#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x64 s MET 1 N 0.00 4.57 -0.13 1.57 1.00 -1.26 -4.44 119.30 120.60 2x64 s MET 1 Ca 0.00 1.81 0.02 0.00 0.00 0.00 0.00 55.69 57.52 2x64 s MET 1 Cb 0.00 -3.23 0.02 0.00 0.00 0.00 0.00 34.83 31.61 2x64 s MET 1 CO 0.00 0.05 -0.17 -1.59 0.00 0.00 0.00 175.02 173.31 2x64 s LYS 2 N -0.69 2.52 -0.26 2.03 0.00 -0.25 -0.40 119.74 122.68 2x64 s LYS 2 Ca 0.49 -0.66 -0.09 0.00 0.00 0.00 0.00 55.97 55.71 2x64 s LYS 2 Cb -0.32 -2.14 -0.04 0.00 0.00 0.00 0.00 37.83 35.33 2x64 s LYS 2 CO 0.38 -0.10 0.11 -1.17 0.00 0.00 0.00 175.35 174.57 2x64 s LEU 3 N 1.08 3.65 -0.42 2.77 2.96 0.29 -0.20 118.68 128.80 2x64 s LEU 3 Ca -0.03 -0.14 -0.25 0.00 -0.22 0.00 0.00 54.13 53.49 2x64 s LEU 3 Cb -0.14 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.57 2x64 s LEU 3 CO -0.05 -0.04 0.90 -0.31 -1.32 0.00 0.00 176.35 175.54 2x64 s TYR 4 N 1.66 2.99 0.35 5.38 1.51 0.17 -0.33 117.35 129.08 2x64 s TYR 4 Ca 0.07 0.50 0.09 0.00 -1.01 0.00 0.00 57.07 56.72 2x64 s TYR 4 Cb -0.15 -3.81 -0.06 0.00 -0.11 0.00 0.00 41.96 37.83 2x64 s TYR 4 CO 0.06 -0.98 -0.04 0.96 -1.11 0.00 0.00 175.55 174.44 2x64 s ILE 5 N 3.59 2.35 -0.07 2.71 -4.36 0.95 -3.41 121.20 122.97 2x64 s ILE 5 Ca 0.36 -2.10 -0.01 0.00 -0.26 0.00 0.00 60.65 58.65 2x64 s ILE 5 Cb -0.11 -2.73 0.03 0.00 1.25 0.00 0.00 42.46 40.89 2x64 s ILE 5 CO 0.23 -0.18 -0.02 -0.32 0.24 0.00 0.00 174.94 174.89 2x64 s MET 6 N -3.66 0.73 -0.02 0.37 -2.45 -1.26 -0.21 119.30 112.81 2x64 s MET 6 Ca 0.34 0.02 -0.36 0.00 -1.25 0.00 0.00 55.69 54.44 2x64 s MET 6 Cb 0.02 -0.98 -0.14 0.00 1.25 0.00 0.00 34.83 34.99 2x64 s MET 6 CO 0.18 -0.24 1.65 -2.30 1.05 0.00 0.00 175.02 175.36 2x64 n PRO 7 N 4.82 1.75 -0.69 4.11 -0.02 -1.26 -1.64 135.00 142.06 2x64 n PRO 7 Ca -0.13 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2x64 n PRO 7 Cb 0.50 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 2x64 n PRO 7 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x64 n GLY 8 N 3.68 1.50 3.74 -1.23 0.00 -1.26 -5.03 105.19 106.58 2x64 n GLY 8 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 2x64 n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x64 s ALA 9 N -3.58 1.31 0.57 4.61 0.00 -0.65 -4.86 121.76 119.16 2x64 s ALA 9 Ca 0.00 -1.01 0.28 0.00 0.00 0.00 0.00 51.96 51.23 2x64 s ALA 9 Cb 0.00 -2.86 1.50 0.00 0.00 0.00 0.00 23.12 21.76 2x64 s ALA 9 CO 0.00 -3.06 1.97 0.00 0.00 0.00 0.00 175.76 174.68 2x64 n SER 11 N -3.97 0.53 0.16 0.00 3.41 -1.26 -1.77 113.62 110.72 2x64 n SER 11 Ca 0.08 0.74 0.00 0.00 -0.26 0.00 0.00 58.87 59.44 2x64 n SER 11 Cb 0.59 -0.81 0.26 0.00 -0.26 0.00 0.00 64.21 63.99 2x64 n SER 11 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2x64 h LEU 12 N 0.00 0.02 -0.57 1.04 5.85 -1.45 -2.73 115.31 117.48 2x64 h LEU 12 Ca 0.00 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2x64 h LEU 12 Cb 0.01 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2x64 h LEU 12 CO 0.00 0.51 0.34 0.00 -0.34 0.00 0.00 178.44 178.94 2x64 h ALA 13 N 1.50 0.73 -0.26 1.25 0.00 -1.56 0.61 119.26 121.52 2x64 h ALA 13 Ca -0.00 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 2x64 h ALA 13 Cb 0.87 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2x64 h ALA 13 CO 0.06 0.22 -0.45 -0.44 0.00 0.00 0.00 179.25 178.64 2x64 h ASP 14 N 0.77 0.74 0.12 0.00 5.19 -1.71 -2.20 116.42 119.32 2x64 h ASP 14 Ca 0.20 -0.35 -0.01 0.00 -0.62 0.00 0.00 57.03 56.25 2x64 h ASP 14 Cb -0.00 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.30 2x64 h ASP 14 CO -0.04 1.08 -0.06 -0.74 -3.12 0.00 0.00 179.24 176.36 2x64 h HIS 15 N 0.55 -0.15 -0.19 4.55 2.76 -1.18 0.41 115.15 121.90 2x64 h HIS 15 Ca 0.03 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.23 2x64 h HIS 15 Cb 1.00 0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.98 2x64 h HIS 15 CO 0.05 -0.02 -0.02 0.82 -1.30 0.00 0.00 177.93 177.46 2x64 h ILE 16 N -0.24 0.85 -0.75 6.26 2.04 -0.84 -2.51 117.51 122.32 2x64 h ILE 16 Ca -0.02 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 2x64 h ILE 16 Cb 0.19 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 2x64 h ILE 16 CO 0.03 0.01 0.37 0.25 0.00 0.00 0.00 178.15 178.81 2x64 h LEU 17 N 0.04 0.97 -1.24 1.44 5.85 -1.25 -1.87 115.31 119.23 2x64 h LEU 17 Ca 0.09 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.76 2x64 h LEU 17 Cb 0.12 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 40.85 2x64 h LEU 17 CO -0.17 0.82 0.55 -0.07 -0.34 0.00 0.00 178.44 179.23 2x64 h LEU 18 N 1.05 0.79 -0.23 2.25 3.38 -0.63 0.50 115.31 122.42 2x64 h LEU 18 Ca 0.26 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.16 2x64 h LEU 18 Cb 0.09 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2x64 h LEU 18 CO -0.04 0.50 -0.18 0.03 0.09 0.00 0.00 178.44 178.84 2x64 h ARG 19 N 0.89 0.53 -0.41 1.13 3.08 -1.09 -3.00 114.38 115.51 2x64 h ARG 19 Ca 0.37 -0.26 -0.03 0.00 0.07 0.00 0.00 59.98 60.13 2x64 h ARG 19 Cb 0.29 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 2x64 h ARG 19 CO -0.14 0.84 0.13 -1.49 -1.07 0.00 0.00 179.97 178.23 2x64 h TRP 20 N 0.22 0.59 0.00 3.04 6.55 -0.65 -2.80 115.95 122.90 2x64 h TRP 20 Ca 0.04 -0.03 -0.03 0.00 0.95 0.00 0.00 58.89 59.82 2x64 h TRP 20 Cb 0.72 -0.18 -0.00 0.00 -0.86 0.00 0.00 29.16 28.83 2x64 h TRP 20 CO 0.07 0.49 -0.16 0.66 -1.05 0.00 0.00 178.44 178.46 2x64 h SER 21 N 0.58 0.00 0.00 -3.49 4.64 -0.88 -3.48 113.55 110.93 2x64 h SER 21 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2x64 h SER 21 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2x64 h SER 21 CO -0.01 0.16 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 2x64 n GLY 22 N 0.36 0.55 3.78 -0.77 0.00 -1.06 -4.54 105.19 103.50 2x64 n GLY 22 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2x64 n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x64 s SER 23 N -2.13 5.90 -0.03 1.61 0.01 -1.19 -5.03 113.70 112.85 2x64 s SER 23 Ca 0.00 2.18 -0.27 0.00 1.31 0.00 0.00 55.95 59.17 2x64 s SER 23 Cb 0.00 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.61 2x64 s SER 23 CO 0.00 -1.09 0.85 -0.44 0.41 0.00 0.00 173.24 172.96 2x64 s SER 24 N -1.70 7.20 0.12 2.44 0.01 -1.26 -4.80 113.70 115.71 2x64 s SER 24 Ca 0.70 1.45 -0.20 0.00 1.31 0.00 0.00 55.95 59.20 2x64 s SER 24 Cb -0.24 -2.50 0.05 0.00 0.21 0.00 0.00 66.02 63.54 2x64 s SER 24 CO 0.28 -0.18 0.51 0.72 0.41 0.00 0.00 173.24 174.97 2x64 s PHE 25 N 0.86 -0.39 0.07 2.43 -0.12 -1.26 -4.29 117.98 115.29 2x64 s PHE 25 Ca 0.45 0.19 0.07 0.00 -0.05 0.00 0.00 56.93 57.59 2x64 s PHE 25 Cb -0.20 0.40 -0.04 0.00 -0.63 0.00 0.00 43.02 42.56 2x64 s PHE 25 CO 0.23 -0.75 -0.15 -0.51 -0.05 0.00 0.00 175.22 174.00 2x64 s ASP 26 N -2.60 4.07 -0.06 1.98 1.01 0.46 -4.95 116.67 116.58 2x64 s ASP 26 Ca 0.00 -0.41 -0.03 0.00 0.71 0.00 0.00 52.55 52.83 2x64 s ASP 26 Cb 0.00 -0.71 -0.04 0.00 1.01 0.00 0.00 42.92 43.18 2x64 s ASP 26 CO -0.10 0.22 0.07 -0.76 0.21 0.00 0.00 175.17 174.82 2x64 s LEU 27 N -1.77 3.94 -0.24 1.23 1.43 -1.26 -0.55 118.68 121.46 2x64 s LEU 27 Ca 0.17 0.23 0.02 0.00 -1.03 0.00 0.00 54.13 53.52 2x64 s LEU 27 Cb -0.11 -2.09 0.06 0.00 0.03 0.00 0.00 46.19 44.08 