#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h3h s LEU 2 N 0.00 3.91 -0.06 -0.89 1.43 -1.26 -4.98 118.68 116.84 2h3h s LEU 2 Ca 0.00 1.08 0.02 0.00 -1.03 0.00 0.00 54.13 54.20 2h3h s LEU 2 Cb 0.00 -3.93 0.01 0.00 0.03 0.00 0.00 46.19 42.30 2h3h s LEU 2 CO 0.00 -0.33 -0.11 -0.89 0.23 0.00 0.00 176.35 175.26 2h3h s THR 3 N -2.25 0.99 -0.11 5.49 2.01 -1.26 -1.28 115.64 119.23 2h3h s THR 3 Ca 0.50 -0.40 0.02 0.00 0.31 0.00 0.00 61.69 62.12 2h3h s THR 3 Cb -0.10 -0.91 0.01 0.00 0.01 0.00 0.00 72.50 71.51 2h3h s THR 3 CO 0.29 0.32 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.74 2h3h s ILE 4 N 0.63 1.61 -0.07 1.82 1.01 -0.13 0.44 121.20 126.50 2h3h s ILE 4 Ca -0.12 -0.72 -0.05 0.00 0.00 0.00 0.00 60.65 59.76 2h3h s ILE 4 Cb -0.15 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 2h3h s ILE 4 CO 0.03 0.46 0.14 -0.83 0.00 0.00 0.00 174.94 174.74 2h3h s GLY 5 N 0.84 2.14 -0.06 6.18 0.00 0.69 -1.22 107.32 115.89 2h3h s GLY 5 Ca -0.09 -0.71 0.02 0.00 0.00 0.00 0.00 44.72 43.94 2h3h s GLY 5 CO 0.00 -0.51 -0.09 0.14 0.00 0.00 0.00 173.10 172.64 2h3h s VAL 6 N -1.13 0.91 -0.21 1.40 1.01 0.65 -0.89 120.40 122.14 2h3h s VAL 6 Ca 0.20 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.85 2h3h s VAL 6 Cb -0.12 -0.86 0.04 0.00 0.00 0.00 0.00 36.38 35.44 2h3h s VAL 6 CO 0.09 0.31 -0.15 -0.63 0.00 0.00 0.00 175.10 174.72 2h3h s ILE 7 N 0.75 2.01 0.00 2.22 1.01 -0.09 -0.47 121.20 126.63 2h3h s ILE 7 Ca -0.13 -1.20 0.00 0.00 0.00 0.00 0.00 60.65 59.31 2h3h s ILE 7 Cb -0.15 -1.98 0.00 0.00 0.01 0.00 0.00 42.46 40.34 2h3h s ILE 7 CO 0.02 0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.83 2h3h n GLY 8 N 4.57 1.54 0.02 6.18 0.00 -0.28 -1.18 105.19 116.04 2h3h n GLY 8 Ca -0.17 -2.07 -0.00 0.00 0.00 0.00 0.00 46.02 43.78 2h3h n GLY 8 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h3h n LYS 9 N -0.94 1.55 -3.87 1.61 5.02 -1.26 -4.44 118.16 115.83 2h3h n LYS 9 Ca 0.00 -0.04 -0.07 0.00 -2.02 0.00 0.00 58.31 56.18 2h3h n LYS 9 Cb 0.00 -1.21 -0.02 0.00 -0.02 0.00 0.00 35.03 33.78 2h3h n LYS 9 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2h3h s SER 10 N -3.57 -0.22 0.00 4.39 1.04 -1.26 -3.67 113.70 110.41 2h3h s SER 10 Ca -0.04 -0.67 0.11 0.00 0.48 0.00 0.00 55.95 55.83 2h3h s SER 10 Cb 0.04 0.72 0.49 0.00 0.10 0.00 0.00 66.02 67.38 2h3h s SER 10 CO 0.35 -1.35 1.34 1.33 0.98 0.00 0.00 173.24 175.89 2h3h n VAL 11 N -0.46 0.13 -1.64 5.02 0.24 -0.78 -4.69 118.33 116.15 2h3h n VAL 11 Ca -0.04 -0.15 -0.40 0.00 -2.04 0.00 0.00 64.34 61.71 2h3h n VAL 11 Cb 0.59 0.03 0.02 0.00 -1.47 0.00 0.00 33.84 33.02 2h3h n VAL 11 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 2h3h n HIS 12 N -0.23 1.35 -0.21 6.34 -0.00 -1.26 -4.84 115.22 116.37 2h3h n HIS 12 Ca 0.09 0.50 0.31 0.00 -0.00 0.00 0.00 57.72 58.62 2h3h n HIS 12 Cb 0.13 -2.24 0.67 0.00 -0.00 0.00 0.00 29.99 28.55 2h3h n HIS 12 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2h3h h PRO 13 N 1.37 0.00 -0.81 1.57 0.11 -2.00 0.02 132.00 132.26 2h3h h PRO 13 Ca -0.47 0.00 0.19 0.00 0.11 0.00 0.00 66.00 65.83 2h3h h PRO 13 Cb 1.33 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.33 2h3h h PRO 13 CO 0.56 0.00 0.26 -0.92 -0.21 0.00 0.00 178.00 177.69 2h3h h TYR 14 N 0.00 0.42 0.00 0.65 3.20 -1.95 -1.42 116.97 117.87 2h3h h TYR 14 Ca 0.47 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.39 2h3h h TYR 14 Cb 2.27 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 40.48 2h3h h TYR 14 CO 0.00 -0.07 -0.01 -1.49 -1.64 0.00 0.00 178.16 174.95 2h3h h TRP 15 N 0.32 0.00 -0.05 -3.82 4.06 -1.26 -2.45 115.95 112.76 2h3h h TRP 15 Ca 0.48 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 61.28 2h3h h TRP 15 Cb 0.85 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.00 2h3h h TRP 15 CO -0.22 0.01 -0.62 0.77 -3.56 0.00 0.00 178.44 174.82 2h3h h SER 16 N 0.00 0.20 -0.30 -3.49 0.02 -1.38 0.26 113.55 108.86 2h3h h SER 16 Ca -0.00 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 2h3h h SER 16 Cb 0.91 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.38 2h3h h SER 16 CO 0.00 0.77 0.14 1.56 -1.14 0.00 0.00 176.83 178.16 2h3h h GLN 17 N 0.13 0.43 -0.09 3.45 4.20 -0.85 -0.97 115.11 121.41 2h3h h GLN 17 Ca -0.01 -0.07 0.01 0.00 0.06 0.00 0.00 58.65 58.64 2h3h h GLN 17 Cb 1.12 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.82 2h3h h GLN 17 CO 0.09 0.41 0.03 0.28 -0.67 0.00 0.00 178.83 178.97 2h3h h VAL 18 N 0.35 0.97 -0.90 -0.54 2.07 -1.37 -2.70 116.25 114.14 2h3h h VAL 18 Ca 0.10 -0.02 0.12 0.00 0.82 0.00 0.00 66.70 67.72 2h3h h VAL 18 Cb 0.13 0.90 -0.07 0.00 -1.52 0.00 0.00 31.29 30.73 2h3h h VAL 18 CO -0.01 0.01 0.58 -0.08 0.02 0.00 0.00 177.57 178.09 2h3h h GLU 19 N 0.07 0.77 -0.24 1.57 4.81 -0.85 -0.31 114.58 120.39 2h3h h GLU 19 Ca 0.04 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2h3h h GLU 19 Cb 0.02 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 2h3h h GLU 19 CO -0.04 0.51 0.15 1.96 -0.73 0.00 0.00 179.01 180.85 2h3h h GLN 20 N 0.79 0.33 -0.60 1.92 4.20 -0.87 -1.35 115.11 119.54 2h3h h GLN 20 Ca 0.44 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 59.14 2h3h h GLN 20 Cb 0.57 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.24 2h3h h GLN 20 CO -0.20 0.27 0.37 0.78 -0.67 0.00 0.00 178.83 179.38 2h3h h GLY 21 N 0.30 0.86 0.62 3.46 0.00 -1.05 -0.10 103.07 107.16 2h3h h GLY 21 Ca 0.09 -0.28 0.05 0.00 0.00 0.00 0.00 47.33 47.19 2h3h h GLY 21 CO -0.02 0.24 0.12 -2.08 0.00 0.00 0.00 176.54 174.81 2h3h h VAL 22 N 0.73 0.86 -0.24 4.60 2.07 -0.82 -1.33 116.25 122.12 2h3h h VAL 22 Ca 0.24 -0.09 -0.19 0.00 0.82 0.00 0.00 66.70 67.47 2h3h h VAL 22 Cb 0.01 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 2h3h h VAL 22 CO -0.10 0.05 -0.61 0.11 0.02 0.00 0.00 177.57 177.04 2h3h h LYS 23 N 0.27 0.81 -0.46 1.57 1.79 -0.96 -1.70 116.57 117.89 2h3h h LYS 23 Ca 0.18 -0.55 0.00 0.00 -2.18 0.00 0.00 60.65 58.11 2h3h h LYS 23 Cb 0.18 0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 2h3h h LYS 23 CO -0.20 1.18 0.30 0.00 -1.08 0.00 0.00 179.45 179.64 2h3h h ALA 24 N 0.70 0.58 -0.68 3.86 0.00 -0.89 -0.97 119.26 121.86 2h3h h ALA 24 Ca -0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2h3h h ALA 24 Cb 1.22 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2h3h h ALA 24 CO 0.13 0.05 0.30 0.00 0.00 0.00 0.00 179.25 179.73 2h3h h ALA 25 N 1.16 0.88 -0.83 0.00 0.00 -1.19 -1.30 119.26 117.97 2h3h h ALA 25 Ca 0.17 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2h3h h ALA 25 Cb -0.05 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.43 2h3h h ALA 25 CO -0.03 0.46 0.39 0.78 0.00 0.00 0.00 179.25 180.85 2h3h h GLY 26 N 0.95 1.28 0.85 0.00 0.00 -0.96 -0.11 103.07 105.09 2h3h h GLY 26 Ca 0.23 -0.64 -0.04 0.00 0.00 0.00 0.00 47.33 46.88 2h3h h GLY 26 CO -0.02 0.61 0.00 1.70 0.00 0.00 0.00 176.54 178.83 2h3h h LYS 27 N 1.18 0.44 -0.55 4.80 3.64 -1.02 0.15 116.57 125.21 2h3h h LYS 27 Ca 0.28 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 2h3h h LYS 27 Cb 0.12 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 2h3h h LYS 27 CO -0.04 0.61 0.17 0.00 -2.27 0.00 0.00 179.45 177.92 2h3h h ALA 28 N 0.82 0.72 -0.00 5.00 0.00 -0.98 -3.12 119.26 121.69 2h3h h ALA 28 Ca 0.07 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2h3h h ALA 28 Cb 0.41 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2h3h h ALA 28 CO 0.01 0.38 -0.48 1.28 0.00 0.00 0.00 179.25 180.45 2h3h n LEU 29 N -4.45 0.85 -2.62 0.00 4.77 -0.08 -4.97 117.00 110.50 2h3h n LEU 29 Ca 0.02 -0.20 -0.11 0.00 -0.03 0.00 0.00 56.01 55.70 2h3h n LEU 29 Cb 0.20 -0.16 0.05 0.00 -2.33 0.00 0.00 43.42 41.19 2h3h n LEU 29 CO 0.40 0.18 0.05 0.61 -1.33 0.00 0.00 177.39 177.29 2h3h n GLY 30 N 1.44 -0.26 2.93 -0.72 0.00 0.34 -5.05 105.19 103.88 2h3h n GLY 30 Ca 0.08 0.08 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 2h3h n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h3h s VAL 31 N -3.25 0.22 0.30 1.61 0.11 -0.16 -4.78 120.40 114.45 2h3h s VAL 31 Ca 0.14 -0.25 -0.28 0.00 -2.93 0.00 0.00 61.98 58.66 2h3h s VAL 31 Cb -0.02 -0.22 -0.09 0.00 -1.53 0.00 0.00 36.38 34.52 2h3h s VAL 31 CO 0.48 -0.02 1.03 -1.81 -3.33 0.00 0.00 175.10 171.46 2h3h s ASP 32 N -0.29 7.26 -0.04 3.54 -0.00 -0.41 -4.52 116.67 122.21 2h3h s ASP 32 Ca -0.01 2.10 0.03 0.00 -0.00 0.00 0.00 52.55 54.66 2h3h s ASP 32 Cb -0.02 -2.61 0.00 0.00 -0.00 0.00 0.00 42.92 40.29 2h3h s ASP 32 CO -0.00 -0.14 -0.12 0.42 -0.00 0.00 0.00 175.17 175.33 2h3h s THR 33 N -1.32 1.08 -0.28 -1.27 -4.23 -1.26 -0.96 115.64 107.41 2h3h s THR 33 Ca 0.47 -0.50 -0.05 0.00 -1.18 0.00 0.00 61.69 60.43 2h3h s THR 33 Cb -0.27 -0.96 0.01 0.00 1.34 0.00 0.00 72.50 72.62 2h3h s THR 33 CO 0.34 0.33 0.03 -0.54 -0.54 0.00 0.00 174.62 174.24 2h3h s LYS 34 N 0.29 3.04 -0.13 3.99 1.02 -0.36 -4.94 119.74 122.65 2h3h s LYS 34 Ca -0.07 -0.87 -0.05 0.00 0.02 0.00 0.00 55.97 54.99 2h3h s LYS 34 Cb -0.12 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 33.92 2h3h s LYS 34 CO 0.02 -0.41 0.06 0.12 -0.92 0.00 0.00 175.35 174.22 2h3h s PHE 35 N 1.45 3.32 0.00 3.18 2.19 -1.26 -0.26 117.98 126.60 2h3h s PHE 35 Ca 0.02 0.24 0.00 0.00 0.33 0.00 0.00 56.93 57.52 2h3h s PHE 35 Cb -0.17 -1.95 -0.00 0.00 -1.31 0.00 0.00 43.02 39.59 2h3h s PHE 35 CO 0.00 0.42 -0.02 0.12 1.83 0.00 0.00 175.22 177.57 2h3h s PHE 36 N -0.42 0.14 -0.10 10.12 5.36 0.38 -4.95 117.98 128.51 2h3h s PHE 36 Ca 0.10 -0.09 -0.07 0.00 -0.96 0.00 0.00 56.93 55.91 2h3h s PHE 36 Cb -0.12 -0.09 0.04 0.00 -0.34 0.00 0.00 43.02 42.50 2h3h s PHE 36 CO 0.02 -0.02 0.24 0.08 -1.46 0.00 0.00 175.22 174.08 2h3h s VAL 37 N -0.22 -0.02 0.87 3.12 1.01 -1.26 -1.13 120.40 122.76 2h3h s VAL 37 Ca -0.02 0.08 -0.13 0.00 0.00 0.00 0.00 61.98 61.91 2h3h s VAL 37 Cb -0.02 -0.36 0.12 0.00 0.00 0.00 0.00 36.38 36.12 2h3h s VAL 37 CO -0.00 0.03 1.21 -2.16 0.00 0.00 0.00 175.10 174.18 2h3h s PRO 38 N 0.75 1.47 0.22 2.72 0.04 -1.26 -4.83 135.00 134.11 2h3h s PRO 38 Ca -0.05 -0.01 -0.01 0.00 0.04 0.00 0.00 61.00 60.97 2h3h s PRO 38 Cb -0.06 -1.90 0.20 0.00 0.04 0.00 0.00 34.50 32.77 2h3h s PRO 38 CO -0.05 -1.92 1.57 1.96 0.04 0.00 0.00 177.00 178.61 2h3h h GLN 39 N -1.29 0.53 0.00 4.56 1.08 -1.91 -2.08 115.11 116.00 2h3h h GLN 39 Ca -0.46 -0.29 -0.08 0.00 -1.45 0.00 0.00 58.65 56.36 2h3h h GLN 39 Cb 1.30 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.73 2h3h h GLN 39 CO 0.58 0.88 -0.00 0.36 -0.95 0.00 0.00 178.83 179.70 2h3h n LYS 40 N -4.00 0.36 -1.70 1.46 -0.00 -1.26 -3.06 118.16 109.97 2h3h n LYS 40 Ca -0.02 -1.11 -0.54 0.00 -0.00 0.00 0.00 58.31 56.64 2h3h n LYS 40 Cb 0.55 1.16 -0.06 0.00 -0.00 0.00 0.00 35.03 36.68 2h3h n LYS 40 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2h3h n GLU 41 N -0.24 1.53 -3.11 -1.58 2.13 -0.50 -4.69 120.64 114.18 2h3h n GLU 41 Ca -0.01 0.56 -0.10 0.00 0.66 0.00 0.00 57.16 58.27 2h3h n GLU 41 Cb 0.25 -2.30 -0.03 0.00 0.27 0.00 0.00 31.44 29.63 2h3h n GLU 41 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2h3h s ASP 42 N 3.62 -0.35 0.26 4.31 -1.08 -1.26 -5.01 116.67 117.16 2h3h s ASP 42 Ca 0.96 -1.73 -0.04 0.00 -0.52 0.00 0.00 52.55 51.23 2h3h s ASP 42 Cb -0.93 1.19 0.33 0.00 -1.46 0.00 0.00 42.92 42.05 2h3h s ASP 42 CO 0.60 -0.15 1.85 0.40 0.52 0.00 0.00 175.17 178.39 2h3h h ILE 43 N 4.94 1.23 0.00 4.11 2.04 -1.97 -1.90 117.51 125.96 2h3h h ILE 43 Ca 0.09 -0.70 -0.13 0.00 1.00 0.00 0.00 64.86 65.12 2h3h h ILE 43 Cb 1.08 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 2h3h h ILE 43 CO 0.14 0.29 -0.62 0.78 0.00 0.00 0.00 178.15 178.74 2h3h h ASN 44 N 1.01 0.00 -0.14 1.72 2.35 -1.99 -1.84 115.58 116.69 2h3h h ASN 44 Ca 0.24 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.97 2h3h h ASN 44 Cb 0.15 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.52 2h3h h ASN 44 CO -0.03 0.62 -0.01 0.00 -1.65 0.00 0.00 177.43 176.36 2h3h h ALA 45 N 1.38 0.19 -0.28 -0.83 0.00 -1.83 -0.46 119.26 117.44 2h3h h ALA 45 Ca -0.01 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.77 2h3h h ALA 45 Cb 1.10 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.76 2h3h h ALA 45 CO 0.08 -0.09 -0.22 1.96 0.00 0.00 0.00 179.25 180.98 2h3h h GLN 46 N -0.02 -0.19 -0.87 0.00 4.20 -1.29 0.24 115.11 117.19 2h3h h GLN 46 Ca 0.04 0.01 0.10 0.00 0.06 0.00 0.00 58.65 58.86 2h3h h GLN 46 Cb 0.40 0.04 -0.08 0.00 0.30 0.00 0.00 27.48 28.15 2h3h h GLN 46 CO 0.01 -0.13 0.51 -0.07 -0.67 0.00 0.00 178.83 178.48 2h3h h LEU 47 N -0.20 0.73 -0.25 1.46 4.07 -1.26 0.18 115.31 120.05 2h3h h LEU 47 Ca 0.15 0.05 -0.02 0.00 0.08 0.00 0.00 57.88 58.14 2h3h h LEU 47 Cb 0.43 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.07 2h3h h LEU 47 CO -0.40 0.41 0.07 1.56 -1.08 0.00 0.00 178.44 179.00 2h3h h GLN 48 N 0.84 0.39 -0.65 1.13 4.20 -0.14 -0.53 115.11 120.35 2h3h h GLN 48 Ca 0.42 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.96 2h3h h GLN 48 Cb 0.40 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 2h3h h GLN 48 CO -0.26 0.48 0.09 1.98 -0.67 0.00 0.00 178.83 180.46 2h3h h MET 49 N 0.23 1.09 -0.34 1.46 4.05 -0.61 -0.95 114.93 119.86 2h3h h MET 49 Ca 0.08 -0.30 0.05 0.00 -0.28 0.00 0.00 59.70 59.25 2h3h h MET 49 Cb 0.26 -0.12 -0.05 0.00 -0.80 0.00 0.00 31.60 30.89 2h3h h MET 49 CO -0.00 1.01 0.06 1.25 0.23 0.00 0.00 176.91 179.46 2h3h h LEU 50 N 1.01 -0.00 -0.83 3.39 5.85 -0.84 -0.86 115.31 123.02 2h3h h LEU 50 Ca 0.20 0.06 0.03 0.00 0.84 0.00 0.00 57.88 59.00 2h3h h LEU 50 Cb 0.46 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 2h3h h LEU 50 CO 0.02 0.04 0.54 -0.33 -0.34 0.00 0.00 178.44 178.36 2h3h h GLU 51 N 0.18 1.03 -0.33 1.25 4.39 -0.73 -2.24 114.58 118.13 2h3h h GLU 51 Ca 0.16 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 2h3h h GLU 51 Cb 0.18 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 2h3h h GLU 51 CO -0.22 0.68 0.20 0.77 -1.16 0.00 0.00 179.01 179.28 2h3h h SER 52 N 1.06 0.39 -0.83 1.42 0.02 -0.62 -0.16 113.55 114.84 2h3h h SER 52 Ca 0.33 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.22 2h3h h SER 52 Cb -0.02 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.38 2h3h h SER 52 CO -0.10 0.33 0.49 -0.26 -1.14 0.00 0.00 176.83 176.14 2h3h h PHE 53 N 0.43 1.09 -0.67 3.45 0.04 -0.93 0.50 116.94 120.85 2h3h h PHE 53 Ca 0.12 -0.01 -0.08 0.00 2.80 0.00 0.00 57.97 60.80 2h3h h PHE 53 Cb 0.00 -0.36 -0.03 0.00 2.20 0.00 0.00 35.95 37.77 2h3h h PHE 53 CO -0.04 0.74 0.11 0.82 -0.60 0.00 0.00 178.31 179.34 2h3h h ILE 54 N 1.14 1.26 -0.47 -0.55 2.04 -1.18 -1.35 117.51 118.40 2h3h h ILE 54 Ca 0.30 -1.04 -0.06 0.00 1.00 0.00 0.00 64.86 65.06 2h3h h ILE 54 Cb -0.03 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 2h3h h ILE 54 CO -0.05 0.39 0.05 0.00 0.00 0.00 0.00 178.15 178.54 2h3h h ALA 55 N 1.05 0.63 0.00 1.87 0.00 -0.31 -2.70 119.26 119.79 2h3h h ALA 55 Ca 0.20 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2h3h h ALA 55 Cb 0.44 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2h3h h ALA 55 CO 0.01 0.38 0.00 0.93 0.00 0.00 0.00 179.25 180.57 2h3h h GLU 56 N 0.66 0.00 -3.00 0.00 5.08 0.21 -3.47 114.58 114.06 2h3h h GLU 56 Ca 0.14 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.38 2h3h h GLU 56 Cb 0.43 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.73 2h3h h GLU 56 CO 0.01 0.00 -0.24 0.41 -1.00 0.00 0.00 179.01 178.19 2h3h n GLY 57 N -0.53 0.27 3.74 -3.84 0.00 -0.57 -5.03 105.19 99.23 2h3h n GLY 57 Ca -0.01 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 2h3h n GLY 57 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2h3h s VAL 58 N -3.11 2.92 -1.77 1.61 -7.23 -0.80 -4.95 120.40 107.06 2h3h s VAL 58 Ca 0.06 0.33 0.24 0.00 -1.81 0.00 0.00 61.98 60.81 2h3h s VAL 58 Cb -0.03 -2.73 0.11 0.00 0.56 0.00 0.00 36.38 34.29 2h3h s VAL 58 CO 0.24 -0.36 1.32 0.59 -0.31 0.00 0.00 175.10 176.58 2h3h n ASN 59 N -3.42 1.40 -3.62 4.85 4.13 0.17 -4.88 115.26 113.88 2h3h n ASN 59 Ca 0.10 -1.11 -0.06 0.00 1.68 0.00 0.00 54.58 55.20 2h3h n ASN 59 Cb 0.52 0.34 -0.05 0.00 -1.54 0.00 0.00 39.78 39.05 2h3h n ASN 59 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2h3h s GLY 60 N -2.56 0.01 -0.09 7.41 0.00 -1.20 -4.26 107.32 106.63 2h3h s GLY 60 Ca 0.20 2.71 0.01 0.00 0.00 0.00 0.00 44.72 47.64 2h3h s GLY 60 CO 0.58 1.33 -0.11 -0.42 0.00 0.00 0.00 173.10 174.48 2h3h s ILE 61 N -0.69 1.17 -0.18 0.90 1.01 -0.29 -0.22 121.20 122.89 2h3h s ILE 61 Ca 0.05 -0.44 -0.07 0.00 0.00 0.00 0.00 60.65 60.18 2h3h s ILE 61 Cb -0.02 -1.11 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 2h3h s ILE 61 CO -0.06 0.38 0.05 0.00 0.00 0.00 0.00 174.94 175.30 2h3h s ALA 62 N 1.09 3.32 -0.00 9.38 0.00 -0.07 -1.19 121.76 134.30 2h3h s ALA 62 Ca -0.06 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.13 2h3h s ALA 62 Cb -0.14 -1.87 -0.00 0.00 0.00 0.00 0.00 23.12 21.10 2h3h s ALA 62 CO -0.02 0.14 -0.06 -1.50 0.00 0.00 0.00 175.76 174.32 2h3h s ILE 63 N 0.46 0.44 -0.66 0.00 2.07 -0.86 -0.91 121.20 121.74 2h3h s ILE 63 Ca 0.02 -0.26 -0.10 0.00 -1.41 0.00 0.00 60.65 58.90 2h3h s ILE 63 Cb -0.13 -0.38 0.17 0.00 0.13 0.00 0.00 42.46 42.26 2h3h s ILE 63 CO 0.01 0.11 0.55 0.00 -1.91 0.00 0.00 174.94 173.70 2h3h s ALA 64 N -0.16 3.74 0.01 1.50 0.00 -0.32 -2.27 121.76 124.25 2h3h s ALA 64 Ca 0.02 -3.02 -0.30 0.00 0.00 0.00 0.00 51.96 48.65 2h3h s ALA 64 Cb -0.02 -3.11 -0.06 0.00 0.00 0.00 0.00 23.12 19.93 2h3h s ALA 64 CO -0.00 -2.11 1.41 -1.25 0.00 0.00 0.00 175.76 173.81 2h3h s PRO 65 N 0.57 4.28 0.37 0.00 0.04 -1.26 -4.54 135.00 134.46 2h3h s PRO 65 Ca 0.13 1.99 0.09 0.00 0.04 0.00 0.00 61.00 63.25 2h3h s PRO 65 Cb -0.19 -3.55 0.73 0.00 0.04 0.00 0.00 34.50 31.52 2h3h s PRO 65 CO -0.04 -0.57 1.88 0.77 0.04 0.00 0.00 177.00 179.08 2h3h h SER 66 N 7.79 0.25 -3.24 6.66 0.02 -1.94 -3.39 113.55 119.69 2h3h h SER 66 Ca -0.38 -0.06 -0.57 0.00 -0.84 0.00 0.00 61.79 59.94 2h3h h SER 66 Cb 1.18 -0.07 -0.37 0.00 0.14 0.00 0.00 62.40 63.29 2h3h h SER 66 CO 0.90 0.43 -0.81 -0.62 -1.14 0.00 0.00 176.83 175.59 2h3h s ASP 67 N -6.87 2.69 0.27 3.07 2.15 -1.26 -1.42 116.67 115.30 2h3h s ASP 67 Ca -0.05 -0.55 -0.01 0.00 0.43 0.00 0.00 52.55 52.36 2h3h s ASP 67 Cb 0.15 -1.01 0.36 0.00 -0.30 0.00 0.00 42.92 42.12 2h3h s ASP 67 CO 0.74 -0.13 1.78 1.55 -0.17 0.00 0.00 175.17 178.95 2h3h h PRO 68 N 8.10 0.79 0.01 4.34 0.13 -1.76 -3.11 132.00 140.51 2h3h h PRO 68 Ca -0.30 -0.20 -0.23 0.00 -0.87 0.00 0.00 66.00 64.40 2h3h h PRO 68 Cb 1.12 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2h3h h PRO 68 CO 0.45 0.77 -0.97 1.15 -0.23 0.00 0.00 178.00 179.17 2h3h h THR 69 N 0.75 1.41 -0.01 1.56 2.02 -1.93 -3.30 112.91 113.40 2h3h h THR 69 Ca 0.15 -2.50 -0.06 0.00 0.77 0.00 0.00 66.41 64.77 2h3h h THR 69 Cb 0.40 2.47 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 2h3h h THR 69 CO 0.01 0.75 -0.26 0.00 0.37 0.00 0.00 175.52 176.38 2h3h h ALA 70 N 0.72 1.55 0.00 6.16 0.00 -1.98 -2.88 119.26 122.83 2h3h h ALA 70 Ca -0.09 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2h3h h ALA 70 Cb 1.62 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2h3h h ALA 70 CO 0.17 0.34 -0.10 -0.39 0.00 0.00 0.00 179.25 179.26 2h3h h VAL 71 N 0.01 0.00 -0.11 0.00 -1.51 -1.63 -3.40 116.25 109.61 2h3h h VAL 71 Ca -0.00 -0.72 0.04 0.00 -1.23 0.00 0.00 66.70 64.79 2h3h h VAL 71 Cb 0.47 1.65 -0.06 0.00 -2.13 0.00 0.00 31.29 31.22 2h3h h VAL 71 CO 0.03 0.00 -0.47 0.40 -1.23 0.00 0.00 177.57 176.30 2h3h h ILE 72 N 0.00 0.08 -0.93 7.19 2.04 -1.62 -1.62 117.51 122.66 2h3h h ILE 72 Ca 0.00 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.98 2h3h h ILE 72 Cb 0.86 0.08 -0.08 0.00 -0.74 0.00 0.00 36.82 36.94 2h3h h ILE 72 CO 0.00 0.00 0.55 -0.65 0.00 0.00 0.00 178.15 178.05 2h3h h PRO 73 N -0.55 0.83 -0.22 2.37 0.11 -1.81 -0.16 132.00 132.57 2h3h h PRO 73 Ca 0.05 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.96 2h3h h PRO 73 Cb 0.66 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.58 2h3h h PRO 73 CO -0.40 0.55 -0.46 1.15 -0.21 0.00 0.00 178.00 178.63 2h3h h THR 74 N 0.86 1.31 -0.79 -1.15 2.02 -1.71 -1.59 112.91 111.87 2h3h h THR 74 Ca 0.47 -1.67 0.00 0.00 0.77 0.00 0.00 66.41 65.98 2h3h h THR 74 Cb 0.51 1.80 -0.04 0.00 -1.74 0.00 0.00 68.15 68.68 2h3h h THR 74 CO -0.28 0.53 0.50 0.40 0.37 0.00 0.00 175.52 177.03 2h3h h ILE 75 N 0.42 1.21 -0.95 3.11 2.04 -0.92 0.19 117.51 122.61 2h3h h ILE 75 Ca 0.01 -0.43 0.06 0.00 1.00 0.00 0.00 64.86 65.49 2h3h h ILE 75 Cb 1.06 0.08 -0.06 0.00 -0.74 0.00 0.00 36.82 37.16 2h3h h ILE 75 CO 0.10 0.22 0.62 0.50 0.00 0.00 0.00 178.15 179.58 2h3h h LYS 76 N 1.08 1.08 -0.15 2.37 3.64 -0.96 -1.23 116.57 122.40 2h3h h LYS 76 Ca 0.29 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 2h3h h LYS 76 Cb -0.08 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.49 2h3h h LYS 76 CO -0.06 0.71 -0.05 -0.22 -2.27 0.00 0.00 179.45 177.57 2h3h h LYS 77 N 1.11 0.29 -0.13 1.90 3.64 -0.24 0.12 116.57 123.26 2h3h h LYS 77 Ca 0.41 -0.12 0.05 0.00 -1.27 0.00 0.00 60.65 59.71 2h3h h LYS 77 Cb 0.17 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.91 2h3h h LYS 77 CO -0.15 0.59 -0.38 0.00 -2.27 0.00 0.00 