#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1um9 s PHE 8 N 0.00 3.50 0.16 -1.55 0.40 -1.26 -5.05 117.98 114.18 1um9 s PHE 8 Ca 0.00 0.57 -0.30 0.00 -0.60 0.00 0.00 56.93 56.60 1um9 s PHE 8 Cb 0.00 -2.07 -0.07 0.00 0.51 0.00 0.00 43.02 41.39 1um9 s PHE 8 CO 0.00 0.06 1.15 -1.21 0.70 0.00 0.00 175.22 175.92 1um9 s GLU 9 N -4.06 4.53 0.37 0.44 2.02 -1.26 -5.03 118.70 115.72 1um9 s GLU 9 Ca 0.43 1.78 -0.07 0.00 0.02 0.00 0.00 54.97 57.13 1um9 s GLU 9 Cb -0.10 -3.27 -0.06 0.00 0.10 0.00 0.00 34.13 30.80 1um9 s GLU 9 CO 0.35 -0.03 0.68 0.95 0.02 0.00 0.00 175.26 177.23 1um9 s THR 10 N 0.01 4.90 -1.63 3.63 -4.23 -1.26 -4.33 115.64 112.73 1um9 s THR 10 Ca 0.52 0.32 -0.16 0.00 -1.18 0.00 0.00 61.69 61.19 1um9 s THR 10 Cb -0.31 -3.75 0.13 0.00 1.34 0.00 0.00 72.50 69.91 1um9 s THR 10 CO 0.35 -0.48 0.88 0.49 -0.54 0.00 0.00 174.62 175.32 1um9 n PHE 11 N -1.28 -2.00 -1.88 3.99 3.72 0.33 -4.93 117.46 115.40 1um9 n PHE 11 Ca 0.00 0.85 -0.33 0.00 -0.05 0.00 0.00 57.45 57.92 1um9 n PHE 11 Cb 0.54 -3.42 0.03 0.00 -0.94 0.00 0.00 39.48 35.70 1um9 n PHE 11 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1um9 s THR 12 N -3.29 3.33 -0.02 4.37 -4.23 -1.26 -4.97 115.64 109.57 1um9 s THR 12 Ca 0.71 0.65 -0.26 0.00 -1.18 0.00 0.00 61.69 61.61 1um9 s THR 12 Cb -0.37 -3.18 -0.20 0.00 1.34 0.00 0.00 72.50 70.09 1um9 s THR 12 CO 0.88 -0.35 1.28 -0.33 -0.54 0.00 0.00 174.62 175.56 1um9 h GLU 13 N 0.28 -0.03 -5.77 3.99 3.07 -1.96 -3.44 114.58 110.73 1um9 h GLU 13 Ca -0.47 0.00 -0.67 0.00 -0.50 0.00 0.00 59.36 57.72 1um9 h GLU 13 Cb 1.24 0.01 -0.08 0.00 -0.84 0.00 0.00 28.75 29.08 1um9 h GLU 13 CO 0.55 0.43 -0.52 -1.21 -1.40 0.00 0.00 179.01 176.86 1um9 s GLU 14 N -4.35 3.32 0.42 2.33 0.41 -1.26 -5.06 118.70 114.50 1um9 s GLU 14 Ca -0.16 -0.25 -0.26 0.00 -0.41 0.00 0.00 54.97 53.90 1um9 s GLU 14 Cb 0.02 -3.07 -0.09 0.00 -1.78 0.00 0.00 34.13 29.21 1um9 s GLU 14 CO 0.66 0.73 1.39 -0.35 -0.49 0.00 0.00 175.26 177.20 1um9 n PRO 15 N 1.75 2.22 -1.89 0.39 -0.04 -1.26 -4.89 135.00 131.28 1um9 n PRO 15 Ca -0.18 0.79 -0.42 0.00 -0.04 0.00 0.00 63.50 63.66 1um9 n PRO 15 Cb 0.54 -2.55 -0.02 0.00 -0.04 0.00 0.00 33.50 31.43 1um9 n PRO 15 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1um9 s ILE 16 N -1.18 2.41 -0.00 0.52 1.01 0.44 -4.58 121.20 119.83 1um9 s ILE 16 Ca 0.59 0.32 0.02 0.00 0.00 0.00 0.00 60.65 61.58 1um9 s ILE 16 Cb -0.48 -3.21 -0.01 0.00 0.01 0.00 0.00 42.46 38.78 1um9 s ILE 16 CO 0.59 0.04 -0.05 -0.60 0.00 0.00 0.00 174.94 174.92 1um9 s ARG 17 N 0.26 0.40 0.00 2.79 3.52 -1.26 -0.93 118.95 123.73 1um9 s ARG 17 Ca 0.66 -0.22 0.00 0.00 -0.13 0.00 0.00 55.73 56.04 1um9 s ARG 17 Cb -0.45 -0.37 0.00 0.00 -1.56 0.00 0.00 34.95 32.57 1um9 s ARG 17 CO 0.39 0.10 0.00 1.28 -0.81 0.00 0.00 175.30 176.26 1um9 n LEU 18 N 2.85 0.00 -4.46 -0.88 4.77 -1.26 -4.74 117.00 113.28 1um9 n LEU 18 Ca -0.14 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.46 1um9 n LEU 18 Cb 0.58 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.55 1um9 n LEU 18 CO 0.25 0.00 -0.22 -0.63 -1.33 0.00 0.00 177.39 175.46 1um9 s ILE 19 N -1.92 4.62 1.03 -0.08 1.01 -1.26 -0.31 121.20 124.28 1um9 s ILE 19 Ca 0.00 -0.30 -0.13 0.00 0.00 0.00 0.00 60.65 60.22 1um9 s ILE 19 Cb 0.00 -3.30 0.20 0.00 0.01 0.00 0.00 42.46 39.37 1um9 s ILE 19 CO 0.00 0.14 1.10 -0.83 0.00 0.00 0.00 174.94 175.35 1um9 s GLY 20 N 1.63 1.56 0.36 6.18 0.00 0.26 -4.89 107.32 112.41 1um9 s GLY 20 Ca 0.05 -0.44 0.03 0.00 0.00 0.00 0.00 44.72 44.37 1um9 s GLY 20 CO 0.06 0.21 2.01 1.05 0.00 0.00 0.00 173.10 176.43 1um9 h GLU 21 N -1.99 0.80 -0.79 2.90 9.09 -1.99 -2.14 114.58 120.47 1um9 h GLU 21 Ca -0.54 -0.05 -0.23 0.00 0.05 0.00 0.00 59.36 58.59 1um9 h GLU 21 Cb 1.33 -0.18 -0.14 0.00 -1.65 0.00 0.00 28.75 28.11 1um9 h GLU 21 CO 0.56 0.53 0.29 0.39 0.05 0.00 0.00 179.01 180.83 1um9 n GLU 22 N -4.45 3.54 -1.09 1.06 1.02 -1.26 -4.89 120.64 114.56 1um9 n GLU 22 Ca 0.07 -2.93 -0.03 0.00 -0.02 0.00 0.00 57.16 54.25 1um9 n GLU 22 Cb 0.07 -2.18 -0.01 0.00 -0.02 0.00 0.00 31.44 29.30 1um9 n GLU 22 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1um9 n GLY 23 N -0.18 0.63 3.90 0.62 0.00 -0.80 -4.83 105.19 104.53 1um9 n GLY 23 Ca 0.41 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 1um9 n GLY 23 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1um9 s GLU 24 N -1.97 3.68 0.09 1.61 1.03 -1.26 -4.31 118.70 117.56 1um9 s GLU 24 Ca 0.00 0.07 -0.30 0.00 0.03 0.00 0.00 54.97 54.77 1um9 s GLU 24 Cb 0.00 -2.66 -0.05 0.00 -0.80 0.00 0.00 34.13 30.62 1um9 s GLU 24 CO 0.00 0.26 0.98 -0.46 -1.33 0.00 0.00 175.26 174.70 1um9 s TRP 25 N -1.98 3.76 -0.81 4.83 -0.11 -1.26 0.89 118.94 124.26 1um9 s TRP 25 Ca 0.45 1.76 0.07 0.00 1.22 0.00 0.00 56.10 59.59 1um9 s TRP 25 Cb -0.11 -3.09 0.05 0.00 -1.50 0.00 0.00 33.47 28.83 1um9 s TRP 25 CO 0.27 0.10 0.70 1.28 -4.62 0.00 0.00 176.95 174.68 1um9 n LEU 26 N 3.07 1.54 -4.78 5.86 4.77 0.57 -4.88 117.00 123.15 1um9 n LEU 26 Ca 0.03 -1.00 -0.33 0.00 -0.03 0.00 0.00 56.01 54.68 1um9 n LEU 26 Cb 0.49 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.61 1um9 n LEU 26 CO 0.51 0.32 0.74 -0.83 -1.33 0.00 0.00 177.39 176.81 1um9 s GLY 27 N -0.55 2.29 0.05 -0.72 0.00 -1.26 -4.95 107.32 102.17 1um9 s GLY 27 Ca 0.08 0.58 -0.20 0.00 0.00 0.00 0.00 44.72 45.18 1um9 s GLY 27 CO 0.08 0.93 1.38 -0.55 0.00 0.00 0.00 173.10 174.94 1um9 h ASP 28 N 0.50 0.40 -4.35 1.64 3.32 -1.98 -3.44 116.42 112.51 1um9 h ASP 28 Ca -0.48 -0.45 -0.51 0.00 0.02 0.00 0.00 57.03 55.61 1um9 h ASP 28 Cb 1.24 -0.11 0.06 0.00 0.22 0.00 0.00 39.33 40.74 1um9 h ASP 28 CO 0.56 0.76 0.41 0.72 -1.72 0.00 0.00 179.24 179.97 1um9 s PHE 29 N -4.42 3.56 0.43 4.55 -0.71 -1.26 -5.03 117.98 115.10 1um9 s PHE 29 Ca -0.14 1.31 -0.21 0.00 -1.04 0.00 0.00 56.93 56.85 1um9 s PHE 29 Cb 0.06 -2.74 -0.10 0.00 -1.21 0.00 0.00 43.02 39.02 1um9 s PHE 29 CO 0.75 -0.74 0.98 -1.25 -1.34 0.00 0.00 175.22 173.62 1um9 s PRO 30 N -5.12 4.15 0.04 1.99 0.04 -1.26 -4.97 135.00 129.87 1um9 s PRO 30 Ca 0.56 1.22 -0.30 0.00 0.04 0.00 0.00 61.00 62.51 1um9 s PRO 30 Cb -0.11 -2.23 -0.08 0.00 0.04 0.00 0.00 34.50 32.12 1um9 s PRO 30 CO 0.53 -0.11 1.72 -1.17 0.04 0.00 0.00 177.00 178.01 1um9 s LEU 31 N -3.14 4.37 -0.21 -3.56 2.96 -1.26 -4.91 118.68 112.94 1um9 s LEU 31 Ca 0.62 2.49 0.14 0.00 -0.22 0.00 0.00 54.13 57.16 1um9 s LEU 31 Cb -0.12 -3.55 0.47 0.00 0.50 0.00 0.00 46.19 43.49 1um9 s LEU 31 CO 0.16 -0.94 1.38 -0.90 -1.32 0.00 0.00 176.35 174.74 1um9 n ASP 32 N 6.29 3.02 -4.65 3.68 5.68 -1.26 -4.97 116.55 124.33 1um9 n ASP 32 Ca 0.17 -3.34 -0.35 0.00 -0.50 0.00 0.00 54.79 50.78 1um9 n ASP 32 Cb 0.41 -0.56 -0.09 0.00 -1.14 0.00 0.00 41.12 39.74 1um9 n ASP 32 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1um9 s LEU 33 N -3.00 3.92 0.61 -2.12 1.43 -1.26 -5.08 118.68 113.18 1um9 s LEU 33 Ca 0.41 0.11 -0.18 0.00 -1.03 0.00 0.00 54.13 53.44 1um9 s LEU 33 Cb 0.35 -2.00 -0.02 0.00 0.03 0.00 0.00 46.19 44.55 1um9 s LEU 33 CO 0.04 0.16 1.19 -1.61 0.23 0.00 0.00 176.35 176.36 1um9 s GLU 34 N 0.45 2.87 0.42 1.70 8.01 -1.26 -4.78 118.70 126.10 1um9 s GLU 34 Ca 0.05 1.76 0.20 0.00 0.01 0.00 0.00 54.97 56.99 1um9 s GLU 34 Cb -0.12 -1.92 1.15 0.00 -4.31 0.00 0.00 34.13 28.92 1um9 s GLU 34 CO 0.00 -1.27 1.78 0.78 0.01 0.00 0.00 175.26 176.56 1um9 h GLY 35 N 0.67 1.05 1.00 -1.39 0.00 -1.99 0.28 103.07 102.68 1um9 h GLY 35 Ca -0.50 -0.18 -0.05 0.00 0.00 0.00 0.00 47.33 46.60 1um9 h GLY 35 CO 0.54 -0.11 0.17 -2.09 0.00 0.00 0.00 176.54 175.06 1um9 h GLU 36 N 0.35 0.90 -0.45 4.80 4.57 -1.99 -1.07 114.58 121.68 1um9 h GLU 36 Ca 0.58 -0.20 -0.11 0.00 -1.18 0.00 0.00 59.36 58.44 1um9 h GLU 36 Cb 1.54 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.99 1um9 h GLU 36 CO -0.25 0.82 -0.17 0.87 -1.18 0.00 0.00 179.01 179.09 1um9 h LYS 37 N 0.81 0.87 -0.08 1.92 1.57 -1.32 -1.26 116.57 119.08 1um9 h LYS 37 Ca 0.18 -0.33 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1um9 h LYS 37 Cb 0.30 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 1um9 h LYS 37 CO -0.00 0.97 0.04 -0.07 -0.57 0.00 0.00 179.45 179.81 1um9 h LEU 38 N 0.76 0.10 -1.46 2.94 3.38 -1.07 -1.22 115.31 118.74 1um9 h LEU 38 Ca 0.11 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1um9 h LEU 38 Cb 0.69 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 1um9 h LEU 38 CO 0.05 0.20 0.38 0.03 0.09 0.00 0.00 178.44 179.19 1um9 h ARG 39 N 0.00 0.70 -0.69 1.13 3.08 -1.08 -1.70 114.38 115.83 1um9 h ARG 39 Ca 0.03 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 59.98 1um9 h ARG 39 Cb 0.12 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 1um9 h ARG 39 CO -0.00 0.47 0.20 -0.09 -1.07 0.00 0.00 179.97 179.48 1um9 h ARG 40 N 0.73 1.08 -0.52 0.04 9.65 -0.67 -0.17 114.38 124.52 1um9 h ARG 40 Ca 0.22 -0.24 0.02 0.00 -1.10 0.00 0.00 59.98 58.88 1um9 h ARG 40 Cb -0.02 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.38 1um9 h ARG 40 CO -0.05 0.94 0.31 -0.07 2.80 0.00 0.00 179.97 183.90 1um9 h LEU 41 N 1.01 0.50 -0.41 3.80 3.38 -0.32 -0.75 115.31 122.52 1um9 h LEU 41 Ca 0.22 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.14 1um9 h LEU 41 Cb 0.32 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1um9 h LEU 41 CO -0.00 0.36 0.03 0.22 0.09 0.00 0.00 178.44 179.14 1um9 h TYR 42 N 0.62 0.76 -0.16 1.13 3.20 -1.15 -1.63 116.97 119.74 1um9 h TYR 42 Ca 0.21 -0.12 0.04 0.00 3.14 0.00 0.00 58.73 61.99 1um9 h TYR 42 Cb 0.01 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.04 1um9 h TYR 42 CO -0.06 0.75 -0.08 -0.09 -1.64 0.00 0.00 178.16 177.04 1um9 h ARG 43 N 0.55 -0.06 -0.53 1.82 1.12 -0.67 -0.49 114.38 116.12 1um9 h ARG 43 Ca 0.12 0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 58.97 1um9 h ARG 43 Cb 0.43 0.01 -0.03 0.00 -0.01 0.00 0.00 29.97 30.38 1um9 h ARG 43 CO 0.01 -0.04 0.21 -0.44 -3.11 0.00 0.00 179.97 176.61 1um9 h ASP 44 N -0.06 0.69 -0.31 -3.80 3.32 -1.03 -1.12 116.42 114.10 1um9 h ASP 44 Ca 0.09 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1um9 h ASP 44 Cb 0.19 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1um9 h ASP 44 CO -0.20 0.62 0.09 0.24 -1.72 0.00 0.00 179.24 178.27 1um9 h MET 45 N 0.75 0.49 -0.59 3.56 2.86 -0.51 -0.02 114.93 121.48 1um9 h MET 45 Ca 0.18 -0.11 0.01 0.00 -2.06 0.00 0.00 59.70 57.72 1um9 h MET 45 Cb 0.15 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 1um9 h MET 45 CO -0.02 0.54 0.39 -0.07 1.06 0.00 0.00 176.91 178.82 1um9 h LEU 46 N 0.35 0.67 -0.54 1.22 3.38 -0.66 -0.31 115.31 119.42 1um9 h LEU 46 Ca 0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1um9 h LEU 46 Cb 0.26 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1um9 h LEU 46 CO -0.00 0.49 0.30 0.00 0.09 0.00 0.00 178.44 179.32 1um9 h ALA 47 N 1.22 0.69 -0.60 1.53 0.00 -0.97 0.64 119.26 121.77 1um9 h ALA 47 Ca 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1um9 h ALA 47 Cb -0.09 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1um9 h ALA 47 CO -0.05 0.20 0.28 0.00 0.00 0.00 0.00 179.25 179.68 1um9 h ALA 48 N 1.14 0.77 -0.55 0.00 0.00 -0.62 -0.06 119.26 119.94 1um9 h ALA 48 Ca 0.19 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1um9 h ALA 48 Cb 0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1um9 h ALA 48 CO -0.03 0.35 0.22 -0.09 0.00 0.00 0.00 179.25 179.70 1um9 h ARG 49 N 0.82 0.83 0.00 0.00 9.65 -0.70 -1.74 114.38 123.24 1um9 h ARG 49 Ca 0.20 -0.15 -0.08 0.00 -1.10 0.00 0.00 59.98 58.85 1um9 h ARG 49 Cb 0.13 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.57 1um9 h ARG 49 CO -0.02 0.72 -0.39 0.52 2.80 0.00 0.00 179.97 183.60 1um9 h MET 50 N 0.76 0.00 -0.28 0.20 2.86 -0.60 -1.55 114.93 116.32 1um9 