#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iag s THR 24 N 0.00 2.03 0.06 5.15 2.01 -1.26 -5.06 115.64 118.57 2iag s THR 24 Ca 0.00 -1.07 -0.31 0.00 0.31 0.00 0.00 61.69 60.63 2iag s THR 24 Cb 0.00 -1.71 -0.07 0.00 0.01 0.00 0.00 72.50 70.73 2iag s THR 24 CO 0.00 0.57 1.48 -0.60 -0.69 0.00 0.00 174.62 175.38 2iag s ARG 25 N -0.29 4.26 0.55 4.92 3.52 -1.26 -5.03 118.95 125.63 2iag s ARG 25 Ca 0.00 2.12 -0.03 0.00 -0.13 0.00 0.00 55.73 57.69 2iag s ARG 25 Cb -0.13 -3.47 0.01 0.00 -1.56 0.00 0.00 34.95 29.81 2iag s ARG 25 CO 0.02 -0.59 0.82 1.03 -0.81 0.00 0.00 175.30 175.77 2iag s ARG 26 N 2.04 2.87 0.34 5.12 0.52 -1.26 -5.03 118.95 123.56 2iag s ARG 26 Ca 0.67 -0.27 -0.29 0.00 -0.52 0.00 0.00 55.73 55.32 2iag s ARG 26 Cb -0.36 -2.39 -0.11 0.00 0.52 0.00 0.00 34.95 32.62 2iag s ARG 26 CO 0.29 -0.59 1.42 -2.14 0.02 0.00 0.00 175.30 174.30 2iag s PRO 27 N -4.84 4.22 0.00 3.54 0.02 -1.26 -2.76 135.00 133.92 2iag s PRO 27 Ca 0.53 2.41 0.00 0.00 0.02 0.00 0.00 61.00 63.96 2iag s PRO 27 Cb -0.10 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.39 2iag s PRO 27 CO 0.42 -0.40 0.00 0.41 -0.33 0.00 0.00 177.00 177.10 2iag n GLY 28 N 0.89 1.52 3.85 0.52 0.00 -1.26 -4.90 105.19 105.81 2iag n GLY 28 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2iag n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2iag s GLU 29 N -0.63 3.95 1.00 1.61 2.02 -1.11 -1.31 118.70 124.22 2iag s GLU 29 Ca 0.00 0.73 -0.11 0.00 0.02 0.00 0.00 54.97 55.61 2iag s GLU 29 Cb 0.00 -2.32 0.19 0.00 0.10 0.00 0.00 34.13 32.11 2iag s GLU 29 CO 0.00 -0.03 1.10 -2.30 0.02 0.00 0.00 175.26 174.05 2iag n PRO 30 N -0.99 -1.07 -1.56 0.39 -0.02 -1.26 -4.89 135.00 125.61 2iag n PRO 30 Ca 0.04 -0.26 -0.44 0.00 -2.02 0.00 0.00 63.50 60.83 2iag n PRO 30 Cb 0.54 -2.31 -0.01 0.00 -0.02 0.00 0.00 33.50 31.70 2iag n PRO 30 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2iag n PRO 31 N -4.45 1.14 -4.57 0.52 -0.02 -1.26 -4.65 135.00 121.71 2iag n PRO 31 Ca 0.09 0.40 -0.30 0.00 -2.02 0.00 0.00 63.50 61.67 2iag n PRO 31 Cb 0.53 -1.76 -0.17 0.00 -0.02 0.00 0.00 33.50 32.08 2iag n PRO 31 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2iag s LEU 32 N 0.66 1.91 -0.24 2.45 2.96 -1.26 -0.01 118.68 125.15 2iag s LEU 32 Ca 0.60 -0.51 0.00 0.00 -0.22 0.00 0.00 54.13 54.00 2iag s LEU 32 Cb -0.68 -1.26 0.07 0.00 0.50 0.00 0.00 46.19 44.81 2iag s LEU 32 CO 0.59 0.05 -0.02 -0.62 -1.32 0.00 0.00 176.35 175.03 2iag s ASP 33 N 0.89 3.75 0.08 3.68 -1.08 0.21 -4.98 116.67 119.23 2iag s ASP 33 Ca -0.07 -1.22 0.24 0.00 -0.52 0.00 0.00 52.55 50.99 2iag s ASP 33 Cb -0.15 -1.07 0.36 0.00 -1.46 0.00 0.00 42.92 40.60 2iag s ASP 33 CO -0.02 -0.27 1.31 0.18 0.52 0.00 0.00 175.17 176.89 2iag n LEU 34 N 4.73 0.62 0.00 -1.34 4.77 -1.26 -2.49 117.00 122.03 2iag n LEU 34 Ca -0.10 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2iag n LEU 34 Cb 0.44 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2iag n LEU 34 CO 0.17 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 2iag n GLY 35 N 1.39 -0.41 0.01 -0.72 0.00 -1.26 -4.36 105.19 99.84 2iag n GLY 35 Ca 0.04 -1.09 -0.01 0.00 0.00 0.00 0.00 46.02 44.96 2iag n GLY 35 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2iag n SER 36 N 0.23 4.42 -4.56 1.61 7.64 -1.26 -4.97 113.62 116.72 2iag n SER 36 Ca 0.00 -0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 2iag n SER 36 Cb 0.00 0.44 -0.08 0.00 -1.01 0.00 0.00 64.21 63.55 2iag n SER 36 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2iag s ILE 37 N -2.04 5.05 0.07 0.44 1.01 -1.26 -5.04 121.20 119.43 2iag s ILE 37 Ca -0.01 0.35 -0.35 0.00 0.00 0.00 0.00 60.65 60.64 2iag s ILE 37 Cb 0.01 -3.92 -0.19 0.00 0.01 0.00 0.00 42.46 38.37 2iag s ILE 37 CO 0.07 -0.15 0.86 -2.65 0.00 0.00 0.00 174.94 173.06 2iag n PRO 38 N 5.65 0.00 0.00 2.79 -0.01 -1.26 -1.08 135.00 141.09 2iag n PRO 38 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.43 2iag n PRO 38 Cb 0.49 -1.30 0.00 0.00 -0.01 0.00 0.00 33.50 32.68 2iag n PRO 38 CO 0.00 0.00 0.00 1.87 -0.01 0.00 0.00 175.50 177.36 2iag n TRP 39 N 0.94 0.00 -0.12 6.00 -0.00 -1.26 -4.36 117.44 118.63 2iag n TRP 39 Ca 0.19 0.00 -0.06 0.00 -0.00 0.00 0.00 57.50 57.63 2iag n TRP 39 Cb 0.14 0.00 0.12 0.00 -0.00 0.00 0.00 31.31 31.57 2iag n TRP 39 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 2iag h LEU 40 N 0.00 0.82 0.00 5.87 3.38 -1.92 0.73 115.31 124.19 2iag h LEU 40 Ca 0.00 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2iag h LEU 40 Cb 0.00 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.53 2iag h LEU 40 CO 0.00 0.91 0.00 0.61 0.09 0.00 0.00 178.44 180.05 2iag n GLY 41 N -0.51 1.39 0.82 0.83 0.00 -0.24 -1.58 105.19 105.90 2iag n GLY 41 Ca 0.02 0.52 0.07 0.00 0.00 0.00 0.00 46.02 46.63 2iag n GLY 41 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2iag n TYR 42 N 0.00 0.75 -0.29 1.61 4.02 -0.22 -4.42 117.16 118.60 2iag n TYR 42 Ca 0.00 -0.67 0.12 0.00 -0.01 0.00 0.00 57.90 57.34 2iag n TYR 42 Cb 0.00 -0.17 0.27 0.00 -0.02 0.00 0.00 39.34 39.43 2iag n TYR 42 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2iag h ALA 43 N 2.08 1.22 0.24 -0.72 0.00 -1.49 0.19 119.26 120.77 2iag h ALA 43 Ca 0.00 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2iag h ALA 43 Cb 1.09 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.23 2iag h ALA 43 CO 0.11 -0.47 -0.12 1.25 0.00 0.00 0.00 179.25 180.03 2iag h LEU 44 N 0.19 -0.28 -0.36 0.00 5.85 -1.85 -0.68 115.31 118.18 2iag h LEU 44 Ca 0.54 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 59.12 2iag h LEU 44 Cb 1.08 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 42.14 2iag h LEU 44 CO -0.67 0.04 0.14 0.44 -0.34 0.00 0.00 178.44 178.05 2iag h ASP 45 N -0.61 0.17 0.25 1.25 5.19 -1.75 0.65 116.42 121.57 2iag h ASP 45 Ca -0.03 0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 2iag h ASP 45 Cb 0.44 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.96 2iag h ASP 45 CO 0.05 0.13 -0.16 0.15 -3.12 0.00 0.00 179.24 176.29 2iag h PHE 46 N 0.30 -0.43 -0.59 4.55 3.57 -0.71 -3.08 116.94 120.55 2iag h PHE 46 Ca 0.16 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 2iag h PHE 46 Cb 0.12 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 2iag h PHE 46 CO -0.13 -0.26 0.36 0.78 -2.23 0.00 0.00 178.31 176.84 2iag h GLY 47 N -0.41 0.85 0.37 2.40 0.00 -0.86 -2.12 103.07 103.31 2iag h GLY 47 Ca -0.02 -0.35 0.08 0.00 0.00 0.00 0.00 47.33 47.04 2iag h GLY 47 CO 0.02 0.34 0.04 0.50 0.00 0.00 0.00 176.54 177.43 2iag h LYS 48 N 0.80 0.15 -0.77 4.80 1.57 -0.91 -3.42 116.57 118.79 2iag h LYS 48 Ca 0.21 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.93 2iag h LYS 48 Cb -0.04 -0.03 -0.17 0.00 0.08 0.00 0.00 32.23 32.07 2iag h LYS 48 CO -0.04 0.10 -0.37 0.34 -0.57 0.00 0.00 179.45 178.91 2iag s ASP 49 N -5.28 -1.15 0.37 0.86 -1.08 -1.17 -4.59 116.67 104.63 2iag s ASP 49 Ca -0.13 -0.97 0.05 0.00 -0.52 0.00 0.00 52.55 50.98 2iag s ASP 49 Cb 0.14 1.49 0.73 0.00 -1.46 0.00 0.00 42.92 43.82 2iag s ASP 49 CO 0.72 -0.09 2.01 0.00 0.52 0.00 0.00 175.17 178.33 2iag h ALA 50 N 5.67 1.64 -0.30 3.66 0.00 -1.58 -1.18 119.26 127.17 2iag h ALA 50 Ca 0.03 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2iag h ALA 50 Cb 1.16 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2iag h ALA 50 CO 0.01 0.30 -0.10 0.00 0.00 0.00 0.00 179.25 179.47 2iag h ALA 51 N 1.64 0.42 -0.16 0.00 0.00 -1.94 -0.76 119.26 118.46 2iag h ALA 51 Ca 0.24 -0.30 -0.21 0.00 0.00 0.00 0.00 54.91 54.63 2iag h ALA 51 Cb 0.03 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.72 2iag h ALA 51 CO -0.06 0.27 -0.74 1.03 0.00 0.00 0.00 179.25 179.75 2iag h SER 52 N 0.36 0.93 -0.07 0.00 0.87 -1.90 -2.23 113.55 111.51 2iag h SER 52 Ca 0.07 -0.62 -0.00 0.00 -1.23 0.00 0.00 61.79 60.01 2iag h SER 52 Cb 0.60 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.28 2iag h SER 52 CO 0.03 1.40 0.03 0.15 -0.53 0.00 0.00 176.83 177.92 2iag h PHE 53 N 0.52 0.10 0.00 2.24 3.57 -1.24 -2.51 116.94 119.62 2iag h PHE 53 Ca -0.05 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.37 2iag h PHE 53 Cb 1.37 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 40.06 2iag h PHE 53 CO 0.09 0.18 -0.38 -0.07 -2.23 0.00 0.00 178.31 175.90 2iag h LEU 54 N -0.00 0.00 -0.66 0.59 3.38 -1.17 -0.99 115.31 116.47 2iag h LEU 54 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2iag h LEU 54 Cb 0.11 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2iag h LEU 54 CO -0.00 0.38 0.32 0.74 0.09 0.00 0.00 178.44 179.96 2iag h THR 55 N 0.00 1.22 -0.24 0.22 2.02 -1.32 0.12 112.91 114.92 2iag h THR 55 Ca -0.00 -0.62 -0.06 0.00 0.77 0.00 0.00 66.41 66.50 2iag h THR 55 Cb 0.71 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2iag h THR 55 CO 0.05 0.26 -0.07 0.03 0.37 0.00 0.00 175.52 176.16 2iag h ARG 56 N 0.91 0.48 -0.88 6.66 3.08 -0.98 0.19 114.38 123.83 2iag h ARG 56 Ca 0.23 -0.19 0.07 0.00 0.07 0.00 0.00 59.98 60.16 2iag h ARG 56 Cb 0.12 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.07 2iag h ARG 56 CO -0.03 0.71 0.54 0.52 -1.07 0.00 0.00 179.97 180.65 2iag h MET 57 N 0.22 0.93 -0.49 0.04 2.86 -1.12 0.27 114.93 117.64 2iag h MET 57 Ca 0.06 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 2iag h MET 57 Cb 0.54 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 2iag h MET 57 CO 0.03 0.62 -0.13 -0.22 1.06 0.00 0.00 176.91 178.27 2iag h LYS 58 N 0.96 0.95 0.00 1.72 3.64 -0.53 0.64 116.57 123.96 2iag h LYS 58 Ca 0.40 -0.37 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 2iag h LYS 58 Cb 0.24 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2iag h LYS 58 CO -0.20 1.03 -0.17 0.93 -2.27 0.00 0.00 179.45 178.77 2iag h GLU 59 N 0.81 0.00 0.09 1.90 5.08 -0.37 0.50 114.58 122.58 2iag h GLU 59 Ca 0.12 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.33 2iag h GLU 59 Cb 0.69 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.94 2iag h GLU 59 CO 0.05 0.17 -0.74 -0.22 -1.00 0.00 0.00 179.01 177.27 2iag h LYS 60 N 0.00 0.18 0.00 2.33 3.64 0.10 -3.42 116.57 119.40 2iag h LYS 60 Ca -0.00 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 2iag h LYS 60 Cb 0.39 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2iag h LYS 60 CO 0.02 1.15 -0.50 0.72 -2.27 0.00 0.00 179.45 178.58 2iag n HIS 61 N -4.24 0.00 -1.35 1.91 8.25 0.17 -5.08 115.22 114.86 2iag n HIS 61 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.30 2iag n HIS 61 Cb 0.73 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.82 2iag n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2iag n GLY 62 N 1.51 -1.54 0.04 -1.41 0.00 0.16 -4.65 105.19 99.30 2iag n GLY 62 Ca 0.00 -1.75 0.13 0.00 0.00 0.00 0.00 46.02 44.40 2iag n GLY 62 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2iag n ASP 63 N 0.05 0.28 -3.73 1.61 8.00 -1.26 -4.33 116.55 117.16 2iag n ASP 63 Ca 0.00 0.53 -0.14 0.00 0.71 0.00 0.00 54.79 55.89 2iag n ASP 63 Cb 0.00 -0.61 -0.15 0.00 -0.02 0.00 0.00 41.12 40.35 2iag n ASP 63 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2iag s ILE 64 N -3.05 -0.08 0.07 0.53 2.07 -1.26 -0.43 121.20 119.05 2iag s ILE 64 Ca 0.12 0.20 -0.26 0.00 -1.41 0.00 0.00 60.65 59.29 2iag s ILE 64 Cb 0.15 -0.26 0.07 0.00 0.13 0.00 0.00 42.46 42.56 2iag s ILE 64 CO 0.51 0.08 0.64 0.72 -1.91 0.00 0.00 174.94 174.98 2iag s PHE 65 N 1.34 -0.59 -0.17 3.50 -0.71 -1.03 -4.22 117.98 116.11 2iag s PHE 65 Ca -0.07 0.66 -0.04 0.00 -1.04 0.00 0.00 56.93 56.44 2iag s PHE 65 Cb -0.12 0.50 -0.03 0.00 -1.21 0.00 0.00 43.02 42.16 2iag s PHE 65 CO -0.06 -0.74 -0.03 0.99 -1.34 0.00 0.00 175.22 174.04 2iag s THR 66 N -2.66 3.91 0.06 -4.49 2.01 0.98 -0.36 115.64 115.09 2iag s THR 66 Ca -0.04 -0.35 0.07 0.00 0.31 0.00 0.00 61.69 61.69 2iag s THR 66 Cb -0.01 -2.73 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 2iag s THR 66 CO -0.03 0.47 -0.17 0.27 -0.69 0.00 0.00 174.62 174.47 2iag s ILE 67 N 0.57 2.88 -0.05 1.82 -4.36 -0.16 -0.62 121.20 121.28 2iag s ILE 67 Ca -0.02 -1.23 -0.24 0.00 -0.26 0.00 0.00 60.65 58.90 2iag s ILE 67 Cb -0.14 -2.24 -0.04 0.00 1.25 0.00 0.00 42.46 41.29 2iag s ILE 67 CO 0.02 0.28 0.72 -0.22 0.24 0.00 0.00 174.94 175.98 2iag s LEU 68 N -1.61 4.34 -0.25 0.37 2.96 -1.04 -0.77 118.68 122.68 2iag s LEU 68 Ca 0.16 1.24 -0.02 0.00 -0.22 0.00 0.00 54.13 55.28 2iag s LEU 68 Cb -0.11 -3.11 0.13 0.00 0.50 0.00 0.00 46.19 43.60 2iag s LEU 68 CO 0.07 -0.10 0.37 0.54 -1.32 0.00 0.00 176.35 175.90 2iag s VAL 69 N 0.68 -0.58 -0.91 1.68 0.11 0.24 -1.06 120.40 120.56 2iag s VAL 69 Ca 0.38 -0.11 -0.04 0.00 -2.93 0.00 0.00 61.98 59.28 2iag s VAL 69 Cb -0.18 -0.83 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 2iag s VAL 69 CO 0.19 -0.16 0.79 0.61 -3.33 0.00 0.00 175.10 173.20 2iag n GLY 70 N 5.36 -0.10 3.47 6.54 0.00 -0.67 -2.02 105.19 117.77 2iag n GLY 70 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2iag n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2iag n GLY 71 N -1.42 1.26 3.73 -0.02 0.00 0.25 -4.95 105.19 104.04 2iag n GLY 71 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 2iag n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2iag s ARG 72 N -0.19 2.96 -0.29 1.61 0.52 -0.86 -5.10 118.95 117.61 2iag s ARG 72 Ca 0.00 -0.51 -0.11 0.00 -0.52 0.00 0.00 55.73 54.60 2iag s ARG 72 Cb 0.00 -2.79 -0.03 0.00 0.52 0.00 0.00 34.95 32.65 2iag s ARG 72 CO 0.00 0.65 0.17 0.71 0.02 0.00 0.00 175.30 176.86 2iag s TYR 73 N -1.10 3.19 -0.27 -0.53 2.02 -1.26 -0.59 117.35 118.82 2iag s TYR 73 Ca 0.20 -0.15 -0.04 0.00 -0.37 0.00 0.00 57.07 56.71 2iag s TYR 73 Cb -0.12 -2.37 0.02 0.00 -0.40 0.00 0.00 41.96 39.09 2iag s TYR 73 CO 0.10 -0.28 0.01 0.08 -1.57 0.00 0.00 175.55 173.89 2iag s VAL 74 N 1.71 3.41 -0.30 0.71 1.01 0.05 -0.99 120.40 126.00 2iag s VAL 74 Ca 0.06 -0.83 -0.21 0.00 0.00 0.00 0.00 61.98 61.01 2iag s VAL 74 Cb -0.16 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 2iag s VAL 74 CO 0.09 0.16 0.65 -0.89 0.00 0.00 0.00 175.10 175.10 2iag s THR 75 N 1.42 4.93 -0.19 3.92 2.01 0.15 -0.98 115.64 126.89 2iag s THR 75 Ca 0.02 0.93 -0.11 0.00 0.31 0.00 0.00 61.69 62.83 2iag s THR 75 Cb -0.17 -4.01 -0.05 0.00 0.01 0.00 0.00 72.50 68.29 2iag s THR 75 CO -0.01 -0.13 0.18 -0.69 -0.69 0.00 0.00 174.62 173.28 2iag s VAL 76 N 2.63 5.38 -0.13 3.82 1.01 0.52 -0.95 120.40 132.68 2iag s VAL 76 Ca 0.26 0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.54 2iag s VAL 76 Cb -0.15 -3.52 -0.00 0.00 0.00 0.00 0.00 36.38 32.71 2iag s VAL 76 CO 0.11 0.42 -0.18 -0.22 0.00 0.00 0.00 175.10 175.23 2iag s LEU 77 N 0.45 2.39 0.00 3.92 0.20 -0.43 -2.45 118.68 122.76 2iag s LEU 77 Ca 0.10 -0.47 0.00 0.00 0.69 0.00 0.00 54.13 54.46 2iag s LEU 77 Cb -0.12 -1.52 0.00 0.00 -0.43 0.00 0.00 46.19 44.13 2iag s LEU 77 CO -0.00 0.14 0.42 0.18 -0.29 0.00 0.00 176.35 176.80 2iag n LEU 78 N 3.70 0.77 -4.56 -0.68 4.32 0.43 -3.95 117.00 117.03 2iag n LEU 78 Ca -0.19 -0.77 -0.43 0.00 -0.02 0.00 0.00 56.01 54.61 2iag n LEU 78 Cb 0.52 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.29 2iag n LEU 78 CO 0.29 0.19 0.87 -0.62 -1.22 0.00 0.00 177.39 176.90 2iag s ASP 79 N -0.14 6.44 0.43 -1.43 2.15 -1.26 -4.69 116.67 118.18 2iag s ASP 79 Ca 0.00 -0.01 0.10 0.00 0.43 0.00 0.00 52.55 53.06 2iag s ASP 79 Cb 0.00 -2.48 0.94 0.00 -0.30 0.00 0.00 42.92 41.08 2iag s ASP 79 CO 0.00 -1.25 2.06 1.55 -0.17 0.00 0.00 175.17 177.35 2iag h PRO 80 N 9.30 0.36 -0.79 4.34 0.13 -1.93 -1.12 132.00 142.31 2iag h PRO 80 Ca -0.25 -0.03 0.13 0.00 -0.87 0.00 0.00 66.00 64.98 2iag h PRO 80 Cb 1.07 -0.08 -0.06 0.00 0.13 0.00 0.00 31.00 32.07 2iag h PRO 80 CO 1.10 0.28 0.52 0.45 -0.23 0.00 0.00 178.00 180.12 2iag h HIS 81 N 0.37 0.63 0.00 1.56 3.86 -1.91 -2.73 115.15 116.92 2iag h HIS 81 Ca 0.10 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 2iag h HIS 81 Cb 0.02 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.30 2iag h HIS 81 CO 0.00 0.25 -0.38 0.43 0.86 0.00 0.00 177.93 179.10 2iag n SER 82 N -4.51 0.38 -0.21 2.45 7.64 -0.43 -4.25 113.62 114.69 2iag n SER 82 Ca 0.15 -0.06 0.02 0.00 1.01 0.00 0.00 58.87 59.98 2iag n SER 82 Cb 0.46 0.06 0.27 0.00 -1.01 0.00 0.00 64.21 63.99 2iag n SER 82 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 2iag h TYR 83 N 0.00 0.92 0.85 1.43 0.05 -1.39 -3.28 116.97 115.54 2iag h TYR 83 Ca 0.00 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.76 2iag h TYR 83 