179.45 177.24 2h3h h ALA 78 N 0.69 -0.49 -0.78 5.00 0.00 -0.79 -0.94 119.26 121.94 2h3h h ALA 78 Ca 0.04 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.00 2h3h h ALA 78 Cb 0.49 0.71 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 2h3h h ALA 78 CO 0.02 -0.87 0.48 -0.07 0.00 0.00 0.00 179.25 178.81 2h3h h LEU 79 N -0.45 0.76 -1.73 0.00 3.38 -1.17 -0.93 115.31 115.17 2h3h h LEU 79 Ca 0.09 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.12 2h3h h LEU 79 Cb 0.60 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2h3h h LEU 79 CO -0.38 0.50 0.28 -0.33 0.09 0.00 0.00 178.44 178.61 2h3h h GLU 80 N 0.90 0.33 -0.33 1.13 5.08 -0.02 0.54 114.58 122.21 2h3h h GLU 80 Ca 0.33 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 2h3h h GLU 80 Cb 0.11 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2h3h h GLU 80 CO -0.15 0.22 0.00 -1.33 -1.00 0.00 0.00 179.01 176.75 2h3h n MET 81 N -4.48 1.83 -2.02 2.33 2.81 -0.43 -4.91 117.12 112.25 2h3h n MET 81 Ca 0.05 -1.28 0.00 0.00 -1.81 0.00 0.00 57.70 54.67 2h3h n MET 81 Cb 0.24 -1.30 0.00 0.00 -0.71 0.00 0.00 33.22 31.45 2h3h n MET 81 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2h3h n GLY 82 N 1.09 0.62 3.28 3.03 0.00 0.18 -5.05 105.19 108.34 2h3h n GLY 82 Ca 0.13 -0.78 -0.37 0.00 0.00 0.00 0.00 46.02 45.00 2h3h n GLY 82 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h3h s ILE 83 N -2.28 3.71 0.43 -0.61 1.01 -0.46 -4.99 121.20 118.00 2h3h s ILE 83 Ca 0.00 -1.04 -0.25 0.00 0.00 0.00 0.00 60.65 59.37 2h3h s ILE 83 Cb 0.00 -3.04 -0.08 0.00 0.01 0.00 0.00 42.46 39.35 2h3h s ILE 83 CO 0.00 -0.08 1.26 -2.16 0.00 0.00 0.00 174.94 173.95 2h3h s PRO 84 N 1.41 3.88 -0.03 2.79 0.04 -1.26 -3.32 135.00 138.50 2h3h s PRO 84 Ca -0.01 2.03 0.02 0.00 0.04 0.00 0.00 61.00 63.09 2h3h s PRO 84 Cb -0.19 -2.64 0.01 0.00 0.04 0.00 0.00 34.50 31.72 2h3h s PRO 84 CO 0.02 -0.53 -0.10 0.08 0.04 0.00 0.00 177.00 176.52 2h3h s VAL 85 N -1.34 0.84 0.29 -0.36 1.01 -1.26 -1.14 120.40 118.44 2h3h s VAL 85 Ca 0.59 -0.38 0.06 0.00 0.00 0.00 0.00 61.98 62.25 2h3h s VAL 85 Cb -0.35 -0.76 -0.06 0.00 0.00 0.00 0.00 36.38 35.21 2h3h s VAL 85 CO 0.44 0.27 -0.03 0.68 0.00 0.00 0.00 175.10 176.46 2h3h s VAL 86 N 0.29 1.53 0.15 2.92 -7.23 -0.33 -0.83 120.40 116.89 2h3h s VAL 86 Ca -0.05 -2.09 0.09 0.00 -1.81 0.00 0.00 61.98 58.12 2h3h s VAL 86 Cb -0.10 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 2h3h s VAL 86 CO 0.01 -0.23 -0.14 0.42 -0.31 0.00 0.00 175.10 174.85 2h3h s THR 87 N -3.08 3.04 0.08 5.32 -4.23 -0.32 -2.03 115.64 114.41 2h3h s THR 87 Ca 0.31 -1.57 0.02 0.00 -1.18 0.00 0.00 61.69 59.28 2h3h s THR 87 Cb 0.05 -2.45 -0.03 0.00 1.34 0.00 0.00 72.50 71.41 2h3h s THR 87 CO 0.13 -0.00 -0.08 -1.48 -0.54 0.00 0.00 174.62 172.65 2h3h s LEU 88 N -2.48 2.39 0.00 4.79 2.34 -0.96 -0.50 118.68 124.26 2h3h s LEU 88 Ca 0.22 -0.80 0.00 0.00 0.06 0.00 0.00 54.13 53.61 2h3h s LEU 88 Cb -0.10 -0.14 0.00 0.00 -0.56 0.00 0.00 46.19 45.39 2h3h s LEU 88 CO 0.13 -0.33 0.00 -0.67 -1.06 0.00 0.00 176.35 174.42 2h3h n ASP 89 N 0.64 0.00 -3.86 1.48 2.03 -0.68 -3.85 116.55 112.31 2h3h n ASP 89 Ca -0.17 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.03 2h3h n ASP 89 Cb 0.58 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.88 2h3h n ASP 89 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2h3h s THR 90 N 0.00 0.09 0.39 5.18 -1.32 -1.26 -4.67 115.64 114.05 2h3h s THR 90 Ca 0.00 -0.74 0.08 0.00 -1.21 0.00 0.00 61.69 59.81 2h3h s THR 90 Cb 0.00 -0.58 -0.00 0.00 -1.51 0.00 0.00 72.50 70.41 2h3h s THR 90 CO 0.00 -0.41 0.48 -0.62 -2.21 0.00 0.00 174.62 171.87 2h3h s ASP 91 N -1.57 5.56 -0.41 8.08 2.15 -1.26 -4.20 116.67 125.02 2h3h s ASP 91 Ca -0.12 -0.45 0.04 0.00 0.43 0.00 0.00 52.55 52.45 2h3h s ASP 91 Cb -0.06 -0.78 0.17 0.00 -0.30 0.00 0.00 42.92 41.95 2h3h s ASP 91 CO 0.00 -0.64 0.40 -0.55 -0.17 0.00 0.00 175.17 174.21 2h3h s SER 92 N -4.24 1.07 0.57 -0.34 0.15 -1.26 -4.58 113.70 105.07 2h3h s SER 92 Ca 0.50 -2.49 0.37 0.00 0.70 0.00 0.00 55.95 55.03 2h3h s SER 92 Cb -0.08 0.13 1.72 0.00 -1.71 0.00 0.00 66.02 66.08 2h3h s SER 92 CO 0.31 -0.18 2.10 1.55 1.20 0.00 0.00 173.24 178.22 2h3h h PRO 93 N 5.93 0.00 -0.73 5.44 0.13 -1.96 -2.48 132.00 138.33 2h3h h PRO 93 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2h3h h PRO 93 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2h3h h PRO 93 CO 0.27 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.79 2h3h n ASP 94 N -3.03 3.95 0.13 1.44 8.00 -1.26 -4.40 116.55 121.38 2h3h n ASP 94 Ca -0.01 -2.00 0.12 0.00 0.71 0.00 0.00 54.79 53.62 2h3h n ASP 94 Cb 0.22 -0.48 0.26 0.00 -0.02 0.00 0.00 41.12 41.10 2h3h n ASP 94 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2h3h h SER 95 N 4.36 0.00 0.00 -2.24 4.64 -1.78 -3.47 113.55 115.05 2h3h h SER 95 Ca 0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2h3h h SER 95 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2h3h h SER 95 CO 0.00 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 2h3h n GLY 96 N 1.24 0.58 3.60 -0.77 0.00 -1.26 -4.06 105.19 104.52 2h3h n GLY 96 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2h3h n GLY 96 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2h3h n ARG 97 N -2.00 1.33 0.10 1.61 -4.01 -1.26 -4.93 116.66 107.49 2h3h n ARG 97 Ca 0.00 0.47 -0.17 0.00 -1.04 0.00 0.00 57.85 57.12 2h3h n ARG 97 Cb 0.00 -1.99 -0.14 0.00 -3.04 0.00 0.00 32.46 27.29 2h3h n ARG 97 CO 0.00 0.00 0.00 1.88 -3.04 0.00 0.00 177.63 176.47 2h3h h TYR 98 N 1.59 0.53 -3.00 2.89 0.99 -1.35 -3.47 116.97 115.14 2h3h h TYR 98 Ca -0.44 -0.38 -0.14 0.00 2.00 0.00 0.00 58.73 59.77 2h3h h TYR 98 Cb 1.34 -0.02 -0.24 0.00 1.00 0.00 0.00 36.73 38.81 2h3h h TYR 98 CO 0.44 1.33 -0.35 0.08 -0.00 0.00 0.00 178.16 179.66 2h3h s VAL 99 N -2.64 0.01 -0.19 -2.88 1.01 -1.26 -4.31 120.40 110.14 2h3h s VAL 99 Ca -0.06 -0.06 -0.09 0.00 0.00 0.00 0.00 61.98 61.77 2h3h s VAL 99 Cb 0.07 -0.45 -0.05 0.00 0.00 0.00 0.00 36.38 35.95 2h3h s VAL 99 CO 0.88 -0.04 0.10 -0.47 0.00 0.00 0.00 175.10 175.58 2h3h s TYR 100 N -0.03 3.34 -0.29 5.22 6.14 -0.88 -1.17 117.35 129.68 2h3h s TYR 100 Ca -0.02 0.21 0.03 0.00 0.64 0.00 0.00 57.07 57.93 2h3h s TYR 100 Cb -0.03 -2.13 0.08 0.00 0.42 0.00 0.00 41.96 40.30 2h3h s TYR 100 CO 0.01 0.23 -0.04 0.42 0.64 0.00 0.00 175.55 176.81 2h3h s ILE 101 N 0.37 2.03 -0.96 3.14 1.01 0.34 -0.92 121.20 126.22 2h3h s ILE 101 Ca 0.06 -1.79 0.00 0.00 0.00 0.00 0.00 60.65 58.92 2h3h s ILE 101 Cb -0.12 -2.30 0.00 0.00 0.01 0.00 0.00 42.46 40.05 2h3h s ILE 101 CO -0.01 -0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.27 2h3h n GLY 102 N 4.43 -1.29 3.79 6.18 0.00 -0.38 -1.69 105.19 116.24 2h3h n GLY 102 Ca -0.07 -0.91 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 2h3h n GLY 102 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2h3h s THR 103 N -2.87 3.65 -0.94 2.61 2.01 -1.26 -1.70 115.64 117.14 2h3h s THR 103 Ca 0.00 0.87 -0.23 0.00 0.31 0.00 0.00 61.69 62.64 2h3h s THR 103 Cb 0.00 -3.35 0.05 0.00 0.01 0.00 0.00 72.50 69.21 2h3h s THR 103 CO 0.00 -0.37 1.37 -0.62 -0.69 0.00 0.00 174.62 174.31 2h3h s ASP 104 N -2.42 6.43 0.17 3.53 3.68 -1.26 -4.89 116.67 121.91 2h3h s ASP 104 Ca 0.66 -1.28 -0.11 0.00 2.13 0.00 0.00 52.55 53.96 2h3h s ASP 104 Cb -0.18 -2.55 0.04 0.00 -1.45 0.00 0.00 42.92 38.79 2h3h s ASP 104 CO 0.32 -1.54 1.62 0.78 0.13 0.00 0.00 175.17 176.48 2h3h h ASN 105 N 9.75 0.96 -0.31 -0.34 2.35 -1.93 -0.58 115.58 125.48 2h3h h ASN 105 Ca 0.08 -0.31 0.01 0.00 -0.55 0.00 0.00 56.30 55.53 2h3h h ASN 105 Cb 1.02 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 39.12 2h3h h ASN 105 CO 1.36 1.04 0.20 0.22 -1.65 0.00 0.00 177.43 178.60 2h3h h TYR 106 N 0.86 0.38 -0.18 1.19 3.20 -1.90 -1.01 116.97 119.51 2h3h h TYR 106 Ca 0.16 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.92 2h3h h TYR 106 Cb 0.54 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 2h3h h TYR 106 CO 0.04 0.23 -0.41 1.96 -1.64 0.00 0.00 178.16 178.34 2h3h h GLN 107 N 0.41 0.40 0.01 1.82 1.08 -1.80 -0.59 115.11 116.44 2h3h h GLN 107 Ca 0.12 -0.20 -0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2h3h h GLN 107 Cb -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.40 2h3h h GLN 107 CO -0.04 0.75 -0.00 0.00 -0.95 0.00 0.00 178.83 178.59 2h3h h ALA 108 N 1.23 -0.01 -0.74 3.87 0.00 -0.93 -0.67 119.26 122.02 2h3h h ALA 108 Ca 0.03 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 54.95 2h3h h ALA 108 Cb 0.86 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 2h3h h ALA 108 CO 0.07 -0.40 0.34 0.78 0.00 0.00 0.00 179.25 180.04 2h3h h GLY 109 N -0.23 1.13 0.98 0.00 0.00 -1.07 -0.57 103.07 103.31 2h3h h GLY 109 Ca -0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 2h3h h GLY 109 CO 0.00 -0.02 0.02 -1.82 0.00 0.00 0.00 176.54 174.73 2h3h h TYR 110 N 0.53 0.87 -0.81 5.60 5.03 -1.01 -1.78 116.97 125.40 2h3h h TYR 110 Ca 0.39 -0.14 0.00 0.00 2.58 0.00 0.00 58.73 61.56 2h3h h TYR 110 Cb 0.51 -0.23 -0.04 0.00 1.55 0.00 0.00 36.73 38.52 2h3h h TYR 110 CO -0.13 0.83 0.52 1.15 -1.32 0.00 0.00 178.16 179.21 2h3h h THR 111 N 0.66 1.21 -0.48 1.81 2.02 -0.65 -1.89 112.91 115.60 2h3h h THR 111 Ca 0.13 -0.41 0.03 0.00 0.77 0.00 0.00 66.41 66.93 2h3h h THR 111 Cb 0.47 0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 66.88 2h3h h THR 111 CO 0.02 0.21 0.26 0.00 0.37 0.00 0.00 175.52 176.38 2h3h h ALA 112 N 1.29 0.61 -0.87 6.16 0.00 -0.94 -2.41 119.26 123.10 2h3h h ALA 112 Ca 0.30 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.22 2h3h h ALA 112 Cb -0.10 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2h3h h ALA 112 CO -0.06 -0.07 0.57 0.78 0.00 0.00 0.00 179.25 180.47 2h3h h GLY 113 N 0.52 1.22 1.15 0.00 0.00 -0.84 -1.22 103.07 103.91 2h3h h GLY 113 Ca 0.20 -0.46 -0.07 0.00 0.00 0.00 0.00 47.33 47.00 2h3h h GLY 113 CO -0.12 0.45 0.13 1.41 0.00 0.00 0.00 176.54 178.41 2h3h h LEU 114 N 1.18 0.99 0.04 3.11 3.38 -1.12 -0.40 115.31 122.49 2h3h h LEU 114 Ca 0.32 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2h3h h LEU 114 Cb -0.13 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.36 2h3h h LEU 114 CO -0.07 0.98 -0.02 0.40 0.09 0.00 0.00 178.44 179.82 2h3h h ILE 115 N 0.99 1.09 -0.48 1.22 2.04 -1.10 -2.09 117.51 119.17 2h3h h ILE 115 Ca 0.20 -0.41 0.10 0.00 1.00 0.00 0.00 64.86 65.75 2h3h h ILE 115 Cb 0.39 1.36 -0.09 0.00 -0.74 0.00 0.00 36.82 37.74 2h3h h ILE 115 CO 0.01 0.10 -0.13 -0.03 0.00 0.00 0.00 178.15 178.10 2h3h h MET 116 N -0.23 -0.01 -0.76 2.37 4.05 -0.98 0.32 114.93 