2x64 s LEU 27 CO 0.09 0.34 -0.08 0.00 0.23 0.00 0.00 176.35 176.93 2x64 s GLN 28 N -1.30 1.89 -0.06 1.70 1.03 0.55 -4.90 119.66 118.58 2x64 s GLN 28 Ca 0.18 -1.09 -0.26 0.00 0.04 0.00 0.00 55.36 54.22 2x64 s GLN 28 Cb -0.12 -2.67 -0.03 0.00 0.03 0.00 0.00 33.01 30.22 2x64 s GLN 28 CO 0.08 -0.56 0.84 -0.06 -2.54 0.00 0.00 175.29 173.04 2x64 s PHE 29 N 1.30 3.58 0.25 9.60 0.40 -1.26 -0.03 117.98 131.81 2x64 s PHE 29 Ca -0.06 1.43 0.10 0.00 -0.60 0.00 0.00 56.93 57.80 2x64 s PHE 29 Cb -0.19 -2.97 -0.05 0.00 0.51 0.00 0.00 43.02 40.32 2x64 s PHE 29 CO -0.06 -0.02 -0.17 -0.51 0.70 0.00 0.00 175.22 175.17 2x64 s LEU 30 N 1.15 2.58 0.44 -0.37 1.43 0.71 -4.94 118.68 119.67 2x64 s LEU 30 Ca 0.44 -1.04 0.06 0.00 -1.03 0.00 0.00 54.13 52.56 2x64 s LEU 30 Cb -0.19 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 45.10 2x64 s LEU 30 CO 0.21 -0.08 0.16 -1.81 0.23 0.00 0.00 176.35 175.06 2x64 s ASP 31 N -3.43 4.34 0.34 2.29 1.01 -1.26 -4.52 116.67 115.45 2x64 s ASP 31 Ca 0.27 -1.20 0.26 0.00 0.71 0.00 0.00 52.55 52.59 2x64 s ASP 31 Cb -0.02 -0.27 1.12 0.00 1.01 0.00 0.00 42.92 44.76 2x64 s ASP 31 CO 0.11 -0.63 1.79 1.12 0.21 0.00 0.00 175.17 177.78 2x64 h HIS 32 N 1.39 0.00 0.00 4.23 -0.00 -2.00 -2.09 115.15 116.68 2x64 h HIS 32 Ca -0.42 0.00 -0.19 0.00 -0.00 0.00 0.00 60.37 59.76 2x64 h HIS 32 Cb 1.26 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.64 2x64 h HIS 32 CO 0.78 0.00 -1.14 0.00 -0.00 0.00 0.00 177.93 177.57 2x64 n GLN 33 N -2.47 0.54 0.27 5.12 0.00 -1.26 -4.19 117.38 115.39 2x64 n GLN 33 Ca 0.01 0.56 0.14 0.00 0.00 0.00 0.00 57.00 57.71 2x64 n GLN 33 Cb 0.24 -1.73 0.77 0.00 0.00 0.00 0.00 30.24 29.51 2x64 n GLN 33 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2x64 h SER 34 N -1.00 0.00 0.07 2.61 4.64 -1.92 -2.40 113.55 115.56 2x64 h SER 34 Ca -0.29 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.90 2x64 h SER 34 Cb 1.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2x64 h SER 34 CO -0.17 0.10 -0.46 0.24 -0.87 0.00 0.00 176.83 175.66 2x64 h MET 35 N 0.00 0.46 -0.01 4.77 2.86 -1.59 -3.06 114.93 118.36 2x64 h MET 35 Ca -0.00 -0.25 0.00 0.00 -2.06 0.00 0.00 59.70 57.39 2x64 h MET 35 Cb 0.30 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2x64 h MET 35 CO 0.01 0.83 -0.01 1.63 1.06 0.00 0.00 176.91 180.43 2x64 n LYS 36 N -4.00 1.42 -2.53 1.72 4.76 -0.92 -4.27 118.16 114.34 2x64 n LYS 36 Ca -0.02 -0.65 -0.35 0.00 -2.87 0.00 0.00 58.31 54.42 2x64 n LYS 36 Cb 0.54 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 32.21 2x64 n LYS 36 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2x64 s ALA 37 N -2.03 2.92 0.52 7.82 0.00 -1.12 -4.90 121.76 124.96 2x64 s ALA 37 Ca 0.40 0.64 0.26 0.00 0.00 0.00 0.00 51.96 53.27 2x64 s ALA 37 Cb 0.21 -3.26 1.59 0.00 0.00 0.00 0.00 23.12 21.66 2x64 s ALA 37 CO 0.36 -0.30 2.17 -1.35 0.00 0.00 0.00 175.76 176.63 2x64 h PRO 38 N 1.80 0.00 -0.22 0.00 0.11 -1.91 -2.17 132.00 129.60 2x64 h PRO 38 Ca -0.49 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2x64 h PRO 38 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2x64 h PRO 38 CO 0.60 0.05 0.11 0.93 -0.21 0.00 0.00 178.00 179.48 2x64 h GLU 39 N 0.00 0.31 0.05 1.05 5.08 -1.93 -2.05 114.58 117.09 2x64 h GLU 39 Ca -0.00 -0.04 -0.23 0.00 -1.00 0.00 0.00 59.36 58.08 2x64 h GLU 39 Cb 0.13 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2x64 h GLU 39 CO 0.01 0.32 -1.07 -0.92 -1.00 0.00 0.00 179.01 176.34 2x64 h TYR 40 N 0.23 0.22 0.00 4.33 3.20 -1.78 -3.23 116.97 119.94 2x64 h TYR 40 Ca 0.08 -0.16 -0.00 0.00 3.14 0.00 0.00 58.73 61.79 2x64 h TYR 40 Cb 0.11 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.37 2x64 h TYR 40 CO -0.03 1.10 -0.02 -0.07 -1.64 0.00 0.00 178.16 177.51 2x64 h LEU 41 N 0.04 0.00 -0.47 2.82 3.38 -1.33 0.14 115.31 119.89 2x64 h LEU 41 Ca -0.06 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.74 2x64 h LEU 41 Cb 1.81 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.54 2x64 h LEU 41 CO 0.16 0.02 -0.75 0.00 0.09 0.00 0.00 178.44 177.95 2x64 h ALA 42 N 1.98 0.71 0.00 1.53 0.00 -1.38 -2.80 119.26 119.30 2x64 h ALA 42 Ca -0.00 -0.66 -0.08 0.00 0.00 0.00 0.00 54.91 54.17 2x64 h ALA 42 Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2x64 h ALA 42 CO 0.00 0.87 -0.46 -0.07 0.00 0.00 0.00 179.25 179.60 2x64 h LEU 43 N 0.08 0.00 -7.40 0.00 3.38 -1.34 -3.44 115.31 106.59 2x64 h LEU 43 Ca -0.02 -0.66 -0.61 0.00 0.09 0.00 0.00 57.88 56.68 2x64 h LEU 43 Cb 1.33 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.68 2x64 h LEU 43 CO 0.11 1.09 -0.75 0.21 0.09 0.00 0.00 178.44 179.19 2x64 s ASN 44 N -6.33 4.22 0.60 -0.43 2.47 0.38 -4.91 114.94 110.95 2x64 s ASN 44 Ca -0.20 -1.73 0.37 0.00 0.42 0.00 0.00 52.86 51.72 2x64 s ASN 44 Cb 0.01 -1.16 1.87 0.00 -1.45 0.00 0.00 41.25 40.52 2x64 s ASN 44 CO 0.55 -0.38 2.19 -0.65 -3.72 0.00 0.00 177.10 175.09 2x64 h PRO 45 N 7.91 0.00 0.00 0.43 0.11 -1.74 -2.37 132.00 136.35 2x64 h PRO 45 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2x64 h PRO 45 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2x64 h PRO 45 CO 0.48 0.03 0.00 0.77 -0.21 0.00 0.00 178.00 179.07 2x64 h SER 46 N 0.00 0.00 -5.88 -2.05 0.02 -1.95 -3.47 113.55 100.22 2x64 h SER 46 Ca -0.00 0.00 -0.39 0.00 -0.84 0.00 0.00 61.79 60.56 2x64 h SER 46 Cb 0.22 0.00 0.11 0.00 0.14 0.00 0.00 62.40 62.88 2x64 h SER 46 CO 0.00 0.00 -0.74 0.61 -1.14 0.00 0.00 176.83 175.56 2x64 n GLY 47 N -0.22 -0.45 3.03 -3.77 0.00 -0.89 -5.02 105.19 97.87 2x64 n GLY 47 Ca 0.01 0.18 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 2x64 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x64 s ALA 48 N -3.37 0.31 0.13 4.61 0.00 -1.26 -4.70 121.76 117.48 2x64 s ALA 48 Ca 0.33 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.51 2x64 s ALA 48 Cb -0.15 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 2x64 s ALA 48 CO 0.75 -0.19 0.28 0.14 0.00 0.00 0.00 175.76 176.75 2x64 s VAL 49 N -2.10 5.32 0.67 0.00 -7.23 -1.26 -4.59 120.40 111.21 2x64 s VAL 49 Ca -0.09 -0.51 -0.10 0.00 -1.81 0.00 0.00 61.98 59.48 2x64 s VAL 49 Cb -0.05 -3.70 0.01 0.00 0.56 0.00 0.00 36.38 33.20 2x64 s VAL 49 CO -0.03 -0.03 1.04 -2.16 -0.31 0.00 0.00 175.10 173.61 2x64 s PRO 50 N -3.00 2.88 -0.07 4.82 0.04 -1.26 -4.72 135.00 133.69 2x64 s PRO 50 Ca 0.36 0.33 -0.04 0.00 0.04 0.00 0.00 61.00 61.69 2x64 s PRO 50 Cb -0.12 -2.09 0.04 0.00 0.04 0.00 0.00 34.50 32.37 2x64 s PRO 50 CO 0.28 -0.94 0.17 0.00 0.04 0.00 0.00 177.00 176.55 2x64 s ALA 51 N -3.26 -0.34 -0.23 8.56 0.00 -1.22 -4.56 121.76 120.72 2x64 s ALA 51 Ca 0.57 0.69 -0.00 0.00 0.00 0.00 0.00 51.96 53.21 2x64 s ALA 51 Cb -0.11 -0.45 0.03 0.00 0.00 0.00 0.00 23.12 22.59 2x64 s ALA 51 CO 0.50 -0.15 -0.11 -1.17 0.00 0.00 0.00 175.76 174.83 2x64 s LEU 52 N 0.96 2.89 -0.26 0.00 2.96 0.61 -0.66 118.68 125.19 2x64 s LEU 52 Ca -0.07 -0.86 -0.13 0.00 -0.22 0.00 0.00 54.13 52.85 2x64 s LEU 52 Cb -0.09 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.96 2x64 s LEU 52 CO -0.05 -0.09 0.30 -1.58 -1.32 0.00 0.00 176.35 173.61 2x64 s GLN 53 N 1.29 4.03 -0.43 1.98 0.74 0.72 -0.53 119.66 127.46 2x64 s GLN 53 Ca 0.01 -0.07 