.10 0.00 0.00 33.01 29.93 2dd4 s GLN 175 CO 0.49 -0.96 0.44 0.42 -0.55 0.00 0.00 175.29 175.13 2dd4 s ILE 176 N 3.72 5.17 -0.19 -2.34 -1.09 -1.26 -0.89 121.20 124.31 2dd4 s ILE 176 Ca 0.45 0.78 -0.02 0.00 -2.23 0.00 0.00 60.65 59.63 2dd4 s ILE 176 Cb -0.12 -3.76 0.00 0.00 -1.58 0.00 0.00 42.46 37.00 2dd4 s ILE 176 CO 0.18 0.22 -0.11 -0.60 -1.23 0.00 0.00 174.94 173.39 2dd4 s ARG 177 N 1.48 3.24 -0.20 2.79 3.52 0.36 -4.95 118.95 125.20 2dd4 s ARG 177 Ca 0.20 -0.71 -0.16 0.00 -0.13 0.00 0.00 55.73 54.94 2dd4 s ARG 177 Cb -0.15 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.40 2dd4 s ARG 177 CO 0.09 -0.14 0.40 0.08 -0.81 0.00 0.00 175.30 174.92 2dd4 s VAL 178 N 1.24 5.20 -0.27 7.11 1.01 -1.26 -1.94 120.40 131.50 2dd4 s VAL 178 Ca 0.03 0.71 -0.09 0.00 0.00 0.00 0.00 61.98 62.63 2dd4 s VAL 178 Cb -0.14 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 2dd4 s VAL 178 CO -0.05 0.25 0.11 0.00 0.00 0.00 0.00 175.10 175.42 2dd4 s ALA 179 N 1.28 3.28 -0.49 5.51 0.00 -0.54 -4.97 121.76 125.83 2dd4 s ALA 179 Ca 0.19 -1.15 -0.13 0.00 0.00 0.00 0.00 51.96 50.87 2dd4 s ALA 179 Cb -0.15 -2.23 0.11 0.00 0.00 0.00 0.00 23.12 20.85 2dd4 s ALA 179 CO 0.08 -0.55 0.41 0.34 0.00 0.00 0.00 175.76 176.03 2dd4 s ASP 180 N 1.66 5.98 -1.07 0.00 -1.08 -1.26 -1.54 116.67 119.36 2dd4 s ASP 180 Ca 0.06 -1.70 -0.22 0.00 -0.52 0.00 0.00 52.55 50.17 2dd4 s ASP 180 Cb -0.16 -2.12 0.03 0.00 -1.46 0.00 0.00 42.92 39.21 2dd4 s ASP 180 CO 0.06 -0.73 1.61 -0.94 0.52 0.00 0.00 175.17 175.68 2dd4 s SER 181 N 2.97 6.29 0.00 -0.34 1.04 -0.28 -4.73 113.70 118.66 2dd4 s SER 181 Ca 0.04 -1.55 0.21 0.00 0.48 0.00 0.00 55.95 55.13 2dd4 s SER 181 Cb -0.27 -2.57 0.03 0.00 0.10 0.00 0.00 66.02 63.31 2dd4 s SER 181 CO 0.03 -1.70 1.05 -0.46 0.98 0.00 0.00 173.24 173.13 2dd4 n ASN 182 N 9.82 2.09 0.00 7.02 6.94 -1.26 -4.68 115.26 135.19 2dd4 n ASN 182 Ca 0.38 -1.55 0.00 0.00 -0.02 0.00 0.00 54.58 53.39 2dd4 n ASN 182 Cb 0.49 0.37 0.00 0.00 -2.36 0.00 0.00 39.78 38.29 2dd4 n ASN 182 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dd4 n GLN 183 N 0.22 0.99 0.00 -3.83 1.13 -1.26 -5.03 117.38 109.59 2dd4 n GLN 183 Ca 0.09 0.00 0.14 0.00 -1.94 0.00 0.00 57.00 55.29 2dd4 n GLN 183 Cb 0.45 0.00 0.52 0.00 0.11 0.00 0.00 30.24 31.33 2dd4 n GLN 183 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2dd4 n LYS 184 N 0.00 1.20 -3.25 -1.09 5.02 -1.26 -4.89 118.16 113.89 2dd4 n LYS 184 Ca 0.00 -0.63 -0.39 0.00 -2.02 0.00 0.00 58.31 55.28 2dd4 