119.68 2h3h h MET 116 Ca -0.01 0.00 0.10 0.00 -0.28 0.00 0.00 59.70 59.51 2h3h h MET 116 Cb 0.21 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 30.94 2h3h h MET 116 CO 0.01 -0.01 0.40 -0.22 0.23 0.00 0.00 176.91 177.33 2h3h h LYS 117 N -0.01 0.65 0.06 0.39 3.64 -0.94 0.50 116.57 120.87 2h3h h LYS 117 Ca 0.23 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.57 2h3h h LYS 117 Cb 0.36 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 2h3h h LYS 117 CO -0.50 0.43 -0.03 1.49 -2.27 0.00 0.00 179.45 178.57 2h3h h GLU 118 N 0.67 -0.08 -0.76 1.90 4.57 -0.61 -0.86 114.58 119.41 2h3h h GLU 118 Ca 0.38 0.01 0.04 0.00 -1.18 0.00 0.00 59.36 58.60 2h3h h GLU 118 Cb 0.39 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.96 2h3h h GLU 118 CO -0.27 0.10 0.50 -0.07 -1.18 0.00 0.00 179.01 178.09 2h3h h LEU 119 N -0.25 0.79 -2.61 1.64 4.07 0.99 -2.61 115.31 117.34 2h3h h LEU 119 Ca -0.01 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.94 2h3h h LEU 119 Cb 0.22 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.78 2h3h h LEU 119 CO 0.01 0.54 0.00 0.18 -1.08 0.00 0.00 178.44 178.09 2h3h n LEU 120 N -4.46 3.80 0.00 1.67 4.77 0.16 -4.94 117.00 118.00 2h3h n LEU 120 Ca 0.10 -1.90 0.00 0.00 -0.03 0.00 0.00 56.01 54.18 2h3h n LEU 120 Cb 0.13 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 2h3h n LEU 120 CO 0.35 0.95 0.00 0.61 -1.33 0.00 0.00 177.39 177.96 2h3h n GLY 121 N 1.63 0.12 0.72 -0.72 0.00 -0.97 -1.98 105.19 103.99 2h3h n GLY 121 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2h3h n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h3h n GLY 122 N -0.09 0.96 3.62 -0.02 0.00 -0.37 -5.00 105.19 104.29 2h3h n GLY 122 Ca 0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 46.02 45.53 2h3h n GLY 122 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2h3h s LYS 123 N -1.10 0.65 0.00 1.61 2.20 -0.84 -1.10 119.74 121.17 2h3h s LYS 123 Ca 0.00 0.66 0.00 0.00 -0.36 0.00 0.00 55.97 56.27 2h3h s LYS 123 Cb 0.00 0.32 0.00 0.00 -1.51 0.00 0.00 37.83 36.64 2h3h s LYS 123 CO 0.00 -0.10 0.00 0.41 -0.36 0.00 0.00 175.35 175.30 2h3h n GLY 124 N 2.15 -1.86 3.20 5.54 0.00 -1.24 -4.73 105.19 108.25 2h3h n GLY 124 Ca -0.13 -1.48 -0.34 0.00 0.00 0.00 0.00 46.02 44.07 2h3h n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h3h s LYS 125 N -1.77 3.15 -0.08 1.61 1.02 -1.26 0.07 119.74 122.47 2h3h s LYS 125 Ca 0.00 -0.75 0.01 0.00 0.02 0.00 0.00 55.97 55.25 2h3h s LYS 125 Cb 0.00 -2.72 -0.02 0.00 -0.52 0.00 0.00 37.83 34.57 2h3h s LYS 125 CO 0.00 -0.17 -0.11 0.08 -0.92 0.00 0.00 175.35 174.23 2h3h s VAL 126 N 1.28 3.35 -0.08 3.17 1.01 0.29 -1.53 120.40 127.88 2h3h s VAL 126 Ca 0.04 -0.60 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 2h3h s VAL 126 Cb -0.14 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 2h3h s VAL 126 CO -0.08 0.57 -0.03 -0.69 0.00 0.00 0.00 175.10 174.87 2h3h s VAL 127 N -0.39 4.02 -0.11 2.92 1.01 -0.80 -1.08 120.40 125.97 2h3h s VAL 127 Ca 0.05 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 2h3h s VAL 127 Cb -0.12 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 2h3h s VAL 127 CO 0.02 0.59 -0.02 -0.63 0.00 0.00 0.00 175.10 175.06 2h3h s ILE 128 N -0.73 4.07 -0.08 2.22 1.01 -0.24 -0.17 121.20 127.27 2h3h s ILE 128 Ca 0.11 -0.32 0.05 0.00 0.00 0.00 0.00 60.65 60.49 2h3h s ILE 128 Cb -0.11 -2.74 -0.00 0.00 0.01 0.00 0.00 42.46 39.62 2h3h s ILE 128 CO 0.02 0.55 -0.24 -0.83 0.00 0.00 0.00 174.94 174.44 2h3h s GLY 129 N -0.32 1.29 0.21 6.18 0.00 0.07 -0.08 107.32 114.67 2h3h s GLY 129 Ca 0.06 -0.98 -0.06 0.00 0.00 0.00 0.00 44.72 43.74 2h3h s GLY 129 CO 0.02 -0.45 0.27 -1.08 0.00 0.00 0.00 173.10 171.86 2h3h s THR 130 N 0.14 0.01 -1.09 0.90 -1.32 -0.12 -1.25 115.64 112.92 2h3h s THR 130 Ca -0.12 -1.73 0.12 0.00 -1.21 0.00 0.00 61.69 58.74 2h3h s THR 130 Cb -0.16 -2.32 0.29 0.00 -1.51 0.00 0.00 72.50 68.80 2h3h s THR 130 CO 0.07 -0.05 1.21 0.61 -2.21 0.00 0.00 174.62 174.25 2h3h n GLY 131 N -0.30 2.25 3.57 6.08 0.00 -1.26 -0.91 105.19 114.62 2h3h n GLY 131 Ca -0.00 -0.40 -0.15 0.00 0.00 0.00 0.00 46.02 45.47 2h3h n GLY 131 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2h3h s SER 132 N -1.00 -0.62 0.00 1.61 0.15 -1.26 -2.83 113.70 109.75 2h3h s SER 132 Ca 0.23 0.86 0.00 0.00 0.70 0.00 0.00 55.95 57.74 2h3h s SER 132 Cb 0.13 0.76 0.00 0.00 -1.71 0.00 0.00 66.02 65.19 2h3h s SER 132 CO 0.17 -0.44 0.88 0.18 1.20 0.00 0.00 173.24 175.23 2h3h n LEU 133 N 1.43 1.71 -0.04 3.45 4.77 -1.26 -4.72 117.00 122.34 2h3h n LEU 133 Ca -0.16 -1.71 -0.04 0.00 -0.03 0.00 0.00 56.01 54.07 2h3h n LEU 133 Cb 0.57 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.61 2h3h n LEU 133 CO 0.16 0.43 -0.73 0.35 -1.33 0.00 0.00 177.39 176.26 2h3h n THR 134 N -0.39 0.46 -2.15 -5.08 -2.24 -1.26 -4.95 114.28 98.67 2h3h n THR 134 Ca 0.00 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 2h3h n THR 134 Cb 0.22 -0.82 -0.03 0.00 -2.10 0.00 0.00 70.33 67.60 2h3h n THR 134 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h3h s ALA 135 N -2.16 3.59 0.26 6.98 0.00 -0.50 -4.31 121.76 125.61 2h3h s ALA 135 Ca -0.06 1.16 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 2h3h s ALA 135 Cb 0.02 -3.53 0.36 0.00 0.00 0.00 0.00 23.12 19.97 2h3h s ALA 135 CO 0.24 -0.61 1.90 0.52 0.00 0.00 0.00 175.76 177.81 2h3h h MET 136 N 6.11 1.20 -0.36 0.00 0.00 -1.83 -2.58 114.93 117.47 2h3h h MET 136 Ca -0.43 -0.07 -0.02 0.00 0.00 0.00 0.00 59.70 59.18 2h3h h MET 136 Cb 1.21 -0.27 -0.02 0.00 0.00 0.00 0.00 31.60 32.52 2h3h h MET 136 CO 0.83 0.79 0.16 -2.95 0.00 0.00 0.00 176.91 175.74 2h3h h ASN 137 N 1.23 0.45 0.07 1.22 -0.00 -1.91 0.39 115.58 117.02 2h3h h ASN 137 Ca 0.41 -0.04 -0.00 0.00 -0.00 0.00 0.00 56.30 56.67 2h3h h ASN 137 Cb 0.06 -0.11 0.00 0.00 -0.00 0.00 0.00 38.32 38.27 2h3h h ASN 137 CO -0.14 0.40 -0.03 -1.28 -0.00 0.00 0.00 177.43 176.37 2h3h h SER 138 N 0.50 -0.08 -0.57 6.14 0.87 -1.83 -2.17 113.55 116.41 2h3h h SER 138 Ca 0.13 -0.45 0.09 0.00 -1.23 0.00 0.00 61.79 60.33 2h3h h SER 138 Cb 0.08 0.02 -0.07 0.00 -0.44 0.00 0.00 62.40 61.99 2h3h h SER 138 CO -0.02 0.43 0.18 -0.07 -0.53 0.00 0.00 176.83 176.83 2h3h h LEU 139 N -0.61 0.14 -0.65 2.23 3.38 -1.04 -0.15 115.31 118.61 2h3h h LEU 139 Ca -0.01 0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 2h3h h LEU 139 Cb 0.52 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2h3h h LEU 139 CO 0.02 0.09 -0.02 1.56 0.09 0.00 0.00 178.44 180.18 2h3h h GLN 140 N 0.34 1.04 -0.30 1.13 4.20 -0.31 -0.08 115.11 121.14 2h3h h GLN 140 Ca 0.29 -0.33 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 2h3h h GLN 140 Cb 0.37 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 2h3h h GLN 140 CO -0.32 1.02 0.02 0.00 -0.67 0.00 0.00 178.83 178.89 2h3h h ARG 141 N 0.94 0.51 -0.05 1.46 3.08 -0.89 0.82 114.38 120.25 2h3h h ARG 141 Ca 0.17 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2h3h h ARG 141 Cb 0.57 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 2h3h h ARG 141 CO 0.03 0.63 0.02 0.82 -1.07 0.00 0.00 179.97 180.41 2h3h h ILE 142 N 0.31 1.11 -0.57 2.04 2.04 -0.99 0.47 117.51 121.92 2h3h h ILE 142 Ca 0.09 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 65.64 2h3h h ILE 142 Cb 0.39 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 2h3h h ILE 142 CO 0.01 0.09 0.37 -0.61 0.00 0.00 0.00 178.15 178.01 2h3h h GLN 143 N -0.05 0.73 -0.43 2.37 5.75 -0.98 0.16 115.11 122.65 2h3h h GLN 143 Ca 0.02 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.50 2h3h h GLN 143 Cb 0.12 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 28.48 2h3h h GLN 143 CO -0.00 0.48 0.24 0.78 -2.65 0.00 0.00 178.83 177.68 2h3h h GLY 144 N 0.75 0.60 0.99 2.39 0.00 -0.69 -1.09 103.07 106.01 2h3h h GLY 144 Ca 0.22 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 2h3h h GLY 144 CO -0.06 0.14 -0.01 -2.75 0.00 0.00 0.00 176.54 173.86 2h3h h PHE 145 N 0.47 -0.02 -0.46 5.60 3.57 -0.37 -1.83 116.94 123.90 2h3h h PHE 145 Ca 0.18 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.77 2h3h h PHE 145 Cb 0.05 0.01 -0.08 0.00 2.79 0.00 0.00 35.95 38.71 2h3h h PHE 145 CO -0.09 -0.00 -0.06 0.87 -2.23 0.00 0.00 178.31 176.80 2h3h h LYS 146 N -0.03 0.05 -0.51 1.11 1.57 -0.52 -2.27 116.57 115.97 2h3h h LYS 146 Ca -0.00 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 2h3h h LYS 146 Cb 0.02 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 2h3h h LYS 146 CO 0.00 0.03 0.18 -0.44 -0.57 0.00 0.00 179.45 178.65 2h3h h ASP 147 N 0.05 0.68 0.67 0.86 5.19 -1.02 -2.56 116.42 120.28 2h3h h ASP 147 Ca 0.23 -0.09 -0.09 0.00 -0.62 0.00 0.00 57.03 56.46 2h3h h ASP 147 Cb 0.35 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 2h3h h ASP 147 CO -0.43 0.63 -0.42 0.00 -3.12 0.00 0.00 179.24 175.90 2h3h h ALA 148 N 1.47 1.08 -0.40 3.45 0.00 -0.75 -2.93 119.26 121.18 2h3h h ALA 148 Ca 0.17 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2h3h h ALA 148 Cb 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2h3h h ALA 148 CO -0.01 0.52 0.00 0.44 0.00 0.00 0.00 179.25 180.20 2h3h n ILE 149 N -3.71 0.54 -0.07 0.00 -5.35 -1.06 -4.57 119.36 105.14 2h3h n ILE 149 Ca -0.01 -0.77 -0.07 0.00 -0.27 0.00 0.00 62.75 61.63 2h3h n ILE 149 Cb 0.50 0.95 -0.01 0.00 -1.74 0.00 0.00 39.64 39.34 2h3h n ILE 149 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2h3h h LYS 150 N 4.33 -0.08 0.00 6.28 1.63 -1.26 -2.08 116.57 125.39 2h3h h LYS 150 Ca 0.00 0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.78 2h3h h LYS 150 Cb 0.97 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.61 2h3h h LYS 150 CO 0.00 -0.05 -0.12 0.38 -3.45 0.00 0.00 179.45 176.21 2h3h h ASP 151 N -0.08 0.00 -3.87 4.20 -0.00 -1.82 -3.45 116.42 111.40 2h3h h ASP 151 Ca 0.14 0.00 -0.36 0.00 -0.00 0.00 0.00 57.03 56.81 2h3h h ASP 151 Cb 0.30 0.00 0.13 0.00 -0.00 0.00 0.00 39.33 39.76 2h3h h ASP 151 CO -0.33 0.12 0.30 -1.54 -0.00 0.00 0.00 179.24 177.79 2h3h n SER 152 N -3.43 0.30 -1.68 4.15 3.41 -0.78 -5.01 113.62 110.58 2h3h n SER 152 Ca -0.01 -1.51 -0.10 0.00 -0.26 0.00 0.00 58.87 56.98 2h3h n SER 152 Cb 0.29 -0.79 0.22 0.00 -0.26 0.00 0.00 64.21 63.67 2h3h n SER 152 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2h3h n GLU 153 N -3.18 2.44 -2.30 4.33 -0.58 -0.26 -5.00 120.64 116.08 2h3h n GLU 153 Ca 0.14 -3.08 -0.32 0.00 -0.42 0.00 0.00 57.16 53.48 2h3h n GLU 153 Cb 0.48 -2.03 -0.02 0.00 -0.57 0.00 0.00 31.44 29.31 2h3h n GLU 153 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2h3h s ILE 154 N -3.18 4.36 -0.05 -3.67 