Cb 0.50 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.93 2iag h TYR 83 CO 0.00 0.55 -0.50 0.22 -1.05 0.00 0.00 178.16 177.39 2iag h ASP 84 N 0.97 -1.24 -0.21 3.88 1.82 -1.77 -1.25 116.42 118.62 2iag h ASP 84 Ca 0.29 0.06 0.04 0.00 -0.39 0.00 0.00 57.03 57.04 2iag h ASP 84 Cb -0.03 0.36 -0.04 0.00 0.68 0.00 0.00 39.33 40.29 2iag h ASP 84 CO -0.07 -0.78 -0.06 0.00 -1.61 0.00 0.00 179.24 176.72 2iag h ALA 85 N -1.21 0.14 -0.27 -0.78 0.00 -1.87 -3.07 119.26 112.19 2iag h ALA 85 Ca -0.11 0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.93 2iag h ALA 85 Cb 1.00 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 2iag h ALA 85 CO 0.13 -0.48 -0.06 0.28 0.00 0.00 0.00 179.25 179.12 2iag h VAL 86 N -0.01 0.74 0.00 0.00 2.07 -1.57 -2.46 116.25 115.02 2iag h VAL 86 Ca 0.10 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.61 2iag h VAL 86 Cb 0.17 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2iag h VAL 86 CO -0.22 0.00 -0.06 -0.37 0.02 0.00 0.00 177.57 176.94 2iag h VAL 87 N 0.01 0.18 -0.07 2.57 -1.51 -1.14 -2.90 116.25 113.39 2iag h VAL 87 Ca 0.13 -0.58 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 2iag h VAL 87 Cb 0.20 1.49 0.00 0.00 -2.13 0.00 0.00 31.29 30.84 2iag h VAL 87 CO -0.27 0.06 0.00 0.79 -1.23 0.00 0.00 177.57 176.91 2iag n TRP 88 N -3.22 0.06 -1.65 5.19 7.02 -0.95 -3.68 117.44 120.22 2iag n TRP 88 Ca -0.00 -0.03 -0.44 0.00 -1.02 0.00 0.00 57.50 56.01 2iag n TRP 88 Cb 0.30 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.17 2iag n TRP 88 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2iag n GLU 89 N 0.94 1.79 -0.85 -0.99 -0.58 -1.08 -4.97 120.64 114.90 2iag n GLU 89 Ca 0.16 0.63 -0.30 0.00 -0.42 0.00 0.00 57.16 57.24 2iag n GLU 89 Cb 0.51 -2.15 0.18 0.00 -0.57 0.00 0.00 31.44 29.41 2iag n GLU 89 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2iag s PRO 90 N -1.36 0.43 0.48 3.49 0.04 -1.26 -4.65 135.00 132.17 2iag s PRO 90 Ca 0.60 1.01 0.30 0.00 0.04 0.00 0.00 61.00 62.95 2iag s PRO 90 Cb -0.65 -1.70 1.09 0.00 0.04 0.00 0.00 34.50 33.29 2iag s PRO 90 CO 0.58 -2.86 1.87 0.00 0.04 0.00 0.00 177.00 176.63 2iag h ARG 91 N -2.01 0.00 0.00 4.56 3.08 -1.94 -0.43 114.38 117.64 2iag h ARG 91 Ca -0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.53 2iag h ARG 91 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.35 2iag h ARG 91 CO 0.50 0.00 0.00 1.79 -1.07 0.00 0.00 179.97 181.19 2iag h THR 92 N 0.00 0.00 0.00 2.04 1.35 -1.99 -3.36 112.91 110.95 2iag h THR 92 Ca 0.00 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 2iag h THR 92 Cb 0.60 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 2iag h THR 92 CO 0.00 0.00 -0.35 0.54 -0.25 0.00 0.00 175.52 175.46 2iag n ARG 93 N -2.34 0.18 -4.04 4.72 1.74 -0.71 -4.56 116.66 111.65 2iag n ARG 93 Ca 0.03 0.07 -0.31 0.00 -0.77 0.00 0.00 57.85 56.87 2iag n ARG 93 Cb 0.33 -0.75 -0.16 0.00 -1.02 0.00 0.00 32.46 30.86 2iag n ARG 93 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2iag s LEU 94 N -6.76 2.55 -0.29 0.55 1.43 -0.25 -0.90 118.68 115.01 2iag s LEU 94 Ca -0.10 -0.97 -0.18 0.00 -1.03 0.00 0.00 54.13 51.85 2iag s LEU 94 Cb 0.01 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 44.85 2iag s LEU 94 CO 0.15 -0.13 0.52 -0.62 0.23 0.00 0.00 176.35 176.50 2iag s ASP 95 N 1.30 6.40 0.09 2.29 -1.08 0.92 -4.08 116.67 122.51 2iag s ASP 95 Ca -0.02 0.36 0.17 0.00 -0.52 0.00 0.00 52.55 52.54 2iag s ASP 95 Cb -0.17 -2.28 -0.11 0.00 -1.46 0.00 0.00 42.92 38.91 2iag s ASP 95 CO -0.08 -0.36 0.89 2.19 0.52 0.00 0.00 175.17 178.33 2iag h PHE 96 N 8.16 0.00 0.07 -5.34 -5.15 -1.86 0.26 116.94 113.08 2iag h PHE 96 Ca -0.29 0.00 -0.14 0.00 -0.20 0.00 0.00 57.97 57.34 2iag h PHE 96 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.31 2iag h PHE 96 CO 0.75 0.50 -0.68 1.25 -2.00 0.00 0.00 178.31 178.13 2iag h HIS 97 N 0.00 0.26 -0.90 6.09 2.76 -1.93 -3.25 115.15 118.18 2iag h HIS 97 Ca -0.13 -0.19 0.20 0.00 -2.20 0.00 0.00 60.37 58.04 2iag h HIS 97 Cb 1.50 -0.01 -0.07 0.00 1.55 0.00 0.00 27.41 30.38 2iag h HIS 97 CO 0.00 1.26 0.59 0.00 -1.30 0.00 0.00 177.93 178.49 2iag h ALA 98 N -0.04 2.17 0.01 5.26 0.00 -2.00 0.13 119.26 124.79 2iag h ALA 98 Ca -0.14 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2iag h ALA 98 Cb 1.39 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2iag h ALA 98 CO 0.04 -0.45 -0.00 -0.92 0.00 0.00 0.00 179.25 177.91 2iag h TYR 99 N 0.43 -0.01 -0.80 0.00 3.20 -1.83 -1.57 116.97 116.39 2iag h TYR 99 Ca 0.47 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.49 2iag h TYR 99 Cb 1.14 0.00 -0.10 0.00 1.54 0.00 0.00 36.73 39.31 2iag h TYR 99 CO -0.00 0.43 0.35 0.00 -1.64 0.00 0.00 178.16 177.29 2iag h ALA 100 N 0.53 1.16 0.34 1.82 0.00 -1.32 0.38 119.26 122.16 2iag h ALA 100 Ca -0.00 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2iag h ALA 100 Cb 0.45 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2iag h ALA 100 CO 0.00 -0.19 -0.27 0.82 0.00 0.00 0.00 179.25 179.61 2iag h ILE 101 N 0.49 0.43 -0.98 0.00 2.04 -0.73 0.36 117.51 119.10 2iag h ILE 101 Ca 0.44 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.48 2iag h ILE 101 Cb 0.69 0.43 -0.10 0.00 -0.74 0.00 0.00 36.82 37.09 2iag h ILE 101 CO -0.41 0.00 0.59 0.15 0.00 0.00 0.00 178.15 178.48 2iag h PHE 102 N -0.62 1.04 -0.15 1.37 3.04 -0.78 -1.03 116.94 119.81 2iag h PHE 102 Ca -0.03 0.03 -0.20 0.00 3.98 0.00 0.00 57.97 61.75 2iag h PHE 102 Cb 0.54 -0.31 0.01 0.00 2.56 0.00 0.00 35.95 38.75 2iag h PHE 102 CO -0.14 0.27 -0.70 -0.07 -2.02 0.00 0.00 178.31 175.64 2iag h LEU 103 N 0.79 0.88 -0.84 0.59 3.38 -0.60 -1.18 115.31 118.33 2iag h LEU 103 Ca 0.55 -0.62 0.06 0.00 0.09 0.00 0.00 57.88 57.96 2iag h LEU 103 Cb 0.78 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.21 2iag h LEU 103 CO -0.36 1.36 0.52 0.24 0.09 0.00 0.00 178.44 180.29 2iag h MET 104 N 0.46 0.92 0.33 1.13 2.86 0.31 -0.72 114.93 120.22 2iag h MET 104 Ca -0.04 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 2iag h MET 104 Cb 1.34 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.79 2iag h MET 104 CO 0.15 0.61 -0.16 1.49 1.06 0.00 0.00 176.91 180.05 2iag h GLU 105 N 0.94 -0.43 0.00 1.72 4.22 -1.13 -1.29 114.58 118.61 2iag h GLU 105 Ca 0.37 0.03 -0.11 0.00 0.08 0.00 0.00 59.36 59.73 2iag h GLU 105 Cb 0.18 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2iag h GLU 105 CO -0.18 -0.11 -0.50 0.07 -2.18 0.00 0.00 179.01 176.11 2iag h ARG 106 N -0.94 0.00 0.02 1.92 0.11 -1.22 -1.41 114.38 112.85 2iag h ARG 106 Ca -0.05 0.00 -0.38 0.00 0.10 0.00 0.00 59.98 59.66 2iag h ARG 106 Cb 0.52 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.54 2iag h ARG 106 CO 0.07 0.50 -2.36 -0.89 0.10 0.00 0.00 179.97 177.40 2iag n ILE 107 N -3.54 1.51 0.18 0.08 -0.00 -0.28 -4.67 119.36 112.64 2iag n ILE 107 Ca -0.00 -0.66 0.02 0.00 -0.00 0.00 0.00 62.75 62.11 2iag n ILE 107 Cb 0.60 -1.22 0.00 0.00 -0.00 0.00 0.00 39.64 39.02 2iag n ILE 107 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 2iag n PHE 108 N -3.16 0.00 -2.19 1.39 3.72 -0.75 -5.00 117.46 111.46 2iag n PHE 108 Ca -0.40 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 56.84 2iag n PHE 108 Cb 1.04 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.56 2iag n PHE 108 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2iag n ASP 109 N -0.26 -4.81 -4.82 4.37 8.00 -0.53 -4.89 116.55 113.61 2iag n ASP 109 Ca 0.02 0.04 -0.37 0.00 0.71 0.00 0.00 54.79 55.19 2iag n ASP 109 Cb 0.09 -3.90 -0.07 0.00 -0.02 0.00 0.00 41.12 37.22 2iag n ASP 109 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2iag s VAL 110 N -2.77 5.41 -0.09 2.53 -7.23 -0.87 -4.94 120.40 112.45 2iag s VAL 110 Ca 0.00 0.31 -0.01 0.00 -1.81 0.00 0.00 61.98 60.47 2iag s VAL 110 Cb 0.00 -3.47 0.03 0.00 0.56 0.00 0.00 36.38 33.49 2iag s VAL 110 CO 0.00 0.55 -0.03 -1.10 -0.31 0.00 0.00 175.10 174.21 2iag s GLN 111 N -0.55 0.97 0.24 4.82 -0.21 -1.26 -3.07 119.66 120.60 2iag s GLN 111 Ca 0.14 -0.04 0.09 0.00 0.02 0.00 0.00 55.36 55.58 2iag s GLN 111 Cb -0.12 -1.21 -0.04 0.00 1.00 0.00 0.00 33.01 32.63 2iag s GLN 111 CO 0.04 -0.28 -0.01 -0.51 -2.12 0.00 0.00 175.29 172.40 2iag s LEU 112 N 1.85 3.19 0.80 2.90 1.02 -1.26 -5.07 118.68 122.12 2iag s LEU 112 Ca 0.05 -0.59 -0.12 0.00 0.02 0.00 0.00 54.13 53.49 2iag s LEU 112 Cb -0.12 -1.76 0.08 0.00 0.02 0.00 0.00 46.19 44.41 2iag s LEU 112 CO -0.06 0.03 1.17 -2.84 0.02 0.00 0.00 176.35 174.66 2iag s PRO 113 N -3.43 1.74 0.23 1.29 0.02 -1.26 -4.94 135.00 128.64 2iag s PRO 113 Ca 0.30 1.59 -0.31 0.00 0.02 0.00 0.00 61.00 62.60 2iag s PRO 113 Cb -0.07 -1.80 -0.14 0.00 0.02 0.00 0.00 34.50 32.50 2iag s PRO 113 CO 0.19 -2.11 1.27 0.72 -0.33 0.00 0.00 177.00 176.75 2iag n HIS 114 N -3.40 1.76 -3.98 6.54 8.25 -1.26 -5.00 115.22 118.13 2iag n HIS 114 Ca 0.12 0.56 -0.09 0.00 -0.26 0.00 0.00 57.72 58.05 2iag n HIS 114 Cb 0.51 -2.37 -0.08 0.00 1.12 0.00 0.00 29.99 29.17 2iag n HIS 114 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 2iag s TYR 115 N -0.26 0.42 -0.23 4.41 -0.85 -1.26 -5.11 117.35 114.45 2iag s TYR 115 Ca 0.68 -0.83 -0.29 0.00 -0.52 0.00 0.00 57.07 56.11 2iag s TYR 115 Cb -0.72 -0.18 -0.00 0.00 0.38 0.00 0.00 41.96 41.43 2iag s TYR 115 CO 0.52 -0.58 1.25 0.45 -1.52 0.00 0.00 175.55 175.67 2iag s SER 116 N -2.94 6.85 0.37 -0.18 0.15 -1.26 -4.90 113.70 111.79 2iag s SER 116 Ca 0.13 1.43 0.04 0.00 0.70 0.00 0.00 55.95 58.25 2iag s SER 116 Cb 0.05 -2.54 0.71 0.00 -1.71 0.00 0.00 66.02 62.53 2iag s SER 116 CO -0.05 -0.89 2.01 -0.65 1.20 0.00 0.00 173.24 174.86 2iag h PRO 117 N 8.57 0.69 0.06 5.44 0.11 -1.99 -2.28 132.00 142.60 2iag h PRO 117 Ca -0.25 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 65.63 2iag h PRO 117 Cb 1.09 -0.15 0.02 0.00 0.11 0.00 0.00 31.00 32.07 2iag h PRO 117 CO 1.00 0.48 -0.70 0.66 -0.21 0.00 0.00 178.00 179.23 2iag h SER 118 N 0.70 0.50 -0.68 -2.05 4.64 -1.98 -1.63 113.55 113.06 2iag h SER 118 Ca 0.19 -0.85 0.04 0.00 -0.47 0.00 0.00 61.79 60.70 2iag h SER 118 Cb -0.03 -0.16 -0.05 0.00 -0.31 0.00 0.00 62.40 61.86 2iag h SER 118 CO -0.04 1.30 0.41 0.44 -0.87 0.00 0.00 176.83 178.07 2iag h ASP 119 N -0.22 0.65 -0.58 4.97 3.32 -1.94 0.47 116.42 123.09 2iag h ASP 119 Ca -0.11 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.85 2iag h ASP 119 Cb 1.46 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.87 2iag h ASP 119 CO 0.13 0.44 -0.06 -0.08 -1.72 0.00 0.00 179.24 177.96 2iag h GLU 120 N 0.79 1.06 -0.11 3.56 4.57 -1.49 0.15 114.58 123.11 2iag h GLU 120 Ca 0.29 -0.37 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2iag h GLU 120 Cb 0.08 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.59 2iag h GLU 120 CO -0.13 1.07 0.07 -0.22 -1.18 0.00 0.00 179.01 178.61 2iag h LYS 121 N 0.95 0.15 -0.60 1.92 1.63 -0.94 0.45 116.57 120.13 2iag h LYS 121 Ca 0.16 -0.01 0.05 0.00 -0.85 0.00 0.00 60.65 60.00 2iag h LYS 121 Cb 0.63 -0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 32.17 2iag h LYS 121 CO 0.04 0.11 0.32 0.00 -3.45 0.00 0.00 179.45 176.47 2iag h ALA 122 N 1.03 0.79 0.38 5.00 0.00 -0.76 -0.26 119.26 125.44 2iag h ALA 122 Ca 0.04 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2iag h ALA 122 Cb -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2iag h ALA 122 CO -0.01 -0.01 -0.18 -0.09 0.00 0.00 0.00 179.25 178.96 2iag h ARG 123 N 0.60 -0.50 -0.42 0.00 2.43 -0.71 -3.07 114.38 112.71 2iag h ARG 123 Ca 0.27 0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.38 2iag h ARG 123 Cb 0.16 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 2iag h ARG 123 CO -0.17 -0.24 -0.11 1.98 -1.51 0.00 0.00 179.97 179.92 2iag h MET 124 N -0.67 0.76 -0.43 0.20 4.05 -0.84 -3.03 114.93 114.97 2iag h MET 124 Ca -0.05 -0.25 0.09 0.00 -0.28 0.00 0.00 59.70 59.21 2iag h MET 124 Cb 0.48 -0.07 -0.09 0.00 -0.80 0.00 0.00 31.60 31.13 2iag h MET 124 CO 0.09 0.84 -0.15 -0.22 0.23 0.00 0.00 176.91 177.69 2iag h LYS 125 N 0.69 -0.06 0.00 0.39 1.63 -1.06 -2.41 116.57 115.75 2iag h LYS 125 Ca 0.12 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.90 2iag h LYS 125 Cb 0.58 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.22 2iag h LYS 125 CO 0.04 -0.04 -0.12 -0.07 -3.45 0.00 0.00 179.45 175.81 2iag h LEU 126 N -0.06 0.00 0.00 5.20 3.38 -1.43 -1.09 115.31 121.31 2iag h LEU 126 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2iag h LEU 126 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2iag h LEU 126 CO -0.47 0.12 0.00 0.35 0.09 0.00 0.00 178.44 178.53 2iag n THR 127 N -3.56 0.06 -0.62 0.22 -2.24 -0.91 -2.97 114.28 104.27 2iag n THR 127 Ca -0.01 0.02 0.04 0.00 -2.27 0.00 0.00 64.05 61.82 2iag n THR 127 Cb 0.25 -0.64 0.06 0.00 -2.10 0.00 0.00 70.33 67.90 2iag n THR 127 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2iag n LEU 128 N -1.06 1.94 -4.22 3.22 4.32 -0.41 -4.28 117.00 116.51 2iag n LEU 128 Ca 0.16 -2.31 -0.13 0.00 -0.02 0.00 0.00 56.01 53.71 2iag n LEU 128 Cb 0.10 -0.19 -0.10 0.00 -1.62 0.00 0.00 43.42 41.62 2iag n LEU 128 CO 0.14 0.55 -0.22 -0.76 -1.22 0.00 0.00 177.39 175.89 2iag s LEU 129 N -1.71 1.27 0.00 2.23 1.43 -1.16 -4.52 118.68 116.22 2iag s LEU 129 Ca 0.14 -1.46 0.00 0.00 -1.03 0.00 0.00 54.13 51.78 2iag s LEU 129 Cb 0.12 0.41 0.00 0.00 0.03 0.00 0.00 46.19 46.75 2iag s LEU 129 CO 0.01 -0.88 0.00 1.41 0.23 0.00 0.00 176.35 177.12 2iag n HIS 130 N -0.34 0.00 0.07 0.29 8.25 -1.26 -1.81 115.22 120.42 2iag n HIS 130 Ca 0.03 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.44 2iag n HIS 130 Cb 0.65 0.00 0.15 0.00 1.12 0.00 0.00 29.99 31.91 2iag n HIS 130 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2iag h ARG 131 N 0.00 0.30 -0.16 -0.41 2.43 -1.99 -2.64 114.38 111.91 2iag h ARG 131 Ca 0.00 -0.18 -0.13 0.00 -0.81 0.00 0.00 59.98 58.86 2iag h ARG 131 Cb 0.00 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2iag h ARG 131 CO 0.00 0.75 -0.47 0.93 -1.51 0.00 0.00 179.97 179.67 2iag h GLU 132 N 0.24 0.40 -0.51 0.20 4.39 -1.73 -2.02 114.58 115.55 2iag h GLU 132 Ca 0.01 -0.22 -0.02 0.00 0.34 0.00 0.00 59.36 59.47 2iag h GLU 132 Cb 0.99 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.63 2iag h GLU 132 CO 0.08 0.79 0.25 1.25 -1.16 0.00 0.00 179.01 180.22 2iag h LEU 133 N 0.32 0.66 -0.69 1.33 5.85 -1.18 -1.24 115.31 120.36 2iag h LEU 133 Ca 0.02 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.63 2iag h LEU 133 Cb 0.95 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 2iag h LEU 133 CO 0.08 0.60 0.45 -0.61 -0.34 0.00 0.00 178.44 178.62 2iag h GLN 134 N 0.68 0.89 -0.51 1.25 5.75 -1.30 0.10 115.11 121.98 2iag h GLN 134 Ca 0.18 -0.05 0.03 0.00 -0.15 0.00 0.00 58.65 58.65 2iag h GLN 134 Cb 0.11 -0.20 -0.04 0.00 1.07 0.00 0.00 27.48 28.42 2iag h GLN 134 CO -0.02 0.59 0.29 0.00 -2.65 0.00 0.00 178.83 177.03 2iag h ALA 135 N 1.26 0.66 -0.57 3.38 0.00 -1.10 -1.59 119.26 121.30 2iag h ALA 135 Ca 0.26 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2iag h ALA 135 Cb -0.09 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2iag h ALA 135 CO -0.06 -0.03 0.23 -0.07 0.00 0.00 0.00 179.25 179.32 2iag h LEU 136 N 0.57 0.78 -0.53 0.00 3.38 -0.78 -2.00 115.31 116.74 2iag h LEU 136 Ca 0.21 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2iag h LEU 136 Cb 0.07 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2iag h LEU 136 CO -0.12 0.73 0.30 0.74 0.09 0.00 0.00 178.44 180.19 2iag h THR 137 N 0.78 1.17 -0.50 0.22 2.02 -0.58 0.16 112.91 116.18 2iag h THR 137 Ca 0.19 -0.40 -0.08 0.00 0.77 0.00 0.00 66.41 66.89 2iag h THR 137 Cb 0.19 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 2iag h THR 137 CO -0.02 0.18 0.02 -0.33 0.37 0.00 0.00 175.52 175.74 2iag h GLU 138 N 0.70 0.87 -0.38 6.66 5.08 -1.23 -2.22 114.58 124.06 2iag h GLU 138 Ca 0.19 -0.27 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 2iag h GLU 138 Cb 0.02 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 2iag h GLU 138 CO -0.03 0.90 -0.07 0.00 -1.00 0.00 0.00 179.01 178.80 2iag h ALA 139 N 0.94 1.17 -0.42 3.43 0.00 -1.09 -2.65 119.26 120.65 2iag h ALA 139 Ca 0.14 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2iag h ALA 139 Cb 0.49 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2iag h ALA 139 CO 0.02 0.53 -0.03 1.98 0.00 0.00 0.00 179.25 181.75 2iag h MET 140 N 0.59 0.77 -0.21 0.00 1.85 -0.54 0.35 114.93 117.74 2iag h MET 140 Ca 0.11 -0.26 -0.01 0.00 -0.61 0.00 