n LYS 184 Cb 0.00 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.46 2dd4 n LYS 184 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2dd4 s THR 185 N -2.23 4.80 0.03 -0.18 2.01 -1.26 -4.27 115.64 114.54 2dd4 s THR 185 Ca 0.33 1.22 0.07 0.00 0.31 0.00 0.00 61.69 63.63 2dd4 s THR 185 Cb 0.20 -3.91 -0.03 0.00 0.01 0.00 0.00 72.50 68.77 2dd4 s THR 185 CO 0.42 0.51 -0.20 -0.13 -0.69 0.00 0.00 174.62 174.52 2dd4 s ARG 186 N -0.77 2.05 0.20 4.92 1.81 -0.99 -4.73 118.95 121.44 2dd4 s ARG 186 Ca 0.30 -0.98 0.11 0.00 -1.72 0.00 0.00 55.73 53.43 2dd4 s ARG 186 Cb -0.19 -2.15 -0.04 0.00 -0.45 0.00 0.00 34.95 32.11 2dd4 s ARG 186 CO 0.18 0.54 -0.22 0.71 -0.68 0.00 0.00 175.30 175.83 2dd4 s TYR 187 N -0.87 2.18 0.03 -0.53 2.02 -1.26 -1.20 117.35 117.72 2dd4 s TYR 187 Ca 0.13 -0.38 0.02 0.00 -0.37 0.00 0.00 57.07 56.47 2dd4 s TYR 187 Cb -0.10 -1.06 -0.02 0.00 -0.40 0.00 0.00 41.96 40.37 2dd4 s TYR 187 CO 0.04 0.49 -0.07 0.96 -1.57 0.00 0.00 175.55 175.39 2dd4 s ILE 188 N -1.87 0.51 -0.18 2.71 -4.36 -1.12 -4.54 121.20 112.34 2dd4 s ILE 188 Ca 0.21 -0.84 -0.09 0.00 -0.26 0.00 0.00 60.65 59.67 2dd4 s ILE 188 Cb -0.07 -0.54 -0.05 0.00 1.25 0.00 0.00 42.46 43.05 2dd4 s ILE 188 CO 0.10 -0.24 0.12 -0.69 0.24 0.00 0.00 174.94 174.47 2dd4 s VAL 189 N -1.02 5.37 -0.52 8.37 1.01 0.32 -1.77 120.40 132.15 2dd4 s VAL 189 Ca -0.07 0.17 -0.15 0.00 0.00 0.00 0.00 61.98 61.94 2dd4 s VAL 189 Cb -0.08 -3.42 0.12 0.00 0.00 0.00 0.00 36.38 33.01 2dd4 s VAL 189 CO 0.00 0.49 0.47 -0.32 0.00 0.00 0.00 175.10 175.73 2dd4 s MET 190 N 0.02 2.91 0.82 2.72 1.75 0.16 -4.42 119.30 123.25 2dd4 s MET 190 Ca 0.09 -1.69 -0.11 0.00 -1.25 0.00 0.00 55.69 52.74 2dd4 s MET 190 Cb -0.11 -4.22 0.08 0.00 2.84 0.00 0.00 34.83 33.42 2dd4 s MET 190 CO -0.00 -1.28 1.10 -2.14 -0.65 0.00 0.00 175.02 172.04 2dd4 s PRO 191 N 1.57 1.88 0.39 4.11 0.02 -1.26 -0.99 135.00 140.72 2dd4 s PRO 191 Ca 0.03 1.12 -0.25 0.00 0.02 0.00 0.00 61.00 61.92 2dd4 s PRO 191 Cb -0.29 -1.86 -0.09 0.00 0.02 0.00 0.00 34.50 32.29 2dd4 s PRO 191 CO 0.03 -1.89 1.17 0.08 -0.33 0.00 0.00 177.00 176.05 2dd4 s VAL 192 N -2.88 3.18 0.08 3.83 1.01 -1.26 -4.77 120.40 119.58 2dd4 s VAL 192 Ca 0.62 1.00 -0.31 0.00 0.00 0.00 0.00 61.98 63.29 2dd4 s VAL 192 Cb -0.18 -3.57 -0.07 0.00 0.00 0.00 0.00 36.38 32.56 2dd4 s VAL 192 CO 0.57 0.10 1.46 -0.60 0.00 0.00 0.00 175.10 176.63 2dd4 s ARG 193 N -2.25 4.27 0.65 2.72 3.52 -1.26 -4.80 118.95 121.81 2dd4 s ARG 193 Ca 0.56 2.12 -0.13 