1.01 -1.25 -3.68 121.20 114.74 2h3h s ILE 154 Ca 0.51 1.13 0.01 0.00 0.00 0.00 0.00 60.65 62.29 2h3h s ILE 154 Cb 0.43 -3.64 0.02 0.00 0.01 0.00 0.00 42.46 39.28 2h3h s ILE 154 CO 0.07 -0.65 -0.04 -0.70 0.00 0.00 0.00 174.94 173.61 2h3h s GLU 155 N -4.09 0.88 -0.42 2.79 2.12 0.11 -4.87 118.70 115.21 2h3h s GLU 155 Ca 0.60 -0.09 -0.15 0.00 0.36 0.00 0.00 54.97 55.69 2h3h s GLU 155 Cb -0.11 -0.93 0.04 0.00 0.26 0.00 0.00 34.13 33.38 2h3h s GLU 155 CO 0.33 -0.12 0.32 0.42 -0.54 0.00 0.00 175.26 175.67 2h3h s ILE 156 N 1.12 5.19 -0.11 -3.70 1.01 -1.26 0.11 121.20 123.56 2h3h s ILE 156 Ca -0.08 -0.79 0.16 0.00 0.00 0.00 0.00 60.65 59.94 2h3h s ILE 156 Cb -0.14 -3.95 -0.18 0.00 0.01 0.00 0.00 42.46 38.20 2h3h s ILE 156 CO -0.01 -0.38 0.70 1.33 0.00 0.00 0.00 174.94 176.58 2h3h n VAL 157 N 5.16 1.27 -3.60 2.92 0.24 -0.24 -4.95 118.33 119.13 2h3h n VAL 157 Ca -0.11 -0.73 -0.13 0.00 -2.04 0.00 0.00 64.34 61.33 2h3h n VAL 157 Cb 0.46 -0.76 -0.06 0.00 -1.47 0.00 0.00 33.84 32.00 2h3h n VAL 157 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2h3h s ASP 158 N -5.78 -0.61 -0.29 -1.34 -1.08 -1.26 -5.07 116.67 101.25 2h3h s ASP 158 Ca -0.04 0.98 -0.04 0.00 -0.52 0.00 0.00 52.55 52.93 2h3h s ASP 158 Cb 0.08 0.93 0.03 0.00 -1.46 0.00 0.00 42.92 42.50 2h3h s ASP 158 CO 0.82 -0.34 0.03 -0.63 0.52 0.00 0.00 175.17 175.57 2h3h s ILE 159 N -0.28 3.43 -0.32 4.11 1.09 -1.26 -1.08 121.20 126.89 2h3h s ILE 159 Ca -0.02 -0.98 -0.09 0.00 -1.10 0.00 0.00 60.65 58.45 2h3h s ILE 159 Cb -0.03 -2.82 -0.00 0.00 -1.06 0.00 0.00 42.46 38.55 2h3h s ILE 159 CO 0.02 0.05 0.15 -0.76 -0.10 0.00 0.00 174.94 174.30 2h3h s LEU 160 N 1.39 4.15 -0.41 2.97 2.01 0.88 -5.00 118.68 124.67 2h3h s LEU 160 Ca -0.00 -0.61 -0.16 0.00 0.01 0.00 0.00 54.13 53.37 2h3h s LEU 160 Cb -0.18 -1.99 0.02 0.00 0.01 0.00 0.00 46.19 44.05 2h3h s LEU 160 CO -0.00 -0.22 0.38 0.21 1.01 0.00 0.00 176.35 177.73 2h3h s ASN 161 N 1.59 6.16 0.00 2.29 2.47 -1.26 -0.94 114.94 125.25 2h3h s ASN 161 Ca 0.04 -0.74 0.26 0.00 0.42 0.00 0.00 52.86 52.84 2h3h s ASN 161 Cb -0.17 -2.20 0.61 0.00 -1.45 0.00 0.00 41.25 38.04 2h3h s ASN 161 CO 0.06 -0.52 1.47 -0.90 -3.72 0.00 0.00 177.10 173.50 2h3h n ASP 162 N 5.42 0.91 -2.47 -4.21 5.75 -0.09 -4.96 116.55 116.90 2h3h n ASP 162 Ca -0.09 -0.73 -0.21 0.00 -0.01 0.00 0.00 54.79 53.75 2h3h n ASP 162 Cb 0.47 0.22 -0.00 0.00 -1.03 0.00 0.00 41.12 40.78 2h3h n ASP 162 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2h3h n GLU 163 N -0.91 -2.18 -3.10 0.11 1.02 -1.21 -2.77 120.64 111.61 2h3h n GLU 163 Ca 0.10 0.99 -0.14 0.00 -0.02 0.00 0.00 57.16 58.09 2h3h n GLU 163 Cb 0.35 -5.68 0.06 0.00 -0.02 0.00 0.00 31.44 26.15 2h3h n GLU 163 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2h3h n GLU 164 N -3.16 -5.00 -3.97 3.49 1.02 -1.13 -1.40 120.64 110.49 2h3h n GLU 164 Ca -0.23 0.60 -0.34 0.00 -0.02 0.00 0.00 57.16 57.17 2h3h n GLU 164 Cb 0.68 -4.88 -0.14 0.00 -0.02 0.00 0.00 31.44 27.07 2h3h n GLU 164 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2h3h s ASP 165 N -3.72 4.17 0.15 1.62 2.15 -1.12 -4.48 116.67 115.45 2h3h s ASP 165 Ca 0.14 -0.78 -0.14 0.00 0.43 0.00 0.00 52.55 52.19 2h3h s ASP 165 Cb -0.06 -1.65 0.03 0.00 -0.30 0.00 0.00 42.92 40.94 2h3h s ASP 165 CO 0.52 -0.10 1.70 1.23 -0.17 0.00 0.00 175.17 178.34 2h3h h GLY 166 N 8.01 0.78 0.95 2.66 0.00 -1.95 0.98 103.07 114.50 2h3h h GLY 166 Ca -0.35 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.55 2h3h h GLY 166 CO 0.58 0.40 -0.04 0.00 0.00 0.00 0.00 176.54 177.48 2h3h h ALA 167 N 1.03 -0.09 0.00 3.60 0.00 -1.98 -2.76 119.26 119.06 2h3h h ALA 167 Ca 0.16 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 2h3h h ALA 167 Cb 0.21 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2h3h h ALA 167 CO -0.01 -0.55 -0.20 -0.09 0.00 0.00 0.00 179.25 178.40 2h3h h ARG 168 N -0.10 0.00 -0.62 0.00 2.43 -1.86 -0.85 114.38 113.39 2h3h h ARG 168 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2h3h h ARG 168 Cb 0.10 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 2h3h h ARG 168 CO -0.01 0.20 0.34 0.00 -1.51 0.00 0.00 179.97 178.98 2h3h h ALA 169 N 1.80 0.79 0.01 2.80 0.00 -0.52 -1.24 119.26 122.90 2h3h h ALA 169 Ca -0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2h3h h ALA 169 Cb 0.37 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2h3h h ALA 169 CO 0.03 0.31 -0.01 0.28 0.00 0.00 0.00 179.25 179.86 2h3h h VAL 170 N 0.84 1.43 -0.77 0.00 2.07 -1.17 -2.35 116.25 116.30 2h3h h VAL 170 Ca 0.22 -1.35 0.18 0.00 0.82 0.00 0.00 66.70 66.57 2h3h h VAL 170 Cb 0.05 2.33 -0.13 0.00 -1.52 0.00 0.00 31.29 32.02 2h3h h VAL 170 CO -0.03 0.35 0.06 0.28 0.02 0.00 0.00 177.57 178.24 2h3h h SER 171 N -0.60 -0.26 0.02 0.57 0.02 -1.12 0.97 113.55 113.16 2h3h h SER 171 Ca -0.00 0.19 -0.22 0.00 -0.84 0.00 0.00 61.79 60.92 2h3h h SER 171 Cb 0.58 0.31 0.01 0.00 0.14 0.00 0.00 62.40 63.44 2h3h h SER 171 CO 0.00 -0.16 -0.80 -0.07 -1.14 0.00 0.00 176.83 174.67 2h3h h LEU 172 N 0.14 0.78 -0.41 5.07 3.38 -1.30 -2.11 115.31 120.85 2h3h h LEU 172 Ca 0.43 -0.53 -0.15 0.00 0.09 0.00 0.00 57.88 57.72 2h3h h LEU 172 Cb 0.77 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2h3h h LEU 172 CO -0.64 1.31 -0.32 0.00 0.09 0.00 0.00 178.44 178.88 2h3h h ALA 173 N 0.67 0.60 0.52 1.53 0.00 -0.67 -0.59 119.26 121.31 2h3h h ALA 173 Ca -0.05 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 2h3h h ALA 173 Cb 1.41 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2h3h h ALA 173 CO 0.15 0.66 -0.31 1.49 0.00 0.00 0.00 179.25 181.24 2h3h h GLU 174 N 0.78 -0.76 -0.07 0.00 4.81 0.89 -2.51 114.58 117.72 2h3h h GLU 174 Ca 0.08 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 2h3h h GLU 174 Cb 0.91 0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.45 2h3h h GLU 174 CO 0.08 -0.50 0.01 0.00 -0.73 0.00 0.00 179.01 177.87 2h3h h ALA 175 N -0.35 1.88 -0.40 2.92 0.00 -1.37 -2.75 119.26 119.18 2h3h h ALA 175 Ca -0.06 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 2h3h h ALA 175 Cb 0.64 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2h3h h ALA 175 CO 0.07 0.10 -0.32 0.00 0.00 0.00 0.00 179.25 179.09 2h3h h ALA 176 N 1.91 0.66 -0.14 0.00 0.00 -0.85 -2.89 119.26 117.95 2h3h h ALA 176 Ca 0.03 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.35 2h3h h ALA 176 Cb 0.06 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.72 2h3h h ALA 176 CO -0.00 0.67 -0.54 1.25 0.00 0.00 0.00 179.25 180.63 2h3h h LEU 177 N 0.77 0.71 -1.21 0.00 5.85 -1.17 -2.64 115.31 117.62 2h3h h LEU 177 Ca 0.08 -0.62 0.01 0.00 0.84 0.00 0.00 57.88 58.19 2h3h h LEU 177 Cb 0.90 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 2h3h h LEU 177 CO 0.08 1.21 0.54 -0.55 -0.34 0.00 0.00 178.44 179.38 2h3h h ASN 178 N 0.25 0.92 1.05 1.25 7.08 -1.58 -1.72 115.58 122.83 2h3h h ASN 178 Ca -0.03 -0.02 -0.03 0.00 -3.08 0.00 0.00 56.30 53.14 2h3h h ASN 178 Cb 1.17 -0.23 -0.00 0.00 -2.08 0.00 0.00 38.32 37.18 2h3h h ASN 178 CO 0.11 0.66 -0.14 0.00 -2.08 0.00 0.00 177.43 175.99 2h3h h ALA 179 N 1.50 1.00 -2.76 4.14 0.00 -1.47 -3.38 119.26 118.29 2h3h h ALA 179 Ca 0.30 -0.13 -0.61 0.00 0.00 0.00 0.00 54.91 54.48 2h3h h ALA 179 Cb -0.11 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 17.26 2h3h h ALA 179 CO -0.07 0.18 -0.78 -1.01 0.00 0.00 0.00 179.25 177.57 2h3h s HIS 180 N -3.61 2.18 0.14 0.00 3.76 -0.65 -4.92 115.29 112.20 2h3h s HIS 180 Ca 0.01 -2.71 0.34 0.00 -0.15 0.00 0.00 55.06 52.55 2h3h s HIS 180 Cb 0.09 -1.77 1.40 0.00 1.11 0.00 0.00 32.58 33.41 2h3h s HIS 180 CO 0.61 -0.71 2.00 -1.00 -0.85 0.00 0.00 174.74 174.79 2h3h h PRO 181 N 5.80 0.00 -0.73 8.40 0.13 -1.74 -2.10 132.00 141.75 2h3h h PRO 181 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2h3h h PRO 181 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2h3h h PRO 181 CO 0.52 0.02 0.00 -0.40 -0.23 0.00 0.00 178.00 177.91 2h3h n ASP 182 N -3.12 3.82 -4.67 1.44 3.85 -1.26 -4.93 116.55 111.67 2h3h n ASP 182 Ca 0.00 -2.54 -0.42 0.00 -0.71 0.00 0.00 54.79 51.12 2h3h n ASP 182 Cb 0.30 -0.60 -0.03 0.00 -1.35 0.00 0.00 41.12 39.45 2h3h n ASP 182 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 2h3h s LEU 183 N -1.65 4.28 0.06 -2.12 0.20 -0.79 -4.56 118.68 114.09 2h3h s LEU 183 Ca 0.33 2.01 0.17 0.00 0.69 0.00 0.00 54.13 57.33 2h3h s LEU 183 Cb 0.25 -3.55 -0.14 0.00 -0.43 0.00 0.00 46.19 42.33 2h3h s LEU 183 CO 0.10 -0.78 0.80 0.47 -0.29 0.00 0.00 176.35 176.66 2h3h n ASP 184 N 6.17 0.80 -3.51 3.68 10.43 -0.58 -4.66 116.55 128.89 2h3h n ASP 184 Ca 0.14 0.35 -0.15 0.00 2.57 0.00 0.00 54.79 57.70 2h3h n ASP 184 Cb 0.44 0.26 -0.05 0.00 1.84 0.00 0.00 41.12 43.61 2h3h n ASP 184 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2h3h s ALA 185 N -2.96 -1.77 0.10 2.24 0.00 -0.92 -0.78 121.76 117.67 2h3h s ALA 185 Ca -0.03 1.21 0.04 0.00 0.00 0.00 0.00 51.96 53.18 2h3h s ALA 185 Cb 0.09 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 2h3h s ALA 185 CO 0.81 -0.44 0.07 -0.06 0.00 0.00 0.00 175.76 176.14 2h3h s PHE 186 N -1.70 3.14 -0.15 0.00 0.08 0.26 -1.90 117.98 117.72 2h3h s PHE 186 Ca -0.07 0.04 0.00 0.00 0.12 0.00 0.00 56.93 57.02 2h3h s PHE 186 Cb -0.00 -1.58 0.03 0.00 -0.57 0.00 0.00 43.02 40.89 2h3h s PHE 186 CO 0.04 0.51 -0.12 0.12 -0.10 0.00 0.00 175.22 175.67 2h3h s PHE 187 N -1.44 2.11 -0.26 0.36 5.36 0.76 -2.37 117.98 122.50 2h3h s PHE 187 Ca 0.29 -1.21 -0.10 0.00 -0.96 0.00 0.00 56.93 54.95 2h3h s PHE 187 Cb -0.12 -1.55 -0.04 0.00 -0.34 0.00 0.00 43.02 40.97 2h3h s PHE 187 CO 0.21 -0.66 0.14 0.20 -1.46 0.00 0.00 175.22 173.65 2h3h s GLY 188 N 1.51 1.88 -0.19 13.12 0.00 -0.14 -0.75 107.32 122.75 2h3h s GLY 188 Ca 0.04 -1.07 -0.14 0.00 0.00 0.00 0.00 44.72 43.54 2h3h s GLY 188 CO -0.10 0.56 0.18 -0.62 0.00 0.00 0.00 173.10 173.12 2h3h n VAL 189 N 4.88 1.62 -3.21 1.40 0.31 -0.38 -1.69 118.33 121.26 2h3h n VAL 189 Ca -0.15 -0.31 -0.20 0.00 -0.01 0.00 0.00 64.34 63.66 2h3h n VAL 189 Cb 0.52 -1.88 0.04 0.00 -0.91 0.00 0.00 33.84 31.60 2h3h n VAL 189 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2h3h s TYR 190 N -2.46 1.71 0.25 3.52 1.51 -1.26 -4.45 117.35 116.17 2h3h s TYR 190 Ca -0.28 -0.69 0.12 0.00 -1.01 0.00 0.00 57.07 55.21 2h3h s TYR 190 Cb 0.07 -2.18 0.41 0.00 -0.11 0.00 0.00 41.96 40.15 2h3h s TYR 190 CO 0.64 -0.88 1.63 0.00 -1.11 0.00 0.00 175.55 175.84 2h3h h ALA 191 N 0.39 0.97 0.00 3.71 0.00 -1.93 -2.91 119.26 119.49 2h3h h ALA 191 Ca -0.33 -0.53 -0.08 0.00 0.00 0.00 0.00 54.91 53.98 2h3h h ALA 191 Cb 1.