0.04 0.00 0.05 0.00 0.00 55.36 55.38 2x64 s GLN 53 Cb -0.16 -3.63 0.12 0.00 1.10 0.00 0.00 33.01 30.44 2x64 s GLN 53 CO -0.07 -0.17 0.16 0.08 -0.55 0.00 0.00 175.29 174.74 2x64 s VAL 54 N 1.75 2.39 0.00 1.34 1.01 0.40 -1.09 120.40 126.20 2x64 s VAL 54 Ca 0.12 -2.83 0.00 0.00 0.00 0.00 0.00 61.98 59.27 2x64 s VAL 54 Cb -0.15 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.52 2x64 s VAL 54 CO 0.09 -0.71 0.00 0.61 0.00 0.00 0.00 175.10 175.09 2x64 n GLY 55 N 3.66 2.86 0.11 4.51 0.00 -1.26 -2.30 105.19 112.78 2x64 n GLY 55 Ca 0.05 -0.22 0.07 0.00 0.00 0.00 0.00 46.02 45.92 2x64 n GLY 55 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2x64 h ASP 56 N 0.00 0.00 -3.26 1.61 3.32 -1.99 -3.47 116.42 112.63 2x64 h ASP 56 Ca 0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.51 2x64 h ASP 56 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2x64 h ASP 56 CO 0.00 0.22 0.51 0.86 -1.72 0.00 0.00 179.24 179.11 2x64 s TRP 57 N -3.19 3.49 -0.22 4.55 -0.00 -0.97 -5.05 118.94 117.54 2x64 s TRP 57 Ca -0.01 1.46 -0.03 0.00 -0.00 0.00 0.00 56.10 57.52 2x64 s TRP 57 Cb 0.09 -3.29 -0.00 0.00 -0.00 0.00 0.00 33.47 30.27 2x64 s TRP 57 CO 0.79 -0.73 -0.05 0.08 -0.00 0.00 0.00 176.95 177.04 2x64 s VAL 58 N 1.28 3.22 -0.16 5.86 1.01 -1.26 -0.45 120.40 129.90 2x64 s VAL 58 Ca 0.55 -0.61 -0.07 0.00 0.00 0.00 0.00 61.98 61.85 2x64 s VAL 58 Cb -0.25 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 2x64 s VAL 58 CO 0.27 0.39 0.07 -0.22 0.00 0.00 0.00 175.10 175.60 2x64 s LEU 59 N 1.44 3.88 0.00 3.92 2.96 0.31 -4.94 118.68 126.26 2x64 s LEU 59 Ca 0.05 0.15 0.02 0.00 -0.22 0.00 0.00 54.13 54.13 2x64 s LEU 59 Cb -0.15 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.57 2x64 s LEU 59 CO -0.04 0.24 0.19 0.35 -1.32 0.00 0.00 176.35 175.77 2x64 n THR 60 N 3.10 0.00 -3.87 3.68 -2.24 -1.26 -0.28 114.28 113.41 2x64 n THR 60 Ca -0.17 -0.46 -0.36 0.00 -2.27 0.00 0.00 64.05 60.79 2x64 n THR 60 Cb 0.53 1.01 -0.07 0.00 -2.10 0.00 0.00 70.33 69.69 2x64 n THR 60 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2x64 s GLN 61 N -1.02 3.75 0.23 -0.78 -1.52 -1.26 -4.56 119.66 114.50 2x64 s GLN 61 Ca 0.01 -0.21 -0.14 0.00 -1.95 0.00 0.00 55.36 53.07 2x64 s GLN 61 Cb 0.02 -3.25 0.27 0.00 -0.22 0.00 0.00 33.01 29.83 2x64 s GLN 61 CO 0.08 0.53 1.59 -0.91 -0.25 0.00 0.00 175.29 176.34 2x64 h ASN 62 N 5.83 -0.90 -0.73 5.90 -0.26 -1.94 0.78 115.58 124.25 2x64 h ASN 62 Ca -0.47 0.24 -0.03 0.00 -0.56 0.00 0.00 56.30 55.48 2x64 h ASN 62 Cb 1.19 0.54 -0.03 0.00 -1.06 0.00 0.00 38.32 38.95 2x64 h ASN 62 CO 0.66 -0.27 0.35 0.00 -1.06 0.00 0.00 177.43 177.11 2x64 h ALA 63 N 1.57 0.94 -0.22 -0.83 0.00 -1.95 0.13 119.26 118.90 2x64 h ALA 63 Ca 0.34 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2x64 h ALA 63 Cb 0.57 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2x64 h ALA 63 CO -0.80 0.51 -0.26 0.00 0.00 0.00 0.00 179.25 178.70 2x64 h ALA 64 N 1.17 0.33 -0.15 0.00 0.00 -1.46 -2.32 119.26 116.82 2x64 h ALA 64 Ca 0.25 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2x64 h ALA 64 Cb 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2x64 h ALA 64 CO -0.03 0.32 0.06 0.82 0.00 0.00 0.00 179.25 180.41 2x64 h ILE 65 N 0.26 1.16 -0.75 0.00 2.04 0.61 -0.18 117.51 120.65 2x64 h ILE 65 Ca 0.03 -0.50 0.03 0.00 1.00 0.00 0.00 64.86 65.42 2x64 h ILE 65 Cb 0.82 1.21 -0.05 0.00 -0.74 0.00 0.00 36.82 38.07 2x64 h ILE 65 CO 0.06 0.15 0.48 -0.07 0.00 0.00 0.00 178.15 178.77 2x64 h LEU 66 N 0.09 0.78 -0.59 1.44 3.38 -1.03 -0.26 115.31 119.12 2x64 h LEU 66 Ca 0.05 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 2x64 h LEU 66 Cb 0.19 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2x64 h LEU 66 CO -0.00 0.54 -0.34 0.78 0.09 0.00 0.00 178.44 179.51 2x64 h ASN 67 N 0.93 0.78 -0.10 -0.43 2.35 -1.25 -2.01 115.58 115.85 2x64 h ASN 67 Ca 0.30 -0.33 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 2x64 h ASN 67 Cb 0.02 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.17 2x64 h ASN 67 CO -0.11 1.05 0.04 0.22 -1.65 0.00 0.00 177.43 176.97 2x64 h TYR 68 N 0.63 0.15 -0.54 1.19 3.20 -0.57 -0.34 116.97 120.69 2x64 h TYR 68 Ca 0.07 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.97 2x64 h TYR 68 Cb 0.87 -0.05 -0.05 0.00 1.54 0.00 0.00 36.73 39.05 2x64 h TYR 68 CO 0.04 0.28 0.28 0.82 -1.64 0.00 0.00 178.16 177.94 2x64 h ILE 69 N -0.01 0.96 -0.38 1.81 2.04 -1.03 -1.78 117.51 119.12 2x64 h ILE 69 Ca 0.03 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.74 2x64 h ILE 69 Cb 0.19 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 2x64 h ILE 69 CO -0.00 0.10 0.18 0.74 0.00 0.00 0.00 178.15 179.17 2x64 h THR 70 N 0.54 0.98 -0.62 -0.27 2.02 -1.16 -1.81 112.91 112.59 2x64 h THR 70 Ca 0.24 -0.13 -0.00 0.00 0.77 0.00 0.00 66.41 67.29 2x64 h THR 70 Cb 0.15 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 2x64 h THR 70 CO -0.16 0.07 0.37 0.44 0.37 0.00 0.00 175.52 176.60 2x64 h ASP 71 N 0.38 0.74 1.23 4.18 3.32 -0.46 -2.94 116.42 122.86 2x64 h ASP 71 Ca 0.16 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2x64 h ASP 71 Cb 0.07 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.44 2x64 h ASP 71 CO -0.11 0.57 -0.74 0.16 -1.72 0.00 0.00 179.24 177.40 2x64 h ILE 72 N 0.85 0.00 -3.61 0.35 3.07 -1.13 -3.48 117.51 113.56 2x64 h ILE 72 Ca 0.22 -0.97 -0.53 0.00 1.55 0.00 0.00 64.86 65.14 2x64 h ILE 72 Cb -0.03 1.59 0.06 0.00 -0.27 0.00 0.00 36.82 38.18 2x64 h ILE 72 CO -0.04 0.00 0.70 0.00 -1.05 0.00 0.00 178.15 177.76 2x64 s ALA 73 N -3.32 3.56 0.35 0.16 0.00 -0.70 -4.97 121.76 116.85 2x64 s ALA 73 Ca 0.02 1.30 -0.28 0.00 0.00 0.00 0.00 51.96 52.99 2x64 s ALA 73 Cb 0.09 -3.52 -0.11 0.00 0.00 0.00 0.00 23.12 19.58 2x64 s ALA 73 CO 0.76 -0.70 1.42 -2.14 0.00 0.00 0.00 175.76 175.10 2x64 s PRO 74 N -1.01 4.21 0.45 0.00 0.02 -1.26 -4.89 135.00 132.50 2x64 s PRO 74 Ca 0.55 2.43 0.24 0.00 0.02 0.00 0.00 61.00 64.24 2x64 s PRO 74 Cb -0.41 -3.01 1.25 0.00 0.02 0.00 0.00 34.50 32.35 2x64 s PRO 74 CO 0.48 -0.41 1.79 0.00 -0.33 0.00 0.00 177.00 178.53 2x64 h ALA 75 N 3.33 2.51 0.00 -1.55 0.00 -1.95 -0.61 119.26 120.99 2x64 h ALA 75 Ca -0.50 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 2x64 h ALA 75 Cb 1.23 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2x64 h ALA 75 CO 0.66 -0.88 -0.00 1.05 0.00 0.00 0.00 179.25 180.07 2x64 h GLU 76 N 0.26 0.00 0.00 0.00 4.11 -2.00 -1.73 114.58 115.22 2x64 h GLU 76 Ca 0.57 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.00 2x64 h GLU 76 Cb 1.