0.00 -0.13 0.00 0.00 55.73 58.15 2dd4 s ARG 193 Cb -0.31 -3.40 -0.01 0.00 -1.56 0.00 0.00 34.95 29.67 2dd4 s ARG 193 CO 0.39 -0.55 1.06 -1.25 -0.81 0.00 0.00 175.30 174.14 2dd4 s PRO 194 N 1.78 3.06 0.72 5.12 0.04 -1.26 -5.03 135.00 139.42 2dd4 s PRO 194 Ca 0.67 1.11 -0.11 0.00 0.04 0.00 0.00 61.00 62.71 2dd4 s PRO 194 Cb -0.37 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.20 2dd4 s PRO 194 CO 0.30 -1.01 1.07 -1.21 0.04 0.00 0.00 177.00 176.19 2dd4 s GLU 195 N -4.53 2.70 0.00 4.56 2.02 -1.26 -3.97 118.70 118.22 2dd4 s GLU 195 Ca 0.61 1.07 0.00 0.00 0.02 0.00 0.00 54.97 56.68 2dd4 s GLU 195 Cb -0.15 -1.96 0.00 0.00 0.10 0.00 0.00 34.13 32.12 2dd4 s GLU 195 CO 0.46 -1.29 0.00 0.41 0.02 0.00 0.00 175.26 174.85 2dd4 n GLY 196 N -1.55 0.64 0.65 -1.39 0.00 -1.26 -4.77 105.19 97.51 2dd4 n GLY 196 Ca 0.08 -0.55 0.06 0.00 0.00 0.00 0.00 46.02 45.62 2dd4 n GLY 196 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dd4 n THR 197 N -2.59 1.35 -1.99 2.61 -2.24 -1.25 -4.97 114.28 105.20 2dd4 n THR 197 Ca 0.00 -2.07 -0.42 0.00 -2.27 0.00 0.00 64.05 59.29 2dd4 n THR 197 Cb 0.00 0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.33 2dd4 n THR 197 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2dd4 s ASP 198 N -2.58 6.63 0.00 3.42 1.01 -1.26 -2.33 116.67 121.57 2dd4 s ASP 198 Ca 0.30 2.65 0.00 0.00 0.71 0.00 0.00 52.55 56.22 2dd4 s ASP 198 Cb 0.30 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.62 2dd4 s ASP 198 CO -0.06 -0.74 0.00 0.61 0.21 0.00 0.00 175.17 175.20 2dd4 n GLY 199 N 2.63 0.83 3.76 0.21 0.00 -1.26 -5.00 105.19 106.36 2dd4 n GLY 199 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2dd4 n GLY 199 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dd4 s TRP 200 N -3.49 2.46 0.85 1.61 0.52 -0.98 -5.02 118.94 114.89 2dd4 s TRP 200 Ca 0.00 1.45 -0.11 0.00 0.02 0.00 0.00 56.10 57.46 2dd4 s TRP 200 Cb 0.00 -3.62 0.15 0.00 -1.15 0.00 0.00 33.47 28.84 2dd4 s TRP 200 CO 0.00 -2.39 1.19 0.95 0.02 0.00 0.00 176.95 176.71 2dd4 s THR 201 N -1.42 2.07 0.18 2.01 -4.23 -1.26 -4.88 115.64 108.11 2dd4 s THR 201 Ca 0.71 -0.16 -0.12 0.00 -1.18 0.00 0.00 61.69 60.94 2dd4 s THR 201 Cb -0.35 -2.91 0.09 0.00 1.34 0.00 0.00 72.50 70.67 2dd4 s THR 201 CO 0.41 0.00 1.78 -0.08 -0.54 0.00 0.00 174.62 176.19 2dd4 h GLU 202 N -1.18 0.89 -0.68 3.99 4.81 -1.95 -2.06 114.58 118.41 2dd4 h GLU 202 Ca -0.43 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 58.63 2dd4 h GLU 202 Cb 1.27 