h MET 50 Ca 0.18 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.73 1um9 h MET 50 Cb 0.20 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1um9 h MET 50 CO -0.01 0.39 -0.18 1.25 1.06 0.00 0.00 176.91 179.41 1um9 h LEU 51 N 0.00 0.64 -0.79 1.22 5.85 -0.67 -1.48 115.31 120.08 1um9 h LEU 51 Ca -0.00 -0.43 -0.00 0.00 0.84 0.00 0.00 57.88 58.28 1um9 h LEU 51 Cb 0.88 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.69 1um9 h LEU 51 CO 0.05 0.94 0.48 -0.78 -0.34 0.00 0.00 178.44 178.78 1um9 h ASP 52 N 0.35 0.95 1.07 1.25 3.58 -1.01 -0.99 116.42 121.62 1um9 h ASP 52 Ca 0.06 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.42 1um9 h ASP 52 Cb 0.72 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.53 1um9 h ASP 52 CO 0.05 0.73 -0.10 -0.33 -2.88 0.00 0.00 179.24 176.72 1um9 h GLU 53 N 1.08 0.00 0.01 0.28 5.08 -1.16 -2.04 114.58 117.84 1um9 h GLU 53 Ca 0.28 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.44 1um9 h GLU 53 Cb -0.04 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1um9 h GLU 53 CO -0.05 0.10 -0.92 -0.09 -1.00 0.00 0.00 179.01 177.04 1um9 h ARG 54 N 0.00 0.08 -0.29 2.33 9.65 -0.27 -3.06 114.38 122.81 1um9 h ARG 54 Ca -0.00 -0.11 -0.08 0.00 -1.10 0.00 0.00 59.98 58.70 1um9 h ARG 54 Cb 0.66 0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.26 1um9 h ARG 54 CO 0.01 0.94 -0.15 1.88 2.80 0.00 0.00 179.97 185.46 1um9 h TYR 55 N 0.04 0.55 -0.76 2.20 -1.99 -0.51 -0.28 116.97 116.21 1um9 h TYR 55 Ca -0.03 -0.09 -0.04 0.00 2.00 0.00 0.00 58.73 60.57 1um9 h TYR 55 Cb 1.60 -0.14 -0.03 0.00 2.00 0.00 0.00 36.73 40.15 1um9 h TYR 55 CO 0.01 0.63 0.31 1.15 -0.00 0.00 0.00 178.16 180.27 1um9 h THR 56 N 0.46 1.25 -0.50 -2.88 2.02 -1.37 -0.99 112.91 110.91 1um9 h THR 56 Ca 0.08 -0.80 -0.13 0.00 0.77 0.00 0.00 66.41 66.34 1um9 h THR 56 Cb 0.53 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 1um9 h THR 56 CO 0.03 0.32 -0.19 0.40 0.37 0.00 0.00 175.52 176.46 1um9 h ILE 57 N 1.09 1.27 -0.59 3.11 2.04 -1.31 -1.25 117.51 121.88 1um9 h ILE 57 Ca 0.25 -1.36 -0.02 0.00 1.00 0.00 0.00 64.86 64.74 1um9 h ILE 57 Cb 0.21 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 1um9 h ILE 57 CO -0.02 0.47 0.30 -0.07 0.00 0.00 0.00 178.15 178.83 1um9 h LEU 58 N 0.88 0.74 -0.21 1.44 3.38 -0.60 -1.68 115.31 119.27 1um9 h LEU 58 Ca 0.12 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 1um9 h LEU 58 Cb 0.77 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 1um9 h LEU 58 CO 0.06 0.62 -0.32 0.40 0.09 0.00 0.00 178.44 179.29 1um9 h ILE 59 N 0.83 1.33 -0.79 1.22 1.08 -0.93 0.15 117.51 120.40 1um9 h ILE 59 Ca 0.21 -1.53 0.03 0.00 -0.39 0.00 0.00 64.86 63.18 1um9 h ILE 59 Cb 0.06 1.81 -0.04 0.00 -3.07 0.00 0.00 36.82 35.57 1um9 h ILE 59 CO -0.03 0.47 0.52 0.03 -0.69 0.00 0.00 178.15 178.45 1um9 h ARG 60 N 0.27 0.95 -0.35 2.37 3.08 -0.71 -1.53 114.38 118.46 1um9 h ARG 60 Ca 0.02 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1um9 h ARG 60 Cb 0.91 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.74 1um9 h ARG 60 CO 0.07 0.63 0.00 0.25 -1.07 0.00 0.00 179.97 179.86 1um9 n THR 61 N -4.45 0.46 -1.71 2.04 -2.24 -0.68 -4.95 114.28 102.76 1um9 n THR 61 Ca 0.10 -0.63 -0.17 0.00 -2.27 0.00 0.00 64.05 61.08 1um9 n THR 61 Cb 0.11 0.69 -0.05 0.00 -2.10 0.00 0.00 70.33 68.98 1um9 n THR 61 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1um9 n GLY 62 N 1.38 1.14 0.16 3.38 0.00 -0.58 -4.85 105.19 105.81 1um9 n GLY 62 Ca 0.18 -0.21 0.13 0.00 0.00 0.00 0.00 46.02 46.12 1um9 n GLY 62 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1um9 h LYS 63 N 0.00 0.00 -4.61 1.61 1.57 -0.99 -3.43 116.57 110.72 1um9 h LYS 63 Ca -0.36 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.19 1um9 h LYS 63 Cb 1.15 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.29 1um9 h LYS 63 CO 0.49 0.00 -0.71 -0.08 -0.57 0.00 0.00 179.45 178.59 1um9 s THR 64 N -3.26 0.63 -1.22 -0.16 -1.32 -1.12 -4.62 115.64 104.56 1um9 s THR 64 Ca 0.07 -1.67 0.16 0.00 -1.21 0.00 0.00 61.69 59.05 1um9 s THR 64 Cb 0.10 -1.34 -0.07 0.00 -1.51 0.00 0.00 72.50 69.67 1um9 s THR 64 CO 0.54 -0.73 0.80 -1.54 -2.21 0.00 0.00 174.62 171.48 1um9 n SER 65 N 0.43 1.30 -3.64 8.08 3.41 -1.26 -4.50 113.62 117.44 1um9 n SER 65 Ca -0.16 -1.15 -0.13 0.00 -0.26 0.00 0.00 58.87 57.18 1um9 n SER 65 Cb 0.59 0.68 -0.07 0.00 -0.26 0.00 0.00 64.21 65.15 1um9 n SER 65 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1um9 s PHE 66 N -2.17 -0.83 0.02 7.33 5.36 -1.26 -2.33 117.98 124.11 1um9 s PHE 66 Ca 0.11 1.94 -0.00 0.00 -0.96 0.00 0.00 56.93 58.01 1um9 s PHE 66 Cb 0.13 0.34 -0.02 0.00 -0.34 0.00 0.00 43.02 43.13 1um9 s PHE 66 CO 0.51 -0.40 -0.03 0.96 -1.46 0.00 0.00 175.22 174.80 1um9 s ILE 67 N 0.64 0.12 -0.50 3.12 -4.36 -0.69 -4.55 121.20 114.98 1um9 s ILE 67 Ca -0.02 -0.97 0.04 0.00 -0.26 0.00 0.00 60.65 59.43 1um9 s ILE 67 Cb -0.05 -0.36 0.13 0.00 1.25 0.00 0.00 42.46 43.43 1um9 s ILE 67 CO -0.03 -0.54 0.25 0.00 0.24 0.00 0.00 174.94 174.86 1um9 s ALA 68 N -1.65 3.15 0.01 2.27 0.00 -1.26 -1.13 121.76 123.15 1um9 s ALA 68 Ca -0.14 -3.16 -0.39 0.00 0.00 0.00 0.00 51.96 48.27 1um9 s ALA 68 Cb -0.09 -2.12 -0.18 0.00 0.00 0.00 0.00 23.12 20.74 1um9 s ALA 68 CO -0.02 -2.01 1.27 -2.30 0.00 0.00 0.00 175.76 172.70 1um9 n PRO 69 N 3.22 0.64 0.00 0.00 -0.02 -1.26 -4.79 135.00 132.80 1um9 n PRO 69 Ca 0.05 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1um9 n PRO 69 Cb 0.33 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1um9 n PRO 69 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1um9 n ALA 70 N 2.34 1.98 -1.76 3.55 0.00 -1.26 -4.84 120.51 120.53 1um9 n ALA 70 Ca 0.20 -0.99 -0.42 0.00 0.00 0.00 0.00 53.44 52.23 1um9 n ALA 70 Cb 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.55 1um9 n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1um9 s ALA 71 N -0.97 3.69 0.00 0.00 0.00 -1.26 -0.88 121.76 122.34 1um9 s ALA 71 Ca 0.00 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.30 1um9 s ALA 71 Cb 0.00 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 19.35 1um9 s ALA 71 CO 0.00 -1.31 0.00 0.41 0.00 0.00 0.00 175.76 174.86 1um9 n GLY 72 N 4.28 1.57 0.64 0.00 0.00 -1.26 0.02 105.19 110.43 1um9 n GLY 72 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 1um9 n GLY 72 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1um9 n HIS 73 N -0.65 0.00 -0.28 1.61 8.25 -0.05 -4.24 115.22 119.87 1um9 n HIS 73 Ca 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.52 1um9 n HIS 73 Cb 0.00 0.00 0.21 0.00 1.12 0.00 0.00 29.99 31.32 1um9 n HIS 73 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1um9 h GLU 74 N 3.14 0.51 -0.35 -0.41 3.07 -1.91 0.13 114.58 118.75 1um9 h GLU 74 Ca 0.00 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.79 1um9 h GLU 74 Cb 0.82 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.60 1um9 h GLU 74 CO 0.00 0.34 0.08 0.00 -1.40 0.00 0.00 179.01 178.02 1um9 h ALA 75 N 1.56 0.47 0.24 3.43 0.00 -1.82 -0.93 119.26 122.20 1um9 h ALA 75 Ca 0.44 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1um9 h ALA 75 Cb 0.66 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1um9 h ALA 75 CO -0.39 0.15 -0.11 0.00 0.00 0.00 0.00 179.25 178.89 1um9 h ALA 76 N 0.92 -0.32 -0.68 0.00 0.00 -1.32 -1.38 119.26 116.47 1um9 h ALA 76 Ca 0.11 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1um9 h ALA 76 Cb 0.32 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1um9 h ALA 76 CO 0.00 -0.54 0.31 1.96 0.00 0.00 0.00 179.25 180.99 1um9 h GLN 77 N -0.59 0.99 -0.23 0.00 4.20 -0.79 -1.77 115.11 116.92 1um9 h GLN 77 Ca -0.03 -0.15 -0.17 0.00 0.06 0.00 0.00 58.65 58.36 1um9 h GLN 77 Cb 0.43 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 1um9 h GLN 77 CO 0.05 0.79 -0.53 0.28 -0.67 0.00 0.00 178.83 178.76 1um9 h VAL 78 N 0.95 1.30 -0.63 -0.54 2.07 -1.23 -2.32 116.25 115.85 1um9 h VAL 78 Ca 0.23 -1.75 -0.01 0.00 0.82 0.00 0.00 66.70 65.99 1um9 h VAL 78 Cb 0.14 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1um9 h VAL 78 CO -0.03 0.55 0.36 0.00 0.02 0.00 0.00 177.57 178.47 1um9 h ALA 79 N 0.90 0.81 -0.24 1.67 0.00 -1.07 -2.30 119.26 119.03 1um9 h ALA 79 Ca 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1um9 h ALA 79 Cb 1.09 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1um9 h ALA 79 CO 0.11 0.32 0.10 0.82 0.00 0.00 0.00 179.25 180.60 1um9 h ILE 80 N 0.86 1.16 -0.80 0.00 2.04 -1.24 -1.08 117.51 118.46 1um9 h ILE 80 Ca 0.22 -0.48 0.12 0.00 1.00 0.00 0.00 64.86 65.72 1um9 h ILE 80 Cb 0.02 1.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.08 1um9 h ILE 80 CO -0.04 0.16 0.52 0.00 0.00 0.00 0.00 178.15 178.80 1um9 h ALA 81 N 0.95 1.85 0.00 1.87 0.00 -1.14 -2.09 119.26 120.70 1um9 h ALA 81 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1um9 h ALA 81 Cb 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1um9 h ALA 81 CO -0.01 -0.04 -0.65 0.72 0.00 0.00 0.00 179.25 179.27 1um9 n HIS 82 N -4.51 0.44 0.63 0.00 8.25 -0.89 -3.90 115.22 115.25 1um9 n HIS 82 Ca 0.14 0.13 0.13 0.00 -0.26 0.00 0.00 57.72 57.86 1um9 n HIS 82 Cb 0.40 -0.58 0.31 0.00 1.12 0.00 0.00 29.99 31.23 1um9 n HIS 82 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1um9 n ALA 83 N -1.78 2.62 -4.15 -1.41 0.00 -0.44 -4.89 120.51 110.46 1um9 n ALA 83 Ca 0.03 -0.14 -0.27 0.00 0.00 0.00 0.00 53.44 53.06 1um9 n ALA 83 Cb 0.42 -1.32 -0.02 0.00 0.00 0.00 0.00 19.45 18.53 1um9 n ALA 83 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1um9 n ILE 84 N -2.13 0.00 -3.60 0.00 -5.35 -1.17 -4.74 119.36 102.37 1um9 n ILE 84 Ca 0.05 -2.03 -0.40 0.00 -0.27 0.00 0.00 62.75 60.10 1um9 n ILE 84 Cb 0.43 0.11 -0.07 0.00 -1.74 0.00 0.00 39.64 38.37 1um9 n ILE 84 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1um9 s ARG 85 N -3.89 2.88 0.13 6.28 0.52 -1.26 -4.99 118.95 118.62 1um9 s ARG 85 Ca 0.18 -2.52 -0.35 0.00 -0.52 0.00 0.00 55.73 52.51 1um9 s ARG 85 Cb -0.01 -3.94 -0.16 0.00 0.52 0.00 0.00 34.95 31.36 1um9 s ARG 85 CO 0.11 -1.21 1.35 -0.35 0.02 0.00 0.00 175.30 175.22 1um9 n PRO 86 N 3.61 1.40 0.00 3.54 -0.04 -1.26 -0.63 135.00 141.62 1um9 n PRO 86 Ca 0.10 0.50 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 1um9 n PRO 86 Cb 0.40 -2.14 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 1um9 n PRO 86 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1um9 n GLY 87 N 2.55 2.50 0.67 0.55 0.00 -1.26 -4.79 105.19 105.41 1um9 n GLY 87 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 1um9 n GLY 87 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1um9 n PHE 88 N -2.00 0.00 -1.45 1.61 7.35 0.20 -4.85 117.46 118.31 1um9 n PHE 88 Ca 0.00 0.00 -0.30 0.00 -0.76 0.00 0.00 57.45 56.39 1um9 n PHE 88 Cb 0.00 -0.15 0.09 0.00 0.35 0.00 0.00 39.48 39.77 1um9 n PHE 88 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1um9 s ASP 89 N -5.70 4.47 0.09 -2.13 1.01 -0.21 -4.81 116.67 109.40 1um9 s ASP 89 Ca -0.09 1.46 0.04 0.00 0.71 0.00 0.00 52.55 54.67 1um9 s ASP 89 Cb 0.01 -2.21 -0.04 0.00 1.01 0.00 0.00 42.92 41.69 1um9 s ASP 89 CO 0.13 -2.00 0.05 0.26 0.21 0.00 0.00 175.17 173.81 1um9 s TRP 90 N -3.06 3.09 -0.07 4.23 0.52 -0.15 -4.68 118.94 118.82 1um9 s TRP 90 Ca 0.61 0.02 0.03 0.00 0.02 0.00 0.00 56.10 56.78 1um9 s TRP 90 Cb -0.15 -1.57 0.01 0.00 -1.15 0.00 0.00 33.47 30.60 1um9 s TRP 90 CO 0.55 0.50 -0.14 0.08 0.02 0.00 0.00 176.95 177.96 1um9 s VAL 91 N -1.38 1.31 -0.59 4.03 1.01 0.06 -1.14 120.40 123.69 1um9 s VAL 91 Ca 0.28 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1um9 s VAL 91 Cb -0.12 -1.18 0.15 0.00 0.00 0.00 0.00 36.38 35.24 1um9 s VAL 91 CO 0.20 0.39 0.38 -0.36 0.00 0.00 0.00 175.10 175.71 1um9 s PHE 92 N 0.60 