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.97 2x64 h GLU 76 CO -0.20 0.00 0.00 0.00 0.07 0.00 0.00 179.01 178.88 2x64 h ARG 77 N 0.00 0.00 -4.62 1.06 2.47 -1.47 -3.47 114.38 108.35 2x64 h ARG 77 Ca -0.00 0.00 -0.37 0.00 -1.26 0.00 0.00 59.98 58.35 2x64 h ARG 77 Cb 0.01 0.00 0.08 0.00 -1.65 0.00 0.00 29.97 28.42 2x64 h ARG 77 CO 0.00 0.00 -0.58 0.41 0.56 0.00 0.00 179.97 180.36 2x64 n GLY 78 N 0.14 -0.42 0.43 0.04 0.00 -0.65 -4.94 105.19 99.78 2x64 n GLY 78 Ca 0.01 0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.26 2x64 n GLY 78 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x64 n LEU 79 N -4.06 1.65 -0.38 0.99 4.77 -1.26 -4.10 117.00 114.61 2x64 n LEU 79 Ca -0.06 -0.56 0.05 0.00 -0.03 0.00 0.00 56.01 55.41 2x64 n LEU 79 Cb 0.59 -0.05 0.11 0.00 -2.33 0.00 0.00 43.42 41.74 2x64 n LEU 79 CO 0.49 0.30 0.59 -1.20 -1.33 0.00 0.00 177.39 176.25 2x64 n SER 80 N -0.17 2.67 0.00 -1.43 7.64 -1.26 -4.69 113.62 116.38 2x64 n SER 80 Ca 0.11 -2.29 0.00 0.00 1.01 0.00 0.00 58.87 57.71 2x64 n SER 80 Cb 0.42 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 2x64 n SER 80 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2x64 n GLY 81 N -0.24 2.85 0.00 0.23 0.00 -1.26 -1.49 105.19 105.28 2x64 n GLY 81 Ca 0.10 -0.27 0.16 0.00 0.00 0.00 0.00 46.02 46.01 2x64 n GLY 81 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2x64 n ASP 82 N 4.82 0.00 0.00 1.61 5.68 -1.26 -4.90 116.55 122.50 2x64 n ASP 82 Ca 0.00 -0.93 0.00 0.00 -0.50 0.00 0.00 54.79 53.36 2x64 n ASP 82 Cb 0.00 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 2x64 n ASP 82 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x64 n GLY 83 N 0.98 0.74 3.84 6.12 0.00 -0.55 -5.04 105.19 111.27 2x64 n GLY 83 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 2x64 n GLY 83 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x64 s SER 84 N -2.49 3.94 0.20 1.61 1.04 -1.26 -4.89 113.70 111.85 2x64 s SER 84 Ca 0.00 0.86 -0.08 0.00 0.48 0.00 0.00 55.95 57.22 2x64 s SER 84 Cb 0.00 -1.39 0.11 0.00 0.10 0.00 0.00 66.02 64.84 2x64 s SER 84 CO 0.00 -2.27 1.67 -0.07 0.98 0.00 0.00 173.24 173.55 2x64 h LEU 85 N -1.31 1.03 -0.79 2.42 3.38 -1.96 -1.69 115.31 116.39 2x64 h LEU 85 Ca -0.48 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.19 2x64 h LEU 85 Cb 1.33 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2x64 h LEU 85 CO 0.63 1.06 0.40 0.50 0.09 0.00 0.00 178.44 181.12 2x64 h LYS 86 N 0.97 1.12 -0.58 1.13 3.64 -1.98 -0.84 116.57 120.03 2x64 h LYS 86 Ca 0.18 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 2x64 h LYS 86 Cb 0.52 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 2x64 h LYS 86 CO 0.02 0.85 0.24 0.00 -2.27 0.00 0.00 179.45 178.29 2x64 h ALA 87 N 1.21 0.76 -0.05 5.00 0.00 -1.80 -1.10 119.26 123.28 2x64 h ALA 87 Ca 0.27 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2x64 h ALA 87 Cb 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2x64 h ALA 87 CO -0.04 0.37 -0.50 0.00 0.00 0.00 0.00 179.25 179.08 2x64 h ARG 88 N 0.81 0.13 -0.21 0.00 2.47 -1.14 -2.62 114.38 113.81 2x64 h ARG 88 Ca 0.20 -0.07 -0.14 0.00 -1.26 0.00 0.00 59.98 58.70 2x64 h ARG 88 Cb 0.19 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.51 2x64 h ARG 88 CO -0.02 0.60 -0.47 0.00 0.56 0.00 0.00 179.97 180.64 2x64 h ALA 89 N 1.39 0.80 -0.40 0.04 0.00 -0.85 -1.02 119.26 119.22 2x64 h ALA 89 Ca 0.00 -0.47 -0.12 0.00 0.00 0.00 0.00 54.91 54.32 2x64 h ALA 89 Cb 0.92 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2x64 h ALA 89 CO 0.07 0.66 -0.23 0.93 0.00 0.00 0.00 179.25 180.69 2x64 h GLU 90 N 0.43 0.86 -0.14 0.00 4.39 -1.07 -0.49 114.58 118.55 2x64 h GLU 90 Ca 0.02 -0.39 -0.01 0.00 0.34 0.00 0.00 59.36 59.32 2x64 h GLU 90 Cb 0.98 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.61 2x64 h GLU 90 CO 0.09 1.04 0.04 0.82 -1.16 0.00 0.00 179.01 179.83 2x64 h ILE 91 N 0.68 1.19 -0.94 3.13 2.04 -1.41 -3.03 117.51 119.16 2x64 h ILE 91 Ca 0.09 -0.59 0.04 0.00 1.00 0.00 0.00 64.86 65.39 2x64 h ILE 91 Cb 0.80 1.33 -0.06 0.00 -0.74 0.00 0.00 36.82 38.15 2x64 h ILE 91 CO 0.07 0.18 0.61 0.78 0.00 0.00 0.00 178.15 179.78 2x64 h ASN 92 N 0.03 1.02 -0.67 1.72 2.35 -1.04 -0.38 115.58 118.60 2x64 h ASN 92 Ca 0.04 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.70 2x64 h ASN 92 Cb 0.24 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 2x64 h ASN 92 CO -0.00 0.69 0.10 0.08 -1.65 0.00 0.00 177.43 176.65 2x64 h ARG 93 N 1.18 1.11 0.00 0.81 0.11 -1.08 -0.35 114.38 116.18 2x64 h ARG 93 Ca 0.38 -0.30 -0.18 0.00 0.10 0.00 0.00 59.98 59.97 2x64 h ARG 93 Cb 0.01 -0.13 -0.02 0.00 1.11 0.00 0.00 29.97 30.94 2x64 h ARG 93 CO -0.12 1.02 -0.85 -1.49 0.10 0.00 0.00 179.97 178.63 2x64 h TRP 94 N 1.04 0.06 -0.17 4.08 4.06 -1.38 -1.47 115.95 122.18 2x64 h TRP 94 Ca 0.20 -0.04 -0.02 0.00 2.06 0.00 0.00 58.89 61.09 2x64 h TRP 94 Cb 0.46 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.60 2x64 h TRP 94 CO 0.03 0.87 0.02 0.82 -3.56 0.00 0.00 178.44 176.62 2x64 h ILE 95 N 0.02 1.23 -0.21 1.49 2.04 -0.93 -2.96 117.51 118.19 2x64 h ILE 95 Ca -0.02 -0.77 -0.03 0.00 1.00 0.00 0.00 64.86 65.04 2x64 h ILE 95 Cb 1.50 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.98 2x64 h ILE 95 CO 0.11 0.23 -0.00 0.00 0.00 0.00 0.00 178.15 178.49 2x64 h ALA 96 N 0.80 1.60 -0.11 1.87 0.00 -1.00 0.24 119.26 122.66 2x64 h ALA 96 Ca 0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2x64 h ALA 96 Cb 0.33 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2x64 h ALA 96 CO 0.01 0.30 0.07 0.35 0.00 0.00 0.00 179.25 179.97 2x64 h PHE 97 N 0.31 0.14 -0.16 0.00 3.57 -1.17 0.18 116.94 119.81 2x64 h PHE 97 Ca 0.07 -0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.43 2x64 h PHE 97 Cb 0.22 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.92 2x64 h PHE 97 CO 0.00 0.13 -0.45 0.77 -2.23 0.00 0.00 178.31 176.54 2x64 h SER 98 N 0.11 0.67 0.00 0.41 0.02 -1.32 -0.38 113.55 113.07 2x64 h SER 98 Ca 0.04 -0.58 -0.00 0.00 -0.84 0.00 0.00 61.79 60.41 2x64 h SER 98 Cb 0.03 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.37 2x64 h SER 98 CO -0.01 1.14 -0.00 -1.13 -1.14 0.00 0.00 176.83 175.69 2x64 h ASN 99 N 0.24 -0.00 0.00 3.07 -0.00 -0.87 0.37 115.58 118.40 2x64 h ASN 99 Ca -0.01 -0.17 0.00 0.00 -0.00 0.00 0.00 56.30 56.12 2x64 h ASN 99 Cb 1.06 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.38 2x64 h ASN 99 CO 0.10 0.17 -0.83 -1.54 -0.00 0.00 0.00 177.43 175.33 2x64 n SER 100 N -5.01 1.04 -0.06 1.15 3.41 0.64 -4.34 113.62 110.45 2x64 n SER 100 Ca -0.08 -0.55 -0.13 0.00 -0.26 0.00 0.00 58.87 57.85 2x64 n SER 100 Cb 0.11 1.16 -0.04 0.00 -0.26 0.00 0.00 64.21 65.17 2x64 n SER 100 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2x64 n ASP 101 N -1.46 1.20 0.09 4.04 8.00 -0.86 -4.67 116.55 122.89 2x64 n ASP 101 Ca 0.01 0.20 -0.05 0.00 0.71 0.00 0.00 54.79 55.66 2x64 n ASP 101 Cb 0.22 -0.48 -0.02 0.00 -0.02 0.00 0.00 41.12 40.82 2x64 n ASP 101 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2x64 h VAL 102 N -0.54 0.00 -0.55 2.53 2.07 -1.05 -3.33 116.25 115.38 2x64 h VAL 102 Ca -0.29 -0.51 0.11 0.00 0.82 0.00 0.00 66.70 66.83 2x64 h VAL 102 Cb 1.13 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.79 2x64 h VAL 102 CO -0.17 0.00 -0.19 -0.74 0.02 0.00 0.00 177.57 176.49 2x64 h HIS 103 N -0.82 -0.46 0.00 1.57 -0.00 -0.46 -1.68 115.15 113.32 2x64 h HIS 103 Ca -0.03 0.05 -0.01 0.00 -0.00 0.00 0.00 60.37 60.38 2x64 h HIS 103 Cb 0.23 0.29 -0.00 0.00 -0.00 0.00 0.00 27.41 27.93 2x64 h HIS 103 CO 0.02 -0.29 -0.07 -1.35 -0.00 0.00 0.00 177.93 176.25 2x64 h PRO 104 N -0.06 0.00 0.00 5.26 0.11 -1.76 -1.75 132.00 133.81 2x64 h PRO 104 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 2x64 h PRO 104 Cb 0.