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2h3h h ALA 191 CO 0.45 0.72 -0.37 1.88 0.00 0.00 0.00 179.25 181.94 2h3h h TYR 192 N 0.00 0.00 0.15 0.00 0.05 -1.96 -3.37 116.97 111.84 2h3h h TYR 192 Ca -0.01 0.00 -0.24 0.00 0.05 0.00 0.00 58.73 58.53 2h3h h TYR 192 Cb 1.07 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.84 2h3h h TYR 192 CO 0.00 0.37 -1.03 -0.91 -1.05 0.00 0.00 178.16 175.53 2h3h h ASN 193 N 0.00 0.65 -0.26 3.88 4.21 -1.84 -3.09 115.58 119.13 2h3h h ASN 193 Ca -0.00 -0.90 0.04 0.00 1.21 0.00 0.00 56.30 56.65 2h3h h ASN 193 Cb 0.67 -0.21 -0.04 0.00 -1.12 0.00 0.00 38.32 37.62 2h3h h ASN 193 CO 0.05 1.49 0.01 1.23 -1.29 0.00 0.00 177.43 178.92 2h3h h GLY 194 N -0.09 0.27 1.54 2.83 0.00 -1.72 -0.40 103.07 105.50 2h3h h GLY 194 Ca -0.17 0.02 -0.24 0.00 0.00 0.00 0.00 47.33 46.94 2h3h h GLY 194 CO 0.20 -0.04 -0.99 -0.56 0.00 0.00 0.00 176.54 175.14 2h3h h PRO 195 N 0.10 0.41 -0.85 4.80 0.13 -1.77 -2.22 132.00 132.60 2h3h h PRO 195 Ca 0.13 -0.47 -0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2h3h h PRO 195 Cb 0.15 0.14 -0.04 0.00 0.13 0.00 0.00 31.00 31.38 2h3h h PRO 195 CO -0.20 1.14 0.53 0.00 -0.23 0.00 0.00 178.00 179.24 2h3h h ALA 196 N 0.70 1.33 -0.34 -0.56 0.00 -1.46 0.19 119.26 119.12 2h3h h ALA 196 Ca -0.09 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 2h3h h ALA 196 Cb 1.64 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2h3h h ALA 196 CO 0.17 0.59 -0.40 1.96 0.00 0.00 0.00 179.25 181.57 2h3h h GLN 197 N 1.17 0.83 -0.32 0.00 4.20 -1.07 -2.74 115.11 117.18 2h3h h GLN 197 Ca 0.31 -0.44 -0.05 0.00 0.06 0.00 0.00 58.65 58.53 2h3h h GLN 197 Cb -0.08 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 2h3h h GLN 197 CO -0.06 1.08 0.01 0.00 -0.67 0.00 0.00 178.83 179.18 2h3h h ALA 198 N 0.86 0.43 -1.00 3.87 0.00 -1.03 -1.79 119.26 120.60 2h3h h ALA 198 Ca 0.05 -0.23 0.13 0.00 0.00 0.00 0.00 54.91 54.86 2h3h h ALA 198 Cb 0.97 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.56 2h3h h ALA 198 CO 0.09 0.18 0.63 1.25 0.00 0.00 0.00 179.25 181.40 2h3h h LEU 199 N 0.37 0.91 -0.13 0.00 7.12 -0.63 0.27 115.31 123.21 2h3h h LEU 199 Ca 0.09 0.06 -0.22 0.00 0.13 0.00 0.00 57.88 57.94 2h3h h LEU 199 Cb 0.43 -0.12 0.01 0.00 -0.53 0.00 0.00 40.66 40.45 2h3h h LEU 199 CO 0.02 0.46 -0.77 0.58 -0.13 0.00 0.00 178.44 178.60 2h3h h VAL 200 N 0.96 1.29 0.00 1.05 2.07 -1.39 -1.65 116.25 118.58 2h3h h VAL 200 Ca 0.51 -1.98 -0.07 0.00 0.82 0.00 0.00 66.70 65.99 2h3h h VAL 200 Cb 0.55 2.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 2h3h h VAL 200 CO -0.28 0.62 -0.32 0.58 0.02 0.00 0.00 177.57 178.19 2h3h h VAL 201 N 0.47 0.78 -0.08 2.57 2.07 -0.83 -1.92 116.25 119.32 2h3h h VAL 201 Ca -0.06 -1.37 -0.13 0.00 0.82 0.00 0.00 66.70 65.96 2h3h h VAL 201 Cb 1.40 1.86 0.01 0.00 -1.52 0.00 0.00 31.29 33.04 2h3h h VAL 201 CO 0.16 0.32 -0.46 0.50 0.02 0.00 0.00 177.57 178.11 2h3h h LYS 202 N 0.00 0.45 0.00 1.57 3.64 -0.42 -0.92 116.57 120.89 2h3h h LYS 202 Ca -0.00 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 2h3h h LYS 202 Cb 0.83 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 2h3h h LYS 202 CO 0.04 1.02 0.00 -0.91 -2.27 0.00 0.00 179.45 177.33 2h3h h ASN 203 N 0.01 0.00 0.25 4.20 2.35 -1.23 -2.20 115.58 118.96 2h3h h ASN 203 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2h3h h ASN 203 Cb 1.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.48 2h3h h ASN 203 CO 0.09 0.00 -0.28 0.00 -1.65 0.00 0.00 177.43 175.59 2h3h n ALA 204 N -2.02 3.13 -1.80 -0.83 0.00 -0.73 -4.96 120.51 113.31 2h3h n ALA 204 Ca 0.01 -0.40 -0.17 0.00 0.00 0.00 0.00 53.44 52.87 2h3h n ALA 204 Cb 0.28 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.56 2h3h n ALA 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h3h n GLY 205 N 1.35 0.97 2.18 0.00 0.00 -0.83 -4.90 105.19 103.96 2h3h n GLY 205 Ca 0.12 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 2h3h n GLY 205 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h3h n LYS 206 N -2.56 2.93 -2.25 1.61 4.76 -0.37 -4.97 118.16 117.31 2h3h n LYS 206 Ca -0.18 -3.55 -0.42 0.00 -2.87 0.00 0.00 58.31 51.28 2h3h n LYS 206 Cb 0.60 -2.26 -0.03 0.00 -1.84 0.00 0.00 35.03 31.50 2h3h n LYS 206 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2h3h s VAL 207 N -4.63 3.87 0.00 -0.18 1.01 -1.24 -1.32 120.40 117.91 2h3h s VAL 207 Ca 0.59 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.75 2h3h s VAL 207 Cb 0.47 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 33.10 2h3h s VAL 207 CO 0.01 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.68 2h3h n GLY 208 N 3.70 2.73 0.16 4.51 0.00 -1.26 -4.83 105.19 110.20 2h3h n GLY 208 Ca 0.14 -0.52 -0.05 0.00 0.00 0.00 0.00 46.02 45.58 2h3h n GLY 208 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2h3h h LYS 209 N 0.00 -0.34 -6.21 1.61 3.11 -1.86 -3.42 116.57 109.46 2h3h h LYS 209 Ca 0.00 0.02 -0.59 0.00 -2.81 0.00 0.00 60.65 57.28 2h3h h LYS 209 Cb 0.00 0.08 -0.09 0.00 -1.00 0.00 0.00 32.23 31.22 2h3h h LYS 209 CO 0.00 -0.23 0.67 0.08 -2.81 0.00 0.00 179.45 177.16 2h3h s VAL 210 N -2.89 4.50 0.38 2.00 1.01 -0.43 -4.83 120.40 120.14 2h3h s VAL 210 Ca -0.05 1.15 -0.21 0.00 0.00 0.00 0.00 61.98 62.86 2h3h s VAL 210 Cb 0.01 -4.40 -0.10 0.00 0.00 0.00 0.00 36.38 31.88 2h3h s VAL 210 CO 0.16 -0.66 0.91 -0.54 0.00 0.00 0.00 175.10 174.96 2h3h s LYS 211 N 3.69 4.29 -0.07 2.72 -0.14 0.04 -4.82 119.74 125.45 2h3h s LYS 211 Ca 0.40 1.10 0.00 0.00 -1.36 0.00 0.00 55.97 56.12 2h3h s LYS 211 Cb -0.11 -2.40 0.02 0.00 -1.68 0.00 0.00 37.83 33.67 2h3h s LYS 211 CO 0.22 0.09 -0.06 0.42 -0.76 0.00 0.00 175.35 175.26 2h3h s ILE 212 N -1.99 0.79 -0.05 2.17 1.01 -1.26 0.93 121.20 122.80 2h3h s ILE 212 Ca 0.57 -0.21 0.06 0.00 0.00 0.00 0.00 60.65 61.08 2h3h s ILE 212 Cb -0.12 -0.81 -0.01 0.00 0.01 0.00 0.00 42.46 41.53 2h3h s ILE 212 CO 0.17 0.30 -0.25 -0.69 0.00 0.00 0.00 174.94 174.47 2h3h s VAL 213 N 1.28 2.04 0.00 2.92 1.01 -1.00 -2.28 120.40 124.38 2h3h s VAL 213 Ca -0.04 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 60.87 2h3h s VAL 213 Cb -0.14 -1.72 0.00 0.00 0.00 0.00 0.00 36.38 34.52 2h3h s VAL 213 CO -0.02 0.57 0.00 0.00 0.00 0.00 0.00 175.10 175.64 2h3h s PHE 215 N -4.35 2.73 0.00 0.00 0.08 -0.68 -0.07 117.98 115.68 2h3h s PHE 215 Ca 0.00 -0.18 0.00 0.00 0.12 0.00 0.00 56.93 56.87 2h3h s PHE 215 Cb 0.00 -1.35 0.00 0.00 -0.57 0.00 0.00 43.02 41.10 2h3h s PHE 215 CO 0.00 0.49 0.00 -0.25 -0.10 0.00 0.00 175.22 175.36 2h3h n ASP 216 N 0.17 0.00 -2.72 1.36 8.00 0.44 -4.58 116.55 119.23 2h3h n ASP 216 Ca -0.11 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.35 2h3h n ASP 216 Cb 0.54 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.69 2h3h n ASP 216 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2h3h n THR 217 N -1.52 1.41 -1.12 -3.53 -2.24 -1.26 -4.53 114.28 101.49 2h3h n THR 217 Ca 0.00 -3.12 -0.31 0.00 -2.27 0.00 0.00 64.05 58.35 2h3h n THR 217 Cb 0.00 0.91 0.11 0.00 -2.10 0.00 0.00 70.33 69.25 2h3h n THR 217 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2h3h s THR 218 N -3.86 3.01 0.26 4.28 -4.23 -1.26 -4.73 115.64 109.11 2h3h s THR 218 Ca 0.30 0.33 -0.01 0.00 -1.18 0.00 0.00 61.69 61.13 2h3h s THR 218 Cb 0.35 -2.70 0.24 0.00 1.34 0.00 0.00 72.50 71.72 2h3h s THR 218 CO -0.02 -0.43 1.78 -0.65 -0.54 0.00 0.00 174.62 174.76 2h3h h PRO 219 N -1.32 0.67 -0.63 3.99 0.11 -1.99 -1.54 132.00 131.28 2h3h h PRO 219 Ca -0.44 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.65 2h3h h PRO 219 Cb 1.24 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 2h3h h PRO 219 CO 0.49 0.44 0.41 0.38 -0.21 0.00 0.00 178.00 179.52 2h3h h ASP 220 N 0.69 0.70 -0.11 -2.05 -0.00 -1.94 -0.97 116.42 112.74 2h3h h ASP 220 Ca 0.46 -0.01 -0.01 0.00 -0.00 0.00 0.00 57.03 57.46 2h3h h ASP 220 Cb 0.59 -0.17 -0.00 0.00 -0.00 0.00 0.00 39.33 39.75 2h3h h ASP 220 CO -0.33 0.50 0.02 0.40 -0.00 0.00 0.00 179.24 179.83 2h3h h ILE 221 N 0.83 1.22 -0.80 4.15 2.04 -1.69 -2.73 117.51 120.54 2h3h h ILE 221 Ca 0.24 -0.69 0.08 0.00 1.00 0.00 0.00 64.86 65.49 2h3h h ILE 221 Cb -0.06 1.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.43 2h3h h ILE 221 CO -0.07 0.20 0.52 -0.07 0.00 0.00 0.00 178.15 178.73 2h3h h LEU 222 N -0.05 0.71 0.23 1.44 4.07 -1.12 0.11 115.31 120.71 2h3h h LEU 222 Ca 0.03 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.99 2h3h h LEU 222 Cb 0.29 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.89 2h3h h LEU 222 CO 0.00 0.44 -0.11 -0.61 -1.08 0.00 0.00 178.44 177.09 2h3h h GLN 223 N 0.80 -0.30 0.00 1.13 5.75 -1.06 0.22 115.11 121.65 2h3h h GLN 223 Ca 0.35 0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.83 2h3h h GLN 223 Cb 0.33 0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.95 2h3h h GLN 223 CO -0.13 -0.18 -0.20 1.88 -2.65 0.00 0.00 178.83 177.55 2h3h h TYR 224 N -0.33 0.00 -0.37 3.99 -1.99 -1.10 0.15 116.97 117.31 2h3h h TYR 224 Ca -0.03 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.62 2h3h h TYR 224 Cb 0.26 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.97 2h3h h TYR 224 CO -0.06 0.20 -0.06 0.28 -0.00 0.00 0.00 178.16 178.52 2h3h h VAL 225 N 0.00 1.27 -0.38 -2.88 2.07 -0.42 0.10 116.25 116.02 2h3h h VAL 225 Ca -0.00 -1.11 -0.03 0.00 0.82 0.00 0.00 66.70 66.38 2h3h h VAL 225 Cb 0.35 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 2h3h h VAL 225 CO 0.03 0.37 0.11 0.50 0.02 0.00 0.00 177.57 178.60 2h3h h LYS 226 N 0.50 0.59 0.00 1.57 3.64 0.17 -2.75 116.57 120.29 2h3h h LYS 226 Ca 0.10 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2h3h h LYS 226 Cb 0.55 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2h3h h LYS 226 CO 0.03 0.61 -0.02 0.93 -2.27 0.00 0.00 179.45 178.72 2h3h h GLU 227 N 0.46 0.00 0.00 1.90 5.08 -0.71 -3.46 114.58 117.85 2h3h h GLU 227 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2h3h h GLU 227 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2h3h h GLU 227 CO -0.00 0.02 0.00 0.41 -1.00 0.00 0.00 179.01 178.44 2h3h n GLY 228 N -0.67 0.80 0.07 -3.84 0.00 -0.80 -4.95 105.19 95.80 2h3h n GLY 228 Ca -0.02 -0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 2h3h n GLY 228 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2h3h h VAL 229 N 0.00 1.60 -3.33 1.61 2.07 -1.24 -3.41 116.25 113.56 2h3h h VAL 229 Ca 0.00 -3.28 -0.66 0.00 0.82 0.00 0.00 66.70 63.58 2h3h h VAL 229 Cb 0.00 2.85 -0.29 0.00 -1.52 0.00 0.00 31.29 32.33 2h3h h VAL 229 CO 0.00 0.93 -0.75 -0.63 0.02 0.00 0.00 177.57 177.14 2h3h s ILE 230 N -2.69 3.10 -0.48 4.57 1.01 -0.90 -4.24 121.20 121.57 2h3h s