3.32 0.76 5.22 0.40 -0.04 -1.39 117.98 126.85 1um9 s PHE 92 Ca -0.15 -2.98 -0.06 0.00 -0.60 0.00 0.00 56.93 53.14 1um9 s PHE 92 Cb -0.16 -3.00 0.12 0.00 0.51 0.00 0.00 43.02 40.48 1um9 s PHE 92 CO 0.05 -0.77 1.06 -1.25 0.70 0.00 0.00 175.22 175.00 1um9 s PRO 93 N -0.31 1.64 0.38 0.24 0.04 -1.26 -1.49 135.00 134.24 1um9 s PRO 93 Ca 0.18 -0.69 0.04 0.00 0.04 0.00 0.00 61.00 60.57 1um9 s PRO 93 Cb -0.22 -2.18 -0.06 0.00 0.04 0.00 0.00 34.50 32.08 1um9 s PRO 93 CO -0.03 -1.56 0.05 1.52 0.04 0.00 0.00 177.00 177.02 1um9 s TYR 94 N -3.32 2.04 0.64 0.56 1.13 -1.26 -4.73 117.35 112.42 1um9 s TYR 94 Ca 0.66 -0.95 0.23 0.00 -1.41 0.00 0.00 57.07 55.59 1um9 s TYR 94 Cb -0.07 -1.41 1.15 0.00 -1.10 0.00 0.00 41.96 40.54 1um9 s TYR 94 CO 0.46 0.08 1.64 0.10 -2.51 0.00 0.00 175.55 175.31 1um9 h TYR 95 N 1.90 0.00 -0.32 -3.49 -0.00 -1.85 -1.71 116.97 111.51 1um9 h TYR 95 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.32 1um9 h TYR 95 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.99 1um9 h TYR 95 CO 0.87 0.00 0.00 -2.13 -0.00 0.00 0.00 178.16 176.90 1um9 n ARG 96 N -3.05 2.08 -0.78 0.10 0.63 -1.26 -4.52 116.66 109.86 1um9 n ARG 96 Ca 0.04 -1.64 -0.16 0.00 -0.92 0.00 0.00 57.85 55.17 1um9 n ARG 96 Cb 0.73 -1.43 0.10 0.00 0.45 0.00 0.00 32.46 32.31 1um9 n ARG 96 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1um9 n ASP 97 N 0.85 3.84 0.24 6.15 8.00 -0.64 -4.50 116.55 130.50 1um9 n ASP 97 Ca 0.17 -3.02 0.09 0.00 0.71 0.00 0.00 54.79 52.74 1um9 n ASP 97 Cb 0.44 -0.75 0.61 0.00 -0.02 0.00 0.00 41.12 41.41 1um9 n ASP 97 CO 0.00 0.00 0.00 1.12 -0.39 0.00 0.00 177.20 177.93 1um9 h HIS 98 N 0.73 0.00 -0.54 1.24 2.07 -1.85 -0.71 115.15 116.10 1um9 h HIS 98 Ca 0.39 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.80 1um9 h HIS 98 Cb 2.01 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.97 1um9 h HIS 98 CO 0.98 0.16 -0.10 0.78 -3.07 0.00 0.00 177.93 176.68 1um9 h GLY 99 N 0.70 1.10 0.98 6.13 0.00 -1.89 -1.06 103.07 109.02 1um9 h GLY 99 Ca -0.00 -0.89 -0.05 0.00 0.00 0.00 0.00 47.33 46.39 1um9 h GLY 99 CO 0.02 0.82 0.12 -2.00 0.00 0.00 0.00 176.54 175.49 1um9 h LEU 100 N 0.89 0.76 -0.23 3.11 5.85 -1.60 -1.47 115.31 122.62 1um9 h LEU 100 Ca 0.14 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.67 1um9 h LEU 100 Cb 0.67 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 1um9 h LEU 100 CO 0.05 0.80 -0.05 0.00 -0.34 0.00 0.00 178.44 178.89 1um9 h ALA 101 N 0.99 0.16 0.22 1.25 0.00 -0.84 0.21 119.26 121.24 1um9 h ALA 101 Ca 0.15 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1um9 h ALA 101 Cb 0.34 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1um9 h ALA 101 CO 0.00 -0.47 -0.11 1.25 0.00 0.00 0.00 179.25 179.93 1um9 h LEU 102 N 0.01 -0.25 -2.28 0.00 5.85 -1.03 -2.38 115.31 115.22 1um9 h LEU 102 Ca 0.11 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1um9 h LEU 102 Cb 0.17 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 1um9 h LEU 102 CO -0.23 -0.11 -0.02 0.00 -0.34 0.00 0.00 178.44 177.74 1um9 h ALA 103 N 0.39 1.60 0.00 1.25 0.00 -1.08 -0.27 119.26 121.15 1um9 h ALA 103 Ca -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1um9 h ALA 103 Cb 0.29 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1um9 h ALA 103 CO 0.05 0.03 -0.15 1.25 0.00 0.00 0.00 179.25 180.43 1um9 h LEU 104 N 0.00 0.00 0.00 0.00 5.85 -0.58 -3.47 115.31 117.11 1um9 h LEU 104 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1um9 h LEU 104 Cb 0.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1um9 h LEU 104 CO 0.00 0.15 0.00 0.61 -0.34 0.00 0.00 178.44 178.86 1um9 n GLY 105 N 0.53 1.03 3.69 3.75 0.00 -0.11 -4.88 105.19 109.19 1um9 n GLY 105 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1um9 n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1um9 s ILE 106 N -2.00 3.54 0.30 -0.61 1.01 -0.93 -4.93 121.20 117.59 1um9 s ILE 106 Ca 0.00 0.91 -0.28 0.00 0.00 0.00 0.00 60.65 61.29 1um9 s ILE 106 Cb 0.00 -3.59 -0.14 0.00 0.01 0.00 0.00 42.46 38.74 1um9 s ILE 106 CO 0.00 -0.01 1.02 -2.65 0.00 0.00 0.00 174.94 173.30 1um9 n PRO 107 N 5.61 1.39 -0.01 2.79 -0.02 -1.26 -4.58 135.00 138.92 1um9 n PRO 107 Ca 0.14 0.49 0.06 0.00 -2.02 0.00 0.00 63.50 62.16 1um9 n PRO 107 Cb 0.43 -1.88 0.45 0.00 -0.02 0.00 0.00 33.50 32.48 1um9 n PRO 107 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1um9 h LEU 108 N 1.97 0.43 -0.60 2.45 3.38 -1.94 -1.51 115.31 119.49 1um9 h LEU 108 Ca -0.40 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 57.67 1um9 h LEU 108 Cb 1.34 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.90 1um9 h LEU 108 CO 0.60 0.31 0.16 0.50 0.09 0.00 0.00 178.44 180.10 1um9 h LYS 109 N 0.51 0.30 -0.20 1.13 3.64 -1.89 0.36 116.57 120.41 1um9 h LYS 109 Ca 0.17 -0.02 -0.21 0.00 -1.27 0.00 0.00 60.65 59.32 1um9 h LYS 109 Cb 0.05 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1um9 h LYS 109 CO -0.04 0.20 -0.70 0.93 -2.27 0.00 0.00 179.45 177.57 1um9 h GLU 110 N 0.30 0.82 -0.05 1.90 5.08 -1.50 0.19 114.58 121.33 1um9 h GLU 110 Ca 0.31 -0.61 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 1um9 h GLU 110 Cb 0.45 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1um9 h GLU 110 CO -0.37 1.23 -0.00 -0.07 -1.00 0.00 0.00 179.01 178.80 1um9 h LEU 111 N 0.59 0.09 -0.92 1.33 3.38 -0.85 -2.04 115.31 116.89 1um9 h LEU 111 Ca -0.03 -0.32 -0.11 0.00 0.09 0.00 0.00 57.88 57.51 1um9 h LEU 111 Cb 1.32 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1um9 h LEU 111 CO 0.15 0.39 -0.42 -0.07 0.09 0.00 0.00 178.44 178.58 1um9 h LEU 112 N -0.21 0.26 -1.06 1.67 3.38 -0.36 -2.06 115.31 116.92 1um9 h LEU 112 Ca 0.01 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1um9 h LEU 112 Cb 0.35 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1um9 h LEU 112 CO 0.00 0.66 0.23 1.23 0.09 0.00 0.00 178.44 180.65 1um9 h GLY 113 N 1.23 0.97 1.73 0.83 0.00 -0.50 -0.48 103.07 106.84 1um9 h GLY 113 Ca 0.02 -0.50 -0.20 0.00 0.00 0.00 0.00 47.33 46.65 1um9 h GLY 113 CO 0.07 0.48 -0.86 -1.61 0.00 0.00 0.00 176.54 174.61 1um9 h GLN 114 N 0.88 0.24 -0.52 4.80 -0.00 -1.10 0.27 115.11 119.68 1um9 h GLN 114 Ca 0.21 -0.25 -0.11 0.00 -0.00 0.00 0.00 58.65 58.50 1um9 h GLN 114 Cb 0.19 0.07 -0.02 0.00 0.00 0.00 0.00 27.48 27.72 1um9 h GLN 114 CO -0.02 0.96 -0.10 0.52 0.00 0.00 0.00 178.83 180.19 1um9 h MET 115 N 0.14 0.98 -0.01 1.69 2.86 -0.94 -3.06 114.93 116.58 1um9 h MET 115 Ca -0.05 -0.35 0.00 0.00 -2.06 0.00 0.00 59.70 57.24 1um9 h MET 115 Cb 1.48 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 33.07 1um9 h MET 115 CO 0.14 1.02 -0.46 1.28 1.06 0.00 0.00 176.91 179.95 1um9 n LEU 116 N -4.15 1.04 -3.50 1.22 4.32 -0.23 -4.63 117.00 111.07 1um9 n LEU 116 Ca 0.02 -0.30 -0.18 0.00 -0.02 0.00 0.00 56.01 55.52 1um9 n LEU 116 Cb 0.39 -0.12 0.08 0.00 -1.62 0.00 0.00 43.42 42.15 1um9 n LEU 116 CO 0.45 0.21 0.07 0.00 -1.22 0.00 0.00 177.39 176.90 1um9 n ALA 117 N -0.89 -1.99 -2.26 -1.18 0.00 0.79 -5.02 120.51 109.95 1um9 n ALA 117 Ca 0.09 -0.07 -0.23 0.00 0.00 0.00 0.00 53.44 53.22 1um9 n ALA 117 Cb 0.36 -2.42 0.01 0.00 0.00 0.00 0.00 19.45 17.40 1um9 n ALA 117 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1um9 s THR 118 N -3.43 1.94 -1.25 0.00 -4.23 -0.29 -4.13 115.64 104.25 1um9 s THR 118 Ca 0.02 -1.32 0.10 0.00 -1.18 0.00 0.00 61.69 59.31 1um9 s THR 118 Cb -0.01 -2.26 0.13 0.00 1.34 0.00 0.00 72.50 71.70 1um9 s THR 118 CO 0.75 0.00 1.24 0.29 -0.54 0.00 0.00 174.62 176.36 1um9 n LYS 119 N -1.88 0.08 0.15 3.99 5.02 0.47 -1.51 118.16 124.48 1um9 n LYS 119 Ca 0.04 0.25 0.13 0.00 -2.02 0.00 0.00 58.31 56.72 1um9 n LYS 119 Cb 0.63 -1.50 0.45 0.00 -0.02 0.00 0.00 35.03 34.59 1um9 n LYS 119 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1um9 h ALA 120 N 2.40 1.00 -1.94 7.82 0.00 -1.81 -3.43 119.26 123.31 1um9 h ALA 120 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 1um9 h ALA 120 Cb 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 1um9 h ALA 120 CO 0.00 0.00 0.85 0.34 0.00 0.00 0.00 179.25 180.44 1um9 s ASP 121 N -4.75 6.92 0.30 0.00 2.15 -0.57 -4.35 116.67 116.36 1um9 s ASP 121 Ca 0.06 1.03 0.22 0.00 0.43 0.00 0.00 52.55 54.30 1um9 s ASP 121 Cb 0.10 -2.54 1.11 0.00 -0.30 0.00 0.00 42.92 41.28 1um9 s ASP 121 CO 0.52 -0.90 1.68 -0.81 -0.17 0.00 0.00 175.17 175.49 1um9 n PRO 122 N 6.92 0.16 -0.22 4.34 -0.04 -1.26 0.03 135.00 144.92 1um9 n PRO 122 Ca 0.12 0.56 0.08 0.00 -0.04 0.00 0.00 63.50 64.22 1um9 n PRO 122 Cb 0.47 -1.93 0.23 0.00 -0.04 0.00 0.00 33.50 32.23 1um9 n PRO 122 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1um9 n ASN 123 N -2.26 2.55 -2.92 3.54 3.02 -1.26 -4.95 115.26 112.98 1um9 n ASN 123 Ca -0.00 -1.97 -0.19 0.00 -0.03 0.00 0.00 54.58 52.39 1um9 n ASN 123 Cb 0.11 -0.29 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 1um9 n ASN 123 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1um9 n LYS 124 N 0.89 -3.20 -1.98 3.52 5.02 0.10 -2.25 118.16 120.27 1um9 n LYS 124 Ca 0.16 0.63 -0.20 0.00 -2.02 0.00 0.00 58.31 56.88 1um9 n LYS 124 Cb 0.41 -5.33 -0.05 0.00 -0.02 0.00 0.00 35.03 30.04 1um9 n LYS 124 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1um9 n GLY 125 N -1.11 0.78 0.15 0.72 0.00 -1.26 -4.87 105.19 99.60 1um9 n GLY 125 Ca -0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 46.02 45.89 1um9 n GLY 125 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1um9 h ARG 126 N 0.00 0.03 -5.72 1.61 2.47 -1.85 -3.46 114.38 107.45 1um9 h ARG 126 Ca -0.45 -0.02 -0.61 0.00 -1.26 0.00 0.00 59.98 57.64 1um9 h ARG 126 Cb 1.34 0.00 -0.13 0.00 -1.65 0.00 0.00 29.97 29.53 1um9 h ARG 126 CO 0.59 0.58 -0.63 -0.65 0.56 0.00 0.00 179.97 180.43 1um9 s GLN 127 N -3.76 1.89 0.85 0.04 -0.21 -1.26 -5.13 119.66 112.07 1um9 s GLN 127 Ca -0.02 -2.04 -0.11 0.00 0.02 0.00 0.00 55.36 53.21 1um9 s GLN 127 Cb 0.13 -1.61 0.10 0.00 1.00 0.00 0.00 33.01 32.63 1um9 s GLN 127 CO 0.76 0.01 1.09 0.00 -2.12 0.00 0.00 175.29 175.03 1um9 s MET 128 N -3.69 1.66 0.85 2.91 0.23 -1.26 -4.95 119.30 115.04 1um9 s MET 128 Ca 0.34 0.75 -0.15 0.00 -1.03 0.00 0.00 55.69 55.60 1um9 s MET 128 Cb 0.07 -1.86 -0.06 0.00 -1.53 0.00 0.00 34.83 31.46 1um9 s MET 128 CO 0.17 -1.95 0.07 -2.30 -2.03 0.00 0.00 175.02 168.99 1um9 n PRO 129 N -3.67 0.00 -2.27 3.16 -0.02 -1.26 -3.65 135.00 127.29 1um9 n PRO 129 Ca 0.07 0.03 -0.10 0.00 -2.02 0.00 0.00 63.50 61.49 1um9 n PRO 129 Cb 0.56 -1.53 -0.00 0.00 -0.02 0.00 0.00 33.50 32.50 1um9 n PRO 129 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1um9 n GLU 130 N 0.05 -1.07 -2.82 -0.52 -0.58 -1.26 -4.91 120.64 109.53 1um9 n GLU 130 Ca 0.06 0.45 -0.22 0.00 -0.42 0.00 0.00 57.16 57.03 1um9 n GLU 130 Cb 0.52 -4.44 -0.01 0.00 -0.57 0.00 0.00 31.44 26.94 1um9 n GLU 130 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1um9 n HIS 131 N -3.97 2.47 -1.07 -0.32 8.25 -1.24 -4.38 115.22 114.97 1um9 n HIS 131 Ca -0.10 -3.50 -0.30 0.00 -0.26 0.00 0.00 57.72 53.56 1um9 n HIS 131 Cb 0.58 -0.34 0.15 0.00 1.12 0.00 0.00 29.99 31.49 1um9 n HIS 131 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1um9 s PRO 132 N -3.19 1.14 -0.29 -0.41 0.04 -1.26 -4.41 135.00 126.61 1um9 s PRO 132 Ca 0.43 0.99 -0.20 0.00 0.04 0.00 0.00 61.00 62.26 1um9 s PRO 132 Cb 0.36 -1.78 0.14 0.00 0.04 0.00 0.00 34.50 33.26 1um9 s PRO 132 CO -0.11 -2.37 1.04 0.20 0.04 0.00 0.00 177.00 175.81 1um9 s GLY 133 N -3.21 0.01 -0.11 0.56 0.00 -1.26 -1.77 107.32 101.54 1um9 s GLY 133 Ca 0.64 3.05 -0.04 0.00 0.00 0.00 0.00 44.72 48.38 1um9 s GLY 133 CO 0.58 2.31 0.08 -0.45 0.00 0.00 0.00 173.10 175.61 1um9 s SER 134 N 0.87 1.79 0.13 1.64 0.15 -0.12 -4.73 113.70 113.44 1um9 s SER 134 Ca -0.04 -0.29 -0.17 0.00 0.70 