0.00 59.70 58.93 2iag h MET 140 Cb 0.48 -0.06 -0.01 0.00 0.43 0.00 0.00 31.60 32.44 2iag h MET 140 CO 0.03 0.86 0.11 -0.92 -0.40 0.00 0.00 176.91 176.59 2iag h TYR 141 N 0.60 0.30 -0.54 1.39 3.20 -1.28 0.25 116.97 120.90 2iag h TYR 141 Ca 0.12 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.90 2iag h TYR 141 Cb 0.53 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 2iag h TYR 141 CO 0.04 0.28 0.04 0.00 -1.64 0.00 0.00 178.16 176.89 2iag h THR 142 N 0.22 1.25 -0.41 1.81 1.03 -1.38 -1.65 112.91 113.78 2iag h THR 142 Ca 0.07 -1.00 -0.10 0.00 -0.01 0.00 0.00 66.41 65.38 2iag h THR 142 Cb 0.09 0.79 -0.01 0.00 -1.07 0.00 0.00 68.15 67.95 2iag h THR 142 CO -0.01 0.36 -0.12 0.78 -0.01 0.00 0.00 175.52 176.52 2iag h ASN 143 N 0.83 0.81 -0.19 0.00 2.35 -0.57 0.13 115.58 118.94 2iag h ASN 143 Ca 0.16 -0.37 0.01 0.00 -0.55 0.00 0.00 56.30 55.55 2iag h ASN 143 Cb 0.44 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 2iag h ASN 143 CO 0.02 1.00 0.08 -0.07 -1.65 0.00 0.00 177.43 176.81 2iag h LEU 144 N 0.62 0.12 -0.31 1.61 3.38 -0.40 -0.77 115.31 119.55 2iag h LEU 144 Ca 0.10 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2iag h LEU 144 Cb 0.66 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 2iag h LEU 144 CO 0.05 0.10 0.19 -0.74 0.09 0.00 0.00 178.44 178.13 2iag h HIS 145 N 0.19 0.41 -0.34 1.13 2.76 -1.29 -1.23 115.15 116.78 2iag h HIS 145 Ca 0.08 0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.28 2iag h HIS 145 Cb 0.03 -0.13 -0.03 0.00 1.55 0.00 0.00 27.41 28.83 2iag h HIS 145 CO -0.10 0.29 0.16 0.00 -1.30 0.00 0.00 177.93 176.97 2iag h ALA 146 N 1.09 0.41 0.05 5.26 0.00 -0.69 -0.96 119.26 124.42 2iag h ALA 146 Ca 0.11 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2iag h ALA 146 Cb -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2iag h ALA 146 CO -0.02 -0.22 -0.02 0.28 0.00 0.00 0.00 179.25 179.26 2iag h VAL 147 N 0.33 1.28 0.70 0.00 2.07 -1.06 -0.51 116.25 119.07 2iag h VAL 147 Ca 0.14 -1.23 -0.03 0.00 0.82 0.00 0.00 66.70 66.40 2iag h VAL 147 Cb 0.07 2.08 0.01 0.00 -1.52 0.00 0.00 31.29 31.92 2iag h VAL 147 CO -0.11 0.30 -0.34 0.25 0.02 0.00 0.00 177.57 177.69 2iag h LEU 148 N -0.63 -0.80 -1.43 2.57 7.12 -1.25 0.06 115.31 120.95 2iag h LEU 148 Ca -0.01 0.03 -0.00 0.00 0.13 0.00 0.00 57.88 58.03 2iag h LEU 148 Cb 0.55 0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 40.86 2iag h LEU 148 CO 0.01 -0.54 0.29 -0.07 -0.13 0.00 0.00 178.44 178.01 2iag h LEU 149 N -1.01 0.60 0.55 2.25 -0.00 -1.31 0.67 115.31 117.05 2iag h LEU 149 Ca -0.10 -0.03 -0.03 0.00 -0.00 0.00 0.00 57.88 57.72 2iag h LEU 149 Cb 0.72 -0.15 0.01 0.00 -0.00 0.00 0.00 40.66 41.24 2iag h LEU 149 CO 0.16 0.47 -0.26 1.23 -0.00 0.00 0.00 178.44 180.04 2iag h GLY 150 N 0.74 -0.77 0.47 0.83 0.00 -1.08 -0.62 103.07 102.65 2iag h GLY 150 Ca 0.18 0.28 0.09 0.00 0.00 0.00 0.00 47.33 47.88 2iag h GLY 150 CO -0.03 -0.28 0.29 -0.55 0.00 0.00 0.00 176.54 175.97 2iag h ASP 151 N -0.87 0.35 -0.14 0.19 5.19 -0.70 -1.52 116.42 118.92 2iag h ASP 151 Ca -0.07 0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.36 2iag h ASP 151 Cb 0.61 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.13 2iag h ASP 151 CO 0.12 0.21 -0.06 0.00 -3.12 0.00 0.00 179.24 176.39 2iag h ALA 152 N 1.40 0.19 -0.47 3.45 0.00 -0.86 -1.80 119.26 121.17 2iag h ALA 152 Ca 0.31 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 55.00 2iag h ALA 152 Cb 0.34 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2iag h ALA 152 CO -0.27 -0.02 0.23 1.15 0.00 0.00 0.00 179.25 180.34 2iag h THR 153 N -0.06 0.96 0.00 0.00 2.02 -1.03 -1.40 112.91 113.40 2iag h THR 153 Ca 0.03 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 2iag h THR 153 Cb 0.53 0.46 -0.00 0.00 -1.74 0.00 0.00 68.15 67.39 2iag h THR 153 CO 0.02 0.08 -0.08 -0.08 0.37 0.00 0.00 175.52 175.84 2iag h GLU 154 N 0.46 0.00 -0.00 6.66 4.81 -1.22 -2.40 114.58 122.88 2iag h GLU 154 Ca 0.20 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2iag h GLU 154 Cb 0.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2iag h GLU 154 CO -0.15 0.08 -0.23 0.00 -0.73 0.00 0.00 179.01 177.98 2iag n ALA 155 N -2.50 2.97 0.00 2.92 0.00 -0.58 -5.04 120.51 118.27 2iag n ALA 155 Ca -0.03 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.13 2iag n ALA 155 Cb 0.16 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.34 2iag n ALA 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2iag n GLY 156 N 1.40 2.14 1.22 0.00 0.00 -0.87 -4.79 105.19 104.28 2iag n GLY 156 Ca 0.10 -1.94 0.04 0.00 0.00 0.00 0.00 46.02 44.22 2iag n GLY 156 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2iag n SER 157 N 0.00 3.45 -1.48 1.61 3.41 -1.26 -4.57 113.62 114.78 2iag n SER 157 Ca 0.00 -2.48 0.00 0.00 -0.26 0.00 0.00 58.87 56.13 2iag n SER 157 Cb 0.00 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 2iag n SER 157 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2iag n GLY 158 N 0.34 2.57 3.78 5.00 0.00 -1.26 -4.73 105.19 110.88 2iag n GLY 158 Ca 0.14 -2.12 -0.36 0.00 0.00 0.00 0.00 46.02 43.69 2iag n GLY 158 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2iag s TRP 159 N 0.91 2.79 -0.02 1.61 0.52 -1.26 -4.48 118.94 119.02 2iag s TRP 159 Ca 0.00 1.55 0.01 0.00 0.02 0.00 0.00 56.10 57.68 2iag s TRP 159 Cb 0.00 -3.29 0.01 0.00 -1.15 0.00 0.00 33.47 29.04 2iag s TRP 159 CO 0.00 -1.43 -0.04 -1.01 0.02 0.00 0.00 176.95 174.48 2iag s HIS 160 N -1.72 0.51 -0.06 -1.98 3.76 -0.34 -4.95 115.29 110.51 2iag s HIS 160 Ca 0.69 -0.10 -0.13 0.00 -0.15 0.00 0.00 55.06 55.36 2iag s HIS 160 Cb -0.24 -0.39 -0.05 0.00 1.11 0.00 0.00 32.58 33.00 2iag s HIS 160 CO 0.28 -0.06 0.34 -1.21 -0.85 0.00 0.00 174.74 173.25 2iag s GLU 161 N 0.24 3.91 -0.27 1.40 2.02 -1.26 -1.99 118.70 122.75 2iag s GLU 161 Ca -0.03 0.26 -0.25 0.00 0.02 0.00 0.00 54.97 54.98 2iag s GLU 161 Cb -0.06 -3.26 0.10 0.00 0.10 0.00 0.00 34.13 31.00 2iag s GLU 161 CO -0.00 0.60 0.89 1.41 0.02 0.00 0.00 175.26 178.18 2iag s MET 162 N -0.71 0.66 0.34 1.61 1.75 -0.77 -5.02 119.30 117.16 2iag s MET 162 Ca 0.21 0.75 -0.29 0.00 -1.25 0.00 0.00 55.69 55.11 2iag s MET 162 Cb -0.15 0.32 -0.10 0.00 2.84 0.00 0.00 34.83 37.74 2iag s MET 162 CO 0.10 -0.09 1.38 0.20 -0.65 0.00 0.00 175.02 175.96 2iag s GLY 163 N 0.23 2.90 0.31 2.11 0.00 -1.26 0.04 107.32 111.65 2iag s GLY 163 Ca 0.01 1.37 0.04 0.00 0.00 0.00 0.00 44.72 46.14 2iag s GLY 163 CO -0.03 2.06 1.78 -2.00 0.00 0.00 0.00 173.10 174.91 2iag h LEU 164 N 3.46 0.43 -0.08 0.66 5.85 -0.80 0.43 115.31 125.26 2iag h LEU 164 Ca -0.49 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.08 2iag h LEU 164 Cb 1.23 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.14 2iag h LEU 164 CO 0.66 0.64 -0.03 0.25 -0.34 0.00 0.00 178.44 179.62 2iag h LEU 165 N 0.39 0.16 -0.48 2.25 5.85 -1.92 0.11 115.31 121.67 2iag h LEU 165 Ca 0.07 -0.39 0.10 0.00 0.84 0.00 0.00 57.88 58.49 2iag h LEU 165 Cb 0.57 -0.04 -0.10 0.00 0.37 0.00 0.00 40.66 41.46 2iag h LEU 165 CO 0.04 0.52 -0.15 -0.78 -0.34 0.00 0.00 178.44 177.72 2iag h ASP 166 N -0.20 -0.55 0.67 1.25 1.82 -1.91 0.41 116.42 117.92 2iag h ASP 166 Ca 0.02 0.16 -0.03 0.00 -0.39 0.00 0.00 57.03 56.79 2iag h ASP 166 Cb 0.45 0.34 -0.01 0.00 0.68 0.00 0.00 39.33 40.79 2iag h ASP 166 CO 0.01 -0.19 -0.43 0.15 -1.61 0.00 0.00 179.24 177.17 2iag h PHE 167 N -0.04 -1.14 -0.36 0.28 3.57 -0.80 -0.88 116.94 117.57 2iag h PHE 167 Ca 0.23 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.67 2iag h PHE 167 Cb 0.40 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 39.53 2iag h PHE 167 CO -0.44 -0.64 0.04 0.77 -2.23 0.00 0.00 178.31 175.81 2iag h SER 168 N -1.04 0.59 -0.31 0.41 0.02 -0.47 -2.59 113.55 110.16 2iag h SER 168 Ca -0.09 -0.28 -0.10 0.00 -0.84 0.00 0.00 61.79 60.49 2iag h SER 168 Cb 0.84 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.22 2iag h SER 168 CO 0.08 0.72 -0.19 0.22 -1.14 0.00 0.00 176.83 176.51 2iag h TYR 169 N 0.44 0.78 -0.44 3.45 5.03 -0.22 -2.68 116.97 123.33 2iag h TYR 169 Ca 0.11 -0.21 -0.05 0.00 2.58 0.00 0.00 58.73 61.16 2iag h TYR 169 Cb 0.39 -0.18 -0.02 0.00 1.55 0.00 0.00 36.73 38.48 2iag h TYR 169 CO 0.03 0.92 0.07 0.66 -1.32 0.00 0.00 178.16 178.51 2iag h SER 170 N 0.42 0.71 -0.09 -2.11 4.64 -1.07 -2.03 113.55 114.02 2iag h SER 170 Ca 0.06 -0.26 -0.14 0.00 -0.47 0.00 0.00 61.79 60.98 2iag h SER 170 Cb 0.74 -0.19 0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2iag h SER 170 CO 0.05 0.79 -0.48 -0.26 -0.87 0.00 0.00 176.83 176.06 2iag h PHE 171 N 0.60 0.66 -0.09 4.77 0.04 -1.47 -2.01 116.94 119.42 2iag h PHE 171 Ca 0.13 -0.29 -0.00 0.00 2.80 0.00 0.00 57.97 60.61 2iag h PHE 171 Cb 0.39 -0.10 -0.00 0.00 2.20 0.00 0.00 35.95 38.43 2iag h PHE 171 CO 0.03 1.07 0.05 -0.07 -0.60 0.00 0.00 178.31 178.79 2iag h LEU 172 N 0.06 0.12 -0.33 1.54 3.38 -1.52 -2.08 115.31 116.47 2iag h LEU 172 Ca -0.04 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 2iag h LEU 172 Cb 1.14 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 2iag h LEU 172 CO 0.10 0.17 0.06 0.25 0.09 0.00 0.00 178.44 179.11 2iag h LEU 173 N 0.05 0.53 -0.27 1.67 6.46 -1.44 0.37 115.31 122.68 2iag h LEU 173 Ca 0.03 -0.26 0.00 0.00 -0.12 0.00 0.00 57.88 57.54 2iag h LEU 173 Cb 0.08 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 39.86 2iag h LEU 173 CO -0.01 0.65 0.17 0.03 -0.62 0.00 0.00 178.44 178.67 2iag h ARG 174 N 0.38 0.36 -0.27 1.25 3.08 -1.38 0.17 114.38 117.96 2iag h ARG 174 Ca 0.10 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 60.03 2iag h ARG 174 Cb 0.35 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 2iag h ARG 174 CO 0.01 0.26 -0.23 0.00 -1.07 0.00 0.00 179.97 178.93 2iag h ALA 175 N 1.08 1.09 -0.26 0.04 0.00 -1.31 -2.21 119.26 117.68 2iag h ALA 175 Ca 0.10 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 2iag h ALA 175 Cb -0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2iag h ALA 175 CO -0.02 0.56 -0.35 0.78 0.00 0.00 0.00 179.25 180.23 2iag h GLY 176 N 1.01 0.75 0.52 0.00 0.00 -0.63 -0.72 103.07 103.99 2iag h GLY 176 Ca 0.07 -0.82 0.04 0.00 0.00 0.00 0.00 47.33 46.61 2iag h GLY 176 CO 0.05 0.74 -0.15 -1.82 0.00 0.00 0.00 176.54 175.36 2iag h TYR 177 N 0.41 -0.39 -0.42 5.60 3.20 -0.61 -0.72 116.97 124.05 2iag h TYR 177 Ca 0.03 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.86 2iag h TYR 177 Cb 0.93 0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.37 2iag h TYR 177 CO 0.08 -0.22 0.01 -0.07 -1.64 0.00 0.00 178.16 176.32 2iag h LEU 178 N -0.21 0.63 0.10 2.82 3.38 -1.36 0.23 115.31 120.90 2iag h LEU 178 Ca 0.08 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2iag h LEU 178 Cb 0.32 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2iag h LEU 178 CO -0.21 0.70 -0.05 0.74 0.09 0.00 0.00 178.44 179.71 2iag h THR 179 N 0.63 1.06 -0.01 0.22 2.02 -0.88 -0.00 112.91 115.95 2iag h THR 179 Ca 0.13 -0.59 -0.17 0.00 0.77 0.00 0.00 66.41 66.55 2iag h THR 179 Cb 0.38 1.44 0.01 0.00 -1.74 0.00 0.00 68.15 68.24 2iag h THR 179 CO 0.01 0.14 -0.64 -0.07 0.37 0.00 0.00 175.52 175.34 2iag h LEU 180 N -0.40 0.59 -1.20 2.58 3.38 -1.06 -3.33 115.31 115.86 2iag h LEU 180 Ca -0.01 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.21 2iag h LEU 180 Cb 0.34 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2iag h LEU 180 CO 0.02 1.25 -0.24 -1.22 0.09 0.00 0.00 178.44 178.34 2iag n TYR 181 N -4.18 0.00 0.00 1.13 4.01 0.79 -2.64 117.16 116.27 2iag n TYR 181 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 2iag n TYR 181 Cb 0.69 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.70 2iag n TYR 181 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2iag n GLY 182 N 1.36 0.22 3.60 2.72 0.00 -0.01 -4.74 105.19 108.33 2iag n GLY 182 Ca 0.12 -1.91 -0.27 0.00 0.00 0.00 0.00 46.02 43.97 2iag n GLY 182 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2iag s ILE 183 N -1.56 1.58 0.20 -0.61 -4.36 0.11 -4.43 121.20 112.13 2iag s ILE 183 Ca 0.00 -2.00 -0.09 0.00 -0.26 0.00 0.00 60.65 58.30 2iag s ILE 183 Cb 0.00 -2.77 0.13 0.00 1.25 0.00 0.00 42.46 41.07 2iag s ILE 183 CO 0.00 0.00 1.78 -0.08 0.24 0.00 0.00 174.94 176.88 2iag h GLU 184 N 1.78 1.07 -1.86 0.37 4.57 -1.84 0.25 114.58 118.92 2iag h GLU 184 Ca -0.43 -0.16 -0.01 0.00 -1.18 0.00 0.00 59.36 57.58 2iag h GLU 184 Cb 1.26 -0.19 -0.22 0.00 -0.16 0.00 0.00 28.75 29.44 2iag h GLU 184 CO 0.76 0.84 0.26 0.00 -1.18 0.00 0.00 179.01 179.69 2iag s ALA 185 N -5.67 -1.84 -1.62 2.92 0.00 -1.26 -4.46 121.76 109.84 2iag s ALA 185 Ca -0.13 1.76 0.15 0.00 0.00 0.00 0.00 51.96 53.74 2iag s ALA 185 Cb 0.15 -0.87 0.07 0.00 0.00 0.00 0.00 23.12 22.46 2iag s ALA 185 CO 0.81 -0.32 0.89 -0.11 0.00 0.00 0.00 175.76 177.03 2iag n LEU 186 N 1.89 1.92 0.00 0.00 0.00 -1.26 -2.45 117.00 117.10 2iag n LEU 186 Ca -0.15 -0.90 0.00 0.00 0.00 0.00 0.00 56.01 54.97 2iag n LEU 186 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.98 2iag n LEU 186 CO 0.10 0.36 0.36 -2.65 0.00 0.00 0.00 177.39 175.56 2iag n PRO 187 N 0.41 0.00 -1.06 1.96 -0.02 -1.26 -5.04 135.00 129.98 2iag n PRO 187 Ca 0.07 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 2iag n PRO 187 Cb 0.34 -1.23 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 2iag n PRO 187 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2iag n ARG 188 N -1.88 0.00 -4.69 -0.52 0.63 -1.02 -5.15 116.66 104.02 2iag n ARG 188 Ca 0.00 0.35 -0.31 0.00 -0.92 0.00 0.00 57.85 56.97 2iag n ARG 188 Cb 0.00 -0.71 -0.08 0.00 0.45 0.00 0.00 32.46 32.13 2iag n ARG 188 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 2iag s THR 189 N 0.00 0.99 0.25 5.15 -4.23 -1.26 -5.01 115.64 111.53 2iag s THR 189 Ca 0.00 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 2iag s THR 189 Cb 0.00 -2.21 0.01 0.00 1.34 0.00 0.00 72.50 71.64 2iag s THR 189 CO 0.00 0.00 1.63 1.12 -0.54 0.00 0.00 174.62 176.83 2iag h HIS 190 N 1.47 0.48 -0.33 3.99 2.07 -2.01 -2.55 115.15 118.27 2iag h HIS 190 Ca -0.41 -0.14 -0.14 0.00 -2.85 0.00 0.00 60.37 56.83 2iag h HIS 190 Cb 1.30 -0.10 -0.01 0.00 2.57 0.00 0.00 27.41 31.18 2iag h HIS 190 CO 1.54 0.76 -0.33 0.93 -3.07 0.00 0.00 177.93 177.76 2iag h GLU 191 N 0.34 0.80 -0.35 5.12 3.07 -1.98 -1.91 114.58 119.66 2iag h GLU 191 Ca 0.03 -0.42 -0.14 0.00 -0.50 0.00 0.00 59.36 58.32 2iag h GLU 191 Cb 0.88 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.80 2iag h GLU 191 CO 0.07 1.06 -0.34 0.66 -1.40 0.00 0.00 179.01 179.06 2iag h SER 192 N 0.58 0.91 -0.28 1.42 4.64 -1.96 -1.47 113.55 117.40 2iag h SER 192 Ca 0.05 -0.46 -0.11 0.00 -0.47 0.00 0.00 61.79 60.79 2iag h SER 192 Cb 0.91 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 2iag h SER 192 CO 0.08 1.19 -0.22 1.56 -0.87 0.00 0.00 176.83 178.57 2iag h GLN 193 N 0.65 0.75 -0.61 4.77 4.20 -1.51 0.23 115.11 123.60 2iag h GLN 193 Ca 0.06 -0.30 -0.07 0.00 0.06 0.00 0.00 58.65 58.40 2iag h GLN 193 Cb 0.93 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.65 2iag h GLN 193 CO 0.09 0.91 0.12 0.00 -0.67 0.00 0.00 178.83 179.27 2iag h ALA 194 N 1.09 1.05 -0.45 3.87 0.00 -1.32 -1.51 119.26 122.00 2iag h ALA 194 Ca 0.09 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 2iag h ALA 194 Cb 0.73 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2iag h ALA 194 CO 0.06 0.62 -0.21 0.37 0.00 0.00 0.00 179.25 180.08 2iag h GLN 195 N 0.93 0.91 -0.90 0.00 5.75 -0.82 -2.46 115.11 118.53 2iag h GLN 195 Ca 0.19 -0.38 0.12 0.00 -0.15 0.00 0.00 58.65 58.43 2iag h GLN 195 Cb 0.38 -0.04 -0.08 0.00 1.07 0.00 0.00 27.48 28.81 2iag h GLN 195 CO 0.01 1.03 0.52 -0.44 -2.65 0.00 0.00 178.83 177.30 2iag h ASP 196 N 0.79 0.74 -0.21 -0.69 3.32 -0.15 0.04 116.42 120.26 2iag h ASP 196 Ca 0.11 0.06 -0.09 0.00 0.02 0.00 0.00 57.03 57.12 2iag h ASP 196 Cb 0.76 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 2iag h ASP 196 CO 0.06 0.38 -0.23 0.03 -1.72 0.00 0.00 179.24 177.76 2iag h ARG 197 N 0.83 0.52 0.26 3.56 3.08 -1.13 -1.49 114.38 120.01 2iag h ARG 197 Ca 0.45 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 2iag h ARG 197 Cb 0.48 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.55 2iag h ARG 197 CO -0.28 0.87 -0.13 0.28 -1.07 0.00 0.00 179.97 179.65 2iag h VAL 198 N 0.20 0.79 0.22 2.04 2.07 -1.21 -2.31 116.25 118.04 2iag h VAL 198 Ca 0.03 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.22 2iag h VAL 198 Cb 0.79 