ILE 230 Ca -0.01 -0.59 0.23 0.00 0.00 0.00 0.00 60.65 60.28 2h3h s ILE 230 Cb 0.09 -2.38 0.06 0.00 0.01 0.00 0.00 42.46 40.23 2h3h s ILE 230 CO 0.84 0.46 1.25 1.56 0.00 0.00 0.00 174.94 179.04 2h3h h GLN 231 N 7.90 0.00 -1.65 2.79 7.50 -1.74 -3.40 115.11 126.52 2h3h h GLN 231 Ca -0.40 0.00 0.06 0.00 0.50 0.00 0.00 58.65 58.81 2h3h h GLN 231 Cb 1.16 0.00 -0.26 0.00 0.05 0.00 0.00 27.48 28.44 2h3h h GLN 231 CO 0.61 0.00 0.37 0.00 -1.50 0.00 0.00 178.83 178.30 2h3h s ALA 232 N -3.24 -2.03 0.03 3.87 0.00 -1.24 -4.32 121.76 114.83 2h3h s ALA 232 Ca 0.04 2.03 0.04 0.00 0.00 0.00 0.00 51.96 54.07 2h3h s ALA 232 Cb 0.11 -1.49 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 2h3h s ALA 232 CO 0.74 -0.29 -0.11 -0.08 0.00 0.00 0.00 175.76 176.02 2h3h s THR 233 N 0.68 0.87 -0.81 0.00 -1.32 -0.07 -2.11 115.64 112.87 2h3h s THR 233 Ca -0.02 -0.90 -0.18 0.00 -1.21 0.00 0.00 61.69 59.39 2h3h s THR 233 Cb -0.05 -0.81 0.15 0.00 -1.51 0.00 0.00 72.50 70.28 2h3h s THR 233 CO -0.09 -0.07 0.92 -0.04 -2.21 0.00 0.00 174.62 173.13 2h3h s MET 234 N -1.09 3.45 0.05 7.08 -1.94 0.90 -1.03 119.30 126.73 2h3h s MET 234 Ca -0.01 -1.80 -0.31 0.00 -1.71 0.00 0.00 55.69 51.86 2h3h s MET 234 Cb -0.07 -4.60 -0.06 0.00 2.01 0.00 0.00 34.83 32.11 2h3h s MET 234 CO 0.01 -1.59 1.26 0.20 -0.01 0.00 0.00 175.02 174.89 2h3h s GLY 235 N 3.23 2.22 0.07 -0.03 0.00 0.55 -0.42 107.32 112.94 2h3h s GLY 235 Ca 0.23 0.88 0.00 0.00 0.00 0.00 0.00 44.72 45.84 2h3h s GLY 235 CO -0.05 2.18 0.09 -1.06 0.00 0.00 0.00 173.10 174.27 2h3h n GLN 236 N 4.24 0.63 -3.21 2.90 6.02 -1.26 -0.63 117.38 126.08 2h3h n GLN 236 Ca 0.10 -0.27 -0.24 0.00 -0.01 0.00 0.00 57.00 56.58 2h3h n GLN 236 Cb 0.45 -0.06 -0.06 0.00 1.02 0.00 0.00 30.24 31.60 2h3h n GLN 236 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2h3h n ARG 237 N -1.17 1.54 -0.12 -1.09 1.74 -1.26 -4.86 116.66 111.44 2h3h n ARG 237 Ca 0.02 -3.82 0.10 0.00 -0.77 0.00 0.00 57.85 53.38 2h3h n ARG 237 Cb 0.06 -1.71 0.44 0.00 -1.02 0.00 0.00 32.46 30.23 2h3h n ARG 237 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2h3h h PRO 238 N 3.66 0.53 -0.43 5.56 0.13 -1.92 -1.53 132.00 137.99 2h3h h PRO 238 Ca 0.11 -0.03 0.06 0.00 -0.87 0.00 0.00 66.00 65.28 2h3h h PRO 238 Cb 0.80 -0.12 -0.06 0.00 0.13 0.00 0.00 31.00 31.76 2h3h h PRO 238 CO 0.60 0.35 0.10 -0.92 -0.23 0.00 0.00 178.00 177.90 2h3h h TYR 239 N 0.54 0.16 -0.25 1.56 5.03 -1.87 -1.94 116.97 120.20 2h3h h TYR 239 Ca 0.30 0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.54 2h3h h TYR 239 Cb 0.44 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.70 2h3h h TYR 239 CO -0.00 0.03 -0.22 0.52 -1.32 0.00 0.00 178.16 177.17 2h3h h MET 240 N 0.24 0.46 -0.49 1.82 2.86 -1.64 -0.16 114.93 118.02 2h3h h MET 240 Ca 0.21 -0.16 0.01 0.00 -2.06 0.00 0.00 59.70 57.70 2h3h h MET 240 Cb 0.25 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.84 2h3h h MET 240 CO -0.26 0.66 0.31 0.52 1.06 0.00 0.00 176.91 179.20 2h3h h MET 241 N 0.42 0.61 -0.17 1.72 2.86 -0.92 0.68 114.93 120.13 2h3h h MET 241 Ca 0.07 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 2h3h h MET 241 Cb 0.62 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.14 2h3h h MET 241 CO 0.04 0.40 -0.13 0.78 1.06 0.00 0.00 176.91 179.06 2h3h h GLY 242 N 0.63 0.42 0.98 8.32 0.00 -1.14 -2.07 103.07 110.22 2h3h h GLY 242 Ca 0.19 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 2h3h h GLY 242 CO -0.06 0.37 -0.05 -1.82 0.00 0.00 0.00 176.54 174.98 2h3h h TYR 243 N 0.04 -0.14 -0.01 5.60 5.03 -0.92 -2.59 116.97 123.98 2h3h h TYR 243 Ca 0.03 -0.00 -0.13 0.00 2.58 0.00 0.00 58.73 61.20 2h3h h TYR 243 Cb 0.65 0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.96 2h3h h TYR 243 CO 0.08 -0.07 -0.63 -0.07 -1.32 0.00 0.00 178.16 176.15 2h3h h LEU 244 N -0.17 0.03 -0.22 2.82 3.38 -0.94 -1.66 115.31 118.56 2h3h h LEU 244 Ca -0.02 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2h3h h LEU 244 Cb 0.13 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2h3h h LEU 244 CO 0.02 0.65 0.12 0.28 0.09 0.00 0.00 178.44 179.60 2h3h h SER 245 N 0.02 0.18 -0.24 -0.43 0.02 -1.26 0.16 113.55 112.00 2h3h h SER 245 Ca -0.01 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2h3h h SER 245 Cb 1.11 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.61 2h3h h SER 245 CO 0.08 0.14 0.13 0.58 -1.14 0.00 0.00 176.83 176.62 2h3h h VAL 246 N 0.25 1.12 -0.29 2.27 2.07 -1.37 -2.16 116.25 118.13 2h3h h VAL 246 Ca 0.09 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.30 2h3h h VAL 246 Cb 0.01 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2h3h h VAL 246 CO -0.05 0.12 0.15 0.74 0.02 0.00 0.00 177.57 178.54 2h3h h THR 247 N 0.27 0.99 -0.44 2.57 2.02 -0.93 0.16 112.91 117.54 2h3h h THR 247 Ca 0.08 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.12 2h3h h THR 247 Cb 0.08 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 2h3h h THR 247 CO -0.01 0.06 0.14 0.58 0.37 0.00 0.00 175.52 176.65 2h3h h VAL 248 N 0.31 1.22 -0.29 3.16 2.07 -0.68 -1.23 116.25 120.80 2h3h h VAL 248 Ca 0.12 -0.74 -0.13 0.00 0.82 0.00 0.00 66.70 66.77 2h3h h VAL 248 Cb 0.04 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2h3h h VAL 248 CO -0.08 0.27 -0.33 -0.07 0.02 0.00 0.00 177.57 177.37 2h3h h LEU 249 N 0.58 0.67 -0.25 2.57 3.38 -1.21 -0.02 115.31 121.02 2h3h h LEU 249 Ca 0.14 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.87 2h3h h LEU 249 Cb 0.27 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2h3h h LEU 249 CO -0.00 0.95 0.07 0.22 0.09 0.00 0.00 178.44 179.77 2h3h h TYR 250 N 0.54 0.12 -0.57 1.13 5.03 -0.74 -2.23 116.97 120.26 2h3h h TYR 250 Ca 0.06 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.37 2h3h h TYR 250 Cb 0.84 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 39.08 2h3h h TYR 250 CO 0.04 0.04 0.31 -0.07 -1.32 0.00 0.00 178.16 177.16 2h3h h LEU 251 N 0.17 0.71 -1.83 2.82 3.38 -0.94 -0.48 115.31 119.14 2h3h h LEU 251 Ca 0.11 -0.10 0.10 0.00 0.09 0.00 0.00 57.88 58.09 2h3h h LEU 251 Cb 0.10 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2h3h h LEU 251 CO -0.14 0.60 0.33 0.24 0.09 0.00 0.00 178.44 179.57 2h3h h MET 252 N 0.76 0.18 0.10 1.13 2.86 -0.81 0.30 114.93 119.46 2h3h h MET 252 Ca 0.20 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.82 2h3h h MET 252 Cb 0.05 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.67 2h3h h MET 252 CO -0.03 0.12 -0.05 -0.91 1.06 0.00 0.00 176.91 177.10 2h3h h ASN 253 N 0.19 -0.12 -0.12 1.22 2.35 -0.95 -2.82 115.58 115.33 2h3h h ASN 253 Ca 0.23 -0.46 -0.03 0.00 -0.55 0.00 0.00 56.30 55.48 2h3h h ASN 253 Cb 0.64 0.03 -0.00 0.00 0.05 0.00 0.00 38.32 39.04 2h3h h ASN 253 CO -0.04 0.51 -0.05 0.11 -1.65 0.00 0.00 177.43 176.31 2h3h h LYS 254 N -0.85 0.25 -0.01 0.81 1.79 -0.55 -3.34 116.57 114.66 2h3h h LYS 254 Ca -0.01 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.35 2h3h h LYS 254 Cb 0.57 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 2h3h h LYS 254 CO 0.02 0.57 -0.18 0.44 -1.08 0.00 0.00 179.45 179.22 2h3h n ILE 255 N -4.71 0.00 0.00 1.86 -5.35 0.10 -5.08 119.36 106.18 2h3h n ILE 255 Ca -0.06 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 2h3h n ILE 255 Cb 0.27 1.17 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 2h3h n ILE 255 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2h3h n GLY 256 N 0.91 0.71 0.07 3.28 0.00 -1.07 -4.43 105.19 104.66 2h3h n GLY 256 Ca 0.06 -1.75 -0.12 0.00 0.00 0.00 0.00 46.02 44.20 2h3h n GLY 256 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2h3h h VAL 257 N 0.00 1.22 -0.39 1.61 2.07 -1.85 -2.43 116.25 116.48 2h3h h VAL 257 Ca 0.00 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.86 2h3h h VAL 257 Cb 0.00 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 2h3h h VAL 257 CO 0.00 0.18 0.25 1.56 0.02 0.00 0.00 177.57 179.58 2h3h h GLN 258 N -0.15 0.52 -0.83 1.57 4.20 -1.94 -0.01 115.11 118.48 2h3h h GLN 258 Ca 0.02 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 2h3h h GLN 258 Cb 0.28 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.91 2h3h h GLN 258 CO 0.00 0.36 0.39 -0.91 -0.67 0.00 0.00 178.83 178.00 2h3h h ASN 259 N 0.52 1.08 -0.20 1.46 2.35 -1.77 -2.27 115.58 116.75 2h3h h ASN 259 Ca 0.14 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.73 2h3h h ASN 259 Cb -0.04 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.05 2h3h h ASN 259 CO -0.03 0.91 0.01 0.74 -1.65 0.00 0.00 177.43 177.41 2h3h h THR 260 N 1.18 1.25 -0.72 2.81 2.02 -0.90 -3.00 112.91 115.54 2h3h h THR 260 Ca 0.28 -0.85 0.09 0.00 0.77 0.00 0.00 66.41 66.71 2h3h h THR 260 Cb 0.12 1.42 -0.05 0.00 -1.74 0.00 0.00 68.15 67.91 2h3h h THR 260 CO -0.04 0.26 0.48 -0.07 0.37 0.00 0.00 175.52 176.52 2h3h h LEU 261 N 0.11 0.56 -2.42 2.58 3.38 -0.79 -0.94 115.31 117.78 2h3h h LEU 261 Ca 0.06 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2h3h h LEU 261 Cb 0.38 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2h3h h LEU 261 CO 0.01 0.34 -0.00 -0.03 0.09 0.00 0.00 178.44 178.84 2h3h h MET 262 N 0.62 0.00 0.00 1.13 4.05 -1.26 -2.01 114.93 117.46 2h3h h MET 262 Ca 0.33 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.75 2h3h h MET 262 Cb 0.47 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.27 2h3h h MET 262 CO -0.12 0.00 -0.22 -1.33 0.23 0.00 0.00 176.91 175.48 2h3h n MET 263 N -3.11 0.21 -3.83 0.39 2.81 -0.36 -4.97 117.12 108.26 2h3h n MET 263 Ca -0.02 0.13 -0.21 0.00 -1.81 0.00 0.00 57.70 55.80 2h3h n MET 263 Cb 0.16 -1.70 -0.02 0.00 -0.71 0.00 0.00 33.22 30.94 2h3h n MET 263 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2h3h s LEU 264 N -4.10 3.99 0.32 4.03 1.43 -0.76 -5.06 118.68 118.53 2h3h s LEU 264 Ca 0.10 -0.17 -0.29 0.00 -1.03 0.00 0.00 54.13 52.74 2h3h s LEU 264 Cb 0.14 -2.61 -0.10 0.00 0.03 0.00 0.00 46.19 43.65 2h3h s LEU 264 CO 0.63 -0.21 1.32 -2.84 0.23 0.00 0.00 176.35 175.47 2h3h s PRO 265 N -4.01 4.35 -0.04 1.29 0.02 -1.26 -4.98 135.00 130.37 2h3h s PRO 265 Ca 0.38 2.21 -0.02 0.00 0.02 0.00 0.00 61.00 63.59 2h3h s PRO 265 Cb -0.08 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 31.32 2h3h s PRO 265 CO 0.28 -0.21 0.10 0.15 -0.33 0.00 0.00 177.00 176.99 2h3h s LYS 266 N -1.59 3.18 0.13 5.54 1.02 -1.26 -2.79 119.74 123.96 2h3h s LYS 266 Ca 0.50 -0.39 0.09 0.00 0.02 0.00 0.00 55.97 56.20 2h3h s LYS 266 Cb -0.40 -2.94 -0.04 0.00 -0.52 0.00 0.00 37.83 33.93 2h3h s LYS 266 CO 0.51 0.68 -0.22 0.14 -0.92 0.00 0.00 175.35 175.55 2h3h s VAL 267 N -1.14 1.91 -0.36 3.17 -7.23 0.34 -4.92 120.40 