0.00 0.00 55.95 56.15 1um9 s SER 134 Cb -0.04 -0.20 -0.02 0.00 -1.71 0.00 0.00 66.02 64.06 1um9 s SER 134 CO -0.12 -0.30 1.70 0.50 1.20 0.00 0.00 173.24 176.22 1um9 h LYS 135 N 8.43 0.52 -0.73 5.44 3.64 -1.97 0.13 116.57 132.03 1um9 h LYS 135 Ca -0.14 -0.08 0.08 0.00 -1.27 0.00 0.00 60.65 59.25 1um9 h LYS 135 Cb 1.14 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.82 1um9 h LYS 135 CO 0.23 0.47 0.48 0.00 -2.27 0.00 0.00 179.45 178.36 1um9 h ALA 136 N 1.02 1.77 -0.39 5.00 0.00 -1.96 -2.47 119.26 122.23 1um9 h ALA 136 Ca 0.12 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1um9 h ALA 136 Cb 0.12 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1um9 h ALA 136 CO -0.02 0.10 0.03 1.28 0.00 0.00 0.00 179.25 180.65 1um9 n LEU 137 N -4.49 4.51 -4.13 0.00 4.77 -1.11 -4.64 117.00 111.92 1um9 n LEU 137 Ca 0.12 -3.13 -0.32 0.00 -0.03 0.00 0.00 56.01 52.65 1um9 n LEU 137 Cb 0.28 -0.61 -0.03 0.00 -2.33 0.00 0.00 43.42 40.74 1um9 n LEU 137 CO 0.33 0.76 -0.15 0.59 -1.33 0.00 0.00 177.39 177.59 1um9 n ASN 138 N -0.39 -1.72 -4.24 -1.43 3.02 -0.81 -4.27 115.26 105.43 1um9 n ASN 138 Ca 0.27 -1.04 -0.43 0.00 -0.03 0.00 0.00 54.58 53.36 1um9 n ASN 138 Cb 1.03 -2.76 -0.06 0.00 -0.61 0.00 0.00 39.78 37.38 1um9 n ASN 138 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1um9 s PHE 139 N -3.66 3.56 -0.20 3.10 5.36 -0.03 -0.76 117.98 125.35 1um9 s PHE 139 Ca 0.38 -2.14 -0.33 0.00 -0.96 0.00 0.00 56.93 53.88 1um9 s PHE 139 Cb -0.21 -3.58 -0.10 0.00 -0.34 0.00 0.00 43.02 38.79 1um9 s PHE 139 CO 0.92 -0.95 2.05 0.34 -1.46 0.00 0.00 175.22 176.12 1um9 n PHE 140 N 4.08 2.03 -1.64 10.12 7.35 -0.48 -0.95 117.46 137.97 1um9 n PHE 140 Ca 0.06 0.05 -0.59 0.00 -0.76 0.00 0.00 57.45 56.21 1um9 n PHE 140 Cb 0.43 -2.64 -0.08 0.00 0.35 0.00 0.00 39.48 37.54 1um9 n PHE 140 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 1um9 n THR 141 N 6.36 0.07 -1.66 -2.13 -1.04 -1.26 -4.43 114.28 110.19 1um9 n THR 141 Ca 0.30 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.88 1um9 n THR 141 Cb 0.31 -0.62 0.01 0.00 -1.82 0.00 0.00 70.33 68.21 1um9 n THR 141 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1um9 n VAL 142 N 3.11 2.49 -5.04 12.58 0.31 -0.73 -4.99 118.33 126.07 1um9 n VAL 142 Ca 0.24 -0.50 -0.28 0.00 -0.01 0.00 0.00 64.34 63.79 1um9 n VAL 142 Cb 0.08 -1.39 -0.16 0.00 -0.91 0.00 0.00 33.84 31.47 1um9 n VAL 142 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1um9 s ALA 143 N -1.22 1.76 0.14 3.52 0.00 -1.26 -4.89 121.76 119.82 1um9 s ALA 143 Ca 0.62 -0.91 -0.19 0.00 0.00 0.00 0.00 51.96 51.48 1um9 s ALA 143 Cb -0.54 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.15 1um9 s ALA 143 CO 0.58 0.43 1.69 0.77 0.00 0.00 0.00 175.76 179.22 1um9 h SER 144 N 5.63 -0.26 -1.78 0.00 0.02 -1.97 -3.44 113.55 111.76 1um9 h SER 144 Ca -0.39 0.08 -0.66 0.00 -0.84 0.00 0.00 61.79 59.99 1um9 h SER 144 Cb 1.14 0.17 0.09 0.00 0.14 0.00 0.00 62.40 63.94 1um9 h SER 144 CO 0.48 -0.09 0.04 -0.81 -1.14 0.00 0.00 176.83 175.30 1um9 n PRO 145 N -5.24 0.85 -0.35 3.45 -0.04 -1.26 -4.85 135.00 127.56 1um9 n PRO 145 Ca -0.01 0.30 0.12 0.00 -0.04 0.00 0.00 63.50 63.87 1um9 n PRO 145 Cb 0.16 -1.65 0.31 0.00 -0.04 0.00 0.00 33.50 32.27 1um9 n PRO 145 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1um9 h ILE 146 N 2.15 0.76 0.00 0.52 1.08 -2.00 -3.30 117.51 116.73 1um9 h ILE 146 Ca -0.40 -0.28 0.00 0.00 -0.39 0.00 0.00 64.86 63.79 1um9 h ILE 146 Cb 1.37 -0.12 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 1um9 h ILE 146 CO 0.64 0.15 0.00 0.00 -0.69 0.00 0.00 178.15 178.25 1um9 n ALA 147 N -2.34 1.47 0.33 1.87 0.00 -1.26 -4.72 120.51 115.86 1um9 n ALA 147 Ca 0.22 -0.65 0.22 0.00 0.00 0.00 0.00 53.44 53.23 1um9 n ALA 147 Cb 0.52 0.00 1.17 0.00 0.00 0.00 0.00 19.45 21.14 1um9 n ALA 147 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1um9 h SER 148 N 0.00 0.00 0.24 0.00 4.64 -1.93 -1.89 113.55 114.61 1um9 h SER 148 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1um9 h SER 148 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1um9 h SER 148 CO 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 176.83 175.84 1um9 n HIS 149 N -3.07 0.00 0.00 4.77 1.44 -1.26 -4.18 115.22 112.92 1um9 n HIS 149 Ca -0.03 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.56 1um9 n HIS 149 Cb 0.09 -0.13 -0.10 0.00 0.12 0.00 0.00 29.99 29.98 1um9 n HIS 149 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 1um9 h VAL 150 N 0.96 1.30 -0.52 0.61 2.07 -1.66 -2.24 116.25 116.77 1um9 h VAL 150 Ca 0.00 -1.12 0.04 0.00 0.82 0.00 0.00 66.70 66.44 1um9 h VAL 150 Cb 0.39 2.05 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 1um9 h VAL 150 CO 0.00 0.28 0.28 -0.65 0.02 0.00 0.00 177.57 177.50 1um9 h PRO 151 N -0.54 0.52 -0.86 1.57 0.11 -1.75 -2.00 132.00 129.05 1um9 h PRO 151 Ca -0.00 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 66.15 1um9 h PRO 151 Cb 0.50 -0.12 -0.07 0.00 0.11 0.00 0.00 31.00 31.42 1um9 h PRO 151 CO 0.01 0.35 0.52 -1.35 -0.21 0.00 0.00 178.00 177.31 1um9 h PRO 152 N 0.54 0.88 -0.51 1.05 0.11 -1.76 -0.45 132.00 131.86 1um9 h PRO 152 Ca 0.23 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 66.32 1um9 h PRO 152 Cb 0.12 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 30.99 1um9 h PRO 152 CO -0.15 0.58 0.27 0.00 -0.21 0.00 0.00 178.00 178.50 1um9 h ALA 153 N 1.44 0.65 -0.61 -0.75 0.00 -0.76 -0.32 119.26 118.90 1um9 h ALA 153 Ca 0.39 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 1um9 h ALA 153 Cb 0.27 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1um9 h ALA 153 CO -0.21 -0.06 0.38 0.00 0.00 0.00 0.00 179.25 179.36 1um9 h ALA 154 N 1.26 0.78 -0.44 0.00 0.00 -0.58 -1.74 119.26 118.54 1um9 h ALA 154 Ca 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1um9 h ALA 154 Cb 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1um9 h ALA 154 CO -0.14 0.25 0.28 0.78 0.00 0.00 0.00 179.25 180.43 1um9 h GLY 155 N 0.83 0.63 1.34 0.00 0.00 -0.38 -0.00 103.07 105.48 1um9 h GLY 155 Ca 0.22 -0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.26 1um9 h GLY 155 CO -0.04 0.24 0.16 0.00 0.00 0.00 0.00 176.54 176.89 1um9 h ALA 156 N 1.14 1.23 -0.62 3.60 0.00 -0.85 -0.48 119.26 123.28 1um9 h ALA 156 Ca 0.16 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1um9 h ALA 156 Cb -0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1um9 h ALA 156 CO -0.03 0.54 0.12 0.00 0.00 0.00 0.00 179.25 179.88 1um9 h ALA 157 N 1.36 0.82 -0.66 0.00 0.00 -0.86 0.53 119.26 120.45 1um9 h ALA 157 Ca 0.18 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1um9 h ALA 157 Cb 0.26 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1um9 h ALA 157 CO -0.01 0.56 0.24 0.82 0.00 0.00 0.00 179.25 180.86 1um9 h ILE 158 N 0.93 1.23 -0.38 0.00 2.04 -0.35 -1.11 117.51 119.86 1um9 h ILE 158 Ca 0.19 -0.77 -0.04 0.00 1.00 0.00 0.00 64.86 65.24 1um9 h ILE 158 Cb 0.40 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1um9 h ILE 158 CO 0.01 0.30 0.07 -1.28 0.00 0.00 0.00 178.15 177.26 1um9 h SER 159 N 0.95 0.60 -0.99 1.72 0.87 -0.56 -0.55 113.55 115.60 1um9 h SER 159 Ca 0.22 -0.25 0.09 0.00 -1.23 0.00 0.00 61.79 60.62 1um9 h SER 159 Cb 0.22 -0.16 -0.07 0.00 -0.44 0.00 0.00 62.40 61.95 1um9 h SER 159 CO -0.01 0.70 0.63 0.24 -0.53 0.00 0.00 176.83 177.86 1um9 h MET 160 N 0.48 1.04 0.16 2.24 2.86 -0.31 -0.15 114.93 121.25 1um9 h MET 160 Ca 0.12 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 1um9 h MET 160 Cb 0.34 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.77 1um9 h MET 160 CO 0.01 0.69 -0.08 -0.22 1.06 0.00 0.00 176.91 178.37 1um9 h LYS 161 N 1.08 -0.21 -0.97 1.72 3.64 -0.75 -1.20 116.57 119.88 1um9 h LYS 161 Ca 0.45 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.88 1um9 h LYS 161 Cb 0.32 0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.13 1um9 h LYS 161 CO -0.21 0.15 0.63 -0.07 -2.27 0.00 0.00 179.45 177.69 1um9 h LEU 162 N -0.61 1.06 -0.72 5.20 3.38 -0.78 -1.77 115.31 121.07 1um9 h LEU 162 Ca -0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1um9 h LEU 162 Cb 0.45 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1um9 h LEU 162 CO 0.04 0.73 0.00 0.18 0.09 0.00 0.00 178.44 179.47 1um9 n LEU 163 N -4.46 1.10 -4.09 1.67 4.77 -0.10 -4.94 117.00 110.94 1um9 n LEU 163 Ca 0.13 -0.41 -0.30 0.00 -0.03 0.00 0.00 56.01 55.40 1um9 n LEU 163 Cb 0.09 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1um9 n LEU 163 CO 0.34 0.20 -0.16 0.54 -1.33 0.00 0.00 177.39 176.99 1um9 n ARG 164 N -0.11 -3.14 0.23 3.23 5.12 -0.52 -4.84 116.66 116.63 1um9 n ARG 164 Ca 0.18 0.37 0.13 0.00 -1.93 0.00 0.00 57.85 56.60 1um9 n ARG 164 Cb 0.27 -4.73 0.31 0.00 -1.16 0.00 0.00 32.46 27.16 1um9 n ARG 164 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 1um9 h THR 165 N -1.70 0.08 0.00 0.55 1.35 -1.65 -3.47 112.91 108.07 1um9 h THR 165 Ca -0.61 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.29 1um9 h THR 165 Cb 1.38 1.88 0.00 0.00 -1.73 0.00 0.00 68.15 69.68 1um9 h THR 165 CO 0.70 0.04 0.00 0.61 -0.25 0.00 0.00 175.52 176.62 1um9 n GLY 166 N 0.78 0.61 3.94 5.82 0.00 -1.26 -5.03 105.19 110.05 1um9 n GLY 166 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 1um9 n GLY 166 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1um9 s GLN 167 N -0.01 1.97 0.04 1.61 -0.21 -1.26 -4.94 119.66 116.86 1um9 s GLN 167 Ca 0.00 -0.42 0.02 0.00 0.02 0.00 0.00 55.36 54.99 1um9 s GLN 167 Cb 0.00 -2.17 -0.02 0.00 1.00 0.00 0.00 33.01 31.81 1um9 s GLN 167 CO 0.00 -1.37 -0.07 0.08 -2.12 0.00 0.00 175.29 171.81 1um9 s VAL 168 N -3.28 0.51 -0.14 1.09 1.01 -1.26 -4.82 120.40 113.51 1um9 s VAL 168 Ca 0.62 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 61.59 1um9 s VAL 168 Cb -0.09 -0.58 0.00 0.00 0.00 0.00 0.00 36.38 35.72 1um9 s VAL 168 CO 0.45 -0.36 -0.19 0.00 0.00 0.00 0.00 175.10 174.99 1um9 s ALA 169 N -1.32 2.35 -0.05 5.51 0.00 -0.81 -0.98 121.76 126.45 1um9 s ALA 169 Ca -0.10 -1.07 -0.00 0.00 0.00 0.00 0.00 51.96 50.79 1um9 s ALA 169 Cb -0.10 -1.08 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 1um9 s ALA 169 CO 0.00 -0.02 0.00 0.14 0.00 0.00 0.00 175.76 175.89 1um9 s VAL 170 N 0.79 4.23 -0.11 0.00 -7.23 -0.29 -0.85 120.40 116.94 1um9 s VAL 170 Ca -0.07 -0.42 -0.00 0.00 -1.81 0.00 0.00 61.98 59.68 1um9 s VAL 170 Cb -0.16 -2.83 0.02 0.00 0.56 0.00 0.00 36.38 33.98 1um9 s VAL 170 CO -0.01 0.50 -0.08 0.00 -0.31 0.00 0.00 175.10 175.20 1um9 s THR 172 N 1.59 4.15 0.06 0.00 -4.23 -0.55 0.06 115.64 116.71 1um9 s THR 172 Ca 0.03 -1.01 -0.27 0.00 -1.18 0.00 0.00 61.69 59.25 1um9 s THR 172 Cb -0.13 -3.01 0.09 0.00 1.34 0.00 0.00 72.50 70.78 1um9 s THR 172 CO -0.07 0.06 0.88 0.72 -0.54 0.00 0.00 174.62 175.67 1um9 s PHE 173 N -1.44 -0.30 0.66 3.99 -0.12 -0.72 -4.09 117.98 115.96 1um9 s PHE 173 Ca 0.27 0.11 -0.03 0.00 -0.05 0.00 0.00 56.93 57.23 1um9 s PHE 173 Cb -0.11 0.57 0.14 0.00 -0.63 0.00 0.00 43.02 42.99 1um9 s PHE 173 CO 0.20 -0.66 0.91 0.41 -0.05 0.00 0.00 175.22 176.03 1um9 n GLY 174 N -0.32 0.26 0.31 1.99 0.00 -1.26 -0.78 105.19 105.39 1um9 n GLY 174 Ca -0.09 -1.96 -0.06 0.00 0.00 0.00 0.00 46.02 43.92 1um9 n GLY 174 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1um9 h ASP 175 N -0.70 0.98 -0.41 1.61 3.58 -1.95 -2.98 116.42 116.55 1um9 h ASP 175 Ca -0.30 -0.13 0.02 0.00 0.42 0.00 0.00 57.03 57.04 1um9 h ASP 175 Cb 1.04 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.82 1um9 h ASP 175 CO 0.30 0.84 0.28 1.23 -2.88 0.00 0.00 179.24 179.00 1um9 h GLY 176 N 1.06 0.54 1.93 -0.78 0.00 -1.96 -2.00 103.07 101.86 1um9 h GLY 176 Ca 0.26 -0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.40 1um9 h GLY 176 