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2iag h VAL 198 CO 0.06 0.07 -0.19 -0.74 0.02 0.00 0.00 177.57 176.79 2iag h HIS 199 N -0.52 -0.50 -0.28 1.57 -0.00 -1.06 -2.12 115.15 112.24 2iag h HIS 199 Ca -0.04 0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.34 2iag h HIS 199 Cb 0.39 0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 27.98 2iag h HIS 199 CO -0.01 -0.29 0.18 0.66 -0.00 0.00 0.00 177.93 178.47 2iag h SER 200 N -0.43 0.30 -0.02 3.26 4.64 -1.35 -1.23 113.55 118.72 2iag h SER 200 Ca -0.01 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.16 2iag h SER 200 Cb 0.39 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 2iag h SER 200 CO -0.03 0.22 -0.48 0.00 -0.87 0.00 0.00 176.83 175.67 2iag h ALA 201 N 1.83 0.77 0.24 5.18 0.00 -1.16 -0.29 119.26 125.83 2iag h ALA 201 Ca 0.10 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 2iag h ALA 201 Cb -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2iag h ALA 201 CO -0.02 0.67 -0.11 0.22 0.00 0.00 0.00 179.25 180.00 2iag h ASP 202 N 0.45 -0.27 -0.47 0.00 3.58 -0.58 -0.47 116.42 118.66 2iag h ASP 202 Ca 0.02 -0.08 0.09 0.00 0.42 0.00 0.00 57.03 57.49 2iag h ASP 202 Cb 1.00 0.07 -0.09 0.00 1.72 0.00 0.00 39.33 42.03 2iag h ASP 202 CO 0.09 -0.09 -0.10 0.58 -2.88 0.00 0.00 179.24 176.85 2iag h VAL 203 N -0.44 0.54 -0.13 2.25 2.07 -1.24 -1.52 116.25 117.79 2iag h VAL 203 Ca -0.03 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.50 2iag h VAL 203 Cb 0.33 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 2iag h VAL 203 CO 0.05 0.00 0.01 0.15 0.02 0.00 0.00 177.57 177.81 2iag h PHE 204 N 0.02 0.01 -0.44 1.57 3.57 -0.83 0.34 116.94 121.18 2iag h PHE 204 Ca 0.23 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.71 2iag h PHE 204 Cb 0.35 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 2iag h PHE 204 CO -0.39 -0.00 0.15 0.45 -2.23 0.00 0.00 178.31 176.29 2iag h HIS 205 N 0.06 0.69 -0.56 0.41 3.86 -0.83 0.59 115.15 119.36 2iag h HIS 205 Ca 0.06 -0.06 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 2iag h HIS 205 Cb 0.06 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.30 2iag h HIS 205 CO -0.13 0.61 0.23 1.15 0.86 0.00 0.00 177.93 180.65 2iag h THR 206 N 0.57 1.22 -0.78 2.45 2.02 -1.19 -2.84 112.91 114.36 2iag h THR 206 Ca 0.14 -0.68 0.07 0.00 0.77 0.00 0.00 66.41 66.71 2iag h THR 206 Cb 0.23 0.62 -0.06 0.00 -1.74 0.00 0.00 68.15 67.20 2iag h THR 206 CO -0.01 0.26 0.46 0.15 0.37 0.00 0.00 175.52 176.76 2iag h PHE 207 N 0.77 0.85 -0.10 3.16 3.57 0.17 -2.20 116.94 123.16 2iag h PHE 207 Ca 0.19 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 2iag h PHE 207 Cb 0.19 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 2iag h PHE 207 CO 0.01 0.41 -0.07 0.00 -2.23 0.00 0.00 178.31 176.43 2iag h ARG 208 N 0.84 0.15 -0.27 1.11 2.47 -0.65 0.74 114.38 118.76 2iag h ARG 208 Ca 0.35 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 59.01 2iag h ARG 208 Cb 0.21 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 2iag h ARG 208 CO -0.19 0.23 0.03 1.96 0.56 0.00 0.00 179.97 182.56 2iag h GLN 209 N 0.15 0.45 0.28 0.04 4.20 -1.27 -0.36 115.11 118.60 2iag h GLN 209 Ca 0.03 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 2iag h GLN 209 Cb 0.22 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2iag h GLN 209 CO 0.01 0.58 -0.14 1.25 -0.67 0.00 0.00 178.83 179.86 2iag h LEU 210 N 0.26 -0.34 -1.10 1.46 6.46 -1.20 -2.95 115.31 117.90 2iag h LEU 210 Ca 0.08 0.01 0.10 0.00 -0.12 0.00 0.00 57.88 57.95 2iag h LEU 210 Cb 0.36 0.09 -0.07 0.00 -0.73 0.00 0.00 40.66 40.31 2iag h LEU 210 CO 0.01 -0.24 0.61 -0.78 -0.62 0.00 0.00 178.44 177.42 2iag h ASP 211 N -0.38 0.89 -0.20 1.25 3.58 -0.76 -0.01 116.42 120.78 2iag h ASP 211 Ca -0.04 0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.37 2iag h ASP 211 Cb 0.30 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.18 2iag h ASP 211 CO 0.05 0.52 -0.08 0.03 -2.88 0.00 0.00 179.24 176.89 2iag h ARG 212 N 0.99 0.55 0.00 0.28 3.08 -0.99 -3.18 114.38 115.11 2iag h ARG 212 Ca 0.44 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.34 2iag h ARG 212 Cb 0.37 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2iag h ARG 212 CO -0.20 0.64 -0.57 1.28 -1.07 0.00 0.00 179.97 180.05 2iag n LEU 213 N -4.22 0.55 -0.24 3.04 4.32 -0.11 -4.48 117.00 115.86 2iag n LEU 213 Ca 0.01 0.07 -0.07 0.00 -0.02 0.00 0.00 56.01 56.00 2iag n LEU 213 Cb 0.30 -0.22 0.04 0.00 -1.62 0.00 0.00 43.42 41.92 2iag n LEU 213 CO 0.40 0.06 0.98 0.25 -1.22 0.00 0.00 177.39 177.86 2iag h LEU 214 N 0.00 0.97 0.45 2.23 6.46 -1.28 -1.56 115.31 122.59 2iag h LEU 214 Ca 0.00 -0.20 -0.01 0.00 -0.12 0.00 0.00 57.88 57.55 2iag h LEU 214 Cb 0.59 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 40.24 2iag h LEU 214 CO 0.00 0.91 -0.47 -0.65 -0.62 0.00 0.00 178.44 177.61 2iag h PRO 215 N 0.97 -0.91 -0.81 5.25 0.11 -1.80 -0.93 132.00 133.89 2iag h PRO 215 Ca 0.22 0.06 0.18 0.00 0.11 0.00 0.00 66.00 66.57 2iag h PRO 215 Cb 0.28 0.21 -0.05 0.00 0.11 0.00 0.00 31.00 31.54 2iag h PRO 215 CO -0.01 -0.60 0.54 0.87 -0.21 0.00 0.00 178.00 178.59 2iag h LYS 216 N -0.94 0.36 0.09 1.05 6.56 -1.83 -0.21 116.57 121.64 2iag h LYS 216 Ca -0.05 -0.02 -0.00 0.00 -1.06 0.00 0.00 60.65 59.51 2iag h LYS 216 Cb 0.83 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 32.41 2iag h LYS 216 CO -0.07 0.24 -0.04 1.25 -2.06 0.00 0.00 179.45 178.76 2iag h LEU 217 N 0.37 -0.10 -1.30 2.94 5.85 -1.04 0.55 115.31 122.58 2iag h LEU 217 Ca 0.41 -0.39 0.06 0.00 0.84 0.00 0.00 57.88 58.80 2iag h LEU 217 Cb 1.03 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.04 2iag h LEU 217 CO -0.13 0.36 0.52 0.00 -0.34 0.00 0.00 178.44 178.84 2iag h ALA 218 N 0.26 1.64 0.00 1.25 0.00 -0.64 -1.78 119.26 119.98 2iag h ALA 218 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2iag h ALA 218 Cb 0.48 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2iag h ALA 218 CO 0.02 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.51 2iag h ARG 219 N 0.85 0.00 -1.18 0.00 3.08 -1.03 -3.48 114.38 112.63 2iag h ARG 219 Ca 0.34 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.32 2iag h ARG 219 Cb 0.24 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.30 2iag h ARG 219 CO -0.12 0.00 -0.10 0.41 -1.07 0.00 0.00 179.97 179.09 2iag n GLY 220 N 1.13 0.49 0.16 0.04 0.00 -0.63 -4.99 105.19 101.39 2iag n GLY 220 Ca 0.05 -0.63 0.05 0.00 0.00 0.00 0.00 46.02 45.49 2iag n GLY 220 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2iag n SER 221 N 1.04 2.39 -4.77 1.61 3.41 0.09 -5.03 113.62 112.35 2iag n SER 221 Ca -0.02 -2.53 -0.39 0.00 -0.26 0.00 0.00 58.87 55.67 2iag n SER 221 Cb 0.52 -0.24 -0.06 0.00 -0.26 0.00 0.00 64.21 64.17 2iag n SER 221 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2iag s LEU 222 N -1.92 4.53 0.91 1.04 1.43 -1.24 -5.01 118.68 118.41 2iag s LEU 222 Ca 0.19 1.73 -0.11 0.00 -1.03 0.00 0.00 54.13 54.91 2iag s LEU 222 Cb 0.15 -3.54 0.13 0.00 0.03 0.00 0.00 46.19 42.97 2iag s LEU 222 CO 0.03 0.13 1.11 -1.54 0.23 0.00 0.00 176.35 176.31 2iag n SER 223 N 1.28 0.27 -0.12 2.29 3.41 -1.26 -4.75 113.62 114.74 2iag n SER 223 Ca -0.03 0.44 -0.05 0.00 -0.26 0.00 0.00 58.87 58.96 2iag n SER 223 Cb 0.49 -1.47 0.03 0.00 -0.26 0.00 0.00 64.21 63.00 2iag n SER 223 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2iag h VAL 224 N -1.76 0.83 -0.40 -3.33 2.07 -1.99 -0.29 116.25 111.38 2iag h VAL 224 Ca -0.43 -0.08 0.07 0.00 0.82 0.00 0.00 66.70 67.07 2iag h VAL 224 Cb 1.27 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 31.55 2iag h VAL 224 CO 0.41 0.04 0.03 1.23 0.02 0.00 0.00 177.57 179.31 2iag h GLY 225 N 0.24 0.43 1.57 2.17 0.00 -1.99 -0.80 103.07 104.69 2iag h GLY 225 Ca 0.19 0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.47 2iag h GLY 225 CO -0.22 -0.08 -0.07 -0.55 0.00 0.00 0.00 176.54 175.62 2iag h ASP 226 N 0.14 0.50 -0.68 0.19 3.32 -1.83 -0.50 116.42 117.57 2iag h ASP 226 Ca 0.20 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 2iag h ASP 226 Cb 0.27 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 2iag h ASP 226 CO -0.30 0.62 0.15 0.11 -1.72 0.00 0.00 179.24 178.10 2iag h LYS 227 N 0.49 1.10 -0.23 3.56 1.57 -0.59 0.33 116.57 122.81 2iag h LYS 227 Ca 0.10 -0.27 -0.12 0.00 -1.87 0.00 0.00 60.65 58.49 2iag h LYS 227 Cb 0.43 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2iag h LYS 227 CO 0.02 0.98 -0.37 0.22 -0.57 0.00 0.00 179.45 179.74 2iag h ASP 228 N 1.04 0.53 -0.69 0.86 3.58 -0.75 -1.66 116.42 119.33 2iag h ASP 228 Ca 0.21 -0.22 -0.04 0.00 0.42 0.00 0.00 57.03 57.41 2iag h ASP 228 Cb 0.39 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 41.26 2iag h ASP 228 CO 0.01 0.85 0.28 -0.74 -2.88 0.00 0.00 179.24 176.76 2iag h HIS 229 N 0.42 1.04 -0.63 0.28 2.76 -0.71 -2.50 115.15 115.81 2iag h HIS 229 Ca 0.04 -0.07 -0.05 0.00 -2.20 0.00 0.00 60.37 58.09 2iag h HIS 229 Cb 0.84 -0.31 -0.03 0.00 1.55 0.00 0.00 27.41 29.46 2iag h HIS 229 CO 0.03 0.80 0.19 1.98 -1.30 0.00 0.00 177.93 179.63 2iag h MET 230 N 0.97 0.99 -0.76 5.26 1.85 -0.69 -2.02 114.93 120.53 2iag h MET 230 Ca 0.23 -0.22 0.06 0.00 -0.61 0.00 0.00 59.70 59.16 2iag h MET 230 Cb 0.19 -0.14 -0.06 0.00 0.43 0.00 0.00 31.60 32.03 2iag h MET 230 CO -0.02 0.87 0.45 0.00 -0.40 0.00 0.00 176.91 177.82 2iag h SER 232 N 0.83 0.88 -0.28 0.00 0.02 -1.00 0.38 113.55 114.38 2iag h SER 232 Ca 0.34 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 61.08 2iag h SER 232 Cb 0.17 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 2iag h SER 232 CO -0.17 0.82 0.06 0.58 -1.14 0.00 0.00 176.83 176.97 2iag h VAL 233 N 0.88 1.22 -0.35 2.27 2.07 -1.18 -1.16 116.25 120.00 2iag h VAL 233 Ca 0.21 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 2iag h VAL 233 Cb 0.22 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 2iag h VAL 233 CO -0.02 0.24 0.15 0.11 0.02 0.00 0.00 177.57 178.08 2iag h LYS 234 N 0.29 0.52 -0.67 1.57 1.57 -1.05 -2.04 116.57 116.76 2iag h LYS 234 Ca 0.09 -0.09 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 2iag h LYS 234 Cb 0.31 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 2iag h LYS 234 CO 0.00 0.50 0.42 0.77 -0.57 0.00 0.00 179.45 180.58 2iag h SER 235 N 0.43 0.70 -0.26 0.86 0.02 -0.86 0.54 113.55 114.97 2iag h SER 235 Ca 0.12 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2iag h SER 235 Cb 0.17 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2iag h SER 235 CO -0.01 0.49 0.15 -0.09 -1.14 0.00 0.00 176.83 176.23 2iag h ARG 236 N 0.83 0.36 -0.57 3.45 2.43 -1.01 -2.01 114.38 117.86 2iag h ARG 236 Ca 0.27 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.37 2iag h ARG 236 Cb 0.00 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 2iag h ARG 236 CO -0.10 0.30 0.23 -0.07 -1.51 0.00 0.00 179.97 178.81 2iag h LEU 237 N 0.32 0.76 -1.06 3.80 3.38 -1.05 -0.18 115.31 121.28 2iag h LEU 237 Ca 0.09 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2iag h LEU 237 Cb 0.04 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2iag h LEU 237 CO -0.02 0.68 -0.42 -0.50 0.09 0.00 0.00 178.44 178.27 2iag h TRP 238 N 0.82 0.11 -0.06 1.13 6.55 -0.67 -0.60 115.95 123.23 2iag h TRP 238 Ca 0.20 -0.03 -0.02 0.00 0.95 0.00 0.00 58.89 59.98 2iag h TRP 238 Cb 0.16 -0.02 -0.00 0.00 -0.86 0.00 0.00 29.16 28.44 2iag h TRP 238 CO 0.01 0.51 -0.06 0.87 -1.05 0.00 0.00 178.44 178.72 2iag h LYS 239 N 0.08 0.14 -0.69 0.49 1.79 -0.85 -2.83 116.57 114.70 2iag h LYS 239 Ca 0.00 -0.08 -0.00 0.00 -2.18 0.00 0.00 60.65 58.40 2iag h LYS 239 Cb 0.79 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.41 2iag h LYS 239 CO 0.06 0.60 0.42 -0.07 -1.08 0.00 0.00 179.45 179.38 2iag h LEU 240 N -0.31 0.82 -3.49 2.94 4.07 -0.79 -3.06 115.31 115.49 2iag h LEU 240 Ca 0.01 -0.04 -0.16 0.00 0.08 0.00 0.00 57.88 57.76 2iag h LEU 240 Cb 0.58 -0.21 -0.10 0.00 1.08 0.00 0.00 40.66 42.01 2iag h LEU 240 CO 0.01 0.63 0.11 0.18 -1.08 0.00 0.00 178.44 178.29 2iag n LEU 241 N -4.40 4.84 -4.75 1.67 4.32 -0.25 -4.75 117.00 113.67 2iag n LEU 241 Ca 0.07 -3.37 -0.36 0.00 -0.02 0.00 0.00 56.01 52.32 2iag n LEU 241 Cb 0.06 -0.66 0.04 0.00 -1.62 0.00 0.00 43.42 41.25 2iag n LEU 241 CO 0.37 0.93 0.87 -0.94 -1.22 0.00 0.00 177.39 177.40 2iag s SER 242 N -1.83 5.11 0.25 -1.43 1.04 -1.07 -4.65 113.70 111.13 2iag s SER 242 Ca 0.48 2.48 -0.03 0.00 0.48 0.00 0.00 55.95 59.35 2iag s SER 242 Cb 0.40 -2.61 0.45 0.00 0.10 0.00 0.00 66.02 64.36 2iag s SER 242 CO 0.07 -1.65 1.78 -0.65 0.98 0.00 0.00 173.24 173.77 2iag h PRO 243 N 0.92 0.66 -0.74 4.02 0.11 -1.90 -1.51 132.00 133.57 2iag h PRO 243 Ca -0.51 -0.04 0.11 0.00 0.11 0.00 0.00 66.00 65.67 2iag h PRO 243 Cb 1.31 -0.15 -0.08 0.00 0.11 0.00 0.00 31.00 32.19 2iag h PRO 243 CO 0.55 0.44 0.36 0.00 -0.21 0.00 0.00 178.00 179.14 2iag h ALA 244 N 1.50 1.03 -0.36 -0.75 0.00 -1.94 0.23 119.26 118.96 2iag h ALA 244 Ca 0.42 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.29 2iag h ALA 244 Cb 0.50 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2iag h ALA 244 CO -0.30 -0.08 -0.19 -0.09 0.00 0.00 0.00 179.25 178.59 2iag h ARG 245 N 0.58 0.76 0.00 0.00 9.65 -1.72 -3.10 114.38 120.55 2iag h ARG 245 Ca 0.37 -0.34 -0.06 0.00 -1.10 0.00 0.00 59.98 58.85 2iag h ARG 245 Cb 0.44 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.99 2iag h ARG 245 CO -0.30 0.96 -0.28 -0.07 2.80 0.00 0.00 179.97 183.08 2iag h LEU 246 N 0.55 0.00 -1.19 3.80 3.38 -0.81 -3.29 115.31 117.75 2iag h LEU 246 Ca 0.08 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.12 2iag h LEU 246 Cb 0.74 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 2iag h LEU 246 CO 0.06 0.28 0.57 0.00 0.09 0.00 0.00 178.44 179.44 2iag h ALA 247 N 1.72 1.58 -0.00 1.53 0.00 -0.88 -2.07 119.26 121.13 2iag h ALA 247 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2iag h ALA 247 Cb 0.80 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2iag h ALA 247 CO 0.04 0.28 -0.06 2.89 0.00 0.00 0.00 179.25 182.40 2iag n ARG 248 N -4.50 0.77 -2.89 0.00 1.85 -1.24 -4.89 116.66 105.75 2iag n ARG 248 Ca 0.14 -0.19 -0.34 0.00 -1.00 0.00 0.00 57.85 56.45 2iag n ARG 248 Cb 0.24 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 30.08 2iag n ARG 248 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 2iag s ARG 249 N -2.36 4.29 0.12 2.89 0.52 -0.78 -4.93 118.95 118.70 2iag s ARG 249 Ca 0.33 1.07 0.00 0.00 -0.52 0.00 0.00 55.73 56.62 2iag s ARG 249 Cb 0.21 -2.46 -0.04 0.00 0.52 0.00 0.00 34.95 33.17 2iag s ARG 249 CO 0.44 0.13 0.28 0.00 0.02 0.00 0.00 175.30 176.17 2iag s ALA 250 N -1.93 3.94 -1.16 2.13 0.00 0.89 -4.56 121.76 121.09 2iag s ALA 250 Ca 0.55 -0.88 -0.07 0.00 0.00 0.00 0.00 51.96 51.57 2iag s ALA 250 Cb -0.13 -1.87 0.01 0.00 0.00 0.00 0.00 23.12 21.13 2iag s ALA 250 CO 0.17 0.64 0.90 1.58 0.00 0.00 0.00 175.76 179.06 2iag n HIS 251 N -0.19 -2.27 -1.77 0.00 -0.00 -1.26 0.07 115.22 109.80 2iag n HIS 251 Ca -0.05 0.77 -0.41 0.00 -0.00 0.00 0.00 57.72 58.03 2iag n HIS 251 Cb 0.53 -4.28 -0.00 0.00 -0.00 0.00 0.00 29.99 26.23 2iag n HIS 251 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2iag n ARG 252 N -4.11 2.70 -1.15 1.57 1.74 -1.26 -4.31 116.66 111.84 2iag n ARG 252 Ca -0.01 0.95 -0.33 0.00 -0.77 0.00 0.00 57.85 57.69 2iag n ARG 252 Cb 0.56 -2.70 0.12 0.00 -1.02 0.00 0.00 32.46 29.42 2iag n ARG 252 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2iag s SER 253 N 0.04 3.76 0.29 0.55 1.04 -1.08 -4.89 113.70 113.41 2iag s SER 253 Ca 0.56 2.25 -0.02 0.00 0.48 0.00 0.00 55.95 59.22 2iag s SER 253 Cb -0.48 -2.58 0.42 0.00 0.10 0.00 0.00 66.02 63.49 2iag s SER 253 CO 0.60 -2.55 1.96 0.50 0.98 0.00 0.00 173.24 174.72 2iag h LYS 254 N -0.94 1.11 -0.62 4.02 1.63 -1.90 -2.58 116.57 117.30 2iag h LYS 254 Ca -0.46 -0.07 0.12 0.00 -0.85 0.00 0.00 60.65 59.39 2iag h LYS 254 Cb 1.28 -0.25 -0.12 0.00 -0.60 0.00 0.00 32.23 32.55 2iag h LYS 254 CO 0.47 0.74 -0.27 2.35 -3.45 0.00 0.00 179.45 179.29 2iag h TRP 255 N 1.14 -0.71 -0.18 1.91 7.01 -1.92 -0.34 115.95 122.87 2iag h TRP 255 Ca 0.30 0.07 -0.05 0.00 2.11 0.00 0.00 58.89 61.32 2iag h TRP 255 Cb -0.11 0.40 -0.00 0.00 -2.10 0.00 0.00 29.16 27.35 2iag h TRP 255 CO 0.00 -0.35 -0.09 1.25 -2.79 0.00 0.00 178.44 176.46 2iag h LEU 256 N -0.11 0.39 -0.48 0.65 5.85 -1.71 -2.31 115.31 117.58 2iag h LEU 256 Ca 0.27 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 2iag h LEU 256 Cb 0.53 