112.17 2h3h s VAL 267 Ca 0.21 -1.70 -0.05 0.00 -1.81 0.00 0.00 61.98 58.63 2h3h s VAL 267 Cb -0.12 -1.75 0.07 0.00 0.56 0.00 0.00 36.38 35.13 2h3h s VAL 267 CO 0.11 -0.07 0.13 -0.54 -0.31 0.00 0.00 175.10 174.42 2h3h s LYS 268 N -2.16 2.40 -0.04 4.82 -0.14 -1.26 -0.70 119.74 122.66 2h3h s LYS 268 Ca 0.11 -1.43 0.01 0.00 -1.36 0.00 0.00 55.97 53.30 2h3h s LYS 268 Cb -0.09 -3.48 0.02 0.00 -1.68 0.00 0.00 37.83 32.61 2h3h s LYS 268 CO 0.06 -0.82 -0.03 0.08 -0.76 0.00 0.00 175.35 173.88 2h3h s VAL 269 N 1.30 0.38 -1.36 3.17 1.01 0.09 -4.76 120.40 120.23 2h3h s VAL 269 Ca 0.01 -0.03 -0.07 0.00 0.00 0.00 0.00 61.98 61.89 2h3h s VAL 269 Cb -0.21 -0.44 0.04 0.00 0.00 0.00 0.00 36.38 35.77 2h3h s VAL 269 CO -0.00 0.19 0.49 0.47 0.00 0.00 0.00 175.10 176.25 2h3h n ASP 270 N 4.10 -4.51 -0.05 3.32 8.00 -1.26 -1.34 116.55 124.82 2h3h n ASP 270 Ca -0.25 -0.31 -0.01 0.00 0.71 0.00 0.00 54.79 54.93 2h3h n ASP 270 Cb 0.51 -3.70 -0.00 0.00 -0.02 0.00 0.00 41.12 37.90 2h3h n ASP 270 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2h3h n GLY 271 N -1.26 0.47 3.40 0.44 0.00 -1.26 -5.01 105.19 101.97 2h3h n GLY 271 Ca -0.06 -0.19 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 2h3h n GLY 271 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h3h s LYS 272 N -0.71 1.52 -0.04 1.61 1.02 -0.45 -5.13 119.74 117.56 2h3h s LYS 272 Ca 0.00 -1.80 -0.19 0.00 0.02 0.00 0.00 55.97 54.00 2h3h s LYS 272 Cb 0.00 -0.83 -0.05 0.00 -0.52 0.00 0.00 37.83 36.42 2h3h s LYS 272 CO 0.00 -0.11 0.54 0.08 -0.92 0.00 0.00 175.35 174.94 2h3h s VAL 273 N -3.28 5.00 0.33 3.17 1.01 -1.26 -0.74 120.40 124.63 2h3h s VAL 273 Ca 0.32 1.12 0.03 0.00 0.00 0.00 0.00 61.98 63.45 2h3h s VAL 273 Cb 0.07 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 2h3h s VAL 273 CO 0.12 0.41 0.09 -0.62 0.00 0.00 0.00 175.10 175.11 2h3h s ASP 274 N -0.07 2.16 -0.11 3.32 -1.08 0.12 -4.96 116.67 116.06 2h3h s ASP 274 Ca 0.29 -1.47 0.02 0.00 -0.52 0.00 0.00 52.55 50.87 2h3h s ASP 274 Cb -0.17 0.16 0.01 0.00 -1.46 0.00 0.00 42.92 41.46 2h3h s ASP 274 CO 0.15 -0.74 -0.16 -0.31 0.52 0.00 0.00 175.17 174.63 2h3h s TYR 275 N -3.40 1.99 -0.03 -5.34 2.02 -1.26 -0.50 117.35 110.82 2h3h s TYR 275 Ca 0.33 -0.92 -0.01 0.00 -0.37 0.00 0.00 57.07 56.10 2h3h s TYR 275 Cb 0.07 -1.43 0.03 0.00 -0.40 0.00 0.00 41.96 40.23 2h3h s TYR 275 CO 0.15 -0.46 0.04 0.08 -1.57 0.00 0.00 175.55 173.79 2h3h s VAL 276 N 0.92 -0.03 -0.35 0.71 1.01 -1.12 -2.07 120.40 119.47 2h3h s VAL 276 Ca -0.08 0.31 -0.16 0.00 0.00 0.00 0.00 61.98 62.05 2h3h s VAL 276 Cb -0.15 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.06 2h3h s VAL 276 CO -0.01 0.15 0.38 -0.63 0.00 0.00 0.00 175.10 175.00 2h3h s ILE 277 N 1.68 5.15 -0.41 2.22 1.01 -0.10 -4.37 121.20 126.39 2h3h s ILE 277 Ca -0.01 0.05 -0.23 0.00 0.00 0.00 0.00 60.65 60.45 2h3h s ILE 277 Cb -0.12 -3.85 0.02 0.00 0.01 0.00 0.00 42.46 38.51 2h3h s ILE 277 CO -0.03 -0.13 0.80 -0.62 0.00 0.00 0.00 174.94 174.96 2h3h s ASP 278 N 1.74 6.49 0.02 3.58 -1.08 -1.26 -1.25 116.67 124.92 2h3h s ASP 278 Ca 0.12 0.16 0.27 0.00 -0.52 0.00 0.00 52.55 52.59 2h3h s ASP 278 Cb -0.16 -2.40 0.96 0.00 -1.46 0.00 0.00 42.92 39.86 2h3h s ASP 278 CO 0.12 -0.83 1.74 0.35 0.52 0.00 0.00 175.17 177.07 2h3h n THR 279 N 5.98 0.06 0.00 1.71 -2.24 -0.69 -4.95 114.28 114.16 2h3h n THR 279 Ca 0.03 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2h3h n THR 279 Cb 0.48 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 2h3h n THR 279 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h3h n GLY 280 N 1.48 2.29 3.12 3.38 0.00 -1.26 -4.63 105.19 109.56 2h3h n GLY 280 Ca 0.06 -1.87 -0.17 0.00 0.00 0.00 0.00 46.02 44.04 2h3h n GLY 280 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h3h s VAL 281 N -2.77 0.92 -0.11 1.61 0.11 -1.26 -4.02 120.40 114.89 2h3h s VAL 281 Ca 0.00 -1.10 0.00 0.00 -2.93 0.00 0.00 61.98 57.95 2h3h s VAL 281 Cb 0.00 -0.89 0.02 0.00 -1.53 0.00 0.00 36.38 33.98 2h3h s VAL 281 CO 0.00 -0.18 -0.09 -1.81 -3.33 0.00 0.00 175.10 169.69 2h3h s ASP 282 N -1.43 2.13 -0.45 3.54 1.11 0.20 -4.97 116.67 116.79 2h3h s ASP 282 Ca -0.03 -0.32 -0.29 0.00 0.18 0.00 0.00 52.55 52.10 2h3h s ASP 282 Cb -0.09 -0.86 0.03 0.00 1.07 0.00 0.00 42.92 43.06 2h3h s ASP 282 CO 0.01 -0.08 1.12 -0.69 1.18 0.00 0.00 175.17 176.71 2h3h s VAL 283 N 1.46 4.27 -0.22 -1.27 1.01 -1.26 -0.33 120.40 124.05 2h3h s VAL 283 Ca 0.01 1.28 -0.05 0.00 0.00 0.00 0.00 61.98 63.22 2h3h s VAL 283 Cb -0.13 -4.57 -0.02 0.00 0.00 0.00 0.00 36.38 31.66 2h3h s VAL 283 CO -0.06 -0.92 -0.01 -0.69 0.00 0.00 0.00 175.10 173.43 2h3h s VAL 284 N 4.29 3.70 0.32 2.92 1.01 -0.20 -4.96 120.40 127.49 2h3h s VAL 284 Ca 0.47 -0.38 0.10 0.00 0.00 0.00 0.00 61.98 62.17 2h3h s VAL 284 Cb -0.08 -2.70 -0.06 0.00 0.00 0.00 0.00 36.38 33.55 2h3h s VAL 284 CO 0.29 0.40 -0.09 0.42 0.00 0.00 0.00 175.10 176.13 2h3h s THR 285 N 1.44 2.49 0.50 3.92 -4.23 -1.26 -0.89 115.64 117.61 2h3h s THR 285 Ca 0.05 -2.17 0.24 0.00 -1.18 0.00 0.00 61.69 58.63 2h3h s THR 285 Cb -0.15 -2.62 0.41 0.00 1.34 0.00 0.00 72.50 71.49 2h3h s THR 285 CO -0.01 -0.26 1.93 -0.65 -0.54 0.00 0.00 174.62 175.09 2h3h h PRO 286 N 2.01 0.13 0.16 3.99 0.11 -1.75 -0.94 132.00 135.71 2h3h h PRO 286 Ca -0.42 -0.01 -0.31 0.00 0.11 0.00 0.00 66.00 65.37 2h3h h PRO 286 Cb 1.25 -0.03 0.03 0.00 0.11 0.00 0.00 31.00 32.36 2h3h h PRO 286 CO 0.66 0.09 -1.32 1.05 -0.21 0.00 0.00 178.00 178.27 2h3h h GLU 287 N 0.13 0.59 -0.60 1.05 9.09 -1.93 -3.29 114.58 119.63 2h3h h GLU 287 Ca 0.35 -0.85 0.00 0.00 0.05 0.00 0.00 59.36 58.91 2h3h h GLU 287 Cb 1.20 0.29 0.00 0.00 -1.65 0.00 0.00 28.75 28.59 2h3h h GLU 287 CO -0.05 1.39 0.00 0.27 0.05 0.00 0.00 179.01 180.67 2h3h n ASN 288 N -3.76 3.25 -0.18 3.06 0.23 -1.08 -4.62 115.26 112.16 2h3h n ASN 288 Ca -0.14 -1.99 -0.01 0.00 -0.53 0.00 0.00 54.58 51.90 2h3h n ASN 288 Cb 1.03 -0.40 0.09 0.00 -2.08 0.00 0.00 39.78 38.41 2h3h n ASN 288 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2h3h h LEU 289 N 3.60 0.19 -0.66 -4.53 6.46 -1.25 -0.55 115.31 118.56 2h3h h LEU 289 Ca 0.00 0.07 -0.10 0.00 -0.12 0.00 0.00 57.88 57.73 2h3h h LEU 289 Cb 0.82 0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.79 2h3h h LEU 289 CO 0.00 0.13 -0.06 0.44 -0.62 0.00 0.00 178.44 178.32 2h3h h ASP 290 N 0.38 0.96 -0.57 1.25 3.32 -1.85 -2.58 116.42 117.33 2h3h h ASP 290 Ca 0.27 -0.29 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 2h3h h ASP 290 Cb 0.32 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 2h3h h ASP 290 CO -0.28 1.05 0.25 -0.33 -1.72 0.00 0.00 179.24 178.21 2h3h h GLU 291 N 0.88 0.83 -0.33 3.56 4.39 -1.67 -2.69 114.58 119.55 2h3h h GLU 291 Ca 0.15 -0.14 0.06 0.00 0.34 0.00 0.00 59.36 59.77 2h3h h GLU 291 Cb 0.60 -0.14 -0.06 0.00 -0.10 0.00 0.00 28.75 29.05 2h3h h GLU 291 CO 0.04 0.70 -0.03 -0.92 -1.16 0.00 0.00 179.01 177.64 2h3h h TYR 292 N 0.77 -0.07 -0.82 4.33 5.03 -0.99 -0.34 116.97 124.88 2h3h h TYR 292 Ca 0.19 0.03 0.02 0.00 2.58 0.00 0.00 58.73 61.54 2h3h h TYR 292 Cb 0.16 0.08 -0.04 0.00 1.55 0.00 0.00 36.73 38.48 2h3h h TYR 292 CO 0.00 -0.09 0.54 -0.07 -1.32 0.00 0.00 178.16 177.23 2h3h h LEU 293 N 0.06 0.93 -0.16 2.82 3.38 -1.21 -0.07 115.31 121.05 2h3h h LEU 293 Ca 0.16 -0.02 -0.19 0.00 0.09 0.00 0.00 57.88 57.92 2h3h h LEU 293 Cb 0.23 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.76 2h3h h LEU 293 CO -0.29 0.66 -0.62 0.07 0.09 0.00 0.00 178.44 178.35 2h3h h LYS 294 N 1.09 0.71 -0.46 1.13 2.10 -1.17 -2.77 116.57 117.20 2h3h h LYS 294 Ca 0.31 -0.54 0.05 0.00 -2.00 0.00 0.00 60.65 58.47 2h3h h LYS 294 Cb -0.08 0.10 -0.05 0.00 -0.90 0.00 0.00 32.23 31.30 2h3h h LYS 294 CO -0.07 1.16 0.18 -0.22 -2.00 0.00 0.00 179.45 178.50 2h3h h LYS 295 N 0.41 0.36 -0.80 0.07 3.64 -0.31 0.40 116.57 120.33 2h3h h LYS 295 Ca -0.03 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2h3h h LYS 295 Cb 1.25 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.95 2h3h h LYS 295 CO 0.13 0.24 0.49 0.52 -2.27 0.00 0.00 179.45 178.56 2h3h h MET 296 N 0.37 1.08 -0.45 1.90 2.86 -1.03 -1.41 114.93 118.25 2h3h h MET 296 Ca 0.21 -0.09 -0.12 0.00 -2.06 0.00 0.00 59.70 57.64 2h3h h MET 296 Cb 0.19 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 2h3h h MET 296 CO -0.20 0.75 -0.19 1.49 1.06 0.00 0.00 176.91 179.82 2h3h h GLU 297 N 1.10 0.93 -0.93 1.72 4.81 -1.07 -0.72 114.58 120.43 2h3h h GLU 297 Ca 0.29 -0.40 0.14 0.00 -0.13 0.00 0.00 59.36 59.26 2h3h h GLU 297 Cb -0.06 -0.03 -0.09 0.00 0.63 0.00 0.00 28.75 29.20 2h3h h GLU 297 CO -0.06 1.06 0.55 0.93 -0.73 0.00 0.00 179.01 180.76 2h3h h GLU 298 N 0.77 0.79 -0.01 1.92 5.08 -0.33 -2.40 114.58 120.41 2h3h h GLU 298 Ca 0.10 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2h3h h GLU 298 Cb 0.76 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2h3h h GLU 298 CO 0.06 0.52 -0.01 1.28 -1.00 0.00 0.00 179.01 179.86 2h3h n LEU 299 N -4.74 0.58 -0.00 1.33 4.77 -0.59 -4.90 117.00 113.46 2h3h n LEU 299 Ca 0.18 -0.17 -0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2h3h n LEU 299 Cb 0.41 -0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 41.47 2h3h n LEU 299 CO 0.24 0.10 -0.00 0.61 -1.33 0.00 0.00 177.39 177.01 2h3h n GLY 300 N 1.10 0.39 3.50 -0.72 0.00 -0.90 -5.03 105.19 103.53 2h3h n GLY 300 Ca 0.21 -1.05 -0.38 0.00 0.00 0.00 0.00 46.02 44.80 2h3h n GLY 300 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h3h s ILE 301 N -2.00 4.87 0.28 -0.61 1.01 -0.30 -5.03 121.20 119.42 2h3h s ILE 301 Ca 0.00 -0.16 -0.30 0.00 0.00 0.00 0.00 60.65 60.20 2h3h s ILE 301 Cb 0.00 -3.40 -0.10 0.00 0.01 0.00 0.00 42.46 38.97 2h3h s ILE 301 CO 0.00 0.17 1.46 -2.84 0.00 0.00 0.00 174.94 173.72 2h3h s PRO 302 N 1.68 4.23 -0.01 2.79 0.02 -1.26 -4.19 135.00 138.26 2h3h s PRO 302 Ca 0.06 2.38 0.01 0.00 0.02 0.00 0.00 61.00 63.47 2h3h s PRO 302 Cb -0.16 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.29 2h3h s PRO 302 CO 0.08 -0.44 -0.03 0.42 -0.33 0.00 0.00 177.00 176.70 2h3h s ILE 303 N -0.30 0.27 -0.97 2.83 -1.09 -1.26 -5.04 121.20 115.64 2h3h s ILE 303 Ca 0.58 -0.10 -0.01 0.00 -2.23 0.00 0.00 60.65 58.89 2h3h s ILE 303 Cb -0.43 -0.26 0.32 0.00 -1.58 0.00 0.00 42.46 40.50 2h3h s ILE 303 CO 0.48 0.10 1.59 0.29 -1.23 0.00 0.00 174.94 176.17 2h3h n LYS 304 N 3.28 4.83 0.00 2.79 5.02 -1.26 -5.14 118.16 127.68 2h3h n LYS 304 Ca -0.16 -4.67 0.00 0.00 -2.02 0.00 0.00 58.31 51.46 2h3h n LYS 304 Cb 0.57 -2.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.13 2h3h n LYS 304 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22