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 2dd4 h GLU 202 CO 0.46 0.69 0.23 -0.44 -0.73 0.00 0.00 179.01 179.22 2dd4 h ASP 203 N 0.85 0.97 -0.53 1.04 3.32 -1.99 -0.49 116.42 119.59 2dd4 h ASP 203 Ca 0.22 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 2dd4 h ASP 203 Cb 0.08 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 2dd4 h ASP 203 CO -0.03 0.91 0.30 1.56 -1.72 0.00 0.00 179.24 180.26 2dd4 h GLN 204 N 0.98 0.74 -0.16 3.56 4.20 -1.87 -1.90 115.11 120.67 2dd4 h GLN 204 Ca 0.22 -0.08 -0.07 0.00 0.06 0.00 0.00 58.65 58.78 2dd4 h GLN 204 Cb 0.28 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.91 2dd4 h GLN 204 CO -0.01 0.57 -0.18 -0.07 -0.67 0.00 0.00 178.83 178.46 2dd4 h LEU 205 N 0.72 0.43 -1.44 1.46 3.38 -1.19 -3.16 115.31 115.50 2dd4 h LEU 205 Ca 0.19 -0.50 0.06 0.00 0.09 0.00 0.00 57.88 57.72 2dd4 h LEU 205 Cb 0.04 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2dd4 h LEU 205 CO -0.03 0.84 0.44 0.00 0.09 0.00 0.00 178.44 179.78 2dd4 h ALA 206 N 0.60 1.74 -0.12 1.53 0.00 -1.03 -2.08 119.26 119.91 2dd4 h ALA 206 Ca 0.02 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2dd4 h ALA 206 Cb 0.73 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2dd4 h ALA 206 CO 0.04 0.16 0.08 1.49 0.00 0.00 0.00 179.25 181.02 2dd4 h GLU 207 N 0.69 0.09 -0.11 0.00 4.81 -1.31 -2.21 114.58 116.54 2dd4 h GLU 207 Ca 0.29 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 2dd4 h GLU 207 Cb 0.25 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.61 2dd4 h GLU 207 CO -0.09 0.06 0.00 0.44 -0.73 0.00 0.00 179.01 178.69 2dd4 n ILE 208 N -4.52 0.12 -3.21 2.32 -6.64 -0.78 -4.48 119.36 102.17 2dd4 n ILE 208 Ca -0.01 -0.41 -0.46 0.00 -1.77 0.00 0.00 62.75 60.10 2dd4 n ILE 208 Cb 0.13 0.82 -0.02 0.00 -1.44 0.00 0.00 39.64 39.13 2dd4 n ILE 208 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 2dd4 s VAL 209 N -1.88 5.36 0.81 7.28 1.01 -0.83 -4.26 120.40 127.88 2dd4 s VAL 209 Ca 0.34 -2.21 -0.11 0.00 0.00 0.00 0.00 61.98 60.00 2dd4 s VAL 209 Cb 0.20 -4.56 0.09 0.00 0.00 0.00 0.00 36.38 32.12 2dd4 s VAL 209 CO 0.31 -1.17 1.16 0.42 0.00 0.00 0.00 175.10 175.82 2dd4 s THR 210 N 0.90 2.05 0.22 3.92 -4.23 -1.26 -4.62 115.64 112.62 2dd4 s THR 210 Ca 0.22 -0.06 -0.07 0.00 -1.18 0.00 0.00 61.69 60.60 2dd4 s THR 210 Cb -0.09 -2.99 0.17 0.00 1.34 0.00 0.00 72.50 70.93 2dd4 s THR 210 CO -0.09 0.00 1.79 -0.09 -0.54 0.00 0.00 174.62 175.69 2dd4 h ARG 211 N -1.03 0.62 -0.67 3.99 2.43 -1.96 -1.54 