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.57 2x64 h PRO 104 CO -0.60 0.07 0.00 1.98 -0.21 0.00 0.00 178.00 179.24 2x64 h MET 105 N 0.00 0.00 0.00 1.05 4.05 -1.40 -2.35 114.93 116.27 2x64 h MET 105 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2x64 h MET 105 Cb 0.33 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.13 2x64 h MET 105 CO 0.01 0.00 -0.24 0.66 0.23 0.00 0.00 176.91 177.57 2x64 n TYR 106 N -2.31 0.06 -0.24 1.39 4.01 -0.66 -4.33 117.16 115.09 2x64 n TYR 106 Ca 0.02 0.02 0.04 0.00 -0.16 0.00 0.00 57.90 57.82 2x64 n TYR 106 Cb 0.21 -0.42 0.16 0.00 -0.31 0.00 0.00 39.34 38.98 2x64 n TYR 106 CO 0.00 0.00 0.00 -1.49 -0.46 0.00 0.00 176.86 174.91 2x64 h TRP 107 N 0.00 0.30 0.00 -0.72 6.55 -1.56 -0.79 115.95 119.73 2x64 h TRP 107 Ca 0.00 0.04 -0.07 0.00 0.95 0.00 0.00 58.89 59.81 2x64 h TRP 107 Cb 0.52 -0.02 -0.01 0.00 -0.86 0.00 0.00 29.16 28.79 2x64 h TRP 107 CO 0.00 -0.04 -0.35 0.00 -1.05 0.00 0.00 178.44 176.99 2x64 h ALA 108 N 1.56 1.35 -0.00 1.49 0.00 -1.83 0.11 119.26 121.95 2x64 h ALA 108 Ca 0.39 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2x64 h ALA 108 Cb 0.63 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2x64 h ALA 108 CO -0.46 0.44 -0.14 1.28 0.00 0.00 0.00 179.25 180.37 2x64 n LEU 109 N -4.03 0.27 -1.92 0.00 4.77 -0.36 -3.73 117.00 112.00 2x64 n LEU 109 Ca -0.02 0.20 -0.14 0.00 -0.03 0.00 0.00 56.01 56.02 2x64 n LEU 109 Cb 0.40 -0.31 0.05 0.00 -2.33 0.00 0.00 43.42 41.23 2x64 n LEU 109 CO 0.38 0.06 0.17 0.49 -1.33 0.00 0.00 177.39 177.16 2x64 n PHE 110 N -1.28 1.93 -1.06 -1.77 3.72 -0.86 -4.97 117.46 113.17 2x64 n PHE 110 Ca 0.10 -2.02 -0.02 0.00 -0.05 0.00 0.00 57.45 55.46 2x64 n PHE 110 Cb 0.31 -0.30 -0.01 0.00 -0.94 0.00 0.00 39.48 38.54 2x64 n PHE 110 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2x64 n GLY 111 N -0.70 0.54 0.19 1.37 0.00 -1.22 -4.95 105.19 100.42 2x64 n GLY 111 Ca 0.32 -0.31 0.14 0.00 0.00 0.00 0.00 46.02 46.17 2x64 n GLY 111 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2x64 h GLY 112 N 0.00 0.00 -2.27 -0.02 0.00 -0.98 -3.03 103.07 96.77 2x64 h GLY 112 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 2x64 h GLY 112 CO 0.07 0.00 0.01 -1.30 0.00 0.00 0.00 176.54 175.32 2x64 n THR 113 N -2.57 2.47 0.26 4.70 -2.24 -1.26 -4.66 114.28 110.98 2x64 n THR 113 Ca 0.01 -1.76 0.09 0.00 -2.27 0.00 0.00 64.05 60.13 2x64 n THR 113 Cb 0.26 -0.27 0.69 0.00 -2.10 0.00 0.00 70.33 68.90 2x64 n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2x64 h ALA 114 N 2.46 1.81 -0.10 6.98 0.00 -1.90 -2.24 119.26 126.26 2x64 h ALA 114 Ca 0.02 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.92 2x64 h ALA 114 Cb 1.65 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.43 2x64 h ALA 114 CO 0.33 0.04 0.15 0.10 0.00 0.00 0.00 179.25 179.87 2x64 h TYR 115 N 0.00 0.00 0.00 0.00 -0.00 -1.87 -1.72 116.97 113.39 2x64 h TYR 115 Ca -0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.71 2x64 h TYR 115 Cb 0.07 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.80 2x64 h TYR 115 CO 0.00 0.00 -0.08 -0.07 -0.00 0.00 0.00 178.16 178.01 2x64 h LEU 116 N 0.00 0.00 0.00 0.10 3.38 -1.78 -3.46 115.31 113.54 2x64 h LEU 116 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2x64 h LEU 116 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2x64 h LEU 116 CO -0.00 0.08 0.00 0.00 0.09 0.00 0.00 178.44 178.61 2x64 n GLN 117 N -4.29 0.00 -1.98 1.13 1.13 -0.65 -4.92 117.38 107.79 2x64 n GLN 117 Ca -0.03 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.61 2x64 n GLN 117 Cb 0.16 -0.08 -0.03 0.00 0.11 0.00 0.00 30.24 30.40 2x64 n GLN 117 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2x64 s ASP 118 N 0.00 6.65 0.28 1.08 -1.08 -1.26 -4.94 116.67 117.40 2x64 s ASP 118 Ca 0.00 2.30 -0.01 0.00 -0.52 0.00 0.00 52.55 54.32 2x64 s ASP 118 Cb 0.00 -2.54 0.44 0.00 -1.46 0.00 0.00 42.92 39.37 2x64 s ASP 118 CO 0.00 -0.92 1.90 -0.65 0.52 0.00 0.00 175.17 176.02 2x64 h PRO 119 N 9.31 1.10 -0.61 4.34 0.11 -1.99 -1.22 132.00 143.03 2x64 h PRO 119 Ca -0.40 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 2x64 h PRO 119 Cb 1.19 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 2x64 h PRO 119 CO 0.95 0.73 0.03 1.96 -0.21 0.00 0.00 178.00 181.45 2x64 h GLN 120 N 1.14 1.06 -0.45 1.05 4.20 -1.99 -1.52 115.11 118.60 2x64 h GLN 120 Ca 0.41 -0.33 -0.08 0.00 0.06 0.00 0.00 58.65 58.72 2x64 h GLN 120 Cb 0.14 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 2x64 h GLN 120 CO -0.15 1.03 -0.02 0.52 -0.67 0.00 0.00 178.83 179.53 2x64 h MET 121 N 0.97 0.81 -0.47 1.46 2.86 -1.84 -1.13 114.93 117.58 2x64 h MET 121 Ca 0.18 -0.27 0.01 0.00 -2.06 0.00 0.00 59.70 57.56 2x64 h MET 121 Cb 0.53 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 2x64 h MET 121 CO 0.03 0.88 0.31 0.82 1.06 0.00 0.00 176.91 180.00 2x64 h ILE 122 N 0.65 1.11 -0.85 -1.22 2.04 -1.15 -1.42 117.51 116.67 2x64 h ILE 122 Ca 0.12 -0.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 2x64 h ILE 122 Cb 0.53 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 2x64 h ILE 122 CO 0.03 0.11 0.39 0.00 0.00 0.00 0.00 178.15 178.68 2x64 h ALA 123 N 1.18 1.09 -0.63 1.87 0.00 -1.14 -1.78 119.26 119.85 2x64 h ALA 123 Ca 0.17 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2x64 h ALA 123 Cb -0.06 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.37 2x64 h ALA 123 CO -0.04 0.67 0.13 0.00 0.00 0.00 0.00 179.25 180.01 2x64 h ARG 124 N 1.21 1.01 -0.38 0.00 3.08 -0.87 -0.41 114.38 118.02 2x64 h ARG 124 Ca 0.29 -0.24 -0.07 0.00 0.07 0.00 0.00 59.98 60.03 2x64 h ARG 124 Cb 0.14 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 2x64 h ARG 124 CO -0.03 0.91 -0.06 0.66 -1.07 0.00 0.00 179.97 180.38 2x64 h SER 125 N 0.96 0.61 -0.25 7.04 4.64 -0.87 -0.73 113.55 124.95 2x64 h SER 125 Ca 0.20 -0.15 -0.17 0.00 -0.47 0.00 0.00 61.79 61.20 2x64 h SER 125 Cb 0.37 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2x64 h SER 125 CO 0.00 0.73 -0.51 1.56 -0.87 0.00 0.00 176.83 177.74 2x64 h GLN 126 N 0.59 0.78 -0.55 4.77 4.20 -0.88 -2.09 115.11 121.94 2x64 h GLN 126 Ca 0.11 -0.51 -0.03 0.00 0.06 0.00 0.00 58.65 58.29 2x64 h GLN 126 Cb 0.47 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 2x64 h GLN 126 CO 0.02 1.14 0.24 -0.44 -0.67 0.00 0.00 178.83 179.12 2x64 h ASP 127 N 0.53 0.75 -0.45 1.46 3.32 -0.88 -1.62 116.42 119.53 2x64 h ASP 127 Ca 0.01 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.91 2x64 h ASP 127 Cb 1.12 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.46 2x64 h ASP 127 CO 0.11 0.69 0.28 -1.13 -1.72 0.00 0.00 179.24 177.48 2x64 h ASN 128 N 0.75 0.52 -0.76 6.45 -1.24 -1.12 -0.61 115.58 119.58 2x64 h ASN 128 Ca 0.19 -0.03 0.02 0.00 0.71 0.00 0.00 56.30 57.19 2x64 h ASN 128 Cb 0.16 -0.13 -0.04 0.00 0.73 0.00 0.00 38.32 39.04 2x64 h ASN 128 CO -0.02 0.40 0.48 0.00 -1.29 0.00 0.00 177.43 177.01 2x64 h ALA 129 N 1.15 0.98 -0.58 1.57 0.00 -1.12 -0.94 119.26 120.31 2x64 h ALA 129 Ca 0.16 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 2x64 h ALA 129 Cb -0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2x64 h ALA 129 CO -0.03 0.30 0.03 0.00 0.00 0.00 0.00 179.25 179.55 2x64 