CO -0.03 0.18 0.03 0.00 0.00 0.00 0.00 176.54 176.71 1um9 h ALA 177 N 1.75 1.81 0.00 3.60 0.00 -1.81 -1.94 119.26 122.68 1um9 h ALA 177 Ca 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1um9 h ALA 177 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1um9 h ALA 177 CO -0.04 -0.04 0.00 0.25 0.00 0.00 0.00 179.25 179.42 1um9 n THR 178 N -4.20 0.00 0.24 0.00 -2.24 -0.75 -1.78 114.28 105.54 1um9 n THR 178 Ca -0.02 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.87 1um9 n THR 178 Cb 0.12 -0.68 -0.04 0.00 -2.10 0.00 0.00 70.33 67.63 1um9 n THR 178 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1um9 n SER 179 N -0.98 0.53 -4.76 3.42 7.64 -0.73 -4.92 113.62 113.82 1um9 n SER 179 Ca 0.14 0.04 -0.39 0.00 1.01 0.00 0.00 58.87 59.67 1um9 n SER 179 Cb 0.06 1.00 -0.05 0.00 -1.01 0.00 0.00 64.21 64.21 1um9 n SER 179 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1um9 s GLU 180 N -3.35 4.71 0.23 1.43 0.41 -0.74 -4.98 118.70 116.42 1um9 s GLU 180 Ca -0.01 1.56 -0.07 0.00 -0.41 0.00 0.00 54.97 56.03 1um9 s GLU 180 Cb 0.12 -3.13 0.20 0.00 -1.78 0.00 0.00 34.13 29.54 1um9 s GLU 180 CO 0.83 0.35 1.85 0.78 -0.49 0.00 0.00 175.26 178.58 1um9 h GLY 181 N 3.80 1.34 2.00 -1.39 0.00 -1.93 -2.55 103.07 104.33 1um9 h GLY 181 Ca -0.46 -0.62 -0.04 0.00 0.00 0.00 0.00 47.33 46.21 1um9 h GLY 181 CO 0.67 0.59 -0.20 -0.55 0.00 0.00 0.00 176.54 177.05 1um9 h ASP 182 N 1.25 0.00 0.21 0.19 5.19 -1.93 0.10 116.42 121.42 1um9 h ASP 182 Ca 0.31 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.71 1um9 h ASP 182 Cb 0.05 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.56 1um9 h ASP 182 CO -0.05 0.20 -0.10 -0.25 -3.12 0.00 0.00 179.24 175.93 1um9 h TRP 183 N 0.00 -0.26 0.25 4.55 7.01 -1.67 -0.93 115.95 124.91 1um9 h TRP 183 Ca -0.00 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 60.98 1um9 h TRP 183 Cb 0.40 0.09 0.00 0.00 -2.10 0.00 0.00 29.16 27.54 1um9 h TRP 183 CO 0.00 0.01 -0.12 -0.92 -2.79 0.00 0.00 178.44 174.61 1um9 h TYR 184 N -0.50 -0.32 -0.59 2.65 3.20 -1.32 -2.32 116.97 117.76 1um9 h TYR 184 Ca -0.03 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.89 1um9 h TYR 184 Cb 0.38 0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.70 1um9 h TYR 184 CO 0.00 -0.18 0.31 0.00 -1.64 0.00 0.00 178.16 176.65 1um9 h ALA 185 N 0.38 0.78 -0.10 1.82 0.00 -0.81 -0.18 119.26 121.15 1um9 h ALA 185 Ca -0.03 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1um9 h ALA 185 Cb 0.28 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1um9 h ALA 185 CO 0.06 -0.03 0.03 0.78 0.00 0.00 0.00 179.25 180.09 1um9 h GLY 186 N 0.58 0.18 1.09 0.00 0.00 -1.12 -2.26 103.07 101.53 1um9 h GLY 186 Ca 0.27 -0.11 -0.05 0.00 0.00 0.00 0.00 47.33 47.44 1um9 h GLY 186 CO -0.18 0.10 0.27 -2.22 0.00 0.00 0.00 176.54 174.51 1um9 h ILE 187 N -0.03 1.26 -0.95 2.60 2.04 -1.24 -2.26 117.51 118.93 1um9 h ILE 187 Ca 0.03 -0.86 -0.00 0.00 1.00 0.00 0.00 64.86 65.03 1um9 h ILE 187 Cb 0.24 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 36.66 1um9 h ILE 187 CO -0.00 0.34 0.59 -1.13 0.00 0.00 0.00 178.15 177.95 1um9 h ASN 188 N 1.11 1.12 -0.51 1.72 -1.24 -0.94 -0.36 115.58 116.49 1um9 h ASN 188 Ca 0.25 -0.06 -0.11 0.00 0.71 0.00 0.00 56.30 57.09 1um9 h ASN 188 Cb 0.26 -0.28 -0.02 0.00 0.73 0.00 0.00 38.32 39.01 1um9 h ASN 188 CO -0.01 0.84 -0.12 0.15 -1.29 0.00 0.00 177.43 177.00 1um9 h PHE 189 N 1.30 1.10 -0.69 0.67 3.57 -1.11 -0.61 116.94 121.15 1um9 h PHE 189 Ca 0.34 -0.23 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 1um9 h PHE 189 Cb -0.09 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.35 1um9 h PHE 189 CO 0.00 1.04 0.37 0.00 -2.23 0.00 0.00 178.31 177.49 1um9 h ALA 190 N 0.90 0.89 -0.21 2.41 0.00 -0.84 -0.91 119.26 121.50 1um9 h ALA 190 Ca 0.13 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1um9 h ALA 190 Cb 0.68 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1um9 h ALA 190 CO 0.05 0.41 0.04 0.00 0.00 0.00 0.00 179.25 179.75 1um9 h ALA 191 N 1.18 0.28 -0.61 0.00 0.00 -0.84 0.90 119.26 120.17 1um9 h ALA 191 Ca 0.24 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1um9 h ALA 191 Cb 0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1um9 h ALA 191 CO -0.04 -0.05 0.38 0.28 0.00 0.00 0.00 179.25 179.82 1um9 h VAL 192 N 0.15 1.17 -0.00 0.00 2.07 -0.91 -1.56 116.25 117.17 1um9 h VAL 192 Ca 0.06 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1um9 h VAL 192 Cb 0.30 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1um9 h VAL 192 CO 0.00 0.17 -0.23 0.00 0.02 0.00 0.00 177.57 177.53 1um9 n GLN 193 N -4.42 0.15 -2.73 1.57 1.13 -0.36 -4.92 117.38 107.80 1um9 n GLN 193 Ca 0.06 -0.06 -0.19 0.00 -1.94 0.00 0.00 57.00 54.88 1um9 n GLN 193 Cb 0.06 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 28.93 1um9 n GLN 193 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1um9 n GLY 194 N 1.45 -0.34 3.77 1.08 0.00 0.10 -4.95 105.19 106.29 1um9 n GLY 194 Ca 0.08 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1um9 n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1um9 s ALA 195 N -3.02 3.12 -1.10 4.61 0.00 0.02 -3.86 121.76 121.53 1um9 s ALA 195 Ca 0.18 0.92 -0.18 0.00 0.00 0.00 0.00 51.96 52.88 1um9 s ALA 195 Cb -0.08 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.61 1um9 s ALA 195 CO 0.22 -0.49 2.09 -0.35 0.00 0.00 0.00 175.76 177.22 1um9 n PRO 196 N -0.00 2.17 -4.42 0.00 -0.04 -1.26 -2.49 135.00 128.95 1um9 n PRO 196 Ca 0.05 -2.19 -0.20 0.00 -0.04 0.00 0.00 63.50 61.12 1um9 n PRO 196 Cb 0.47 -3.07 -0.14 0.00 -0.04 0.00 0.00 33.50 30.71 1um9 n PRO 196 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1um9 s ALA 197 N 4.09 0.96 -0.18 0.55 0.00 -1.26 -1.93 121.76 124.00 1um9 s ALA 197 Ca 0.52 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 51.91 1um9 s ALA 197 Cb 0.14 -0.20 0.01 0.00 0.00 0.00 0.00 23.12 23.07 1um9 s ALA 197 CO 0.02 0.21 -0.17 0.08 0.00 0.00 0.00 175.76 175.90 1um9 s VAL 198 N -0.47 2.35 -0.27 0.00 1.01 -0.03 -3.36 120.40 119.62 1um9 s VAL 198 Ca 0.03 -0.85 -0.12 0.00 0.00 0.00 0.00 61.98 61.03 1um9 s VAL 198 Cb -0.05 -2.00 -0.05 0.00 0.00 0.00 0.00 36.38 34.28 1um9 s VAL 198 CO 0.00 0.52 0.25 -0.36 0.00 0.00 0.00 175.10 175.51 1um9 s PHE 199 N 1.21 3.25 -0.15 5.22 0.08 -0.62 -0.39 117.98 126.56 1um9 s PHE 199 Ca 0.02 0.24 0.02 0.00 0.12 0.00 0.00 56.93 57.33 1um9 s PHE 199 Cb -0.14 -2.43 0.02 0.00 -0.57 0.00 0.00 43.02 39.90 1um9 s PHE 199 CO -0.08 -0.15 -0.20 0.42 -0.10 0.00 0.00 175.22 175.11 1um9 s ILE 200 N 1.74 1.96 -0.18 0.64 1.01 0.11 -0.45 121.20 126.03 1um9 s ILE 200 Ca 0.10 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 59.69 1um9 s ILE 200 Cb -0.16 -1.76 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 1um9 s ILE 200 CO 0.10 0.53 0.37 0.00 0.00 0.00 0.00 174.94 175.94 1um9 s ALA 201 N 1.06 3.56 -0.98 9.38 0.00 0.67 -1.75 121.76 133.70 1um9 s ALA 201 Ca -0.02 -0.48 -0.09 0.00 0.00 0.00 0.00 51.96 51.37 1um9 s ALA 201 Cb -0.14 -2.57 0.25 0.00 0.00 0.00 0.00 23.12 20.66 1um9 s ALA 201 CO -0.07 -0.16 0.94 -1.21 0.00 0.00 0.00 175.76 175.26 1um9 s GLU 202 N 1.01 3.83 -0.54 0.00 2.02 0.04 -0.07 118.70 124.99 1um9 s GLU 202 Ca 0.19 -2.97 -0.24 0.00 0.02 0.00 0.00 54.97 51.96 1um9 s GLU 202 Cb -0.14 -4.40 0.04 0.00 0.10 0.00 0.00 34.13 29.72 1um9 s GLU 202 CO 0.07 -1.26 0.94 1.21 0.02 0.00 0.00 175.26 176.24 1um9 s ASN 203 N 1.35 6.36 -0.87 -0.19 2.47 -0.63 -4.17 114.94 119.27 1um9 s ASN 203 Ca 0.26 -0.30 -0.25 0.00 0.42 0.00 0.00 52.86 52.99 1um9 s ASN 203 Cb -0.10 -2.44 -0.03 0.00 -1.45 0.00 0.00 41.25 37.23 1um9 s ASN 203 CO -0.09 -1.21 1.86 0.21 -3.72 0.00 0.00 177.10 174.16 1um9 s ASN 204 N 2.78 5.34 0.46 -4.21 2.47 -1.26 -0.68 114.94 119.84 1um9 s ASN 204 Ca 0.31 -0.61 0.05 0.00 0.42 0.00 0.00 52.86 53.03 1um9 s ASN 204 Cb -0.12 -2.56 0.01 0.00 -1.45 0.00 0.00 41.25 37.14 1um9 s ASN 204 CO 0.20 -2.53 0.63 0.12 -3.72 0.00 0.00 177.10 171.80 1um9 s PHE 205 N 9.25 2.89 0.00 0.43 2.19 0.13 -4.94 117.98 127.93 1um9 s PHE 205 Ca 0.66 -0.21 0.00 0.00 0.33 0.00 0.00 56.93 57.72 1um9 s PHE 205 Cb -0.07 -2.46 0.00 0.00 -1.31 0.00 0.00 43.02 39.18 1um9 s PHE 205 CO 0.02 -0.52 0.00 -0.35 1.83 0.00 0.00 175.22 176.19 1um9 n PRO 219 N -2.01 0.00 -1.62 10.12 -0.04 -1.26 -4.77 135.00 135.43 1um9 n PRO 219 Ca 0.07 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.23 1um9 n PRO 219 Cb 0.59 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.15 1um9 n PRO 219 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1um9 s THR 220 N 0.00 2.58 0.17 0.52 -4.23 -1.26 -4.95 115.64 108.47 1um9 s THR 220 Ca 0.00 0.19 -0.05 0.00 -1.18 0.00 0.00 61.69 60.65 1um9 s THR 220 Cb 0.00 -2.99 -0.08 0.00 1.34 0.00 0.00 72.50 70.77 1um9 s THR 220 CO 0.00 -0.25 1.45 0.40 -0.54 0.00 0.00 174.62 175.69 1um9 h ILE 221 N -1.20 1.32 -0.76 2.99 2.04 -2.00 -3.02 117.51 116.89 1um9 h ILE 221 Ca -0.48 -1.89 0.07 0.00 1.00 0.00 0.00 64.86 63.56 1um9 h ILE 221 Cb 1.30 1.87 -0.06 0.00 -0.74 0.00 0.00 36.82 39.18 1um9 h ILE 221 CO 0.61 0.59 0.44 0.00 0.00 0.00 0.00 178.15 179.79 1um9 h ALA 222 N 0.88 1.05 -0.24 1.87 0.00 -1.90 -1.57 119.26 119.35 1um9 h ALA 222 Ca -0.01 0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.99 1um9 h ALA 222 Cb 1.19 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1um9 h ALA 222 CO 0.12 0.11 0.20 -0.44 0.00 0.00 0.00 179.25 179.23 1um9 h ASP 223 N 0.77 0.00 0.18 0.00 3.32 -1.89 -0.36 116.42 118.44 1um9 h ASP 223 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1um9 h ASP 223 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1um9 h ASP 223 CO -0.21 0.00 0.00 0.11 -1.72 0.00 0.00 179.24 177.42 1um9 h LYS 224 N 0.00 0.00 0.00 3.56 1.57 -1.33 -2.03 116.57 118.34 1um9 h LYS 224 Ca 0.12 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1um9 h LYS 224 Cb 0.51 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 1um9 h LYS 224 CO -0.00 0.00 -0.02 0.00 -0.57 0.00 0.00 179.45 178.86 1um9 h ALA 225 N 2.01 1.53 0.00 3.86 0.00 -1.18 -1.17 119.26 124.31 1um9 h ALA 225 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1um9 h ALA 225 Cb 0.09 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1um9 h ALA 225 CO 0.00 0.02 -0.14 0.45 0.00 0.00 0.00 179.25 179.58 1um9 h HIS 226 N 0.00 0.00 0.00 0.00 3.86 -1.56 -1.16 115.15 116.29 1um9 h HIS 226 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1um9 h HIS 226 Cb 0.04 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.51 1um9 h HIS 226 CO 0.00 0.14 0.00 0.00 0.86 0.00 0.00 177.93 178.93 1um9 n ALA 227 N -2.45 1.71 0.32 2.45 0.00 -0.44 -2.78 120.51 119.31 1um9 n ALA 227 Ca -0.02 0.07 0.04 0.00 0.00 0.00 0.00 53.44 53.53 1um9 n ALA 227 Cb 0.22 -1.39 -0.05 0.00 0.00 0.00 0.00 19.45 18.23 1um9 n ALA 227 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1um9 n PHE 228 N -2.21 0.00 -1.90 0.00 3.72 -0.53 -4.99 117.46 111.55 1um9 n PHE 228 Ca 0.02 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.36 1um9 n PHE 228 Cb 0.24 -0.03 -0.01 0.00 -0.94 0.00 0.00 39.48 38.74 1um9 n PHE 228 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1um9 n GLY 229 N 1.32 0.29 3.55 1.37 0.00 -0.66 -4.83 105.19 106.22 1um9 n GLY 229 Ca 0.01 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.12 1um9 n GLY 229 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1um9 s ILE 230 N -2.28 2.58 0.28 -0.61 -4.36 -1.05 -5.05 121.20 110.71 1um9 s ILE 230 Ca 0.00 -2.19 -0.29 0.00 -0.26 0.00 0.00 60.65 57.91 1um9 s ILE 230 Cb 0.00 -2.58 -0.10 0.00 1.25 0.00 0.00 42.46 41.03 1um9 s ILE 230 CO 0.00 -0.30 1.11 -2.16 0.24 0.00 0.00 174.94 173.83 1um9 s PRO 231 N -3.61 4.62 -0.02 0.37 0.04 -1.26 -4.36 135.00 130.78 