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 2iag h LEU 256 CO -0.68 0.72 0.26 -0.33 -0.34 0.00 0.00 178.44 178.06 2iag h GLU 257 N 0.05 0.68 -0.01 1.25 5.08 -1.16 0.18 114.58 120.66 2iag h GLU 257 Ca 0.04 -0.08 -0.14 0.00 -1.00 0.00 0.00 59.36 58.17 2iag h GLU 257 Cb 0.58 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2iag h GLU 257 CO 0.03 0.54 -0.66 0.66 -1.00 0.00 0.00 179.01 178.58 2iag h SER 258 N 0.64 0.05 -0.12 1.42 4.64 -1.14 -1.30 113.55 117.74 2iag h SER 258 Ca 0.17 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.42 2iag h SER 258 Cb 0.07 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2iag h SER 258 CO -0.03 0.69 -0.06 0.22 -0.87 0.00 0.00 176.83 176.78 2iag h TYR 259 N 0.03 0.29 -0.51 4.77 3.20 -1.11 0.16 116.97 123.80 2iag h TYR 259 Ca -0.01 -0.07 0.10 0.00 3.14 0.00 0.00 58.73 61.89 2iag h TYR 259 Cb 1.16 -0.07 -0.10 0.00 1.54 0.00 0.00 36.73 39.27 2iag h TYR 259 CO 0.00 0.61 -0.16 -0.07 -1.64 0.00 0.00 178.16 176.90 2iag h LEU 260 N -0.11 -0.58 -0.30 2.82 3.38 -0.97 -0.40 115.31 119.15 2iag h LEU 260 Ca 0.02 0.16 0.01 0.00 0.09 0.00 0.00 57.88 58.17 2iag h LEU 260 Cb 0.53 0.36 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 2iag h LEU 260 CO 0.02 -0.20 0.16 0.25 0.09 0.00 0.00 178.44 178.76 2iag h LEU 261 N -0.04 0.26 -0.98 1.67 7.12 -1.08 -0.56 115.31 121.69 2iag h LEU 261 Ca 0.24 0.01 0.09 0.00 0.13 0.00 0.00 57.88 58.35 2iag h LEU 261 Cb 0.41 -0.05 -0.07 0.00 -0.53 0.00 0.00 40.66 40.42 2iag h LEU 261 CO -0.55 0.19 0.62 -0.74 -0.13 0.00 0.00 178.44 177.84 2iag h HIS 262 N 0.34 1.15 -0.09 1.25 2.76 -0.29 -1.71 115.15 118.55 2iag h HIS 262 Ca 0.12 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.26 2iag h HIS 262 Cb 0.01 -0.37 0.00 0.00 1.55 0.00 0.00 27.41 28.61 2iag h HIS 262 CO -0.08 0.53 -0.19 -0.07 -1.30 0.00 0.00 177.93 176.82 2iag h LEU 263 N 1.07 0.32 -1.58 0.26 3.38 -0.54 -3.08 115.31 115.14 2iag h LEU 263 Ca 0.45 -0.57 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 2iag h LEU 263 Cb 0.30 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2iag h LEU 263 CO -0.21 0.83 -0.19 1.05 0.09 0.00 0.00 178.44 180.00 2iag h GLU 264 N -0.18 0.00 0.00 1.13 4.11 -1.03 -1.70 114.58 116.92 2iag h GLU 264 Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.36 2iag h GLU 264 Cb 0.78 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 2iag h GLU 264 CO 0.04 0.19 -0.34 0.93 0.07 0.00 0.00 179.01 179.91 2iag h GLU 265 N 0.00 0.00 -0.00 1.06 5.08 -1.33 -2.56 114.58 116.83 2iag h GLU 265 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2iag h GLU 265 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2iag h GLU 265 CO 0.02 0.34 -0.10 -1.33 -1.00 0.00 0.00 179.01 176.94 2iag n MET 266 N -3.73 0.34 -1.48 2.33 2.81 -0.68 -4.94 117.12 111.77 2iag n MET 266 Ca -0.01 -0.08 -0.02 0.00 -1.81 0.00 0.00 57.70 55.78 2iag n MET 266 Cb 0.43 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.44 2iag n MET 266 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2iag n GLY 267 N 1.37 0.42 3.68 3.03 0.00 -0.97 -4.86 105.19 107.87 2iag n GLY 267 Ca 0.11 -0.93 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 2iag n GLY 267 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2iag s VAL 268 N -2.07 3.65 0.84 1.61 1.01 -0.95 -4.99 120.40 119.50 2iag s VAL 268 Ca 0.00 1.02 -0.13 0.00 0.00 0.00 0.00 61.98 62.87 2iag s VAL 268 Cb 0.00 -3.65 0.09 0.00 0.00 0.00 0.00 36.38 32.81 2iag s VAL 268 CO 0.00 -0.01 1.09 -1.54 0.00 0.00 0.00 175.10 174.63 2iag n SER 269 N 5.58 0.50 0.27 3.32 3.41 -1.26 -4.66 113.62 120.79 2iag n SER 269 Ca 0.14 0.53 0.16 0.00 -0.26 0.00 0.00 58.87 59.44 2iag n SER 269 Cb 0.43 -1.46 0.68 0.00 -0.26 0.00 0.00 64.21 63.60 2iag n SER 269 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2iag h GLU 270 N -1.15 0.00 -0.13 4.33 5.08 -1.98 0.10 114.58 120.84 2iag h GLU 270 Ca -0.45 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.88 2iag h GLU 270 Cb 1.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 2iag h GLU 270 CO 0.44 0.03 -0.02 0.93 -1.00 0.00 0.00 179.01 179.39 2iag h GLU 271 N 0.00 0.24 -0.17 2.33 5.08 -1.99 -2.26 114.58 117.81 2iag h GLU 271 Ca -0.00 -0.09 -0.18 0.00 -1.00 0.00 0.00 59.36 58.09 2iag h GLU 271 Cb 0.52 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 2iag h GLU 271 CO 0.00 0.52 -0.64 1.98 -1.00 0.00 0.00 179.01 179.87 2iag h MET 272 N -0.06 0.62 -0.55 2.33 4.05 -1.81 -3.05 114.93 116.46 2iag h MET 272 Ca 0.03 -0.44 0.08 0.00 -0.28 0.00 0.00 59.70 59.10 2iag h MET 272 Cb 0.43 0.07 -0.07 0.00 -0.80 0.00 0.00 31.60 31.23 2iag h MET 272 CO 0.01 1.06 0.19 1.96 0.23 0.00 0.00 176.91 180.36 2iag h GLN 273 N 0.45 0.35 -0.65 0.39 4.20 -0.81 -0.10 115.11 118.94 2iag h GLN 273 Ca -0.01 -0.02 0.11 0.00 0.06 0.00 0.00 58.65 58.79 2iag h GLN 273 Cb 1.22 -0.08 -0.08 0.00 0.30 0.00 0.00 27.48 28.84 2iag h GLN 273 CO 0.12 0.23 0.21 0.00 -0.67 0.00 0.00 178.83 178.73 2iag h ALA 274 N 1.38 0.83 -0.53 3.87 0.00 -1.30 0.11 119.26 123.62 2iag h ALA 274 Ca 0.27 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.20 2iag h ALA 274 Cb 0.32 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2iag h ALA 274 CO -0.29 -0.23 -0.01 0.00 0.00 0.00 0.00 179.25 178.72 2iag h ARG 275 N 0.37 0.95 -0.27 0.00 3.08 -1.24 -2.09 114.38 115.19 2iag h ARG 275 Ca 0.34 -0.31 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 2iag h ARG 275 Cb 0.48 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 2iag h ARG 275 CO -0.37 0.97 0.02 0.00 -1.07 0.00 0.00 179.97 179.52 2iag h ALA 276 N 0.95 1.55 0.00 0.04 0.00 -0.02 -1.79 119.26 119.99 2iag h ALA 276 Ca 0.15 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 2iag h ALA 276 Cb 0.55 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2iag h ALA 276 CO 0.03 0.33 -0.60 -0.07 0.00 0.00 0.00 179.25 178.95 2iag h LEU 277 N 0.38 0.00 0.15 0.00 3.38 -0.50 -1.64 115.31 117.09 2iag h LEU 277 Ca 0.09 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.77 2iag h LEU 277 Cb 0.22 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.99 2iag h LEU 277 CO 0.00 0.60 -1.29 0.58 0.09 0.00 0.00 178.44 178.42 2iag h VAL 278 N 0.00 1.45 -0.18 1.22 2.07 -1.18 -1.75 116.25 117.88 2iag h VAL 278 Ca -0.01 -2.98 0.03 0.00 0.82 0.00 0.00 66.70 64.56 2iag h VAL 278 Cb 1.19 2.96 -0.03 0.00 -1.52 0.00 0.00 31.29 33.89 2iag h VAL 278 CO 0.08 0.87 0.01 0.25 0.02 0.00 0.00 177.57 178.80 2iag h LEU 279 N 0.09 -0.05 -1.62 2.57 5.85 -1.30 -2.09 115.31 118.76 2iag h LEU 279 Ca -0.16 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.61 2iag h LEU 279 Cb 2.01 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 43.08 2iag h LEU 279 CO 0.22 0.00 0.27 1.56 -0.34 0.00 0.00 178.44 180.15 2iag h GLN 280 N 0.07 0.50 -0.62 1.25 1.08 -1.29 0.81 115.11 116.92 2iag h GLN 280 Ca 0.08 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.24 2iag h GLN 280 Cb 0.10 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.39 2iag h GLN 280 CO -0.14 0.33 0.31 1.25 -0.95 0.00 0.00 178.83 179.64 2iag h LEU 281 N 0.52 0.79 -0.35 1.46 5.85 -0.77 -0.63 115.31 122.18 2iag h LEU 281 Ca 0.15 -0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 2iag h LEU 281 Cb -0.02 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 2iag h LEU 281 CO -0.03 0.68 -0.19 -0.25 -0.34 0.00 0.00 178.44 178.30 2iag h TRP 282 N 0.84 0.87 0.00 1.25 7.01 -0.71 0.59 115.95 125.80 2iag h TRP 282 Ca 0.21 -0.22 -0.02 0.00 2.11 0.00 0.00 58.89 60.97 2iag h TRP 282 Cb 0.08 -0.20 -0.00 0.00 -2.10 0.00 0.00 29.16 26.94 2iag h TRP 282 CO -0.00 0.96 -0.09 0.00 -2.79 0.00 0.00 178.44 176.51 2iag h ALA 283 N 0.78 1.36 0.00 2.65 0.00 -0.44 -0.26 119.26 123.36 2iag h ALA 283 Ca 0.08 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2iag h ALA 283 Cb 0.74 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2iag h ALA 283 CO 0.06 0.12 -1.63 -2.37 0.00 0.00 0.00 179.25 175.42 2iag n THR 284 N -3.72 0.41 0.11 0.00 5.66 -0.28 -4.66 114.28 111.80 2iag n THR 284 Ca -0.02 -0.36 0.01 0.00 -3.05 0.00 0.00 64.05 60.63 2iag n THR 284 Cb 0.20 -0.31 -0.01 0.00 -1.55 0.00 0.00 70.33 68.66 2iag n THR 284 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2iag n GLN 285 N -2.17 4.46 0.00 1.09 1.13 0.20 -4.74 117.38 117.34 2iag n GLN 285 Ca -0.11 -0.17 0.09 0.00 -1.94 0.00 0.00 57.00 54.88 2iag n GLN 285 Cb 0.61 -0.72 0.46 0.00 0.11 0.00 0.00 30.24 30.69 2iag n GLN 285 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2iag n GLY 286 N 0.82 -0.96 0.00 1.08 0.00 -0.11 -4.07 105.19 101.94 2iag n GLY 286 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2iag n GLY 286 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2iag n ASN 287 N -1.34 4.14 0.01 1.61 3.02 -1.26 -4.72 115.26 116.71 2iag n ASN 287 Ca 0.08 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.51 2iag n ASN 287 Cb 0.17 0.42 -0.06 0.00 -0.61 0.00 0.00 39.78 39.70 2iag n ASN 287 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 2iag h MET 288 N 0.00 0.09 0.33 3.52 2.86 -1.86 -1.08 114.93 118.78 2iag h MET 288 Ca 0.00 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2iag h MET 288 Cb 0.82 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.46 2iag h MET 288 CO 0.00 0.09 -0.16 0.78 1.06 0.00 0.00 176.91 178.68 2iag h GLY 289 N 0.06 -0.46 0.48 8.32 0.00 -1.83 -0.96 103.07 108.68 2iag h GLY 289 Ca 0.02 0.17 0.13 0.00 0.00 0.00 0.00 47.33 47.65 2iag h GLY 289 CO -0.00 -0.17 0.61 -2.55 0.00 0.00 0.00 176.54 174.43 2iag h PRO 290 N -0.57 0.86 -0.01 4.80 0.11 -1.85 -1.98 132.00 133.36 2iag h PRO 290 Ca -0.05 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.01 2iag h PRO 290 Cb 0.42 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 31.33 2iag h PRO 290 CO 0.07 0.57 0.01 0.00 -0.21 0.00 0.00 178.00 178.44 2iag h ALA 291 N 1.56 0.02 -0.42 -0.75 0.00 -0.83 -2.68 119.26 116.16 2iag h ALA 291 Ca 0.49 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 2iag h ALA 291 Cb 0.58 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2iag h ALA 291 CO -0.25 -0.42 0.23 0.00 0.00 0.00 0.00 179.25 178.81 2iag h ALA 292 N 0.89 1.62 0.04 0.00 0.00 -1.06 -2.43 119.26 118.32 2iag h ALA 292 Ca 0.00 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2iag h ALA 292 Cb 0.12 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2iag h ALA 292 CO -0.00 0.32 -0.14 0.35 0.00 0.00 0.00 179.25 179.78 2iag h PHE 293 N 0.58 -0.37 -0.37 0.00 3.57 -1.06 -0.17 116.94 119.13 2iag h PHE 293 Ca 0.15 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 2iag h PHE 293 Cb 0.01 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2iag h PHE 293 CO 0.00 -0.21 0.05 -1.49 -2.23 0.00 0.00 178.31 174.43 2iag h TRP 294 N -0.26 0.66 0.04 0.41 4.06 -1.32 -0.56 115.95 118.98 2iag h TRP 294 Ca 0.04 -0.10 0.02 0.00 2.06 0.00 0.00 58.89 60.91 2iag h TRP 294 Cb 0.30 -0.18 -0.03 0.00 -1.00 0.00 0.00 29.16 28.25 2iag h TRP 294 CO -0.18 0.68 -0.19 1.25 -3.56 0.00 0.00 178.44 176.44 2iag h LEU 295 N 0.45 -0.53 -0.83 -4.49 6.46 -1.34 0.24 115.31 115.27 2iag h LEU 295 Ca 0.11 0.07 -0.03 0.00 -0.12 0.00 0.00 57.88 57.91 2iag h LEU 295 Cb 0.38 0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 40.49 2iag h LEU 295 CO 0.01 -0.26 0.40 -0.07 -0.62 0.00 0.00 178.44 177.91 2iag h LEU 296 N -0.32 1.09 -0.37 2.25 4.07 -0.92 -1.04 115.31 120.06 2iag h LEU 296 Ca 0.05 -0.13 -0.04 0.00 0.08 0.00 0.00 57.88 57.84 2iag h LEU 296 Cb 0.37 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.82 2iag h LEU 296 CO -0.15 0.92 0.09 0.25 -1.08 0.00 0.00 178.44 178.47 2iag h LEU 297 N 1.18 0.56 -0.99 1.67 5.85 -0.71 -0.08 115.31 122.79 2iag h LEU 297 Ca 0.29 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 2iag h LEU 297 Cb 0.12 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 2iag h LEU 297 CO -0.04 0.64 0.58 -0.26 -0.34 0.00 0.00 178.44 179.03 2iag h PHE 298 N 0.45 1.23 -0.46 1.25 0.04 -0.19 -1.01 116.94 118.25 2iag h PHE 298 Ca 0.12 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.77 2iag h PHE 298 Cb 0.30 -0.41 -0.01 0.00 2.20 0.00 0.00 35.95 38.03 2iag h PHE 298 CO 0.02 0.81 -0.16 -0.07 -0.60 0.00 0.00 178.31 178.30 2iag h LEU 299 N 1.30 0.94 -0.77 1.54 3.38 -0.98 -2.63 115.31 118.08 2iag h LEU 299 Ca 0.34 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2iag h LEU 299 Cb -0.08 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.38 2iag h LEU 299 CO -0.07 1.11 0.27 -0.07 0.09 0.00 0.00 178.44 179.77 2iag h LEU 300 N 0.76 1.09 -0.05 1.67 4.07 -0.65 -2.74 115.31 119.46 2iag h LEU 300 Ca 0.11 -0.19 0.00 0.00 0.08 0.00 0.00 57.88 57.88 2iag h LEU 300 Cb 0.73 -0.29 0.00 0.00 1.08 0.00 0.00 40.66 42.18 2iag h LEU 300 CO 0.06 0.99 -0.02 0.29 -1.08 0.00 0.00 178.44 178.68 2iag n LYS 301 N -4.27 0.55 -3.59 1.13 4.76 -0.42 -4.58 118.16 111.75 2iag n LYS 301 Ca 0.07 -0.05 -0.29 0.00 -2.87 0.00 0.00 58.31 55.17 2iag n LYS 301 Cb 0.21 -1.50 -0.12 0.00 -1.84 0.00 0.00 35.03 31.78 2iag n LYS 301 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2iag s ASN 302 N -2.48 3.15 0.23 4.39 0.01 -0.99 -5.04 114.94 114.20 2iag s ASN 302 Ca 0.31 -2.62 -0.09 0.00 -0.71 0.00 0.00 52.86 49.74 2iag s ASN 302 Cb 0.20 -0.76 0.35 0.00 0.41 0.00 0.00 41.25 41.45 2iag s ASN 302 CO 0.45 -0.25 1.64 -0.65 -1.51 0.00 0.00 177.10 176.78 2iag h PRO 303 N 6.57 0.09 -0.25 -0.60 0.11 -1.81 -0.44 132.00 135.68 2iag h PRO 303 Ca 0.07 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.16 2iag h PRO 303 Cb 0.93 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 2iag h PRO 303 CO 0.41 0.06 0.08 1.05 -0.21 0.00 0.00 178.00 179.39 2iag h GLU 304 N 0.09 0.34 0.28 1.05 4.11 -1.96 -0.14 114.58 118.35 2iag h GLU 304 Ca 0.36 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.74 2iag h GLU 304 Cb 0.61 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2iag h GLU 304 CO -0.62 0.30 -0.13 0.00 0.07 0.00 0.00 179.01 178.63 2iag h ALA 305 N 1.75 -0.37 -0.76 1.06 0.00 -1.43 -2.04 119.26 117.48 2iag h ALA 305 Ca 0.09 -0.20 0.11 0.00 0.00 0.00 0.00 54.91 54.91 2iag h ALA 305 Cb 0.10 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 17.96 2iag h ALA 305 CO -0.01 -0.47 0.39 1.25 0.00 0.00 0.00 179.25 180.40 2iag h LEU 306 N -0.85 0.50 -0.68 0.00 6.46 -1.10 -1.35 115.31 118.30 2iag h LEU 306 Ca -0.04 0.07 -0.04 0.00 -0.12 0.00 0.00 57.88 57.75 2iag h LEU 306 Cb 0.51 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.40 2iag h LEU 306 CO 0.06 0.27 0.26 0.00 -0.62 0.00 0.00 178.44 178.41 2iag h ALA 307 N 1.46 0.89 -0.54 1.25 0.00 -1.06 0.18 119.26 121.44 2iag h ALA 307 Ca 0.38 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2iag h ALA 307 Cb 0.43 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2iag h ALA 307 CO -0.29 0.52 0.31 0.00 0.00 0.00 0.00 179.25 179.79 2iag h ALA 308 N 1.12 0.69 0.02 0.00 0.00 -0.73 0.29 119.26 120.66 2iag h ALA 308 Ca 0.23 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2iag h ALA 308 Cb 0.22 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2iag h ALA 308 CO -0.02 0.19 -0.01 0.28 0.00 0.00 0.00 179.25 179.70 2iag h VAL 309 N 0.73 1.10 -0.97 0.00 2.07 -1.02 -1.82 116.25 116.34 2iag h VAL 309 Ca 0.19 -0.37 0.07 0.00 0.82 0.00 0.00 66.70 67.41 2iag h VAL 309 Cb 0.02 1.34 -0.07 0.00 -1.52 0.00 0.00 31.29 31.07 2iag h VAL 309 CO -0.03 0.09 0.62 0.03 0.02 0.00 0.00 177.57 178.30 2iag h ARG 310 N -0.19 1.07 -0.63 1.57 3.08 -0.49 -0.67 114.38 118.11 2iag h ARG 310 Ca -0.00 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 2iag h ARG 310 Cb 0.18 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 29.96 2iag h ARG 310 CO 0.01 0.71 0.18 0.78 -1.07 0.00 0.00 179.97 180.58 2iag h GLY 311 N 1.10 1.06 0.98 0.04 0.00 -0.33 -2.39 103.07 103.53 2iag h GLY 311 Ca 0.42 -0.64 -0.13 0.00 0.00 0.00 0.00 47.33 46.98 2iag h GLY 311 CO -0.18 0.60 -0.35 -2.09 0.00 0.00 0.00 176.54 174.52 2iag h GLU 312 N 0.91 0.70 -0.70 4.80 4.81 -0.71 -2.34 114.58 122.05 2iag h GLU 312 Ca 0.20 -0.40 -0.02 0.00 -0.13 0.00 0.00 59.36 59.01 2iag h GLU 312 Cb 0.31 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 2iag h GLU 312 CO -0.00 1.02 0.36 -0.07 -0.73 0.00 0.00 179.01 179.58 2iag h LEU 313 N 0.43 0.89 0.03 1.64 3.38 -1.10 -2.78 115.31 117.79 2iag h LEU 313 Ca 0.03 -0.08 -0.27 0.00 0.09 0.00 0.00 57.88 57.65 2iag h LEU 313 Cb 0.93 -0.23 0.02 0.00 0.09 0.00 0.00 40.66 41.48 2iag h LEU 313 CO 0.08 0.73 -1.06 -0.33 0.09 