h ARG 130 N 0.96 1.01 -0.40 0.00 3.08 -0.95 -1.58 114.38 116.51 2x64 h ARG 130 Ca 0.30 -0.31 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 2x64 h ARG 130 Cb -0.02 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 2x64 h ARG 130 CO -0.10 0.99 -0.17 1.96 -1.07 0.00 0.00 179.97 181.58 2x64 h GLN 131 N 0.91 0.81 -0.22 0.04 4.20 -0.78 -2.12 115.11 117.95 2x64 h GLN 131 Ca 0.17 -0.35 -0.10 0.00 0.06 0.00 0.00 58.65 58.43 2x64 h GLN 131 Cb 0.52 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 2x64 h GLN 131 CO 0.02 0.98 -0.31 0.87 -0.67 0.00 0.00 178.83 179.72 2x64 h LYS 132 N 0.62 0.44 -0.18 1.46 1.79 -1.12 -2.75 116.57 116.83 2x64 h LYS 132 Ca 0.09 -0.18 -0.14 0.00 -2.18 0.00 0.00 60.65 58.24 2x64 h LYS 132 Cb 0.72 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.36 2x64 h LYS 132 CO 0.05 0.70 -0.42 -0.07 -1.08 0.00 0.00 179.45 178.64 2x64 h LEU 133 N 0.38 0.68 -0.71 2.94 3.38 -1.21 -2.07 115.31 118.69 2x64 h LEU 133 Ca 0.05 -0.57 0.09 0.00 0.09 0.00 0.00 57.88 57.54 2x64 h LEU 133 Cb 0.74 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.22 2x64 h LEU 133 CO 0.06 1.12 0.36 -0.09 0.09 0.00 0.00 178.44 179.97 2x64 h ARG 134 N 0.26 0.59 -0.52 1.13 2.43 -1.34 0.35 114.38 117.28 2x64 h ARG 134 Ca -0.00 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2x64 h ARG 134 Cb 1.03 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.41 2x64 h ARG 134 CO 0.09 0.39 0.28 0.28 -1.51 0.00 0.00 179.97 179.50 2x64 h VAL 135 N 0.61 0.98 -0.58 0.20 2.07 -1.39 0.16 116.25 118.30 2x64 h VAL 135 Ca 0.35 -0.18 -0.09 0.00 0.82 0.00 0.00 66.70 67.59 2x64 h VAL 135 Cb 0.37 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2x64 h VAL 135 CO -0.27 0.10 -0.00 -0.07 0.02 0.00 0.00 177.57 177.35 2x64 h LEU 136 N 0.54 0.99 -0.80 2.57 3.38 -0.57 -2.86 115.31 118.55 2x64 h LEU 136 Ca 0.22 -0.27 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 2x64 h LEU 136 Cb 0.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2x64 h LEU 136 CO -0.14 1.04 -0.43 1.88 0.09 0.00 0.00 178.44 180.88 2x64 h TYR 137 N 0.92 0.00 -0.31 1.13 0.05 0.07 -2.46 116.97 116.38 2x64 h TYR 137 Ca 0.17 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.82 2x64 h TYR 137 Cb 0.54 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.27 2x64 h TYR 137 CO 0.04 0.43 -0.32 1.96 -1.05 0.00 0.00 178.16 179.22 2x64 h GLN 138 N 0.00 0.66 -0.03 4.88 4.20 -0.48 0.26 115.11 124.60 2x64 h GLN 138 Ca -0.00 -0.30 -0.00 0.00 0.06 0.00 0.00 58.65 58.40 2x64 h GLN 138 Cb 0.99 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.76 2x64 h GLN 138 CO 0.06 0.89 0.01 -0.09 -0.67 0.00 0.00 178.83 179.03 2x64 h ARG 139 N 0.56 0.04 -0.85 1.46 2.43 -1.34 -0.41 114.38 116.27 2x64 h ARG 139 Ca 0.06 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2x64 h ARG 139 Cb 0.82 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.33 2x64 h ARG 139 CO 0.07 0.25 0.43 0.00 -1.51 0.00 0.00 179.97 179.20 2x64 h ALA 140 N 0.80 1.09 -0.53 2.80 0.00 -1.32 -2.20 119.26 119.90 2x64 h ALA 140 Ca 0.01 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 2x64 h ALA 140 Cb 0.22 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2x64 h ALA 140 CO -0.00 0.64 0.10 0.22 0.00 0.00 0.00 179.25 180.21 2x64 h ASP 141 N 1.20 0.82 -0.63 0.00 3.58 -0.82 -0.60 116.42 119.97 2x64 h ASP 141 Ca 0.29 -0.25 -0.03 0.00 0.42 0.00 0.00 57.03 57.47 2x64 h ASP 141 Cb 0.09 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 40.89 2x64 h ASP 141 CO -0.04 0.86 0.30 0.00 -2.88 0.00 0.00 179.24 177.48 2x64 h ALA 142 N 0.99 1.30 -0.28 -0.78 0.00 -0.80 -1.58 119.26 118.10 2x64 h ALA 142 Ca 0.16 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 2x64 h ALA 142 Cb 0.38 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2x64 h ALA 142 CO 0.01 0.54 -0.35 1.25 0.00 0.00 0.00 179.25 180.70 2x64 h HIS 143 N 0.93 0.90 0.00 0.00 -0.00 -1.20 -3.19 115.15 112.58 2x64 h HIS 143 Ca 0.23 -0.29 0.00 0.00 -0.00 0.00 0.00 60.37 60.31 2x64 h HIS 143 Cb 0.12 -0.18 0.00 0.00 -0.00 0.00 0.00 27.41 27.34 2x64 h HIS 143 CO 0.01 1.05 0.00 1.28 -0.00 0.00 0.00 177.93 180.28 2x64 n LEU 144 N -4.21 0.39 0.06 0.26 4.77 -0.25 -2.93 117.00 115.09 2x64 n LEU 144 Ca -0.04 0.57 0.02 0.00 -0.03 0.00 0.00 56.01 56.53 2x64 n LEU 144 Cb 0.51 -0.49 0.38 0.00 -2.33 0.00 0.00 43.42 41.49 2x64 n LEU 144 CO 0.46 -0.30 0.97 0.11 -1.33 0.00 0.00 177.39 177.30 2x64 h LYS 145 N 0.00 0.39 -0.09 3.23 1.57 -1.28 -3.17 116.57 117.21 2x64 h LYS 145 Ca 0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2x64 h LYS 145 Cb 0.42 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2x64 h LYS 145 CO 0.00 0.41 0.00 0.72 -0.57 0.00 0.00 179.45 180.01 2x64 n HIS 146 N -4.33 0.12 -3.78 -1.35 8.25 -1.17 -5.01 115.22 107.94 2x64 n HIS 146 Ca 0.01 -0.42 -0.13 0.00 -0.26 0.00 0.00 57.72 56.91 2x64 n HIS 146 Cb 0.21 -0.04 -0.14 0.00 1.12 0.00 0.00 29.99 31.14 2x64 n HIS 146 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2x64 s HIS 147 N -0.89 -0.10 0.20 4.41 3.76 -1.15 -5.05 115.29 116.47 2x64 s HIS 147 Ca 0.06 0.33 -0.02 0.00 -0.15 0.00 0.00 55.06 55.28 2x64 s HIS 147 Cb 0.03 -0.08 0.14 0.00 1.11 0.00 0.00 32.58 33.78 2x64 s HIS 147 CO 0.05 -0.11 1.52 -2.95 -0.85 0.00 0.00 174.74 172.39 2x64 h ASN 148 N 6.87 0.57 -3.55 1.40 -0.00 -1.89 -3.40 115.58 115.58 2x64 h ASN 148 Ca -0.38 -0.31 -0.40 0.00 -0.00 0.00 0.00 56.30 55.21 2x64 h ASN 148 Cb 1.16 -0.16 -0.14 0.00 -0.00 0.00 0.00 38.32 39.17 2x64 h ASN 148 CO 0.45 1.01 -0.70 0.26 -0.00 0.00 0.00 177.43 178.45 2x64 s TRP 149 N -3.98 1.58 0.09 4.14 0.52 -1.26 -4.95 118.94 115.07 2x64 s TRP 149 Ca -0.07 -0.74 -0.23 0.00 0.02 0.00 0.00 56.10 55.08 2x64 s TRP 149 Cb 0.11 -0.83 -0.14 0.00 -1.15 0.00 0.00 33.47 31.46 2x64 s TRP 149 CO 0.83 0.16 1.73 -0.07 0.02 0.00 0.00 176.95 179.62 2x64 h LEU 150 N 2.55 0.02 -8.58 2.99 3.38 -1.88 -3.40 115.31 110.40 2x64 h LEU 150 Ca -0.38 -0.02 -0.69 0.00 0.09 0.00 0.00 57.88 56.88 2x64 h LEU 150 Cb 1.21 -0.01 -0.30 0.00 0.09 0.00 0.00 40.66 41.66 2x64 h LEU 150 CO 0.64 0.03 -0.87 0.00 0.09 0.00 0.00 178.44 178.33 2x64 s ALA 151 N -6.13 2.22 -1.73 1.53 0.00 -1.26 -4.80 121.76 111.59 2x64 s ALA 151 Ca -0.13 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.76 2x64 s ALA 151 Cb 0.06 -0.67 0.00 0.00 0.00 0.00 0.00 23.12 22.51 2x64 s ALA 151 CO 0.66 0.47 0.00 0.09 0.00 0.00 0.00 175.76 176.98 2x64 n ASN 152 N 2.70 -4.46 -1.55 0.00 3.02 -1.26 -2.49 115.26 111.22 2x64 n ASN 152 Ca -0.17 0.40 -0.20 0.00 -0.03 0.00 0.00 54.58 54.59 2x64 n ASN 152 Cb 0.52 -3.98 -0.08 0.00 -0.61 0.00 0.00 39.78 35.62 2x64 n ASN 152 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2x64 n GLY 153 N -0.28 1.83 2.93 7.41 0.00 -1.26 -4.96 105.19 110.86 2x64 n GLY 153 Ca -0.16 -0.06 -0.12 0.00 0.00 0.00 0.00 46.02 45.67 2x64 n GLY 153 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2x64 s GLN 154 N -3.73 0.20 0.35 1.61 -0.21 -1.04 -4.63 119.66 112.21 2x64 s GLN 154 Ca 0.00 -0.22 -0.29 0.00 0.02 0.00 0.00 55.36 54.87 2x64 s GLN 154 Cb 0.00 -0.10 -0.11 0.00 1.00 0.00 0.00 33.01 33.80 2x64 s GLN 154 CO 0.00 0.02 1.50 -0.98 -2.12 0.00 0.00 175.29 173.71 2x64 