114.38 116.22 2dd4 h ARG 211 Ca -0.45 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 2dd4 h ARG 211 Cb 1.32 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.69 2dd4 h ARG 211 CO 0.61 0.41 0.43 -0.44 -1.51 0.00 0.00 179.97 179.47 2dd4 h ASP 212 N 0.64 0.78 -0.25 -3.80 3.32 -1.94 -1.56 116.42 113.60 2dd4 h ASP 212 Ca 0.34 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.27 2dd4 h ASP 212 Cb 0.33 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 2dd4 h ASP 212 CO -0.25 0.58 -0.16 0.00 -1.72 0.00 0.00 179.24 177.69 2dd4 h LEU 214 N 0.61 0.00 0.03 0.00 3.38 -0.70 -2.76 115.31 115.88 2dd4 h LEU 214 Ca 0.10 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.77 2dd4 h LEU 214 Cb 0.62 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 2dd4 h LEU 214 CO 0.04 0.05 -1.72 0.40 0.09 0.00 0.00 178.44 177.31 2dd4 h ILE 215 N 0.00 0.86 0.00 1.22 2.04 -1.04 0.92 117.51 121.51 2dd4 h ILE 215 Ca -0.00 -2.67 0.00 0.00 1.00 0.00 0.00 64.86 63.19 2dd4 h ILE 215 Cb 0.70 2.47 0.00 0.00 -0.74 0.00 0.00 36.82 39.25 2dd4 h ILE 215 CO 0.01 0.60 0.00 0.61 0.00 0.00 0.00 178.15 179.37 2dd4 n GLY 216 N 1.64 0.75 0.17 5.37 0.00 -0.06 -0.63 105.19 112.43 2dd4 n GLY 216 Ca -0.19 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.98 2dd4 n GLY 216 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dd4 n VAL 217 N -1.00 0.01 -3.76 1.61 0.24 -0.96 -4.63 118.33 109.83 2dd4 n VAL 217 Ca 0.00 -0.09 -0.10 0.00 -2.04 0.00 0.00 64.34 62.11 2dd4 n VAL 217 Cb 0.00 -0.13 -0.05 0.00 -1.47 0.00 0.00 33.84 32.18 2dd4 n VAL 217 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dd4 s ALA 218 N -1.99 -0.64 0.10 2.33 0.00 -1.19 -4.64 121.76 115.72 2dd4 s ALA 218 Ca 0.43 -0.35 0.10 0.00 0.00 0.00 0.00 51.96 52.14 2dd4 s ALA 218 Cb 0.21 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 24.04 2dd4 s ALA 218 CO 0.34 -0.67 -0.26 0.14 0.00 0.00 0.00 175.76 175.31 2dd4 s VAL 219 N -3.87 2.12 0.33 0.00 -7.23 -1.26 -4.05 120.40 106.45 2dd4 s VAL 219 Ca 0.08 -1.59 -0.29 0.00 -1.81 0.00 0.00 61.98 58.38 2dd4 s VAL 219 Cb 0.02 -1.86 -0.11 0.00 0.56 0.00 0.00 36.38 34.99 2dd4 s VAL 219 CO -0.07 0.16 1.44 -2.16 -0.31 0.00 0.00 175.10 174.17 2dd4 s PRO 220 N -1.74 4.21 -0.02 4.82 0.04 -1.26 -4.96 135.00 136.09 2dd4 s PRO 220 Ca 0.12 2.42 0.00 0.00 0.04 0.00 0.00 61.00 63.59 2dd4 s PRO 220 Cb -0.10 -3.03 0.02 0.00 0.04 0.00 0.00 34.50 31.43 2dd4 s PRO 220 CO 0.04 -0.42 -0.00 0.15 0.04 0.00 0.00 177.00 176.81 2dd4 s LYS 