0.00 0.00 178.44 177.96 2iag h GLU 314 N 0.99 0.67 -1.06 1.13 5.08 -1.47 -2.87 114.58 117.05 2iag h GLU 314 Ca 0.25 -0.75 0.28 0.00 -1.00 0.00 0.00 59.36 58.14 2iag h GLU 314 Cb 0.07 0.22 -0.11 0.00 0.50 0.00 0.00 28.75 29.43 2iag h GLU 314 CO -0.04 1.33 0.66 0.77 -1.00 0.00 0.00 179.01 180.73 2iag h SER 315 N 0.33 0.49 0.62 1.42 0.02 -1.26 -1.32 113.55 113.84 2iag h SER 315 Ca -0.14 0.11 -0.25 0.00 -0.84 0.00 0.00 61.79 60.67 2iag h SER 315 Cb 1.72 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 64.30 2iag h SER 315 CO 0.21 0.04 -1.12 0.40 -1.14 0.00 0.00 176.83 175.22 2iag h ILE 316 N 0.40 1.51 -0.64 3.27 2.04 -1.49 -3.34 117.51 119.26 2iag h ILE 316 Ca 0.64 -2.96 0.11 0.00 1.00 0.00 0.00 64.86 63.65 2iag h ILE 316 Cb 1.56 2.80 -0.08 0.00 -0.74 0.00 0.00 36.82 40.36 2iag h ILE 316 CO -0.38 0.86 0.23 0.25 0.00 0.00 0.00 178.15 179.11 2iag h LEU 317 N 0.09 0.20 -5.22 1.44 7.12 -1.00 -3.50 115.31 114.43 2iag h LEU 317 Ca -0.10 0.09 -0.67 0.00 0.13 0.00 0.00 57.88 57.33 2iag h LEU 317 Cb 1.83 0.08 -0.36 0.00 -0.53 0.00 0.00 40.66 41.68 2iag h LEU 317 CO 0.18 0.11 -0.03 -2.67 -0.13 0.00 0.00 178.44 175.90 2iag n TRP 318 N -5.02 3.43 0.00 1.25 2.14 -1.20 -5.13 117.44 112.91 2iag n TRP 318 Ca 0.10 -3.17 0.00 0.00 2.07 0.00 0.00 57.50 56.50 2iag n TRP 318 Cb 0.31 -0.64 0.00 0.00 -0.81 0.00 0.00 31.31 30.17 2iag n TRP 318 CO 0.00 0.00 0.00 -0.35 2.07 0.00 0.00 177.69 179.41 2iag n PRO 331 N -0.32 0.00 -0.26 -2.67 -0.05 -1.26 -5.02 135.00 125.41 2iag n PRO 331 Ca 0.40 0.00 0.24 0.00 -0.05 0.00 0.00 63.50 64.09 2iag n PRO 331 Cb 0.41 0.00 0.42 0.00 -0.05 0.00 0.00 33.50 34.28 2iag n PRO 331 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 175.50 176.49 2iag n GLN 332 N 0.00 -0.03 0.26 0.54 6.02 -1.26 -0.22 117.38 122.69 2iag n GLN 332 Ca 0.00 0.86 0.11 0.00 -0.01 0.00 0.00 57.00 57.97 2iag n GLN 332 Cb 0.00 -1.62 0.70 0.00 1.02 0.00 0.00 30.24 30.34 2iag n GLN 332 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 2iag h LYS 333 N 0.00 0.00 0.00 -1.09 1.57 -1.96 -0.44 116.57 114.66 2iag h LYS 333 Ca 0.57 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.32 2iag h LYS 333 Cb 1.67 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.97 2iag h LYS 333 CO -0.41 0.12 -0.14 0.28 -0.57 0.00 0.00 179.45 178.73 2iag h VAL 334 N 0.00 1.06 0.11 0.50 2.07 -0.92 0.14 116.25 119.20 2iag h VAL 334 Ca -0.00 -0.50 -0.19 0.00 0.82 0.00 0.00 66.70 66.82 2iag h VAL 334 Cb 0.29 1.28 0.01 0.00 -1.52 0.00 0.00 31.29 31.34 2iag h VAL 334 CO 0.02 0.14 -0.93 -0.07 0.02 0.00 0.00 177.57 176.75 2iag h LEU 335 N 0.00 0.35 -2.76 2.57 3.38 -1.26 -3.42 115.31 114.18 2iag h LEU 335 Ca -0.00 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.07 2iag h LEU 335 Cb 0.26 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2iag h LEU 335 CO 0.02 1.42 -0.10 -0.90 0.09 0.00 0.00 178.44 178.97 2iag n ASP 336 N -4.14 1.81 -2.72 -0.43 5.68 -0.95 -4.61 116.55 111.18 2iag n ASP 336 Ca -0.18 -2.78 -0.05 0.00 -0.50 0.00 0.00 54.79 51.28 2iag n ASP 336 Cb 0.80 -0.35 0.05 0.00 -1.14 0.00 0.00 41.12 40.47 2iag n ASP 336 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2iag n SER 337 N -1.07 1.10 -3.20 -1.12 7.64 0.47 -4.95 113.62 112.48 2iag n SER 337 Ca 0.12 -2.44 -0.25 0.00 1.01 0.00 0.00 58.87 57.32 2iag n SER 337 Cb 0.63 -0.34 -0.06 0.00 -1.01 0.00 0.00 64.21 63.43 2iag n SER 337 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2iag n THR 338 N -0.35 1.29 0.09 0.44 -2.24 -1.25 -4.83 114.28 107.43 2iag n THR 338 Ca 0.06 -4.89 0.04 0.00 -2.27 0.00 0.00 64.05 56.99 2iag n THR 338 Cb 0.82 -1.54 0.45 0.00 -2.10 0.00 0.00 70.33 67.95 2iag n THR 338 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2iag h PRO 339 N 3.62 0.33 -0.21 -0.78 0.13 -1.92 -0.99 132.00 132.17 2iag h PRO 339 Ca 0.13 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 65.18 2iag h PRO 339 Cb 0.74 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.80 2iag h PRO 339 CO 0.67 0.31 -0.04 0.28 -0.23 0.00 0.00 178.00 178.99 2iag h VAL 340 N 0.33 1.28 -0.43 1.56 2.07 -1.92 -1.40 116.25 117.74 2iag h VAL 340 Ca 0.08 -1.01 -0.05 0.00 0.82 0.00 0.00 66.70 66.54 2iag h VAL 340 Cb 0.12 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2iag h VAL 340 CO -0.00 0.31 0.05 0.25 0.02 0.00 0.00 177.57 178.20 2iag h LEU 341 N 0.14 0.62 -0.16 2.57 5.85 -1.84 -0.77 115.31 121.72 2iag h LEU 341 Ca 0.05 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.69 2iag h LEU 341 Cb 0.49 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2iag h LEU 341 CO 0.02 0.65 -0.03 0.44 -0.34 0.00 0.00 178.44 179.18 2iag h ASP 342 N 0.64 -0.12 -0.69 1.25 3.32 -0.99 -0.35 116.42 119.47 2iag h ASP 342 Ca 0.14 0.04 -0.07 0.00 0.02 0.00 0.00 57.03 57.16 2iag h ASP 342 Cb 0.32 0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 2iag h ASP 342 CO 0.01 -0.04 0.15 -1.28 -1.72 0.00 0.00 179.24 176.36 2iag h SER 343 N 0.01 1.07 -0.66 6.45 0.87 -0.94 -1.12 113.55 119.24 2iag h SER 343 Ca 0.08 -0.24 0.07 0.00 -1.23 0.00 0.00 61.79 60.47 2iag h SER 343 Cb 0.11 -0.28 -0.06 0.00 -0.44 0.00 0.00 62.40 61.72 2iag h SER 343 CO -0.15 1.04 0.34 0.58 -0.53 0.00 0.00 176.83 178.10 2iag h VAL 344 N 1.06 0.91 -0.14 2.23 2.07 -0.89 0.75 116.25 122.23 2iag h VAL 344 Ca 0.22 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.48 2iag h VAL 344 Cb 0.40 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 2iag h VAL 344 CO 0.01 0.11 -0.10 0.25 0.02 0.00 0.00 177.57 177.86 2iag h LEU 345 N 0.61 0.33 -1.51 2.57 5.85 -0.76 -0.54 115.31 121.86 2iag h LEU 345 Ca 0.31 -0.44 0.04 0.00 0.84 0.00 0.00 57.88 58.63 2iag h LEU 345 Cb 0.26 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 2iag h LEU 345 CO -0.22 0.70 0.38 0.28 -0.34 0.00 0.00 178.44 179.24 2iag h SER 346 N -0.03 0.54 0.05 1.25 0.02 -1.05 -0.93 113.55 113.40 2iag h SER 346 Ca 0.03 -0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.77 2iag h SER 346 Cb 0.59 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.01 2iag h SER 346 CO 0.03 0.36 -0.76 -0.08 -1.14 0.00 0.00 176.83 175.24 2iag h GLU 347 N 0.62 0.61 -0.37 3.45 4.57 -0.61 -1.57 114.58 121.28 2iag h GLU 347 Ca 0.24 -0.50 -0.07 0.00 -1.18 0.00 0.00 59.36 57.85 2iag h GLU 347 Cb 0.17 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 2iag h GLU 347 CO -0.07 1.12 -0.06 0.77 -1.18 0.00 0.00 179.01 179.60 2iag h SER 348 N 0.42 0.69 -0.85 1.04 0.02 -0.71 -2.98 113.55 111.17 2iag h SER 348 Ca -0.04 -0.35 -0.00 0.00 -0.84 0.00 0.00 61.79 60.56 2iag h SER 348 Cb 1.36 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.67 2iag h SER 348 CO 0.14 0.88 0.53 -0.07 -1.14 0.00 0.00 176.83 177.17 2iag h LEU 349 N 0.50 1.02 -0.60 5.07 3.38 -1.17 -1.48 115.31 122.02 2iag h LEU 349 Ca 0.10 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2iag h LEU 349 Cb 0.56 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2iag h LEU 349 CO 0.03 0.77 0.35 -0.09 0.09 0.00 0.00 178.44 179.59 2iag h ARG 350 N 1.18 0.82 0.00 1.13 2.43 -1.20 0.10 114.38 118.84 2iag h ARG 350 Ca 0.31 -0.08 -0.12 0.00 -0.81 0.00 0.00 59.98 59.28 2iag h ARG 350 Cb -0.07 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.29 2iag h ARG 350 CO -0.06 0.60 -0.56 -0.07 -1.51 0.00 0.00 179.97 178.37 2iag h LEU 351 N 0.81 0.00 -0.00 3.80 3.38 -1.36 -3.41 115.31 118.53 2iag h LEU 351 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2iag h LEU 351 Cb -0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2iag h LEU 351 CO -0.04 0.56 0.00 0.35 0.09 0.00 0.00 178.44 179.40 2iag n THR 352 N -3.57 0.00 -3.19 0.22 -2.24 -0.58 -4.98 114.28 99.94 2iag n THR 352 Ca -0.00 -0.42 -0.40 0.00 -2.27 0.00 0.00 64.05 60.96 2iag n THR 352 Cb 0.63 1.00 -0.07 0.00 -2.10 0.00 0.00 70.33 69.79 2iag n THR 352 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2iag s ALA 353 N -0.84 3.60 -0.39 6.98 0.00 0.31 -0.57 121.76 130.85 2iag s ALA 353 Ca 0.00 -0.54 0.12 0.00 0.00 0.00 0.00 51.96 51.54 2iag s ALA 353 Cb 0.00 -2.94 0.41 0.00 0.00 0.00 0.00 23.12 20.58 2iag s ALA 353 CO 0.00 -0.76 0.92 0.00 0.00 0.00 0.00 175.76 175.92 2iag n ALA 354 N 5.59 3.55 -1.77 0.00 0.00 0.19 -4.52 120.51 123.55 2iag n ALA 354 Ca -0.03 -3.66 -0.33 0.00 0.00 0.00 0.00 53.44 49.43 2iag n ALA 354 Cb 0.49 -0.83 -0.02 0.00 0.00 0.00 0.00 19.45 19.10 2iag n ALA 354 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2iag s PRO 355 N -3.07 3.71 0.11 0.00 0.04 -1.24 0.10 135.00 134.66 2iag s PRO 355 Ca 0.38 1.11 -0.25 0.00 0.04 0.00 0.00 61.00 62.28 2iag s PRO 355 Cb 0.39 -2.09 -0.07 0.00 0.04 0.00 0.00 34.50 32.77 2iag s PRO 355 CO -0.06 -0.48 0.76 -0.06 0.04 0.00 0.00 177.00 177.20 2iag s PHE 356 N -2.45 3.83 -0.28 0.56 0.08 -1.17 -4.53 117.98 114.01 2iag s PHE 356 Ca 0.62 1.54 -0.09 0.00 0.12 0.00 0.00 56.93 59.12 2iag s PHE 356 Cb -0.13 -2.77 -0.02 0.00 -0.57 0.00 0.00 43.02 39.53 2iag s PHE 356 CO 0.31 0.41 0.12 0.42 -0.10 0.00 0.00 175.22 176.38 2iag s ILE 357 N -0.66 4.55 -0.01 0.64 1.01 -0.70 -4.97 121.20 121.07 2iag s ILE 357 Ca 0.36 -0.23 0.04 0.00 0.00 0.00 0.00 60.65 60.82 2iag s ILE 357 Cb -0.22 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.03 2iag s ILE 357 CO 0.24 0.22 -0.12 -0.89 0.00 0.00 0.00 174.94 174.38 2iag s THR 358 N 1.63 0.97 0.02 2.92 2.01 -1.26 0.51 115.64 122.45 2iag s THR 358 Ca 0.06 -0.54 0.02 0.00 0.31 0.00 0.00 61.69 61.54 2iag s THR 358 Cb -0.16 -0.82 -0.01 0.00 0.01 0.00 0.00 72.50 71.52 2iag s THR 358 CO 0.06 0.26 -0.07 -0.13 -0.69 0.00 0.00 174.62 174.05 2iag s ARG 359 N -0.32 0.50 -0.07 4.92 1.81 0.38 -4.71 118.95 121.46 2iag s ARG 359 Ca 0.05 -0.50 -0.18 0.00 -1.72 0.00 0.00 55.73 53.38 2iag s ARG 359 Cb -0.05 -0.37 -0.05 0.00 -0.45 0.00 0.00 34.95 34.03 2iag s ARG 359 CO -0.00 0.09 0.48 -1.21 -0.68 0.00 0.00 175.30 173.97 2iag s GLU 360 N -0.90 4.23 -0.33 3.54 0.41 0.08 -0.01 118.70 125.72 2iag s GLU 360 Ca -0.04 0.48 -0.29 0.00 -0.41 0.00 0.00 54.97 54.72 2iag s GLU 360 Cb -0.06 -3.36 0.02 0.00 -1.78 0.00 0.00 34.13 28.94 2iag s GLU 360 CO 0.00 0.34 1.06 0.08 -0.49 0.00 0.00 175.26 176.25 2iag s VAL 361 N 0.01 4.52 0.09 2.63 1.01 -0.21 -0.05 120.40 128.39 2iag s VAL 361 Ca 0.26 1.68 -0.09 0.00 0.00 0.00 0.00 61.98 63.83 2iag s VAL 361 Cb -0.16 -4.41 -0.24 0.00 0.00 0.00 0.00 36.38 31.57 2iag s VAL 361 CO 0.12 -0.49 1.20 0.58 0.00 0.00 0.00 175.10 176.52 2iag h VAL 362 N 5.74 1.37 -3.47 2.92 2.07 -1.31 -0.99 116.25 122.58 2iag h VAL 362 Ca -0.21 -2.52 -0.13 0.00 0.82 0.00 0.00 66.70 64.66 2iag h VAL 362 Cb 1.06 2.58 -0.19 0.00 -1.52 0.00 0.00 31.29 33.22 2iag h VAL 362 CO 1.03 0.76 -0.42 0.54 0.02 0.00 0.00 177.57 179.50 2iag s VAL 363 N -3.09 0.09 -0.17 2.57 0.11 -1.26 -4.69 120.40 113.96 2iag s VAL 363 Ca -0.07 -0.76 -0.40 0.00 -2.93 0.00 0.00 61.98 57.82 2iag s VAL 363 Cb 0.07 -0.67 -0.17 0.00 -1.53 0.00 0.00 36.38 34.09 2iag s VAL 363 CO 0.90 -0.42 1.52 0.47 -3.33 0.00 0.00 175.10 174.25 2iag n ASP 364 N 1.09 1.71 -3.56 3.54 9.92 -1.26 -4.15 116.55 123.84 2iag n ASP 364 Ca -0.21 1.12 -0.11 0.00 -0.53 0.00 0.00 54.79 55.06 2iag n ASP 364 Cb 0.57 -1.09 -0.03 0.00 -0.64 0.00 0.00 41.12 39.93 2iag n ASP 364 CO 0.00 0.00 0.00 -1.48 0.13 0.00 0.00 177.20 175.85 2iag s LEU 365 N 2.14 -0.15 -0.20 0.64 0.05 -0.57 -4.92 118.68 115.67 2iag s LEU 365 Ca 0.94 -0.21 -0.11 0.00 0.05 0.00 0.00 54.13 54.80 2iag s LEU 365 Cb -1.13 2.30 -0.05 0.00 -2.05 0.00 0.00 46.19 45.27 2iag s LEU 365 CO 0.62 -0.97 0.19 0.00 -0.55 0.00 0.00 176.35 175.64 2iag s ALA 366 N -3.80 3.64 -0.31 1.48 0.00 -1.26 -0.10 121.76 121.41 2iag s ALA 366 Ca 0.04 -0.67 -0.09 0.00 0.00 0.00 0.00 51.96 51.23 2iag s ALA 366 Cb -0.00 -2.29 0.00 0.00 0.00 0.00 0.00 23.12 20.83 2iag s ALA 366 CO -0.10 0.02 0.13 1.41 0.00 0.00 0.00 175.76 177.23 2iag s MET 367 N 0.63 3.17 0.40 0.00 1.75 0.16 -4.87 119.30 120.53 2iag s MET 367 Ca 0.11 -0.82 -0.24 0.00 -1.25 0.00 0.00 55.69 53.48 2iag s MET 367 Cb -0.12 -3.52 -0.09 0.00 2.84 0.00 0.00 34.83 33.94 2iag s MET 367 CO 0.02 -0.47 1.08 -1.25 -0.65 0.00 0.00 175.02 173.75 2iag s PRO 368 N 1.56 4.14 0.12 4.11 0.04 -1.26 -0.68 135.00 143.02 2iag s PRO 368 Ca 0.03 1.60 0.04 0.00 0.04 0.00 0.00 61.00 62.72 2iag s PRO 368 Cb -0.17 -2.59 -0.04 0.00 0.04 0.00 0.00 34.50 31.73 2iag s PRO 368 CO 0.05 -0.18 0.10 -1.64 0.04 0.00 0.00 177.00 175.37 2iag s MET 369 N -2.41 2.88 0.39 4.56 -1.94 0.15 -4.87 119.30 118.05 2iag s MET 369 Ca 0.57 -0.77 0.06 0.00 -1.71 0.00 0.00 55.69 53.84 2iag s MET 369 Cb -0.25 -2.69 0.78 0.00 2.01 0.00 0.00 34.83 34.69 2iag s MET 369 CO 0.31 0.53 2.04 0.00 -0.01 0.00 0.00 175.02 177.89 2iag h ALA 370 N 2.91 1.65 0.00 3.03 0.00 -1.85 -1.71 119.26 123.29 2iag h ALA 370 Ca -0.47 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2iag h ALA 370 Cb 1.18 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2iag h ALA 370 CO 0.65 0.32 0.00 -0.40 0.00 0.00 0.00 179.25 179.82 2iag n ASP 371 N -4.46 0.00 0.00 0.00 5.68 -1.26 -4.90 116.55 111.61 2iag n ASP 371 Ca 0.04 -0.79 0.00 0.00 -0.50 0.00 0.00 54.79 53.54 2iag n ASP 371 Cb 0.06 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 2iag n ASP 371 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2iag n GLY 372 N 0.88 2.62 3.74 6.12 0.00 -0.64 -5.10 105.19 112.81 2iag n GLY 372 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 2iag n GLY 372 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2iag s ARG 373 N -0.47 2.55 0.04 1.61 0.52 -1.26 -4.78 118.95 117.16 2iag s ARG 373 Ca 0.00 1.70 0.07 0.00 -0.52 0.00 0.00 55.73 56.98 2iag s ARG 373 Cb 0.00 -1.89 -0.02 0.00 0.52 0.00 0.00 34.95 33.56 2iag s ARG 373 CO 0.00 -1.51 -0.19 -1.21 0.02 0.00 0.00 175.30 172.41 2iag s GLU 374 N -3.76 1.29 -0.03 3.54 2.02 -1.26 0.31 118.70 120.81 2iag s GLU 374 Ca 0.74 -0.88 0.06 0.00 0.02 0.00 0.00 54.97 54.91 2iag s GLU 374 Cb -0.28 -1.37 -0.01 0.00 0.10 0.00 0.00 34.13 32.57 2iag s GLU 374 CO 0.40 0.35 -0.20 -0.06 0.02 0.00 0.00 175.26 175.78 2iag s PHE 375 N -0.78 1.86 -0.14 1.61 0.08 0.14 -4.89 117.98 115.87 2iag s PHE 375 Ca 0.06 -0.43 -0.26 0.00 0.12 0.00 0.00 56.93 56.42 2iag s PHE 375 Cb -0.08 -1.22 -0.02 0.00 -0.57 0.00 0.00 43.02 41.13 2iag s PHE 375 CO 0.01 -0.09 0.83 -0.80 -0.10 0.00 0.00 175.22 175.07 2iag s ASN 376 N -0.28 7.00 0.02 1.36 0.01 -0.42 0.39 114.94 123.02 2iag s ASN 376 Ca 0.03 1.23 0.05 0.00 -0.71 0.00 0.00 52.86 53.46 2iag s ASN 376 Cb -0.10 -2.46 -0.03 0.00 0.41 0.00 0.00 41.25 39.07 2iag s ASN 376 CO 0.01 -0.34 -0.14 -0.76 -1.51 0.00 0.00 177.10 174.35 2iag s LEU 377 N 1.84 2.81 0.10 0.60 1.43 0.85 -4.43 118.68 121.88 2iag s LEU 377 Ca 0.40 -0.31 -0.03 0.00 -1.03 0.00 0.00 54.13 53.16 2iag s LEU 377 Cb -0.17 -1.63 -0.05 0.00 0.03 0.00 0.00 46.19 44.37 2iag s LEU 377 CO 0.15 0.27 0.30 -0.13 0.23 0.00 0.00 176.35 177.17 2iag s ARG 378 N -1.37 3.54 -0.06 1.70 0.52 -1.26 -1.50 118.95 120.51 2iag s ARG 378 Ca 0.15 -0.24 -0.39 0.00 -0.52 0.00 0.00 55.73 54.73 2iag s ARG 378 Cb -0.11 -2.94 -0.18 0.00 0.52 0.00 0.00 34.95 32.24 2iag s ARG 378 CO 0.06 0.54 1.32 -2.13 0.02 0.00 0.00 175.30 175.11 2iag n ARG 379 N 0.21 0.61 0.00 3.54 0.63 -1.26 -1.68 116.66 118.71 2iag n ARG 379 Ca -0.04 0.22 0.00 0.00 -0.92 0.00 0.00 57.85 57.11 2iag n ARG 379 Cb 0.51 -1.80 0.00 0.00 0.45 0.00 0.00 32.46 31.62 2iag n ARG 379 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2iag n GLY 380 N 2.54 1.57 3.77 5.14 0.00 -0.38 -4.93 105.19 112.90 2iag n GLY 380 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 2iag n GLY 380 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2iag s ASP 381 N -1.80 5.54 -0.06 1.61 1.01 -0.68 -4.82 116.67 117.47 2iag s ASP 381 Ca 0.00 2.20 -0.11 0.00 0.71 0.00 0.00 52.55 55.35 2iag s ASP 381 Cb 0.00 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 2iag s ASP 381 CO 0.00 -1.34 0.29 -0.60 0.21 0.00 0.00 175.17 173.72 2iag s ARG 382 N -3.38 3.72 -0.15 8.23 3.52 -0.16 -1.04 118.95 129.70 2iag s ARG 382 Ca 0.73 0.17 -0.02 0.00 -0.13 0.00 0.00 55.73 56.48 2iag s ARG 382 Cb -0.25 -3.22 -0.02 0.00 -1.56 0.00 0.00 34.95 29.91 2iag s ARG 382 CO 0.30 0.71 -0.09 -1.17 -0.81 0.00 0.00 175.30 174.24 2iag s LEU 383 N -0.99 2.89 -0.06 -0.88 2.96 0.98 0.35 118.68 123.92 2iag s LEU 383 Ca 0.20 -0.28 0.03 0.00 -0.22 0.00 0.00 54.13 53.86 2iag s LEU 383 Cb -0.15 -1.68 0.01 0.00 0.50 0.00 0.00 46.19 44.87 2iag s LEU 383 CO 0.09 0.14 -0.16 -0.22 -1.32 0.00 0.00 176.35 174.88 2iag s LEU 384 N 0.49 1.82 -0.06 -0.68 2.96 -0.13 -0.47 118.68 122.60 2iag s LEU 384 Ca -0.07 -0.36 0.01 0.00 -0.22 0.00 0.00 54.13 53.49 2iag s LEU 384 Cb -0.15 -0.97 -0.03 0.00 0.50 0.00 0.00 46.19 45.54 2iag s LEU 384 CO 0.04 0.10 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.33 2iag s LEU 385 N 0.39 3.15 -0.61 -0.68 1.43 0.18 -1.31 118.68 121.23 2iag s LEU 385 Ca -0.12 -0.03 0.06 0.00 -1.03 0.00 0.00 54.13 53.01 2iag s LEU 385 Cb -0.15 -1.69 0.22 0.00 0.03 0.00 0.00 46.19 44.60 2iag s LEU 385 CO 0.04 0.36 0.59 0.33 0.23 0.00 0.00 176.35 177.91 2iag n PHE 386 N 2.21 2.54 -0.36 0.29 7.35 -1.25 -1.72 117.46 126.51 2iag n PHE 386 Ca -0.18 -4.05 0.30 0.00 -0.76 0.00 0.00 57.45 52.77 2iag n PHE 386 Cb 0.53 -0.47 0.62 0.00 0.35 0.00 0.00 39.48 40.51 2iag n PHE 386 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 2iag h PRO 387 N 4.70 0.20 -0.53 -7.13 0.11 -1.80 -0.31 132.00 127.23 2iag h PRO 387 Ca 0.17 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 66.38 2iag h PRO 387 Cb 0.74 -0.04 -0.11 0.00 0.11 0.00 0.00 31.00 31.70 2iag h PRO 387 CO 0.70 0.13 -0.22 0.35 -0.21 0.00 0.00 178.00 178.75 2iag h PHE 388 N 0.20 -0.55 0.31 0.65 3.04 -1.85 0.07 116.94 118.81 2iag h PHE 388 Ca 0.64 0.06 -0.02 0.00 3.98 0.00 0.00 57.97 62.63 2iag h PHE 388 Cb 2.02 0.32 0.00 0.00 2.56 0.00 0.00 35.95 40.86 2iag h PHE 388 CO -0.00 -0.31 -0.15 -0.07 -2.02 0.00 0.00 178.31 175.76 2iag h LEU 389 N -0.10 -0.35 -7.34 0.59 4.07 -1.44 -0.66 115.31 110.08 2iag h LEU 389 Ca 0.24 -0.16 -0.20 0.00 0.08 0.00 0.00 57.88 57.85 2iag h LEU 389 Cb 0.48 0.09 -0.30 0.00 1.08 0.00 0.00 40.66 42.01 2iag h LEU 389 CO -0.59 -0.01 -0.49 -0.55 -1.08 0.00 0.00 178.44 175.72 2iag s SER 390 N -5.05 -0.23 0.20 -0.43 0.15 -1.02 -2.94 113.70 104.38 2iag s SER 390 Ca -0.14 0.52 0.25 0.00 0.70 0.00 0.00 55.95 57.28 2iag s SER 390 Cb 0.02 0.42 0.57 0.00 -1.71 0.00 0.00 66.02 65.32 2iag s SER 390 CO 0.56 -0.17 1.58 1.55 1.20 0.00 0.00 173.24 177.95 2iag h PRO 391 N 7.26 0.00 -0.52 5.44 0.13 -1.74 -3.30 132.00 139.27 2iag h PRO 391 Ca -0.39 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2iag h PRO 391 Cb 1.15 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 2iag h PRO 391 CO 0.36 0.00 0.31 1.96 -0.23 0.00 0.00 178.00 180.40 2iag h GLN 392 N 0.00 0.71 -0.35 0.86 4.20 -1.08 -2.62 115.11 116.82 2iag h GLN 392 Ca 0.00 -0.07 -0.17 0.00 0.06 0.00 0.00 58.65 58.47 2iag h GLN 392 Cb 0.78 -0.15 -0.10 0.00 0.30 0.00 0.00 27.48 28.31 2iag h GLN 392 CO 0.00 0.52 -0.06 0.54 -0.67 0.00 0.00 178.83 179.16 2iag n ARG 393 N -4.67 1.93 -2.71 1.46 1.74 -0.25 -4.85 116.66 109.30 2iag n ARG 393 Ca 0.03 -3.15 -0.43 0.00 -0.77 0.00 0.00 57.85 53.52 2iag n ARG 393 Cb 0.06 -1.82 -0.03 0.00 -1.02 0.00 0.00 32.46 29.65 2iag n ARG 393 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2iag s ASP 394 N -2.47 6.84 0.09 0.55 -1.08 -0.99 -4.89 116.67 114.71 2iag s ASP 394 Ca 0.45 0.89 0.24 0.00 -0.52 0.00 0.00 52.55 53.60 2iag s ASP 394 Cb 0.40 -2.51 0.94 0.00 -1.46 0.00 0.00 42.92 40.30 2iag s ASP 394 CO 0.01 -0.86 1.74 -0.81 0.52 0.00 0.00 175.17 175.77 2iag n PRO 395 N 6.80 0.09 0.13 4.34 -0.04 -1.26 -0.91 135.00 144.15 2iag n PRO 395 Ca 0.10 0.18 -0.00 0.00 -0.04 0.00 0.00 63.50 63.74 2iag n PRO 395 Cb 0.47 -1.62 0.10 0.00 -0.04 0.00 0.00 33.50 32.41 2iag n PRO 395 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2iag h GLU 396 N 0.00 0.00 0.00 0.54 5.08 -1.94 -3.38 114.58 114.88 2iag h GLU 396 Ca 0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2iag h GLU 396 Cb 0.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2iag h GLU 396 CO 0.00 0.64 -0.69 0.82 -1.00 0.00 0.00 179.01 178.78 2iag h ILE 397 N 0.00 0.41 -3.25 3.13 2.04 -1.23 -3.44 117.51 115.17 2iag h ILE 397 Ca -0.01 -1.48 -0.64 0.00 1.00 0.00 0.00 64.86 63.74 2iag h ILE 397 Cb 1.30 0.95 -0.16 0.00 -0.74 0.00 0.00 36.82 38.17 2iag h ILE 397 CO 0.08 0.14 -0.59 -0.31 0.00 0.00 0.00 178.15 177.47 2iag s TYR 398 N -2.22 3.21 -0.21 1.37 1.51 -0.09 -4.66 117.35 116.26 2iag s TYR 398 Ca -0.18 0.06 -0.29 0.00 -1.01 0.00 0.00 57.07 55.64 2iag s TYR 398 Cb 0.03 -1.98 0.00 0.00 -0.11 0.00 0.00 41.96 39.90 2iag s TYR 398 CO 0.35 0.23 1.12 0.99 -1.11 0.00 0.00 175.55 177.13 2iag s THR 399 N -0.02 4.54 -1.00 -0.71 2.01 -1.26 -3.77 115.64 115.43 2iag s THR 399 Ca 0.05 1.86 -0.09 0.00 0.31 0.00 0.00 61.69 63.82 2iag s THR 399 Cb -0.12 -4.21 -0.04 0.00 0.01 0.00 0.00 72.50 68.14 2iag s THR 399 CO 0.01 -0.18 0.83 0.47 -0.69 0.00 0.00 174.62 175.06 2iag n ASP 400 N 6.45 -6.45 0.25 3.53 8.00 -1.26 -4.91 116.55 122.15 2iag n ASP 400 Ca 0.13 -0.68 0.16 0.00 0.71 0.00 0.00 54.79 55.11 2iag n ASP 400 Cb 0.46 -4.57 0.86 0.00 -0.02 0.00 0.00 41.12 37.84 2iag n ASP 400 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2iag h PRO 401 N -0.96 0.00 0.00 -0.24 0.13 -1.90 -1.05 132.00 127.98 2iag h PRO 401 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2iag h PRO 401 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2iag h PRO 401 CO 0.42 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.34 2iag n GLU 402 N -2.63 0.09 -3.44 0.86 0.00 -1.26 -4.85 120.64 109.42 2iag n GLU 402 Ca -0.02 0.12 -0.38 0.00 0.00 0.00 0.00 57.16 56.88 2iag n GLU 402 Cb 0.09 -1.61 -0.06 0.00 0.00 0.00 0.00 31.44 29.86 2iag n GLU 402 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2iag s VAL 403 N -3.05 5.11 -0.41 3.84 1.01 -0.40 -5.04 120.40 121.46 2iag s VAL 403 Ca 0.12 0.85 -0.29 0.00 0.00 0.00 0.00 61.98 62.65 2iag s VAL 403 Cb 0.15 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.81 2iag s VAL 403 CO 0.51 0.47 1.29 0.12 0.00 0.00 0.00 175.10 177.49 2iag s PHE 404 N -0.29 2.61 -0.30 5.22 5.36 -1.26 -5.00 117.98 124.33 2iag s PHE 404 Ca 0.24 0.74 0.01 0.00 -0.96 0.00 0.00 56.93 56.95 2iag s PHE 404 Cb -0.16 -4.26 0.06 0.00 -0.34 0.00 0.00 43.02 38.32 2iag s PHE 404 CO 0.11 -1.65 -0.02 0.15 -1.46 0.00 0.00 175.22 172.35 2iag s LYS 405 N 4.61 2.21 0.55 10.12 1.02 -1.26 -4.99 119.74 131.99 2iag s LYS 405 Ca 0.55 -1.42 0.22 0.00 0.02 0.00 0.00 55.97 55.35 2iag s LYS 405 Cb -0.12 -3.11 1.52 0.00 -0.52 0.00 0.00 37.83 35.60 2iag s LYS 405 CO 0.30 -0.68 2.20 0.10 -0.92 0.00 0.00 175.35 176.35 2iag h TYR 406 N 7.87 0.00 -0.51 3.18 -0.00 -1.94 -1.87 116.97 123.70 2iag h TYR 406 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.55 2iag h TYR 406 Cb 1.05 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.78 2iag h TYR 406 CO 0.60 0.00 0.00 0.27 -0.00 0.00 0.00 178.16 179.03 2iag n ASN 407 N -4.23 5.26 0.26 0.10 6.94 -1.26 -3.23 115.26 119.10 2iag n ASN 407 Ca -0.03 -2.91 0.11 0.00 -0.02 0.00 0.00 54.58 51.73 2iag n ASN 407 Cb 0.09 -0.65 0.70 0.00 -2.36 0.00 0.00 39.78 37.57 2iag n ASN 407 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 2iag h ARG 408 N 3.52 0.00 -0.44 -3.83 2.43 -1.65 -1.13 114.38 113.28 2iag h ARG 408 Ca 0.00 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 2iag h ARG 408 Cb 1.82 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 31.29 2iag h ARG 408 CO 0.41 0.09 0.07 1.19 -1.51 0.00 0.00 179.97 180.23 2iag n PHE 409 N -4.00 1.43 -4.88 2.20 3.01 -1.26 -4.91 117.46 109.05 2iag n PHE 409 Ca -0.02 -1.27 -0.33 0.00 1.01 0.00 0.00 57.45 56.84 2iag n PHE 409 Cb 0.18 -0.49 -0.14 0.00 -0.01 0.00 0.00 39.48 39.02 2iag n PHE 409 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2iag s LEU 410 N -3.05 2.67 0.68 4.37 1.43 -0.43 -0.13 118.68 124.22 2iag s LEU 410 Ca 0.47 -0.27 -0.12 0.00 -1.03 0.00 0.00 54.13 53.17 2iag s LEU 410 Cb 0.39 -1.56 0.01 0.00 0.03 0.00 0.00 46.19 45.06 2iag s LEU 410 CO 0.07 0.27 1.07 0.20 0.23 0.00 0.00 176.35 178.18 2iag s ASN 411 N -0.26 5.26 0.56 2.29 0.01 0.75 -4.66 114.94 118.89 2iag s ASN 411 Ca 0.01 1.76 0.28 0.00 -0.71 0.00 0.00 52.86 54.20 2iag s ASN 411 Cb -0.13 -2.52 1.48 0.00 0.41 0.00 0.00 41.25 40.49 2iag s ASN 411 CO 0.03 -1.52 1.95 -0.65 -1.51 0.00 0.00 177.10 175.39 2iag h PRO 412 N -0.43 0.00 -0.00 -0.60 0.11 -1.96 0.23 132.00 129.35 2iag h PRO 412 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2iag h PRO 412 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2iag h PRO 412 CO 0.55 0.00 -0.06 -0.40 -0.21 0.00 0.00 178.00 177.89 2iag n ASP 413 N -4.01 0.48 0.00 -2.05 5.75 -1.26 -4.92 116.55 110.53 2iag n ASP 413 Ca 0.10 -0.79 0.00 0.00 -0.01 0.00 0.00 54.79 54.09 2iag n ASP 413 Cb 0.66 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.69 2iag n ASP 413 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2iag n GLY 414 N 1.20 0.61 3.72 6.12 0.00 0.82 -5.08 105.19 112.57 2iag n GLY 414 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2iag n GLY 414 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2iag s SER 415 N -1.87 3.48 -0.01 1.61 1.04 -1.26 -4.72 113.70 111.97 2iag s SER 415 Ca 0.00 1.47 -0.30 0.00 0.48 0.00 0.00 55.95 57.60 2iag s SER 415 Cb 0.00 -2.15 -0.05 0.00 0.10 0.00 0.00 66.02 63.91 2iag s SER 415 CO 0.00 -2.63 1.40 -0.70 0.98 0.00 0.00 173.24 172.29 2iag s GLU 416 N -4.94 4.28 -0.14 4.02 2.12 -1.26 -0.18 118.70 122.59 2iag s GLU 416 Ca 0.63 1.96 -0.29 0.00 0.36 0.00 0.00 54.97 57.63 2iag s GLU 416 Cb -0.18 -3.61 -0.01 0.00 0.26 0.00 0.00 34.13 30.60 2iag s GLU 416 CO 0.57 -0.59 1.07 0.21 -0.54 0.00 0.00 175.26 175.97 2iag s LYS 417 N 2.54 4.35 0.00 4.30 2.20 0.81 -4.65 119.74 129.28 2iag s LYS 417 Ca 0.64 1.45 0.00 0.00 -0.36 0.00 0.00 55.97 57.69 2iag s LYS 417 Cb -0.31 -3.59 0.00 0.00 -1.51 0.00 0.00 37.83 32.42 2iag s LYS 417 CO 0.26 -0.47 0.59 1.63 -0.36 0.00 0.00 175.35 177.01 2iag n LYS 418 N 5.58 0.02 -3.76 4.03 5.02 -1.26 -4.77 118.16 123.02 2iag n LYS 418 Ca 0.11 -0.71 -0.36 0.00 -2.02 0.00 0.00 58.31 55.32 2iag n LYS 418 Cb 0.47 -0.97 -0.11 0.00 -0.02 0.00 0.00 35.03 34.40 2iag n LYS 418 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2iag s ASP 419 N -0.24 5.28 0.12 4.39 -0.00 -1.26 -4.99 116.67 119.97 2iag s ASP 419 Ca 0.00 -2.01 0.09 0.00 -0.00 0.00 0.00 52.55 50.62 2iag s ASP 419 Cb 0.00 -1.84 -0.04 0.00 -0.00 0.00 0.00 42.92 41.04 2iag s ASP 419 CO 0.00 -0.55 -0.21 -0.36 -0.00 0.00 0.00 175.17 174.05 2iag s PHE 420 N 1.16 1.85 0.02 4.23 0.08 -1.26 -5.05 117.98 119.01 2iag s PHE 420 Ca 0.08 -0.42 0.02 0.00 0.12 0.00 0.00 56.93 56.73 2iag s PHE 420 Cb -0.23 -0.99 -0.01 0.00 -0.57 0.00 0.00 43.02 41.21 2iag s PHE 420 CO -0.04 0.25 -0.07 0.71 -0.10 0.00 0.00 175.22 175.97 2iag s TYR 421 N -1.34 0.63 -0.03 0.36 2.02 -1.26 -0.12 117.35 117.61 2iag s TYR 421 Ca 0.09 -0.30 0.02 0.00 -0.37 0.00 0.00 57.07 56.52 2iag s TYR 421 Cb -0.09 -0.39 0.00 0.00 -0.40 0.00 0.00 41.96 41.09 2iag s TYR 421 CO 0.05 -0.04 -0.09 0.21 -1.57 0.00 0.00 175.55 174.11 2iag s LYS 422 N -0.86 0.95 -1.48 -0.62 2.20 -0.71 -4.21 119.74 115.01 2iag s LYS 422 Ca -0.03 -0.29 -0.07 0.00 -0.36 0.00 0.00 55.97 55.21 2iag s LYS 422 Cb -0.06 -0.89 0.02 0.00 -1.51 0.00 0.00 37.83 35.39 2iag s LYS 422 CO 0.00 0.10 0.82 -0.25 -0.36 0.00 0.00 175.35 175.66 2iag n ASP 423 N 3.33 -5.95 0.00 1.43 8.00 -1.26 -1.30 116.55 120.80 2iag n ASP 423 Ca -0.18 -0.42 0.00 0.00 0.71 0.00 0.00 54.79 54.90 2iag n ASP 423 Cb 0.54 -4.76 0.00 0.00 -0.02 0.00 0.00 41.12 36.88 2iag n ASP 423 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2iag n GLY 424 N -1.67 0.25 3.71 0.44 0.00 -1.26 -4.98 105.19 101.67 2iag n GLY 424 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 2iag n GLY 424 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2iag s LYS 425 N -0.98 3.25 0.17 1.61 1.02 -0.42 -5.07 119.74 119.33 2iag s LYS 425 Ca 0.00 -0.35 -0.30 0.00 0.02 0.00 0.00 55.97 55.34 2iag s LYS 425 Cb 0.00 -2.94 -0.08 0.00 -0.52 0.00 0.00 37.83 34.29 2iag s LYS 425 CO 0.00 0.63 1.24 0.50 -0.92 0.00 0.00 175.35 176.80 2iag s ARG 426 N -0.67 4.45 -0.22 1.68 3.52 -1.26 -1.73 118.95 124.72 2iag s ARG 426 Ca 0.11 1.92 -0.21 0.00 -0.13 0.00 0.00 55.73 57.43 2iag s ARG 426 Cb -0.12 -3.24 -0.02 0.00 -1.56 0.00 0.00 34.95 30.01 2iag s ARG 426 CO 0.02 -0.17 0.63 -0.51 -0.81 0.00 0.00 175.30 174.46 2iag s LEU 427 N 0.04 4.12 0.14 -0.88 1.43 0.83 -4.93 118.68 119.43 2iag s LEU 427 Ca 0.55 0.78 -0.15 0.00 -1.03 0.00 0.00 54.13 54.28 2iag s LEU 427 Cb -0.33 -2.87 0.01 0.00 0.03 0.00 0.00 46.19 43.02 2iag s LEU 427 CO 0.36 -0.30 1.71 0.50 0.23 0.00 0.00 176.35 178.84 2iag h LYS 428 N 7.62 0.63 -4.82 1.70 3.64 -1.92 -3.41 116.57 120.01 2iag h LYS 428 Ca -0.30 -0.10 -0.68 0.00 -1.27 0.00 0.00 60.65 58.31 2iag h LYS 428 Cb 1.14 -0.11 -0.26 0.00 -0.41 0.00 0.00 32.23 32.59 2iag h LYS 428 CO 0.77 0.56 -0.63 -0.80 -2.27 0.00 0.00 179.45 177.08 2iag s ASN 429 N -5.84 5.10 0.00 4.20 0.01 -1.26 -4.94 114.94 112.22 2iag s ASN 429 Ca -0.13 -0.68 0.00 0.00 -0.71 0.00 0.00 52.86 51.34 2iag s ASN 429 Cb 0.11 -1.88 0.00 0.00 0.41 0.00 0.00 41.25 39.89 2iag s ASN 429 CO 0.75 -0.18 0.00 0.00 -1.51 0.00 0.00 177.10 176.16 2iag n TYR 430 N 4.87 0.00 -3.53 2.20 4.11 -1.26 -4.83 117.16 118.72 2iag n TYR 430 Ca -0.15 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.63 2iag n TYR 430 Cb 0.48 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.71 2iag n TYR 430 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.86 178.07 2iag s ASN 431 N -1.01 0.44 -0.36 9.48 2.47 -1.26 -4.25 114.94 120.44 2iag s ASN 431 Ca 0.00 0.37 0.10 0.00 0.42 0.00 0.00 52.86 53.75 2iag s ASN 431 Cb 0.00 0.87 0.45 0.00 -1.45 0.00 0.00 41.25 41.12 2iag s ASN 431 CO 0.00 -0.28 1.10 0.23 -3.72 0.00 0.00 177.10 174.43 2iag n MET 432 N 5.36 2.85 0.30 0.43 2.81 -1.26 -4.84 117.12 122.77 2iag n MET 432 Ca -0.06 -4.07 0.17 0.00 -1.81 0.00 0.00 57.70 51.93 2iag n MET 432 Cb 0.50 -1.99 0.92 0.00 -0.71 0.00 0.00 33.22 31.93 2iag n MET 432 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2iag h PRO 433 N 2.56 0.00 -0.38 0.03 0.13 -1.89 -2.93 132.00 129.52 2iag h PRO 433 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2iag h PRO 433 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2iag h PRO 433 CO 0.69 0.04 0.00 0.91 -0.23 0.00 0.00 178.00 179.41 2iag n TRP 434 N -3.43 0.50 -3.61 1.56 7.02 -1.26 -4.88 117.44 113.33 2iag n TRP 434 Ca -0.02 -0.25 0.00 0.00 -1.02 0.00 0.00 57.50 56.21 2iag n TRP 434 Cb 0.16 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.05 2iag n TRP 434 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2iag n GLY 435 N 1.39 -1.63 3.57 6.99 0.00 -1.11 0.06 105.19 114.46 2iag n GLY 435 Ca 0.19 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.68 2iag n GLY 435 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iag s ALA 436 N -1.10 -1.89 0.00 4.61 0.00 -1.26 -4.86 121.76 117.26 2iag s ALA 436 Ca 0.00 1.57 0.00 0.00 0.00 0.00 0.00 51.96 53.53 2iag s ALA 436 Cb 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.50 2iag s ALA 436 CO 0.00 -0.32 0.00 0.41 0.00 0.00 0.00 175.76 175.85 2iag n GLY 437 N 1.01 -0.21 0.09 0.00 0.00 -1.26 -3.87 105.19 100.95 2iag n GLY 437 Ca -0.13 -1.07 0.10 0.00 0.00 0.00 0.00 46.02 44.92 2iag n GLY 437 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2iag n HIS 438 N 2.70 0.55 0.03 1.61 8.25 -1.24 -2.79 115.22 124.33 2iag n HIS 438 Ca 0.00 0.22 0.10 0.00 -0.26 0.00 0.00 57.72 57.79 2iag n HIS 438 Cb 0.00 -0.86 0.23 0.00 1.12 0.00 0.00 29.99 30.48 2iag n HIS 438 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2iag n ASN 439 N -2.01 3.45 -4.68 0.41 3.02 -1.25 -5.04 115.26 109.16 2iag n ASN 439 Ca 0.02 -1.96 -0.31 0.00 -0.03 0.00 0.00 54.58 52.30 2iag n ASN 439 Cb 0.19 -0.31 0.16 0.00 -0.61 0.00 0.00 39.78 39.21 2iag n ASN 439 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 2iag s HIS 440 N -1.22 1.84 0.15 3.10 -3.43 -1.12 -4.73 115.29 109.88 2iag s HIS 440 Ca 0.38 1.67 -0.31 0.00 -0.80 0.00 0.00 55.06 56.00 2iag s HIS 440 Cb 0.21 -3.25 -0.11 0.00 -1.43 0.00 0.00 32.58 28.00 2iag s HIS 440 CO 0.29 -2.65 1.77 0.00 -2.00 0.00 0.00 174.74 172.15 2iag h LEU 442 N 7.95 0.00 -2.82 0.00 4.07 -1.90 -3.34 115.31 119.26 2iag h LEU 442 Ca -0.45 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.51 2iag h LEU 442 Cb 1.