1um9 s PRO 231 Ca 0.32 1.82 0.07 0.00 0.04 0.00 0.00 61.00 63.26 1um9 s PRO 231 Cb -0.02 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.32 1um9 s PRO 231 CO 0.17 0.18 -0.24 0.20 0.04 0.00 0.00 177.00 177.35 1um9 s GLY 232 N -0.82 1.20 -0.00 0.56 0.00 -1.26 -1.44 107.32 105.57 1um9 s GLY 232 Ca 0.45 -1.05 0.06 0.00 0.00 0.00 0.00 44.72 44.18 1um9 s GLY 232 CO 0.41 -0.84 -0.19 -0.19 0.00 0.00 0.00 173.10 172.29 1um9 s TYR 233 N -0.52 1.66 -0.25 1.90 2.02 -0.09 -0.51 117.35 121.56 1um9 s TYR 233 Ca 0.08 -0.32 -0.05 0.00 -0.37 0.00 0.00 57.07 56.40 1um9 s TYR 233 Cb -0.10 -1.05 -0.00 0.00 -0.40 0.00 0.00 41.96 40.40 1um9 s TYR 233 CO -0.00 -0.01 0.01 -1.17 -1.57 0.00 0.00 175.55 172.81 1um9 s LEU 234 N -0.58 3.32 0.11 -1.29 2.96 -1.26 -0.65 118.68 121.29 1um9 s LEU 234 Ca 0.07 -0.51 0.07 0.00 -0.22 0.00 0.00 54.13 53.54 1um9 s LEU 234 Cb -0.07 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 1um9 s LEU 234 CO -0.00 -0.09 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.07 1um9 s VAL 235 N 1.49 1.54 -0.64 1.68 1.01 0.11 -0.42 120.40 125.18 1um9 s VAL 235 Ca 0.04 -1.61 -0.28 0.00 0.00 0.00 0.00 61.98 60.14 1um9 s VAL 235 Cb -0.16 -1.52 0.03 0.00 0.00 0.00 0.00 36.38 34.73 1um9 s VAL 235 CO -0.00 -0.22 1.27 -0.62 0.00 0.00 0.00 175.10 175.53 1um9 s ASP 236 N -2.14 6.28 0.00 3.32 -1.08 -0.11 -1.62 116.67 121.32 1um9 s ASP 236 Ca 0.07 -0.08 0.14 0.00 -0.52 0.00 0.00 52.55 52.16 1um9 s ASP 236 Cb -0.08 -2.55 0.66 0.00 -1.46 0.00 0.00 42.92 39.48 1um9 s ASP 236 CO 0.04 -1.66 1.39 0.61 0.52 0.00 0.00 175.17 176.07 1um9 n GLY 237 N 5.22 -0.82 0.79 2.66 0.00 0.17 -1.82 105.19 111.39 1um9 n GLY 237 Ca 0.07 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.16 1um9 n GLY 237 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1um9 n MET 238 N -1.36 2.09 -3.62 1.61 2.81 -1.22 -3.06 117.12 114.38 1um9 n MET 238 Ca 0.05 -1.59 -0.40 0.00 -1.81 0.00 0.00 57.70 53.95 1um9 n MET 238 Cb 0.13 -1.47 -0.10 0.00 -0.71 0.00 0.00 33.22 31.07 1um9 n MET 238 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1um9 s ASP 239 N -1.96 5.59 0.42 7.83 -1.08 -0.76 -4.33 116.67 122.38 1um9 s ASP 239 Ca 0.32 -1.79 0.08 0.00 -0.52 0.00 0.00 52.55 50.65 1um9 s ASP 239 Cb 0.20 -1.97 0.91 0.00 -1.46 0.00 0.00 42.92 40.60 1um9 s ASP 239 CO 0.31 -0.61 2.07 1.62 0.52 0.00 0.00 175.17 179.08 1um9 h VAL 240 N 6.16 1.09 -0.11 1.11 3.04 -1.83 -1.08 116.25 124.62 1um9 h VAL 240 Ca -0.20 -0.17 -0.17 0.00 -1.01 0.00 0.00 66.70 65.14 1um9 h VAL 240 Cb 1.07 0.55 0.01 0.00 -2.01 0.00 0.00 31.29 30.91 1um9 h VAL 240 CO 0.79 0.09 -0.61 -0.07 -1.01 0.00 0.00 177.57 176.77 1um9 h LEU 241 N 0.50 0.73 -0.50 3.16 3.38 -1.93 -0.95 115.31 119.69 1um9 h LEU 241 Ca 0.14 -0.65 -0.05 0.00 0.09 0.00 0.00 57.88 57.41 1um9 h LEU 241 Cb -0.04 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1um9 h LEU 241 CO -0.03 1.25 0.12 0.00 0.09 0.00 0.00 178.44 179.88 1um9 h ALA 242 N 0.49 0.66 -0.45 1.53 0.00 -1.80 -0.37 119.26 119.32 1um9 h ALA 242 Ca -0.04 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1um9 h ALA 242 Cb 1.25 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1um9 h ALA 242 CO 0.12 0.35 0.18 0.77 0.00 0.00 0.00 179.25 180.68 1um9 h SER 243 N 0.68 0.62 0.06 0.00 0.02 -1.22 -1.69 113.55 112.02 1um9 h SER 243 Ca 0.16 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1um9 h SER 243 Cb 0.33 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.71 1um9 h SER 243 CO 0.00 0.61 -0.03 0.22 -1.14 0.00 0.00 176.83 176.49 1um9 h TYR 244 N 0.58 -0.08 -0.60 3.45 3.20 -0.99 -1.69 116.97 120.85 1um9 h TYR 244 Ca 0.15 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 1um9 h TYR 244 Cb 0.18 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 1um9 h TYR 244 CO 0.00 0.10 0.21 1.88 -1.64 0.00 0.00 178.16 178.71 1um9 h TYR 245 N -0.25 0.94 -0.05 -3.82 0.05 -1.02 0.36 116.97 113.19 1um9 h TYR 245 Ca -0.01 -0.09 -0.02 0.00 0.05 0.00 0.00 58.73 58.66 1um9 h TYR 245 Cb 0.21 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 37.68 1um9 h TYR 245 CO -0.02 0.77 -0.06 0.28 -1.05 0.00 0.00 178.16 178.08 1um9 h VAL 246 N 0.84 1.39 -0.86 -2.88 2.07 -1.34 -1.31 116.25 114.16 1um9 h VAL 246 Ca 0.20 -1.26 0.03 0.00 0.82 0.00 0.00 66.70 66.49 1um9 h VAL 246 Cb 0.26 2.13 -0.05 0.00 -1.52 0.00 0.00 31.29 32.10 1um9 h VAL 246 CO -0.01 0.34 0.56 0.58 0.02 0.00 0.00 177.57 179.06 1um9 h VAL 247 N -0.34 1.15 -0.62 2.57 2.07 -1.31 -1.08 116.25 118.69 1um9 h VAL 247 Ca 0.01 -0.37 0.04 0.00 0.82 0.00 0.00 66.70 67.19 1um9 h VAL 247 Cb 0.58 -0.04 -0.05 0.00 -1.52 0.00 0.00 31.29 30.27 1um9 h VAL 247 CO 0.01 0.20 0.36 0.50 0.02 0.00 0.00 177.57 178.66 1um9 h LYS 248 N 1.09 0.67 -0.56 1.57 1.63 -0.86 0.15 116.57 120.26 1um9 h LYS 248 Ca 0.34 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 60.07 1um9 h LYS 248 Cb -0.01 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.45 1um9 h LYS 248 CO -0.11 0.44 0.25 1.49 -3.45 0.00 0.00 179.45 178.07 1um9 h GLU 249 N 0.69 0.82 -0.55 1.90 4.81 -0.40 -0.44 114.58 121.42 1um9 h GLU 249 Ca 0.26 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1um9 h GLU 249 Cb 0.10 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1um9 h GLU 249 CO -0.14 0.69 0.30 0.00 -0.73 0.00 0.00 179.01 179.13 1um9 h ALA 250 N 1.09 0.70 -0.59 2.92 0.00 -0.52 -0.85 119.26 122.01 1um9 h ALA 250 Ca 0.19 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1um9 h ALA 250 Cb 0.15 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1um9 h ALA 250 CO -0.02 0.23 0.35 0.28 0.00 0.00 0.00 179.25 180.08 1um9 h VAL 251 N 0.73 1.18 -0.61 0.00 2.07 -0.34 -1.17 116.25 118.11 1um9 h VAL 251 Ca 0.19 -0.42 -0.08 0.00 0.82 0.00 0.00 66.70 67.22 1um9 h VAL 251 Cb 0.06 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1um9 h VAL 251 CO -0.03 0.19 0.07 -0.33 0.02 0.00 0.00 177.57 177.49 1um9 h GLU 252 N 0.79 1.01 -0.49 1.57 5.08 -0.80 0.58 114.58 122.33 1um9 h GLU 252 Ca 0.21 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1um9 h GLU 252 Cb -0.00 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1um9 h GLU 252 CO -0.04 0.95 0.25 -0.09 -1.00 0.00 0.00 179.01 179.08 1um9 h ARG 253 N 0.94 0.69 -0.46 2.33 2.43 -0.78 -1.67 114.38 117.86 1um9 h ARG 253 Ca 0.18 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.18 1um9 h ARG 253 Cb 0.45 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1um9 h ARG 253 CO 0.02 0.56 -0.03 0.00 -1.51 0.00 0.00 179.97 179.00 1um9 h ALA 254 N 1.09 0.62 0.00 2.80 0.00 -0.88 -0.70 119.26 122.20 1um9 h ALA 254 Ca 0.17 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1um9 h ALA 254 Cb 0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1um9 h ALA 254 CO -0.02 0.45 -0.20 -0.09 0.00 0.00 0.00 179.25 179.39 1um9 h ARG 255 N 0.68 0.00 -0.48 0.00 2.43 -0.62 -1.22 114.38 115.17 1um9 h ARG 255 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1um9 h ARG 255 Cb 0.54 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1um9 h ARG 255 CO 0.03 0.20 0.00 2.89 -1.51 0.00 0.00 179.97 181.58 1um9 n ARG 256 N -4.20 2.06 -1.05 0.20 1.85 -0.65 -4.89 116.66 109.99 1um9 n ARG 256 Ca -0.02 -1.25 -0.02 0.00 -1.00 0.00 0.00 57.85 55.56 1um9 n ARG 256 Cb 0.26 -1.43 -0.01 0.00 -1.05 0.00 0.00 32.46 30.23 1um9 n ARG 256 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1um9 n GLY 257 N 0.80 0.52 0.51 2.89 0.00 -0.46 -4.94 105.19 104.51 1um9 n GLY 257 Ca 0.11 -0.77 0.06 0.00 0.00 0.00 0.00 46.02 45.43 1um9 n GLY 257 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1um9 n GLU 258 N -2.87 1.65 0.00 1.61 1.02 -0.28 -5.00 120.64 116.77 1um9 n GLU 258 Ca -0.02 -1.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.12 1um9 n GLU 258 Cb 0.06 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 1um9 n GLU 258 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1um9 n GLY 259 N 0.98 -0.05 3.90 0.62 0.00 -1.25 -4.88 105.19 104.51 1um9 n GLY 259 Ca 0.11 -1.90 -0.29 0.00 0.00 0.00 0.00 46.02 43.94 1um9 n GLY 259 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1um9 s PRO 260 N -1.25 2.13 0.09 1.61 0.04 -1.04 -3.71 135.00 132.87 1um9 s PRO 260 Ca 0.00 0.11 -0.04 0.00 0.04 0.00 0.00 61.00 61.11 1um9 s PRO 260 Cb 0.00 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.52 1um9 s PRO 260 CO 0.00 -1.46 0.08 -1.12 0.04 0.00 0.00 177.00 174.54 1um9 s SER 261 N -4.54 0.30 -0.18 6.66 0.01 -1.21 -4.28 113.70 110.46 1um9 s SER 261 Ca 0.61 -0.95 0.01 0.00 1.31 0.00 0.00 55.95 56.94 1um9 s SER 261 Cb -0.11 0.29 0.03 0.00 0.21 0.00 0.00 66.02 66.43 1um9 s SER 261 CO 0.49 -0.70 -0.17 -0.22 0.41 0.00 0.00 173.24 173.05 1um9 s LEU 262 N -2.94 2.19 -0.18 2.44 2.96 -0.52 -1.60 118.68 121.04 1um9 s LEU 262 Ca 0.12 -0.72 -0.01 0.00 -0.22 0.00 0.00 54.13 53.29 1um9 s LEU 262 Cb 0.06 -1.40 -0.00 0.00 0.50 0.00 0.00 46.19 45.35 1um9 s LEU 262 CO -0.06 -0.05 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.11 1um9 s VAL 263 N 1.32 2.88 -0.32 1.68 1.01 0.40 -0.91 120.40 126.47 1um9 s VAL 263 Ca 0.03 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.22 1um9 s VAL 263 Cb -0.14 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 1um9 s VAL 263 CO -0.11 0.49 0.20 -0.70 0.00 0.00 0.00 175.10 174.97 1um9 s GLU 264 N 1.06 3.42 -0.48 2.72 2.12 0.18 -0.23 118.70 127.49 1um9 s GLU 264 Ca -0.00 -0.68 -0.11 0.00 0.36 0.00 0.00 54.97 54.53 1um9 s GLU 264 Cb -0.15 -3.68 0.11 0.00 0.26 0.00 0.00 34.13 30.67 1um9 s GLU 264 CO -0.03 -0.43 0.37 -0.51 -0.54 0.00 0.00 175.26 174.13 1um9 s LEU 265 N 1.67 5.71 -0.11 2.70 1.43 0.90 -0.71 118.68 130.27 1um9 s LEU 265 Ca 0.05 -1.75 -0.30 0.00 -1.03 0.00 0.00 54.13 51.10 1um9 s LEU 265 Cb -0.17 -2.07 -0.03 0.00 0.03 0.00 0.00 46.19 43.95 1um9 s LEU 265 CO 0.08 -0.70 1.30 -0.13 0.23 0.00 0.00 176.35 177.13 1um9 s ARG 266 N 1.46 4.26 0.33 1.70 1.81 -0.64 -1.60 118.95 126.26 1um9 s ARG 266 Ca 0.04 1.75 0.03 0.00 -1.72 0.00 0.00 55.73 55.83 1um9 s ARG 266 Cb -0.26 -3.72 -0.05 0.00 -0.45 0.00 0.00 34.95 30.47 1um9 s ARG 266 CO 0.01 -0.65 0.10 0.14 -0.68 0.00 0.00 175.30 174.22 1um9 s VAL 267 N 3.17 0.79 -0.25 3.52 -7.23 0.15 0.46 120.40 121.00 1um9 s VAL 267 Ca 0.58 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.74 1um9 s VAL 267 Cb -0.24 -2.61 0.08 0.00 0.56 0.00 0.00 36.38 34.16 1um9 s VAL 267 CO 0.19 0.00 0.03 -0.31 -0.31 0.00 0.00 175.10 174.70 1um9 s TYR 268 N -3.42 1.85 0.04 2.82 1.51 -1.26 0.20 117.35 119.09 1um9 s TYR 268 Ca 0.33 -1.56 -0.30 0.00 -1.01 0.00 0.00 57.07 54.53 1um9 s TYR 268 Cb 0.06 -1.55 -0.04 0.00 -0.11 0.00 0.00 41.96 40.32 1um9 s TYR 268 CO 0.15 -0.77 1.09 0.50 -1.11 0.00 0.00 175.55 175.41 1um9 s ARG 269 N 1.57 4.50 -0.02 -0.62 3.52 -1.26 -4.37 118.95 122.27 1um9 s ARG 269 Ca 0.02 1.60 -0.07 0.00 -0.13 0.00 0.00 55.73 57.15 1um9 s ARG 269 Cb -0.18 -3.40 -0.04 0.00 -1.56 0.00 0.00 34.95 29.78 1um9 s ARG 269 CO -0.13 -0.14 0.44 -0.92 -0.81 0.00 0.00 175.30 173.74 1um9 h TYR 270 N 6.72 -0.22 -2.44 5.12 3.20 -0.76 -3.48 116.97 125.11 1um9 h TYR 270 Ca -0.41 -0.01 -0.22 0.00 3.14 0.00 0.00 58.73 61.23 1um9 h TYR 270 Cb 1.22 0.07 0.11 0.00 1.54 0.00 0.00 36.73 39.68 1um9 h TYR 270 CO 0.67 -0.14 0.03 0.41 -1.64 0.00 0.00 178.16 177.49 1um9 n GLY 271 N 0.78 -2.93 3.81 1.82 0.00 -1.26 -5.03 105.19 102.38 1um9 n GLY 271 Ca -0.03 -1.42 -0.31 0.00 0.00 0.00 0.00 46.02 44.26 1um9 n GLY 271 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1um9 s PRO 272 N -4.35 2.73 0.37 1.61 0.04 -1.26 -4.93 135.00 129.20 1um9 s PRO 272 Ca 0.40 0.97 0.16 0.00 0.04 0.00 0.00 61.00 62.57 1um9 s PRO 272 Cb -0.05 -1.96 1.06 0.00 0.04 0.00 0.00 34.50 33.59 1um9 s PRO 272 CO 0.31 -1.25 1.72 1.25 0.04 0.00 0.00 177.00 179.07 