s ARG 155 N -0.44 4.13 0.31 2.91 1.70 -1.26 -4.47 118.95 121.82 2x64 s ARG 155 Ca -0.03 2.55 -0.02 0.00 -0.47 0.00 0.00 55.73 57.75 2x64 s ARG 155 Cb -0.03 -2.99 0.01 0.00 -0.57 0.00 0.00 34.95 31.37 2x64 s ARG 155 CO -0.00 -0.54 0.44 -1.13 -1.08 0.00 0.00 175.30 172.99 2x64 n SER 156 N 0.96 -1.23 0.30 -2.89 3.41 -1.26 -4.41 113.62 108.50 2x64 n SER 156 Ca 0.03 -2.67 0.16 0.00 -0.26 0.00 0.00 58.87 56.14 2x64 n SER 156 Cb 0.39 2.28 0.94 0.00 -0.26 0.00 0.00 64.21 67.56 2x64 n SER 156 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2x64 h GLY 157 N 1.74 0.00 1.00 5.00 0.00 -1.91 -2.09 103.07 106.82 2x64 h GLY 157 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2x64 h GLY 157 CO 0.33 0.00 0.36 0.00 0.00 0.00 0.00 176.54 177.22 2x64 h ALA 158 N 1.97 0.71 -0.35 3.60 0.00 -1.90 -1.38 119.26 121.92 2x64 h ALA 158 Ca -0.00 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2x64 h ALA 158 Cb 0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2x64 h ALA 158 CO 0.00 0.17 -0.06 -0.44 0.00 0.00 0.00 179.25 178.93 2x64 h ASP 159 N 0.76 0.65 -0.58 0.00 3.32 -1.75 -1.49 116.42 117.33 2x64 h ASP 159 Ca 0.20 -0.35 0.00 0.00 0.02 0.00 0.00 57.03 56.91 2x64 h ASP 159 Cb -0.05 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 2x64 h ASP 159 CO -0.04 0.85 0.38 0.00 -1.72 0.00 0.00 179.24 178.70 2x64 h ALA 160 N 0.83 0.73 0.02 3.45 0.00 -1.39 -1.47 119.26 121.42 2x64 h ALA 160 Ca 0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2x64 h ALA 160 Cb 0.55 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2x64 h ALA 160 CO 0.03 0.18 -0.01 -0.92 0.00 0.00 0.00 179.25 178.53 2x64 h TYR 161 N 0.78 -0.02 -0.44 0.00 5.03 -1.15 -2.43 116.97 118.74 2x64 h TYR 161 Ca 0.21 -0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.59 2x64 h TYR 161 Cb -0.08 0.01 -0.06 0.00 1.55 0.00 0.00 36.73 38.15 2x64 h TYR 161 CO -0.03 0.34 0.09 1.25 -1.32 0.00 0.00 178.16 178.48 2x64 h LEU 162 N -0.38 0.01 -0.55 2.82 5.85 -1.19 -2.25 115.31 119.62 2x64 h LEU 162 Ca -0.00 0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.88 2x64 h LEU 162 Cb 0.37 0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.43 2x64 h LEU 162 CO 0.00 0.04 0.18 0.22 -0.34 0.00 0.00 178.44 178.55 2x64 h TYR 163 N 0.22 0.32 -0.45 1.25 3.20 -1.23 -2.06 116.97 118.22 2x64 h TYR 163 Ca 0.22 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 2x64 h TYR 163 Cb 0.27 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 2x64 h TYR 163 CO -0.21 0.08 0.24 0.28 -1.64 0.00 0.00 178.16 176.91 2x64 h VAL 164 N 0.35 1.16 -0.72 1.81 2.07 -0.91 -2.34 116.25 117.68 2x64 h VAL 164 Ca 0.27 -0.43 0.03 0.00 0.82 0.00 0.00 66.70 67.39 2x64 h VAL 164 Cb 0.33 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 30.69 2x64 h VAL 164 CO -0.29 0.17 0.48 0.71 0.02 0.00 0.00 177.57 178.66 2x64 h THR 165 N 0.58 1.13 0.00 2.57 1.35 -1.12 -2.14 112.91 115.28 2x64 h THR 165 Ca 0.16 -0.31 -0.07 0.00 -0.55 0.00 0.00 66.41 65.64 2x64 h THR 165 Cb 0.06 0.15 -0.01 0.00 -1.73 0.00 0.00 68.15 66.62 2x64 h THR 165 CO -0.02 0.17 -0.33 -0.07 -0.25 0.00 0.00 175.52 175.01 2x64 h LEU 166 N 0.90 0.00 -0.70 3.87 3.38 -0.90 -1.28 115.31 120.59 2x64 h LEU 166 Ca 0.28 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.16 2x64 h LEU 166 Cb 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2x64 h LEU 166 CO -0.07 0.33 0.00 0.03 0.09 0.00 0.00 178.44 178.82 2x64 h ARG 167 N 0.00 1.01 -0.46 1.13 3.08 -0.88 -2.53 114.38 115.73 2x64 h ARG 167 Ca -0.00 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 59.67 2x64 h ARG 167 Cb 0.64 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 2x64 h ARG 167 CO 0.04 0.99 0.01 -1.49 -1.07 0.00 0.00 179.97 178.45 2x64 h TRP 168 N 0.92 0.87 -0.62 3.04 6.55 -1.18 -2.86 115.95 122.67 2x64 h TRP 168 Ca 0.17 -0.15 0.11 0.00 0.95 0.00 0.00 58.89 59.97 2x64 h TRP 168 Cb 0.53 -0.23 -0.08 0.00 -0.86 0.00 0.00 29.16 28.53 2x64 h TRP 168 CO 0.04 0.84 0.20 0.00 -1.05 0.00 0.00 178.44 178.46 2x64 h ALA 169 N 0.92 0.79 0.00 1.49 0.00 -1.10 0.66 119.26 122.02 2x64 h ALA 169 Ca 0.13 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 2x64 h ALA 169 Cb 0.48 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2x64 h ALA 169 CO 0.02 -0.24 -0.28 0.87 0.00 0.00 0.00 179.25 179.63 2x64 h LYS 170 N 0.36 0.00 0.00 0.00 1.57 -1.38 -1.09 116.57 116.03 2x64 h LYS 170 Ca 0.32 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.87 2x64 h LYS 170 Cb 0.44 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 2x64 h LYS 170 CO -0.35 0.28 -1.40 0.87 -0.57 0.00 0.00 179.45 178.27 2x64 h LYS 171 N 0.00 0.00 -0.55 3.15 1.57 -0.94 -3.37 116.57 116.43 2x64 h LYS 171 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2x64 h LYS 171 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2x64 h LYS 171 CO 0.04 0.53 0.00 1.33 -0.57 0.00 0.00 179.45 180.77 2x64 n VAL 172 N -3.07 1.01 -1.90 0.50 0.24 0.08 -5.00 118.33 110.18 2x64 n VAL 172 Ca -0.10 -1.00 -0.03 0.00 -2.04 0.00 0.00 64.34 61.16 2x64 n VAL 172 Cb 0.95 0.50 -0.00 0.00 -1.47 0.00 0.00 33.84 33.81 2x64 n VAL 172 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2x64 n GLY 173 N 1.10 0.30 3.70 7.63 0.00 -0.98 -5.03 105.19 111.92 2x64 n GLY 173 Ca 0.18 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 2x64 n GLY 173 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x64 s VAL 174 N -2.15 4.17 -0.31 1.61 1.01 -0.45 -4.97 120.40 119.31 2x64 s VAL 174 Ca 0.00 1.54 -0.29 0.00 0.00 0.00 0.00 61.98 63.24 2x64 s VAL 174 Cb 0.00 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 2x64 s VAL 174 CO 0.00 0.08 1.65 -0.62 0.00 0.00 0.00 175.10 176.22 2x64 s ASP 175 N 1.19 6.16 -0.06 3.32 2.15 -1.26 -4.70 116.67 123.47 2x64 s ASP 175 Ca 0.57 1.32 0.11 0.00 0.43 0.00 0.00 52.55 54.98 2x64 s ASP 175 Cb -0.27 -2.53 0.30 0.00 -0.30 0.00 0.00 42.92 40.12 2x64 s ASP 175 CO 0.27 -1.49 1.24 0.18 -0.17 0.00 0.00 175.17 175.20 2x64 n LEU 176 N 9.32 2.94 -4.76 -1.34 4.77 -1.26 -4.66 117.00 122.01 2x64 n LEU 176 Ca 0.20 -2.37 -0.39 0.00 -0.03 0.00 0.00 56.01 53.42 2x64 n LEU 176 Cb 0.46 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2x64 n LEU 176 CO 0.67 0.67 0.96 -0.94 -1.33 0.00 0.00 177.39 177.42 2x64 s SER 177 N -1.43 6.08 0.00 -1.43 1.04 -1.26 -2.91 113.70 113.78 2x64 s SER 177 Ca 0.24 2.65 0.00 0.00 0.48 0.00 0.00 55.95 59.33 2x64 s SER 177 Cb 0.17 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.66 2x64 s SER 177 CO 0.10 -1.01 0.00 -1.20 0.98 0.00 0.00 173.24 172.11 2x64 n SER 178 N -0.17 -4.23 -3.98 7.02 7.64 -1.26 -4.93 113.62 113.70 2x64 n SER 178 Ca 0.05 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.52 2x64 n SER 178 Cb 0.44 -2.01 -0.00 0.00 -1.01 0.00 0.00 64.21 61.63 2x64 n SER 178 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2x64 n LEU 179 N 0.00 6.05 -0.22 -3.43 4.77 -1.15 -4.86 117.00 118.16 2x64 n LEU 179 Ca 0.00 -5.22 -0.06 0.00 -0.03 0.00 0.00 56.01 50.70 2x64 n LEU 179 Cb 0.24 -1.23 0.09 0.00 -2.33 0.00 0.00 43.42 40.19 2x64 n LEU 179 CO 0.00 1.70 0.95 0.44 -1.33 0.00 0.00 177.39 179.14 2x64 h ASP 180 N 5.43 0.99 0.02 -1.43 3.32 -1.92 -0.34 116.42 122.50 2x64 h