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.95 2iag h LEU 442 CO 0.95 0.01 0.00 0.61 -1.08 0.00 0.00 178.44 178.93 2iag n GLY 443 N 1.15 2.46 0.12 0.83 0.00 -1.26 -4.69 105.19 103.80 2iag n GLY 443 Ca 0.02 -0.79 -0.07 0.00 0.00 0.00 0.00 46.02 45.17 2iag n GLY 443 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2iag h ARG 444 N 3.99 0.05 -0.25 1.61 2.43 -1.94 0.40 114.38 120.68 2iag h ARG 444 Ca 0.00 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2iag h ARG 444 Cb 1.22 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 2iag h ARG 444 CO 0.14 0.04 0.13 0.77 -1.51 0.00 0.00 179.97 179.54 2iag h SER 445 N 0.05 0.20 -0.69 -3.80 0.02 -1.88 -0.08 113.55 107.37 2iag h SER 445 Ca 0.12 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.02 2iag h SER 445 Cb 0.17 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.65 2iag h SER 445 CO -0.22 0.15 0.20 0.22 -1.14 0.00 0.00 176.83 176.04 2iag h TYR 446 N 0.28 1.15 -0.25 3.45 3.20 -1.70 -1.33 116.97 121.76 2iag h TYR 446 Ca 0.10 -0.12 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 2iag h TYR 446 Cb 0.02 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 37.94 2iag h TYR 446 CO -0.09 0.92 0.07 0.00 -1.64 0.00 0.00 178.16 177.42 2iag h ALA 447 N 1.15 0.32 -0.01 1.82 0.00 0.08 -0.87 119.26 121.75 2iag h ALA 447 Ca 0.23 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2iag h ALA 447 Cb 0.33 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2iag h ALA 447 CO -0.00 -0.04 0.01 0.28 0.00 0.00 0.00 179.25 179.49 2iag h VAL 448 N 0.23 1.06 -0.32 0.00 2.07 -0.96 -1.66 116.25 116.66 2iag h VAL 448 Ca 0.08 -0.16 0.07 0.00 0.82 0.00 0.00 66.70 67.51 2iag h VAL 448 Cb 0.25 1.14 -0.07 0.00 -1.52 0.00 0.00 31.29 31.09 2iag h VAL 448 CO -0.00 0.04 -0.14 0.78 0.02 0.00 0.00 177.57 178.27 2iag h ASN 449 N -0.05 -0.48 -0.82 0.57 -0.26 -1.19 -2.37 115.58 110.97 2iag h ASN 449 Ca 0.00 0.12 -0.01 0.00 -0.56 0.00 0.00 56.30 55.85 2iag h ASN 449 Cb 0.07 0.27 -0.04 0.00 -1.06 0.00 0.00 38.32 37.56 2iag h ASN 449 CO -0.00 -0.18 0.48 0.28 -1.06 0.00 0.00 177.43 176.95 2iag h SER 450 N -0.09 1.01 -0.46 5.81 0.02 -0.99 -0.80 113.55 118.06 2iag h SER 450 Ca 0.16 -0.08 -0.13 0.00 -0.84 0.00 0.00 61.79 60.90 2iag h SER 450 Cb 0.34 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 2iag h SER 450 CO -0.38 0.80 -0.24 0.40 -1.14 0.00 0.00 176.83 176.27 2iag h ILE 451 N 1.14 1.27 -0.12 3.27 2.04 -1.16 -0.80 117.51 123.14 2iag h ILE 451 Ca 0.29 -1.40 -0.12 0.00 1.00 0.00 0.00 64.86 64.63 2iag h ILE 451 Cb -0.01 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 2iag h ILE 451 CO -0.05 0.48 -0.45 0.11 0.00 0.00 0.00 178.15 178.24 2iag h LYS 452 N 0.81 0.29 -0.29 2.37 1.57 -1.17 -0.08 116.57 120.08 2iag h LYS 452 Ca 0.10 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 2iag h LYS 452 Cb 0.82 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 2iag h LYS 452 CO 0.07 0.69 -0.27 1.96 -0.57 0.00 0.00 179.45 181.33 2iag h GLN 453 N 0.24 0.69 -0.09 3.15 4.20 -1.00 -1.22 115.11 121.08 2iag h GLN 453 Ca 0.02 -0.36 0.02 0.00 0.06 0.00 0.00 58.65 58.39 2iag h GLN 453 Cb 0.89 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.66 2iag h GLN 453 CO 0.07 0.97 -0.03 0.35 -0.67 0.00 0.00 178.83 179.52 2iag h PHE 454 N 0.43 -0.07 -0.86 2.96 3.57 -0.89 -1.68 116.94 120.40 2iag h PHE 454 Ca 0.05 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.57 2iag h PHE 454 Cb 0.83 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.57 2iag h PHE 454 CO 0.07 -0.05 0.57 0.28 -2.23 0.00 0.00 178.31 176.94 2iag h VAL 455 N -0.02 1.20 0.05 1.41 2.07 -0.94 -1.76 116.25 118.26 2iag h VAL 455 Ca 0.05 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 67.18 2iag h VAL 455 Cb 0.09 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.80 2iag h VAL 455 CO -0.10 0.21 -0.07 0.15 0.02 0.00 0.00 177.57 177.77 2iag h PHE 456 N 1.14 -0.19 -0.66 1.57 3.57 -1.06 0.27 116.94 121.59 2iag h PHE 456 Ca 0.32 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.89 2iag h PHE 456 Cb -0.10 0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.66 2iag h PHE 456 CO -0.01 -0.12 0.36 -0.07 -2.23 0.00 0.00 178.31 176.24 2iag h LEU 457 N -0.15 0.51 -0.31 0.59 3.38 -1.00 -0.63 115.31 117.71 2iag h LEU 457 Ca 0.01 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 2iag h LEU 457 Cb 0.16 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2iag h LEU 457 CO -0.04 0.33 -0.29 0.58 0.09 0.00 0.00 178.44 179.10 2iag h VAL 458 N 0.65 1.30 0.00 1.22 2.07 -1.13 -1.07 116.25 119.28 2iag h VAL 458 Ca 0.30 -1.46 -0.15 0.00 0.82 0.00 0.00 66.70 66.21 2iag h VAL 458 Cb 0.22 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2iag h VAL 458 CO -0.20 0.47 -0.74 -0.07 0.02 0.00 0.00 177.57 177.06 2iag h LEU 459 N 0.50 0.00 0.00 2.57 4.07 -0.77 -2.91 115.31 118.77 2iag h LEU 459 Ca 0.05 0.00 -0.38 0.00 0.08 0.00 0.00 57.88 57.63 2iag h LEU 459 Cb 0.87 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.54 2iag h LEU 459 CO 0.07 0.74 -2.38 0.52 -1.08 0.00 0.00 178.44 176.31 2iag n VAL 460 N -3.55 1.37 0.07 1.22 0.31 -0.26 -4.60 118.33 112.89 2iag n VAL 460 Ca -0.00 -0.47 0.06 0.00 -0.01 0.00 0.00 64.34 63.92 2iag n VAL 460 Cb 0.74 -1.51 -0.04 0.00 -0.91 0.00 0.00 33.84 32.12 2iag n VAL 460 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 2iag h HIS 461 N -0.31 0.00 -2.02 3.52 3.86 -1.34 -3.48 115.15 115.39 2iag h HIS 461 Ca -0.57 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.04 2iag h HIS 461 Cb 1.74 0.00 -0.13 0.00 1.06 0.00 0.00 27.41 30.07 2iag h HIS 461 CO -0.01 0.28 -0.66 -0.51 0.86 0.00 0.00 177.93 177.89 2iag s LEU 462 N -5.60 2.70 -0.18 2.43 1.43 -1.10 -1.33 118.68 117.03 2iag s LEU 462 Ca -0.01 -1.23 -0.08 0.00 -1.03 0.00 0.00 54.13 51.77 2iag s LEU 462 Cb 0.09 -0.91 -0.04 0.00 0.03 0.00 0.00 46.19 45.36 2iag s LEU 462 CO 0.80 -0.28 0.09 -1.81 0.23 0.00 0.00 176.35 175.38 2iag s ASP 463 N -3.60 5.92 -0.05 2.29 1.01 -0.23 -4.57 116.67 117.44 2iag s ASP 463 Ca 0.33 0.18 0.02 0.00 0.71 0.00 0.00 52.55 53.78 2iag s ASP 463 Cb 0.04 -2.01 0.01 0.00 1.01 0.00 0.00 42.92 41.97 2iag s ASP 463 CO 0.16 0.20 -0.10 -0.22 0.21 0.00 0.00 175.17 175.42 2iag s LEU 464 N 0.23 1.59 0.08 1.23 2.96 -1.26 -1.89 118.68 121.62 2iag s LEU 464 Ca 0.06 -0.23 -0.15 0.00 -0.22 0.00 0.00 54.13 53.59 2iag s LEU 464 Cb -0.12 -0.68 0.03 0.00 0.50 0.00 0.00 46.19 45.92 2iag s LEU 464 CO -0.01 0.02 0.35 -1.83 -1.32 0.00 0.00 176.35 173.57 2iag s GLU 465 N 0.63 0.94 0.27 1.98 -1.05 -0.63 -5.01 118.70 115.82 2iag s GLU 465 Ca -0.12 -0.61 -0.30 0.00 -0.15 0.00 0.00 54.97 53.79 2iag s GLU 465 Cb -0.14 0.41 -0.10 0.00 -0.44 0.00 0.00 34.13 33.86 2iag s GLU 465 CO 0.02 -0.34 1.42 -0.51 0.95 0.00 0.00 175.26 176.81 2iag s LEU 466 N -2.45 4.39 0.13 1.83 1.43 -1.26 -1.11 118.68 121.63 2iag s LEU 466 Ca -0.01 2.70 -0.21 0.00 -1.03 0.00 0.00 54.13 55.58 2iag s LEU 466 Cb 0.01 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.57 2iag s LEU 466 CO -0.08 -0.69 1.69 0.40 0.23 0.00 0.00 176.35 177.91 2iag h ILE 467 N 3.43 0.74 -3.17 -0.59 1.08 -1.80 -3.41 117.51 113.80 2iag h ILE 467 Ca -0.47 0.00 -0.67 0.00 -0.39 0.00 0.00 64.86 63.33 2iag h ILE 467 Cb 1.22 0.74 -0.33 0.00 -3.07 0.00 0.00 36.82 35.38 2iag h ILE 467 CO 0.75 0.00 -0.83 0.21 -0.69 0.00 0.00 178.15 177.59 2iag s ASN 468 N -5.15 3.39 0.48 1.72 3.04 -1.26 -5.01 114.94 112.15 2iag s ASN 468 Ca -0.14 -0.58 0.27 0.00 0.04 0.00 0.00 52.86 52.46 2iag s ASN 468 Cb 0.10 -1.53 0.95 0.00 -1.54 0.00 0.00 41.25 39.23 2iag s ASN 468 CO 0.68 0.02 1.83 0.00 -3.04 0.00 0.00 177.10 176.59 2iag h ALA 469 N 7.79 0.99 -0.07 1.71 0.00 -1.99 -2.94 119.26 124.76 2iag h ALA 469 Ca -0.41 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2iag h ALA 469 Cb 1.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2iag h ALA 469 CO 0.61 0.13 0.00 -0.25 0.00 0.00 0.00 179.25 179.74 2iag n ASP 470 N -3.20 1.78 -4.65 0.00 8.00 -1.26 -4.96 116.55 112.27 2iag n ASP 470 Ca 0.01 -1.62 -0.45 0.00 0.71 0.00 0.00 54.79 53.43 2iag n ASP 470 Cb 0.41 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.45 2iag n ASP 470 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 2iag n VAL 471 N 0.39 1.06 -2.70 2.53 3.14 -1.11 -4.95 118.33 116.69 2iag n VAL 471 Ca 0.18 -0.26 -0.35 0.00 -2.96 0.00 0.00 64.34 60.95 2iag n VAL 471 Cb 0.39 -1.34 -0.06 0.00 -1.06 0.00 0.00 33.84 31.77 2iag n VAL 471 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2iag s GLU 472 N -0.55 4.20 -0.05 1.45 0.41 -1.26 -5.00 118.70 117.90 2iag s GLU 472 Ca 0.68 1.29 -0.30 0.00 -0.41 0.00 0.00 54.97 56.23 2iag s GLU 472 Cb -0.68 -2.36 -0.06 0.00 -1.78 0.00 0.00 34.13 29.25 2iag s GLU 472 CO 0.51 -0.07 1.64 0.42 -0.49 0.00 0.00 175.26 177.27 2iag s ILE 473 N -1.92 3.58 0.75 -1.63 1.01 -1.26 -4.96 121.20 116.76 2iag s ILE 473 Ca 0.60 0.72 -0.14 0.00 0.00 0.00 0.00 60.65 61.83 2iag s ILE 473 Cb -0.15 -3.47 0.05 0.00 0.01 0.00 0.00 42.46 38.90 2iag s ILE 473 CO 0.19 -0.06 1.19 -2.84 0.00 0.00 0.00 174.94 173.43 2iag s PRO 474 N 3.92 2.05 0.71 2.79 0.02 -1.26 -5.00 135.00 138.22 2iag s PRO 474 Ca 0.73 1.71 -0.11 0.00 0.02 0.00 0.00 61.00 63.35 2iag s PRO 474 Cb -0.33 -1.83 0.02 0.00 0.02 0.00 0.00 34.50 32.38 2iag s PRO 474 CO 0.29 -1.90 1.07 -2.00 -0.33 0.00 0.00 177.00 174.13 2iag s GLU 475 N -4.03 2.77 0.41 5.54 2.56 -1.26 -4.81 118.70 119.88 2iag s GLU 475 Ca 0.73 0.91 -0.26 0.00 0.00 0.00 0.00 54.97 56.35 2iag s GLU 475 Cb -0.28 -1.97 -0.08 0.00 2.00 0.00 0.00 34.13 33.79 2iag s GLU 475 CO 0.47 -1.20 1.27 -0.06 -0.56 0.00 0.00 175.26 175.17 2iag s PHE 476 N -3.06 2.86 -0.62 5.30 0.08 -1.26 0.18 117.98 121.46 2iag s PHE 476 Ca 0.59 1.44 -0.26 0.00 0.12 0.00 0.00 56.93 58.82 2iag s PHE 476 Cb -0.14 -3.61 -0.03 0.00 -0.57 0.00 0.00 43.02 38.68 2iag s PHE 476 CO 0.55 -1.93 1.90 0.34 -0.10 0.00 0.00 175.22 175.98 2iag s ASP 477 N -0.85 5.20 0.64 1.36 -1.08 -0.14 -4.47 116.67 117.34 2iag s ASP 477 Ca 0.58 0.34 0.39 0.00 -0.52 0.00 0.00 52.55 53.34 2iag s ASP 477 Cb -0.36 -2.53 2.18 0.00 -1.46 0.00 0.00 42.92 40.75 2iag s ASP 477 CO 0.46 -2.43 2.31 -0.07 0.52 0.00 0.00 175.17 175.96 2iag h LEU 478 N 16.72 0.00 0.00 -1.34 3.38 -1.88 -2.01 115.31 130.18 2iag h LEU 478 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2iag h LEU 478 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2iag h LEU 478 CO 1.21 0.01 0.00 -1.54 0.09 0.00 0.00 178.44 178.21 2iag n SER 479 N -3.32 0.00 -0.52 -0.43 3.41 -1.26 -3.31 113.62 108.19 2iag n SER 479 Ca -0.03 0.30 0.13 0.00 -0.26 0.00 0.00 58.87 59.01 2iag n SER 479 Cb 0.09 -0.40 0.38 0.00 -0.26 0.00 0.00 64.21 64.02 2iag n SER 479 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2iag n ARG 480 N -1.40 1.57 -1.70 4.33 1.74 -0.76 -4.82 116.66 115.62 2iag n ARG 480 Ca 0.05 -1.04 -0.43 0.00 -0.77 0.00 0.00 57.85 55.66 2iag n ARG 480 Cb 0.14 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.07 2iag n ARG 480 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2iag n TYR 481 N 0.20 2.61 -0.13 -1.55 4.01 -1.21 -2.19 117.16 118.90 2iag n TYR 481 Ca 0.16 0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.98 2iag n TYR 481 Cb 0.41 -2.65 0.00 0.00 -0.31 0.00 0.00 39.34 36.79 2iag n TYR 481 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2iag n GLY 482 N 3.86 0.74 0.02 2.72 0.00 0.29 -4.92 105.19 107.90 2iag n GLY 482 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 2iag n GLY 482 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2iag n PHE 483 N -2.00 0.15 0.00 1.61 3.01 -0.93 -3.03 117.46 116.27 2iag n PHE 483 Ca 0.00 0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.50 2iag n PHE 483 Cb 0.00 -0.31 0.00 0.00 -0.01 0.00 0.00 39.48 39.16 2iag n PHE 483 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2iag n GLY 484 N 1.41 0.43 3.73 1.37 0.00 -1.26 -4.86 105.19 106.01 2iag n GLY 484 Ca 0.02 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 2iag n GLY 484 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2iag s LEU 485 N 0.00 4.39 0.56 0.99 2.01 -1.26 0.54 118.68 125.91 2iag s LEU 485 Ca 0.00 2.46 -0.17 0.00 0.01 0.00 0.00 54.13 56.43 2iag s LEU 485 Cb 0.00 -3.60 -0.05 0.00 0.01 0.00 0.00 46.19 42.55 2iag s LEU 485 CO 0.00 -0.64 1.06 -0.04 1.01 0.00 0.00 176.35 177.75 2iag s MET 486 N 0.34 3.42 0.14 1.70 -1.94 0.27 -4.89 119.30 118.34 2iag s MET 486 Ca 0.61 1.30 0.11 0.00 -1.71 0.00 0.00 55.69 56.00 2iag s MET 486 Cb -0.38 -2.04 -0.04 0.00 2.01 0.00 0.00 34.83 34.37 2iag s MET 486 CO 0.36 -0.74 -0.24 -0.65 -0.01 0.00 0.00 175.02 173.74 2iag s GLN 487 N -3.77 1.52 0.46 2.03 -0.21 -1.26 -4.84 119.66 113.58 2iag s GLN 487 Ca 0.66 -1.36 -0.20 0.00 0.02 0.00 0.00 55.36 54.48 2iag s GLN 487 Cb -0.17 -1.94 -0.10 0.00 1.00 0.00 0.00 33.01 31.80 2iag s GLN 487 CO 0.32 0.44 0.97 -1.25 -2.12 0.00 0.00 175.29 173.65 2iag s PRO 488 N -2.24 4.10 0.58 2.91 0.04 -1.26 -0.96 135.00 138.17 2iag s PRO 488 Ca 0.17 1.12 0.35 0.00 0.04 0.00 0.00 61.00 62.67 2iag s PRO 488 Cb -0.10 -2.16 1.73 0.00 0.04 0.00 0.00 34.50 34.02 2iag s PRO 488 CO 0.08 -0.14 2.14 1.05 0.04 0.00 0.00 177.00 180.16 2iag h GLU 489 N 1.64 0.00 -3.62 4.56 4.11 -0.49 -3.41 114.58 117.37 2iag h GLU 489 Ca -0.49 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.88 2iag h GLU 489 Cb 1.19 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.33 2iag h GLU 489 CO 0.61 0.04 -0.15 -3.38 0.07 0.00 0.00 179.01 176.19 2iag s HIS 490 N -3.98 0.18 0.68 2.06 -3.43 -1.26 -4.97 115.29 104.57 2iag s HIS 490 Ca -0.02 -0.54 -0.07 0.00 -0.80 0.00 0.00 55.06 53.63 2iag s HIS 490 Cb 0.12 0.16 0.05 0.00 -1.43 0.00 0.00 32.58 31.47 2iag s HIS 490 CO 0.51 -0.83 1.00 0.34 -2.00 0.00 0.00 174.74 173.76 2iag s ASP 491 N -2.93 5.01 -0.20 7.38 -1.08 -1.26 -4.84 116.67 118.75 2iag s ASP 491 Ca 0.14 0.56 -0.01 0.00 -0.52 0.00 0.00 52.55 52.72 2iag s ASP 491 Cb 0.01 -1.28 0.01 0.00 -1.46 0.00 0.00 42.92 40.20 2iag s ASP 491 CO -0.00 -1.48 -0.13 -0.69 0.52 0.00 0.00 175.17 173.39 2iag s VAL 492 N -3.21 2.57 0.20 1.11 1.01 -1.26 -4.98 120.40 115.85 2iag s VAL 492 Ca 0.59 -0.80 -0.31 0.00 0.00 0.00 0.00 61.98 61.46 2iag s VAL 492 Cb -0.11 -2.14 -0.10 0.00 0.00 0.00 0.00 36.38 34.03 2iag s VAL 492 CO 0.45 0.47 1.49 -2.16 0.00 0.00 0.00 175.10 175.35 2iag s PRO 493 N 1.36 4.25 0.35 2.72 0.04 -1.26 -0.05 135.00 142.40 2iag s PRO 493 Ca 0.05 2.30 0.03 0.00 0.04 0.00 0.00 61.00 63.42 2iag s PRO 493 Cb -0.14 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.22 2iag s PRO 493 CO -0.09 -0.50 0.12 0.14 0.04 0.00 0.00 177.00 176.71 2iag s VAL 494 N 0.63 0.65 -0.03 -0.36 -7.23 0.11 -2.61 120.40 111.55 2iag s VAL 494 Ca 0.65 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.83 2iag s VAL 494 Cb -0.42 -2.52 0.01 0.00 0.56 0.00 0.00 36.38 34.01 2iag s VAL 494 CO 0.36 0.00 -0.06 -0.60 -0.31 0.00 0.00 175.10 174.49 2iag s ARG 495 N -3.81 0.85 0.03 4.82 3.52 -0.27 -1.84 118.95 122.26 2iag s ARG 495 Ca 0.31 -0.19 -0.02 0.00 -0.13 0.00 0.00 55.73 55.71 2iag s ARG 495 Cb 0.05 -0.82 -0.02 0.00 -1.56 0.00 0.00 34.95 32.60 2iag s ARG 495 CO 0.16 0.01 0.01 1.52 -0.81 0.00 0.00 175.30 176.18 2iag s TYR 496 N 0.55 0.33 0.03 5.12 -0.85 -0.84 -1.60 117.35 120.08 2iag s TYR 496 Ca -0.08 -0.69 -0.16 0.00 -0.52 0.00 0.00 57.07 55.62 2iag s TYR 496 Cb -0.11 -0.24 0.03 0.00 0.38 0.00 0.00 41.96 42.01 2iag s TYR 496 CO 0.00 -0.30 0.35 -0.98 -1.52 0.00 0.00 175.55 173.11 2iag s ARG 497 N -2.58 0.84 0.37 -3.49 1.70 -0.79 -1.20 118.95 113.78 2iag s ARG 497 Ca -0.05 -0.39 -0.28 0.00 -0.47 0.00 0.00 55.73 54.54 2iag s ARG 497 Cb -0.02 0.37 -0.11 0.00 -0.57 0.00 0.00 34.95 34.62 2iag s ARG 497 CO -0.05 -0.27 1.45 -0.89 -1.08 0.00 0.00 175.30 174.46 2iag n ILE 498 N 0.66 1.96 -1.68 4.99 5.41 -1.26 -1.07 119.36 128.38 2iag n ILE 498 Ca -0.19 -0.49 -0.43 0.00 1.00 0.00 0.00 62.75 62.64 2iag n ILE 498 Cb 0.59 -1.88 -0.03 0.00 -0.71 0.00 0.00 39.64 37.60 2iag n ILE 498 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 2iag n ARG 499 N 0.53 2.70 -1.89 0.38 3.00 -0.44 -4.70 116.66 116.23 2iag n ARG 499 Ca 0.02 0.98 -0.38 0.00 -0.00 0.00 0.00 57.85 58.47 2iag n ARG 499 Cb 0.38 -2.88 0.03 0.00 0.00 0.00 0.00 32.46 29.98 2iag n ARG 499 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 2iag s PRO 500 N 3.36 3.32 -0.40 -0.14 0.02 -1.26 -4.81 135.00 135.09 2iag s PRO 500 Ca 0.86 2.14 -0.07 0.00 0.02 0.00 0.00 61.00 63.95 2iag s PRO 500 Cb -0.51 -2.32 -0.11 0.00 0.02 0.00 0.00 34.50 31.58 2iag s PRO 500 CO 0.41 -1.02 1.46 1.58 -0.33 0.00 0.00 177.00 179.11 2iag n HIS 501 N -0.84 0.17 1.25 6.54 -0.00 -1.26 -5.17 115.22 115.90 2iag n HIS 501 Ca 0.09 -0.02 0.13 0.00 0.46 0.00 0.00 57.72 58.38 2iag n HIS 501 Cb 0.45 -0.86 0.31 0.00 -0.12 0.00 0.00 29.99 29.77 2iag n HIS 501 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38