221 N -1.51 0.24 0.24 4.56 1.02 -1.26 -4.61 119.74 118.41 2dd4 s LYS 221 Ca 0.54 0.05 -0.31 0.00 0.02 0.00 0.00 55.97 56.27 2dd4 s LYS 221 Cb -0.44 -0.39 -0.13 0.00 -0.52 0.00 0.00 37.83 36.36 2dd4 s LYS 221 CO 0.55 -0.10 1.48 -2.30 -0.92 0.00 0.00 175.35 174.07 2dd4 n PRO 222 N 3.88 2.23 0.00 -1.68 -0.02 -1.26 -1.30 135.00 136.86 2dd4 n PRO 222 Ca -0.24 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2dd4 n PRO 222 Cb 0.52 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 2dd4 n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dd4 n GLY 223 N 2.37 2.06 3.33 -1.23 0.00 -1.26 -5.00 105.19 105.46 2dd4 n GLY 223 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 2dd4 n GLY 223 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dd4 s ILE 224 N -2.32 4.32 -0.15 -0.61 -1.09 -0.42 -4.93 121.20 116.00 2dd4 s ILE 224 Ca 0.00 -1.04 0.11 0.00 -2.23 0.00 0.00 60.65 57.49 2dd4 s ILE 224 Cb 0.00 -3.47 0.22 0.00 -1.58 0.00 0.00 42.46 37.63 2dd4 s ILE 224 CO 0.00 -0.28 1.14 0.35 -1.23 0.00 0.00 174.94 174.91 2dd4 n THR 225 N 4.94 1.55 -3.86 2.92 -2.24 -1.26 -4.44 114.28 111.89 2dd4 n THR 225 Ca -0.12 -1.69 -0.11 0.00 -2.27 0.00 0.00 64.05 59.87 2dd4 n THR 225 Cb 0.45 0.07 -0.09 0.00 -2.10 0.00 0.00 70.33 68.66 2dd4 n THR 225 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dd4 s VAL 226 N -2.07 0.09 0.70 2.28 0.11 -1.26 -4.92 120.40 115.34 2dd4 s VAL 226 Ca 0.21 -0.77 -0.16 0.00 -2.93 0.00 0.00 61.98 58.33 2dd4 s VAL 226 Cb 0.18 -0.62 -0.00 0.00 -1.53 0.00 0.00 36.38 34.41 2dd4 s VAL 226 CO 0.04 -0.43 0.97 0.59 -3.33 0.00 0.00 175.10 172.94 2dd4 n ASN 227 N 1.17 0.53 -4.74 3.54 3.02 -1.26 -4.87 115.26 112.64 2dd4 n ASN 227 Ca -0.21 0.69 -0.42 0.00 -0.03 0.00 0.00 54.58 54.61 2dd4 n ASN 227 Cb 0.57 -1.40 -0.01 0.00 -0.61 0.00 0.00 39.78 38.32 2dd4 n ASN 227 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dd4 n ALA 228 N -2.37 2.19 -1.95 5.41 0.00 -1.26 -4.89 120.51 117.63 2dd4 n ALA 228 Ca 0.13 0.36 -0.41 0.00 0.00 0.00 0.00 53.44 53.52 2dd4 n ALA 228 Cb 0.49 -2.40 -0.03 0.00 0.00 0.00 0.00 19.45 17.51 2dd4 n ALA 228 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dd4 s LYS 229 N -1.30 4.34 0.15 0.00 2.20 -1.26 -5.01 119.74 118.86 2dd4 s LYS 229 Ca 0.59 2.16 -0.06 0.00 -0.36 0.00 0.00 55.97 58.29 2dd4 s LYS 229 Cb -0.51 -3.16 -0.02 0.00 -1.51 0.00 0.00 37.83 32.63 2dd4 s LYS 229 CO 0.56 -0.32 0.21 -0.98 -0.36 0.00 0.00 175.35 174.46 2dd4 s ARG 230 N -0.26 1.08 0.46 4.03 1.70 -1.26 -5.13 118.95 119.56 2dd4 s ARG 230 Ca 0.57 -1.27 -0.23 0.00 -0.47 0.00 0.00 55.73 54.34 2dd4 s ARG 230 Cb -0.39 0.33 -0.09 0.00 -0.57 0.00 0.00 34.95 34.23 2dd4 s ARG 230 CO 0.40 -0.37 1.01 -2.30 -1.08 0.00 0.00 175.30 172.97 2dd4 n PRO 231 N -0.17 1.29 -4.08 3.89 -0.02 -1.26 -4.98 135.00 129.66 2dd4 n PRO 231 Ca -0.07 0.47 -0.32 0.00 -2.02 0.00 0.00 63.50 61.56 2dd4 n PRO 231 Cb 0.63 -2.09 -0.16 0.00 -0.02 0.00 0.00 33.50 31.87 2dd4 n PRO 231 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2dd4 s VAL 232 N -1.33 2.02 -0.18 -1.45 1.01 -1.26 -5.09 120.40 114.11 2dd4 s VAL 232 Ca 0.66 -1.14 -0.26 0.00 0.00 0.00 0.00 61.98 61.23 2dd4 s VAL 232 Cb -0.52 -1.95 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 2dd4 s VAL 232 CO 0.55 0.32 0.87 -0.22 0.00 0.00 0.00 175.10 176.62 2dd4 s LEU 233 N 1.26 4.16 0.35 3.92 2.96 -1.26 -5.02 118.68 125.04 2dd4 s LEU 233 Ca 0.00 1.21 -0.26 0.00 -0.22 0.00 0.00 54.13 54.86 2dd4 s LEU 233 Cb -0.15 -3.29 -0.10 0.00 0.50 0.00 0.00 46.19 43.15 2dd4 s LEU 233 CO -0.10 -0.45 0.99 -0.54 -1.32 0.00 0.00 176.35 174.93 2dd4 s LYS 234 N 2.37 4.44 0.52 1.98 1.02 -1.26 -5.05 119.74 123.76 2dd4 s LYS 234 Ca 0.39 1.43 -0.08 0.00 0.02 0.00 0.00 55.97 57.74 2dd4 s LYS 234 Cb -0.16 -2.73 -0.04 0.00 -0.52 0.00 0.00 37.83 34.38 2dd4 s LYS 234 CO 0.11 0.12 0.87 0.00 -0.92 0.00 0.00 175.35 175.53 2dd4 s ALA 235 N -1.60 3.29 0.06 5.17 0.00 -1.26 -4.99 121.76 122.43 2dd4 s ALA 235 Ca 0.53 -0.34 -0.18 0.00 0.00 0.00 0.00 51.96 51.96 2dd4 s ALA 235 Cb -0.21 -2.76 -0.13 0.00 0.00 0.00 0.00 23.12 20.01 2dd4 s ALA 235 CO 0.26 -0.45 1.33 -0.97 0.00 0.00 0.00 175.76 175.94 2dd4 h ASN 236 N 0.10 0.56 -2.61 0.00 -1.24 -2.02 -3.38 115.58 106.99 2dd4 h ASN 236 Ca -0.46 -0.53 -0.59 0.00 0.71 0.00 0.00 56.30 55.43 2dd4 h ASN 236 Cb 1.20 -0.16 -0.39 0.00 0.73 0.00 0.00 38.32 39.70 2dd4 h ASN 236 CO 0.62 0.98 -0.88 -0.60 -1.29 0.00 0.00 177.43 176.26 2dd4 s ARG 237 N -4.13 1.07 0.69 6.67 3.52 -1.26 -5.13 118.95 120.38 2dd4 s ARG 237 Ca -0.13 -2.11 -0.16 0.00 -0.13 0.00 0.00 55.73 53.20 2dd4 s ARG 237 Cb 0.06 -1.74 0.02 0.00 -1.56 0.00 0.00 34.95 31.73 2dd4 s ARG 237 CO 0.80 -1.32 1.18 -1.25 -0.81 0.00 0.00 175.30 173.90 2dd4 s PRO 238 N 0.08 2.45 0.00 5.12 0.04 -1.26 -5.26 135.00 136.18 2dd4 s PRO 238 Ca 0.28 1.66 0.15 0.00 0.04 0.00 0.00 61.00 63.13 2dd4 s PRO 238 Cb -0.05 -1.88 0.89 0.00 0.04 0.00 0.00 34.50 33.50 2dd4 s PRO 238 CO -0.14 -1.57 1.30 0.28 0.04 0.00 0.00 177.00 176.92