ASP 180 Ca 0.20 -0.21 -0.18 0.00 0.02 0.00 0.00 57.03 56.86 2x64 h ASP 180 Cb 0.64 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.93 2x64 h ASP 180 CO 1.25 0.96 -0.62 0.00 -1.72 0.00 0.00 179.24 179.11 2x64 h ALA 181 N 1.16 0.60 -0.45 3.45 0.00 -1.89 -1.65 119.26 120.47 2x64 h ALA 181 Ca 0.21 -0.55 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 2x64 h ALA 181 Cb 0.37 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2x64 h ALA 181 CO 0.00 0.70 -0.24 1.25 0.00 0.00 0.00 179.25 180.96 2x64 h LEU 182 N 0.44 0.98 -0.36 0.00 5.85 -1.79 -1.72 115.31 118.70 2x64 h LEU 182 Ca -0.01 -0.38 -0.00 0.00 0.84 0.00 0.00 57.88 58.33 2x64 h LEU 182 Cb 1.19 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 2x64 h LEU 182 CO 0.12 1.16 0.22 -1.28 -0.34 0.00 0.00 178.44 178.32 2x64 h SER 183 N 0.81 0.43 -0.69 1.25 0.87 -0.97 -0.68 113.55 114.58 2x64 h SER 183 Ca 0.10 -0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.57 2x64 h SER 183 Cb 0.81 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.64 2x64 h SER 183 CO 0.07 0.35 0.28 0.00 -0.53 0.00 0.00 176.83 177.00 2x64 h ALA 184 N 1.10 0.89 0.16 6.23 0.00 -1.18 -1.75 119.26 124.71 2x64 h ALA 184 Ca 0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2x64 h ALA 184 Cb -0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2x64 h ALA 184 CO -0.02 0.50 -0.13 0.35 0.00 0.00 0.00 179.25 179.95 2x64 h PHE 185 N 0.97 -0.33 -0.92 0.00 3.57 -1.04 -0.86 116.94 118.33 2x64 h PHE 185 Ca 0.23 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.81 2x64 h PHE 185 Cb 0.20 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 38.99 2x64 h PHE 185 CO 0.01 -0.20 0.57 0.35 -2.23 0.00 0.00 178.31 176.81 2x64 h PHE 186 N -0.30 1.04 -0.47 0.41 3.57 -0.90 -1.43 116.94 118.85 2x64 h PHE 186 Ca -0.01 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.45 2x64 h PHE 186 Cb 0.27 -0.33 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 2x64 h PHE 186 CO -0.11 0.48 -0.00 0.93 -2.23 0.00 0.00 178.31 177.37 2x64 h GLU 187 N 0.98 0.84 -0.81 1.11 5.08 -1.13 -2.19 114.58 118.45 2x64 h GLU 187 Ca 0.42 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2x64 h GLU 187 Cb 0.30 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 2x64 h GLU 187 CO -0.22 0.89 0.52 -0.09 -1.00 0.00 0.00 179.01 179.11 2x64 h ARG 188 N 0.69 1.07 0.04 2.33 2.43 -0.38 -1.99 114.38 118.57 2x64 h ARG 188 Ca 0.13 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2x64 h ARG 188 Cb 0.51 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2x64 h ARG 188 CO 0.02 0.73 -0.02 0.52 -1.51 0.00 0.00 179.97 179.71 2x64 h MET 189 N 1.10 -0.05 0.00 0.20 2.86 -1.17 -2.73 114.93 115.13 2x64 h MET 189 Ca 0.29 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.94 2x64 h MET 189 Cb -0.10 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.57 2x64 h MET 189 CO -0.06 0.16 -0.00 0.93 1.06 0.00 0.00 176.91 179.00 2x64 h GLU 190 N -0.26 0.00 0.00 1.72 5.08 -1.23 -0.97 114.58 118.92 2x64 h GLU 190 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2x64 h GLU 190 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2x64 h GLU 190 CO 0.01 0.00 -0.16 0.00 -1.00 0.00 0.00 179.01 177.86 2x64 n ALA 191 N -2.48 2.64 -2.31 3.43 0.00 -0.76 -4.62 120.51 116.40 2x64 n ALA 191 Ca -0.03 -0.16 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 2x64 n ALA 191 Cb 0.09 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.14 2x64 n ALA 191 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2x64 s ASP 192 N -3.34 7.07 0.36 0.00 -1.08 -0.37 -4.97 116.67 114.34 2x64 s ASP 192 Ca 0.12 2.09 0.07 0.00 -0.52 0.00 0.00 52.55 54.31 2x64 s ASP 192 Cb 0.17 -2.59 0.69 0.00 -1.46 0.00 0.00 42.92 39.73 2x64 s ASP 192 CO 0.59 -0.46 1.88 1.55 0.52 0.00 0.00 175.17 179.26 2x64 h PRO 193 N 6.44 0.35 -0.38 4.34 0.13 -1.89 -1.84 132.00 139.15 2x64 h PRO 193 Ca -0.42 -0.08 -0.13 0.00 -0.87 0.00 0.00 66.00 64.49 2x64 h PRO 193 Cb 1.21 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2x64 h PRO 193 CO 0.80 0.47 -0.29 0.78 -0.23 0.00 0.00 178.00 179.53 2x64 h GLY 194 N 0.81 0.88 0.74 1.56 0.00 -1.93 -1.06 103.07 104.06 2x64 h GLY 194 Ca 0.07 -0.81 -0.01 0.00 0.00 0.00 0.00 47.33 46.58 2x64 h GLY 194 CO 0.02 0.73 0.00 -2.08 0.00 0.00 0.00 176.54 175.22 2x64 h VAL 195 N 0.69 1.24 -0.47 4.60 2.07 -1.77 -2.32 116.25 120.28 2x64 h VAL 195 Ca 0.08 -0.73 0.03 0.00 0.82 0.00 0.00 66.70 66.90 2x64 h VAL 195 Cb 0.83 1.63 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 2x64 h VAL 195 CO 0.07 0.20 0.27 1.56 0.02 0.00 0.00 177.57 179.68 2x64 h GLN 196 N -0.19 0.51 -0.55 1.57 4.20 -1.28 -0.43 115.11 118.94 2x64 h GLN 196 Ca 0.01 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.72 2x64 h GLN 196 Cb 0.31 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 2x64 h GLN 196 CO 0.00 0.34 0.33 0.00 -0.67 0.00 0.00 178.83 178.83 2x64 h ALA 197 N 1.23 0.71 -0.09 3.87 0.00 -1.21 0.44 119.26 124.21 2x64 h ALA 197 Ca 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2x64 h ALA 197 Cb 0.06 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2x64 h ALA 197 CO -0.11 0.05 0.04 0.00 0.00 0.00 0.00 179.25 179.23 2x64 h ALA 198 N 1.24 0.12 -0.55 0.00 0.00 -0.92 -0.94 119.26 118.22 2x64 h ALA 198 Ca 0.22 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 2x64 h ALA 198 Cb 0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2x64 h ALA 198 CO -0.09 -0.31 0.17 -0.07 0.00 0.00 0.00 179.25 178.95 2x64 h LEU 199 N 0.01 0.75 -0.12 0.00 3.38 -0.90 -1.59 115.31 116.84 2x64 h LEU 199 Ca 0.03 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2x64 h LEU 199 Cb 0.14 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2x64 h LEU 199 CO -0.00 0.71 0.04 -0.61 0.09 0.00 0.00 178.44 178.68 2x64 h GLN 200 N 0.79 0.18 -0.23 1.13 4.15 -0.70 0.23 115.11 120.65 2x64 h GLN 200 Ca 0.18 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.50 2x64 h GLN 200 Cb 0.24 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 2x64 h GLN 200 CO -0.01 0.29 -0.17 0.00 -1.93 0.00 0.00 178.83 177.01 2x64 h ALA 201 N 0.88 1.27 -0.00 3.38 0.00 -0.92 -2.73 119.26 121.14 2x64 h ALA 201 Ca 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2x64 h ALA 201 Cb 0.18 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2x64 h ALA 201 CO -0.00 0.48 -0.11 0.39 0.00 0.00 0.00 179.25 180.01 2x64 n GLU 202 N -4.19 0.77 -2.18 0.00 1.02 -0.62 -4.94 120.64 110.50 2x64 n GLU 202 Ca -0.00 -0.28 -0.08 0.00 -0.02 0.00 0.00 57.16 56.78 2x64 n GLU 202 Cb 0.34 -1.49 -0.00 0.00 -0.02 0.00 0.00 31.44 30.26 2x64 n GLU 202 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x64 n GLY 203 N 1.26 0.06 3.77 0.62 0.00 -0.97 -4.75 105.19 105.18 2x64 n GLY 203 Ca 0.15 -0.55 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 2x64 n GLY 203 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x64 s LEU 204 N -2.32 4.12 0.00 0.99 1.43 0.77 -5.03 118.68 118.63 2x64 s LEU 204 Ca 0.01 0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.40 2x64 s LEU 204 Cb -0.00 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.20 2x64 s LEU 204 CO 0.01 0.30 0.00 -0.38 0.23 0.00 0.00 176.35 176.51