1um9 h HIS 273 N -0.83 0.81 -2.07 0.56 -0.00 -1.96 -3.37 115.15 108.30 1um9 h HIS 273 Ca -0.44 0.03 0.19 0.00 -0.00 0.00 0.00 60.37 60.15 1um9 h HIS 273 Cb 1.22 -0.23 -0.12 0.00 -0.00 0.00 0.00 27.41 28.28 1um9 h HIS 273 CO 0.60 -0.00 0.59 -1.54 -0.00 0.00 0.00 177.93 177.57 1um9 s SER 274 N -5.10 -0.21 0.01 3.26 1.04 -1.26 -4.41 113.70 107.03 1um9 s SER 274 Ca -0.09 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.15 1um9 s SER 274 Cb 0.27 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.75 1um9 s SER 274 CO 0.80 -0.64 -0.02 -0.44 0.98 0.00 0.00 173.24 173.93 1um9 s SER 275 N -2.73 0.16 0.21 7.02 0.01 -0.28 -4.98 113.70 113.11 1um9 s SER 275 Ca 0.10 -0.14 0.09 0.00 1.31 0.00 0.00 55.95 57.30 1um9 s SER 275 Cb -0.00 0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.20 1um9 s SER 275 CO -0.03 -0.07 -0.04 0.00 0.41 0.00 0.00 173.24 173.52 1um9 s ALA 276 N -0.39 3.09 -1.78 1.44 0.00 -1.26 -1.70 121.76 121.15 1um9 s ALA 276 Ca -0.04 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 50.42 1um9 s ALA 276 Cb -0.03 -0.82 0.00 0.00 0.00 0.00 0.00 23.12 22.27 1um9 s ALA 276 CO -0.00 0.40 0.37 -0.25 0.00 0.00 0.00 175.76 176.28 1um9 n ASP 277 N -0.33 0.00 -1.46 0.00 10.43 -0.98 -4.94 116.55 119.27 1um9 n ASP 277 Ca -0.09 0.00 0.01 0.00 2.57 0.00 0.00 54.79 57.28 1um9 n ASP 277 Cb 0.57 0.00 0.08 0.00 1.84 0.00 0.00 41.12 43.61 1um9 n ASP 277 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 1um9 n ASP 278 N -0.87 1.70 0.00 -2.24 3.85 -1.26 -4.87 116.55 112.86 1um9 n ASP 278 Ca 0.00 -2.78 0.00 0.00 -0.71 0.00 0.00 54.79 51.30 1um9 n ASP 278 Cb 0.00 -0.40 0.00 0.00 -1.35 0.00 0.00 41.12 39.37 1um9 n ASP 278 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1um9 n ARG 292 N -0.29 0.00 -0.67 0.11 3.00 -1.26 -5.22 116.66 112.34 1um9 n ARG 292 Ca 0.14 0.00 0.08 0.00 -0.01 0.00 0.00 57.85 58.06 1um9 n ARG 292 Cb 0.94 0.00 0.35 0.00 0.00 0.00 0.00 32.46 33.75 1um9 n ARG 292 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 1um9 n LYS 293 N 0.00 3.99 0.00 5.56 -0.00 -1.26 -4.06 118.16 122.39 1um9 n LYS 293 Ca 0.00 -2.94 0.03 0.00 -0.00 0.00 0.00 58.31 55.40 1um9 n LYS 293 Cb 0.00 -1.99 -0.04 0.00 -0.00 0.00 0.00 35.03 33.01 1um9 n LYS 293 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1um9 n LYS 294 N 0.67 4.72 -1.71 -1.58 5.02 -1.26 -5.01 118.16 119.02 1um9 n LYS 294 Ca 0.25 -0.01 -0.57 0.00 -2.02 0.00 0.00 58.31 55.96 1um9 n LYS 294 Cb 0.98 -0.82 -0.07 0.00 -0.02 0.00 0.00 35.03 35.10 1um9 n LYS 294 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1um9 n ASP 295 N -1.14 2.44 0.21 4.39 -0.08 -1.26 -4.83 116.55 116.28 1um9 n ASP 295 Ca 0.01 1.07 0.12 0.00 -1.51 0.00 0.00 54.79 54.49 1um9 n ASP 295 Cb 0.11 -1.16 0.71 0.00 2.34 0.00 0.00 41.12 43.12 1um9 n ASP 295 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1um9 h PRO 296 N 7.26 0.00 0.60 -0.67 0.13 -1.89 -3.00 132.00 134.42 1um9 h PRO 296 Ca -0.47 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 1um9 h PRO 296 Cb 1.32 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.45 1um9 h PRO 296 CO 0.95 0.00 -0.29 0.82 -0.23 0.00 0.00 178.00 179.26 1um9 h ILE 297 N 0.00 0.00 -0.37 -3.56 2.04 -1.88 -1.63 117.51 112.11 1um9 h ILE 297 Ca 0.05 -0.35 0.06 0.00 1.00 0.00 0.00 64.86 65.63 1um9 h ILE 297 Cb 0.23 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 1um9 h ILE 297 CO -0.00 0.00 0.25 -0.65 0.00 0.00 0.00 178.15 177.75 1um9 h PRO 298 N -1.15 0.22 -0.64 2.37 0.11 -1.96 0.13 132.00 131.09 1um9 h PRO 298 Ca -0.08 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.97 1um9 h PRO 298 Cb 0.61 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.65 1um9 h PRO 298 CO 0.13 0.15 0.21 -0.09 -0.21 0.00 0.00 178.00 178.19 1um9 h ARG 299 N 0.23 0.99 0.01 1.05 2.43 -1.48 -1.03 114.38 116.58 1um9 h ARG 299 Ca 0.16 -0.21 -0.21 0.00 -0.81 0.00 0.00 59.98 58.92 1um9 h ARG 299 Cb 0.37 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1um9 h ARG 299 CO -0.03 0.86 -0.99 0.35 -1.51 0.00 0.00 179.97 178.65 1um9 h PHE 300 N 0.92 0.07 -0.60 2.20 3.57 -0.28 -2.99 116.94 119.83 1um9 h PHE 300 Ca 0.21 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.68 1um9 h PHE 300 Cb 0.28 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 1um9 h PHE 300 CO 0.02 1.00 0.37 -0.09 -2.23 0.00 0.00 178.31 177.39 1um9 h ARG 301 N 0.01 0.72 -0.55 1.11 2.43 -0.52 0.38 114.38 117.96 1um9 h ARG 301 Ca -0.03 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 1um9 h ARG 301 Cb 1.73 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 31.09 1um9 h ARG 301 CO 0.13 0.48 0.24 -0.09 -1.51 0.00 0.00 179.97 179.22 1um9 h ARG 302 N 0.74 0.79 -0.24 0.20 2.43 -1.17 0.12 114.38 117.25 1um9 h ARG 302 Ca 0.24 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1um9 h ARG 302 Cb 0.01 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1um9 h ARG 302 CO -0.09 0.64 -0.03 0.35 -1.51 0.00 0.00 179.97 179.32 1um9 h PHE 303 N 0.79 0.49 -0.31 2.20 3.04 -1.11 -2.45 116.94 119.58 1um9 h PHE 303 Ca 0.19 -0.10 -0.05 0.00 3.98 0.00 0.00 57.97 62.00 1um9 h PHE 303 Cb 0.13 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 38.50 1um9 h PHE 303 CO 0.01 0.65 0.01 -0.07 -2.02 0.00 0.00 178.31 176.89 1um9 h LEU 304 N 0.19 0.54 -0.65 0.59 3.38 -0.58 -3.15 115.31 115.62 1um9 h LEU 304 Ca 0.06 -0.30 0.06 0.00 0.09 0.00 0.00 57.88 57.80 1um9 h LEU 304 Cb 0.48 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.03 1um9 h LEU 304 CO 0.02 0.70 0.35 -0.08 0.09 0.00 0.00 178.44 179.52 1um9 h GLU 305 N 0.35 0.62 0.00 1.13 4.81 -0.75 0.58 114.58 121.31 1um9 h GLU 305 Ca 0.09 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1um9 h GLU 305 Cb 0.42 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.67 1um9 h GLU 305 CO 0.01 0.41 0.00 0.00 -0.73 0.00 0.00 179.01 178.70 1um9 h ALA 306 N 1.36 1.00 -0.35 2.92 0.00 -1.40 -1.36 119.26 121.43 1um9 h ALA 306 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1um9 h ALA 306 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1um9 h ALA 306 CO -0.20 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.59 1um9 n ARG 307 N -2.68 2.92 -1.28 0.00 1.74 -0.02 -4.96 116.66 112.39 1um9 n ARG 307 Ca -0.02 -2.28 -0.10 0.00 -0.77 0.00 0.00 57.85 54.69 1um9 n ARG 307 Cb 0.09 -1.43 -0.04 0.00 -1.02 0.00 0.00 32.46 30.06 1um9 n ARG 307 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1um9 n GLY 308 N 0.35 1.10 1.22 -0.13 0.00 -0.51 -4.88 105.19 102.34 1um9 n GLY 308 Ca 0.15 -0.47 0.12 0.00 0.00 0.00 0.00 46.02 45.82 1um9 n GLY 308 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1um9 n LEU 309 N -1.09 3.63 -3.83 0.99 4.77 -0.01 -4.93 117.00 116.53 1um9 n LEU 309 Ca -0.10 -1.65 -0.12 0.00 -0.03 0.00 0.00 56.01 54.11 1um9 n LEU 309 Cb 0.34 -0.32 -0.11 0.00 -2.33 0.00 0.00 43.42 41.00 1um9 n LEU 309 CO 0.15 0.82 -0.16 0.86 -1.33 0.00 0.00 177.39 177.73 1um9 s TRP 310 N -1.34 -0.11 0.05 -1.77 -0.00 -1.23 -4.81 118.94 109.72 1um9 s TRP 310 Ca 0.42 0.26 -0.15 0.00 -0.00 0.00 0.00 56.10 56.63 1um9 s TRP 310 Cb 0.24 0.03 0.02 0.00 -0.00 0.00 0.00 33.47 33.76 1um9 s TRP 310 CO 0.32 -0.18 0.33 0.54 -0.00 0.00 0.00 176.95 177.96 1um9 s ASN 311 N -0.51 -0.15 0.23 5.86 2.20 -1.26 -4.59 114.94 116.72 1um9 s ASN 311 Ca -0.06 -0.18 -0.06 0.00 -0.94 0.00 0.00 52.86 51.62 1um9 s ASN 311 Cb -0.04 0.38 0.38 0.00 -2.00 0.00 0.00 41.25 39.97 1um9 s ASN 311 CO 0.01 -0.64 1.75 -0.08 -2.94 0.00 0.00 177.10 175.19 1um9 h GLU 312 N 3.11 0.46 -0.49 3.55 4.22 -2.01 -2.20 114.58 121.23 1um9 h GLU 312 Ca -0.32 -0.03 -0.05 0.00 0.08 0.00 0.00 59.36 59.05 1um9 h GLU 312 Cb 1.20 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 1um9 h GLU 312 CO 0.46 0.31 0.12 1.49 -2.18 0.00 0.00 179.01 179.20 1um9 h GLU 313 N 0.48 0.74 -0.62 1.92 4.81 -2.00 -2.27 114.58 117.64 1um9 h GLU 313 Ca 0.37 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.37 1um9 h GLU 313 Cb 0.50 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1um9 h GLU 313 CO -0.35 0.67 0.04 2.35 -0.73 0.00 0.00 179.01 181.00 1um9 h TRP 314 N 0.72 1.14 -0.33 0.92 7.01 -1.82 -2.60 115.95 120.99 1um9 h TRP 314 Ca 0.16 -0.18 -0.12 0.00 2.11 0.00 0.00 58.89 60.86 1um9 h TRP 314 Cb 0.27 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 27.01 1um9 h TRP 314 CO 0.01 0.99 -0.29 1.49 -2.79 0.00 0.00 178.44 177.85 1um9 h GLU 315 N 0.98 0.68 -0.33 2.65 4.81 -1.24 -0.98 114.58 121.16 1um9 h GLU 315 Ca 0.18 -0.30 0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1um9 h GLU 315 Cb 0.51 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 1um9 h GLU 315 CO 0.02 0.89 0.19 0.93 -0.73 0.00 0.00 179.01 180.32 1um9 h GLU 316 N 0.58 0.38 -0.08 1.92 5.08 -1.24 -0.83 114.58 120.39 1um9 h GLU 316 Ca 0.07 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1um9 h GLU 316 Cb 0.79 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 1um9 h GLU 316 CO 0.06 0.25 0.04 -0.44 -1.00 0.00 0.00 179.01 177.93 1um9 h ASP 317 N 0.39 0.10 -0.39 1.42 3.32 -1.28 -1.56 116.42 118.42 1um9 h ASP 317 Ca 0.13 -0.10 0.06 0.00 0.02 0.00 0.00 57.03 57.14 1um9 h ASP 317 Cb 0.00 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.48 1um9 h ASP 317 CO -0.06 0.17 0.09 0.58 -1.72 0.00 0.00 179.24 178.30 1um9 h VAL 318 N 0.02 0.81 -0.92 -1.35 2.07 -0.97 0.99 116.25 116.90 1um9 h VAL 318 Ca 0.03 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1um9 h VAL 318 Cb 0.09 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 1um9 h VAL 318 CO -0.00 0.04 0.58 0.03 0.02 0.00 0.00 177.57 178.23 1um9 h ARG 319 N 0.22 1.23 -0.46 1.57 3.08 -1.00 -0.29 114.38 118.73 1um9 h ARG 319 Ca 0.19 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 60.06 1um9 h ARG 319 Cb 0.21 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1um9 h ARG 319 CO -0.24 0.84 -0.03 0.93 -1.07 0.00 0.00 179.97 180.41 1um9 h GLU 320 N 1.26 0.84 -0.04 0.04 5.08 -0.41 -0.22 114.58 121.12 1um9 h GLU 320 Ca 0.33 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1um9 h GLU 320 Cb -0.09 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.09 1um9 h GLU 320 CO -0.07 0.90 0.02 0.93 -1.00 0.00 0.00 179.01 179.80 1um9 h GLU 321 N 0.68 0.05 -0.45 2.33 5.08 -0.35 -1.67 114.58 120.25 1um9 h GLU 321 Ca 0.13 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1um9 h GLU 321 Cb 0.54 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 1um9 h GLU 321 CO 0.03 0.06 0.27 0.82 -1.00 0.00 0.00 179.01 179.18 1um9 h ILE 322 N 0.03 1.05 -0.77 3.13 2.04 -0.94 0.17 117.51 122.22 1um9 h ILE 322 Ca 0.01 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.72 1um9 h ILE 322 Cb 0.02 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 36.52 1um9 h ILE 322 CO -0.00 0.10 0.51 -0.09 0.00 0.00 0.00 178.15 178.67 1um9 h ARG 323 N 0.54 0.93 -0.35 2.37 2.43 -0.85 0.13 114.38 119.58 1um9 h ARG 323 Ca 0.18 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 59.16 1um9 h ARG 323 Cb 0.01 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.34 1um9 h ARG 323 CO -0.08 0.61 -0.31 0.00 -1.51 0.00 0.00 179.97 178.68 1um9 h ALA 324 N 1.55 0.79 -0.46 2.80 0.00 -0.45 -2.25 119.26 121.23 1um9 h ALA 324 Ca 0.31 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1um9 h ALA 324 Cb 0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1um9 h ALA 324 CO -0.09 0.65 0.03 0.93 0.00 0.00 0.00 179.25 180.78 1um9 h GLU 325 N 0.64 0.79 0.26 0.00 5.08 0.36 -2.34 114.58 119.38 1um9 h GLU 325 Ca 0.07 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1um9 h GLU 325 Cb 0.84 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1um9 h GLU 325 CO 0.07 0.83 -0.12 -0.07 -1.00 0.00 0.00 179.01 178.71 1um9 h LEU 326 N 0.64 -0.30 -1.41 1.33 3.38 -0.67 0.39 115.31 118.68 1um9 h LEU 326 Ca 0.13 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1um9 h LEU 326 Cb 0.45 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1um9 h LEU 326 CO 0.02 -0.19 0.13 -0.33 0.09 0.00 0.00 178.44 178.15 1um9 h GLU 327 N -0.37 0.52 -0.25 1.13 4.39 -1.42 0.26 114.58 118.83 1um9 h GLU 327 Ca -0.04 -0.07 -0.13 0.00 0.34 0.00 0.00 59.36 59.46 1um9 h GLU 327 Cb 0.28 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1um9 h GLU 327 CO 0.06 0.45 -0.35 -0.09 -1.16 0.00 0.00 179.01 177.92 1um9 h ARG 328 N 0.52 0.68 -0.69 2.33 2.43 -1.21 -1.06 114.38 117.38 1um9 h ARG 328 Ca 0.13 -0.40 -0.08 0.00 -0.81 0.00 0.00 59.98 58.82 1um9 h ARG 328 Cb 0.14 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 1um9 h ARG 328 CO -0.01 1.01 0.13 0.78 -1.51 0.00 0.00 179.97 180.37 1um9 h GLY 329 N 0.40 1.22 0.94 2.80 0.00 -0.34 -1.71 103.07 106.38 1um9 h GLY 329 Ca 0.03 -0.80 -0.05 0.00 0.00 0.00 0.00 47.33 46.51 1um9 h GLY 329 CO 0.08 0.74 0.06 -2.00 0.00 0.00 0.00 176.54 175.42 1um9 h LEU 330 N 1.06 0.64 -0.28 3.11 5.85 -0.91 -1.34 115.31 123.45 1um9 h LEU 330 Ca 0.21 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.69 1um9 h LEU 330 Cb 0.42 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1um9 h LEU 330 CO 0.01 0.75 0.12 0.50 -0.34 0.00 0.00 178.44 179.48 1um9 h LYS 331 N 0.52 0.26 -0.45 1.25 3.64 -0.99 -0.52 116.57 120.28 1um9 h LYS 331 Ca 0.12 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.42 1um9 h LYS 331 Cb 0.39 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1um9 h LYS 331 CO 0.01 0.17 0.02 0.93 -2.27 0.00 0.00 179.45 178.31 1um9 h GLU 332 N 0.27 0.73 -0.51 1.90 5.08 -1.20 -1.28 114.58 119.56 1um9 h GLU 332 Ca 0.12 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 1um9 h GLU 332 Cb 0.06 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1um9 h GLU 332 CO -0.10 0.73 0.10 0.00 -1.00 0.00 0.00 179.01 178.75 1um9 h ALA 333 N 1.33 0.67 -0.16 3.43 0.00 -0.60 -2.78 119.26 121.15 1um9 h ALA 333 Ca 0.14 -0.22 -0.21 0.00 0.00 0.00 0.00 54.91 54.61 1um9 h ALA 333 Cb 0.40 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.01 1um9 h ALA 333 CO 0.01 0.38 -0.74 0.93 0.00 0.00 0.00 179.25 179.84 1um9 h GLU 334 N 0.71 0.74 0.00 0.00 5.08 -0.91 -3.11 114.58 117.09 1um9 h GLU 334 Ca 0.16 -0.58 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1um9 h GLU 334 Cb 0.36 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1um9 h GLU 334 CO 0.01 1.20 0.00 0.39 -1.00 0.00 0.00 179.01 179.60 1um9 n GLU 335 N -3.93 0.05 0.26 2.33 1.02 -0.50 -2.21 120.64 117.66 1um9 n GLU 335 Ca -0.06 0.28 0.14 0.00 -0.02 0.00 0.00 57.16 57.49 1um9 n GLU 335 Cb 0.72 -1.59 0.67 0.00 -0.02 0.00 0.00 31.44 31.23 1um9 n GLU 335 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1um9 h ALA 336 N 2.47 1.07 0.00 0.62 0.00 -1.42 -3.49 119.26 118.52 1um9 h ALA 336 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1um9 h ALA 336 Cb 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1um9 h ALA 336 CO 0.00 0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.79 1um9 n GLY 337 N -0.21 -1.44 3.76 0.00 0.00 -0.94 -4.40 105.19 101.96 1um9 n GLY 337 Ca -0.00 -1.56 -0.36 0.00 0.00 0.00 0.00 46.02 44.09 1um9 n GLY 337 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1um9 s PRO 338 N -2.97 3.15 0.22 1.61 0.02 -1.26 -0.40 135.00 135.37 1um9 s PRO 338 Ca 0.00 1.86 -0.30 0.00 0.02 0.00 0.00 61.00 62.58 1um9 s PRO 338 Cb 0.00 -2.06 -0.09 0.00 0.02 0.00 0.00 34.50 32.38 1um9 s PRO 338 CO 0.00 -1.07 1.09 0.14 -0.33 0.00 0.00 177.00 176.83 1um9 s VAL 339 N -1.55 3.70 0.59 3.83 -7.23 -1.26 -4.59 120.40 113.90 1um9 s VAL 339 Ca 0.74 1.58 -0.20 0.00 -1.81 0.00 0.00 61.98 62.29 1um9 s VAL 339 Cb -0.31 -4.01 -0.03 0.00 0.56 0.00 0.00 36.38 32.59 1um9 s VAL 339 CO 0.35 0.32 1.34 -2.84 -0.31 0.00 0.00 175.10 173.96 1um9 s PRO 340 N -0.86 2.87 0.33 4.82 0.02 -1.26 -4.92 135.00 136.01 1um9 s PRO 340 Ca 0.47 2.18 0.01 0.00 0.02 0.00 0.00 61.00 63.68 1um9 s PRO 340 Cb -0.30 -2.08 0.56 0.00 0.02 0.00 0.00 34.50 32.70 1um9 s PRO 340 CO 0.37 -1.38 1.95 -1.35 -0.33 0.00 0.00 177.00 176.26 1um9 h PRO 341 N 1.06 0.82 0.00 5.54 0.11 -2.03 -2.64 132.00 134.86 1um9 h PRO 341 Ca -0.51 -0.09 -0.01 0.00 0.11 0.00 0.00 66.00 65.50 1um9 h PRO 341 Cb 1.32 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1um9 h PRO 341 CO 0.55 0.61 -0.06 0.93 -0.21 0.00 0.00 178.00 179.83 1um9 h GLU 342 N 0.83 0.00 0.00 1.05 3.07 -1.99 -2.26 114.58 115.29 1um9 h GLU 342 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1um9 h GLU 342 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1um9 h GLU 342 CO -0.03 0.06 0.09 -1.49 -1.40 0.00 0.00 179.01 176.24 1um9 h TRP 343 N 0.00 0.00 0.00 4.33 4.06 -1.84 -0.54 115.95 121.96 1um9 h TRP 343 Ca -0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 1um9 h TRP 343 Cb 0.17 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.33 1um9 h TRP 343 CO 0.00 0.00 -0.05 1.98 -3.56 0.00 0.00 178.44 176.81 1um9 h MET 344 N 0.00 0.00 -0.02 0.49 1.85 -1.60 -2.13 114.93 113.53 1um9 h MET 344 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1um9 h MET 344 Cb 0.19 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.22 1um9 h MET 344 CO 0.00 0.05 -0.28 1.19 -0.40 0.00 0.00 176.91 177.46 1um9 n PHE 345 N -3.94 0.00 -3.37 1.39 3.72 -0.21 -4.94 117.46 110.11 1um9 n PHE 345 Ca -0.03 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.07 1um9 n PHE 345 Cb 0.13 -0.03 -0.05 0.00 -0.94 0.00 0.00 39.48 38.60 1um9 n PHE 345 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1um9 s GLU 346 N -2.33 3.74 0.00 -1.08 0.41 -0.80 -4.39 118.70 114.24 1um9 s GLU 346 Ca 0.24 0.19 0.00 0.00 -0.41 0.00 0.00 54.97 54.98 1um9 s GLU 346 Cb 0.19 -2.64 0.00 0.00 -1.78 0.00 0.00 34.13 29.90 1um9 s GLU 346 CO 0.48 0.27 0.00 -0.25 -0.49 0.00 0.00 175.26 175.27 1um9 n ASP 347 N -0.43 -3.85 -0.13 -0.19 8.00 -1.26 -4.86 116.55 113.82 1um9 n ASP 347 Ca -0.00 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.38 1um9 n ASP 347 Cb 0.53 -1.77 -0.02 0.00 -0.02 0.00 0.00 41.12 39.84 1um9 n ASP 347 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1um9 h VAL 348 N 0.00 1.28 -3.94 2.53 2.07 -1.92 -3.45 116.25 112.81 1um9 h VAL 348 Ca 0.00 -1.42 -0.31 0.00 0.82 0.00 0.00 66.70 65.79 1um9 h VAL 348 Cb 0.40 1.29 -0.15 0.00 -1.52 0.00 0.00 31.29 31.31 1um9 h VAL 348 CO 0.00 0.48 -0.63 -0.36 0.02 0.00 0.00 177.57 177.08 1um9 s PHE 349 N -4.56 1.38 0.24 1.57 0.08 -1.26 -5.05 117.98 110.39 1um9 s PHE 349 Ca -0.12 -1.19 -0.04 0.00 0.12 0.00 0.00 56.93 55.70 1um9 s PHE 349 Cb 0.11 -0.78 0.40 0.00 -0.57 0.00 0.00 43.02 42.18 1um9 s PHE 349 CO 0.86 -0.37 1.80 0.00 -0.10 0.00 0.00 175.22 177.41 1um9 h ALA 350 N 2.50 1.16 -3.52 5.36 0.00 -2.01 -3.42 119.26 119.33 1um9 h ALA 350 Ca -0.37 0.04 -0.45 0.00 0.00 0.00 0.00 54.91 54.12 1um9 h ALA 350 Cb 1.24 -0.11 -0.22 0.00 0.00 0.00 0.00 17.79 18.70 1um9 h ALA 350 CO 0.60 0.06 -0.79 -1.21 0.00 0.00 0.00 179.25 177.90 1um9 s GLU 351 N -6.03 0.92 -0.02 0.00 0.41 -1.26 -4.83 118.70 107.88 1um9 s GLU 351 Ca -0.12 -0.99 -0.30 0.00 -0.41 0.00 0.00 54.97 53.15 1um9 s GLU 351 Cb 0.19 -0.99 -0.04 0.00 -1.78 0.00 0.00 34.13 31.52 1um9 s GLU 351 CO 0.78 0.23 1.13 0.15 -0.49 0.00 0.00 175.26 177.05 1um9 s LYS 352 N -1.71 4.43 0.91 1.61 1.02 -1.26 -4.98 119.74 119.76 1um9 s LYS 352 Ca 0.01 1.61 -0.14 0.00 0.02 0.00 0.00 55.97 57.46 1um9 s LYS 352 Cb -0.10 -3.48 0.15 0.00 -0.52 0.00 0.00 37.83 33.88 1um9 s LYS 352 CO 0.03 -0.30 1.22 -2.14 -0.92 0.00 0.00 175.35 173.24 1um9 s PRO 353 N 1.63 1.09 0.24 -1.68 0.02 -1.26 -4.79 135.00 130.25 1um9 s PRO 353 Ca 0.55 -0.07 -0.05 0.00 0.02 0.00 0.00 61.00 61.44 1um9 s PRO 353 Cb -0.24 -1.87 0.41 0.00 0.02 0.00 0.00 34.50 32.82 1um9 s PRO 353 CO 0.25 -2.16 1.75 0.11 -0.33 0.00 0.00 177.00 176.61 1um9 h TRP 354 N -1.47 0.55 0.00 6.54 5.08 -1.99 -2.05 115.95 122.62 1um9 h TRP 354 Ca -0.46 0.03 -0.05 0.00 1.08 0.00 0.00 58.89 59.49 1um9 h TRP 354 Cb 1.29 -0.14 -0.01 0.00 -3.00 0.00 0.00 29.16 27.31 1um9 h TRP 354 CO -0.42 0.12 -0.25 1.12 -1.28 0.00 0.00 178.44 177.73 1um9 h HIS 355 N 0.50 0.00 0.10 0.12 2.07 -1.99 0.55 115.15 116.51 1um9 h HIS 355 Ca 0.39 0.00 -0.27 0.00 -2.85 0.00 0.00 60.37 57.64 1um9 h HIS 355 Cb 0.53 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.52 1um9 h HIS 355 CO -0.14 0.25 -1.18 -0.07 -3.07 0.00 0.00 177.93 173.72 1um9 h LEU 356 N 0.00 0.55 -0.82 6.12 3.38 -1.76 -1.38 115.31 121.40 1um9 h LEU 356 Ca -0.00 -0.54 -0.06 0.00 0.09 0.00 0.00 57.88 57.37 1um9 h LEU 356 Cb 0.45 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1um9 h LEU 356 CO 0.03 1.38 0.18 -0.07 0.09 0.00 0.00 178.44 180.05 1um9 h LEU 357 N 0.15 0.99 0.04 1.67 3.38 -0.96 0.15 115.31 120.74 1um9 h LEU 357 Ca -0.14 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.63 1um9 h LEU 357 Cb 1.87 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.36 1um9 h LEU 357 CO 0.20 0.95 -0.02 -0.09 0.09 0.00 0.00 178.44 179.57 1um9 h ARG 358 N 1.01 -0.05 -0.66 1.13 2.43 -0.86 -1.51 114.38 115.87 1um9 h ARG 358 Ca 0.22 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 1um9 h ARG 358 Cb 0.34 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 1um9 h ARG 358 CO -0.00 0.22 0.39 1.96 -1.51 0.00 0.00 179.97 181.03 1um9 h GLN 359 N -0.32 0.89 -0.29 0.20 4.20 -1.02 -0.34 115.11 118.43 1um9 h GLN 359 Ca -0.01 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.57 1um9 h GLN 359 Cb 0.30 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1um9 h GLN 359 CO 0.01 0.64 -0.03 1.49 -0.67 0.00 0.00 178.83 180.27 1um9 h GLU 360 N 0.91 0.53 -0.66 1.46 4.81 -0.62 -1.60 114.58 119.42 1um9 h GLU 360 Ca 0.24 -0.19 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1um9 h GLU 360 Cb -0.02 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.28 1um9 h GLU 360 CO -0.04 0.71 0.41 0.00 -0.73 0.00 0.00 179.01 179.35 1um9 h ALA 361 N 0.81 0.86 -0.59 2.92 0.00 -0.76 -0.88 119.26 121.61 1um9 h ALA 361 Ca 0.08 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1um9 h ALA 361 Cb 0.48 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1um9 h ALA 361 CO 0.02 0.17 0.35 1.25 0.00 0.00 0.00 179.25 181.04 1um9 h LEU 362 N 0.81 0.56 -0.72 0.00 5.85 -0.87 -2.42 115.31 118.51 1um9 h LEU 362 Ca 0.26 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.89 1um9 h LEU 362 Cb 0.01 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1um9 h LEU 362 CO -0.10 0.39 -0.15 0.25 -0.34 0.00 0.00 178.44 178.48 1um9 h LEU 363 N 0.69 0.82 -1.47 2.25 5.85 -0.75 -2.88 115.31 119.81 1um9 h LEU 363 Ca 0.24 -0.27 0.07 0.00 0.84 0.00 0.00 57.88 58.77 1um9 h LEU 363 Cb 0.05 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 1um9 h LEU 363 CO -0.11 0.97 0.44 0.50 -0.34 0.00 0.00 178.44 179.90 1um9 h LYS 364 N 0.73 0.61 0.00 1.25 3.64 -0.69 0.19 116.57 122.30 1um9 h LYS 364 Ca 0.11 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1um9 h LYS 364 Cb 0.66 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 1um9 h LYS 364 CO 0.05 0.40 0.00 0.39 -2.27 0.00 0.00 179.45 178.02 1um9 n GLU 365 N -4.48 0.40 -0.00 1.90 1.02 -1.07 -1.92 120.64 116.49 1um9 n GLU 365 Ca 0.10 0.02 0.03 0.00 -0.02 0.00 0.00 57.16 57.29 1um9 n GLU 365 Cb 0.27 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.14 1um9 n GLU 365 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1um9 n GLU 366 N -1.04 0.61 0.00 3.49 2.13 0.63 -5.13 120.64 121.33 1um9 n GLU 366 Ca 0.10 -0.05 0.12 0.00 0.66 0.00 0.00 57.16 57.98 1um9 n GLU 366 Cb 0.06 -1.12 0.70 0.00 0.27 0.00 0.00 31.44 31.35 1um9 n GLU 366 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00