#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iel n PRO 5 N 0.00 1.15 -0.32 0.00 -0.02 -1.26 -4.71 135.00 129.84 1iel n PRO 5 Ca 0.00 0.41 0.15 0.00 -2.02 0.00 0.00 63.50 62.04 1iel n PRO 5 Cb 0.00 -1.85 0.38 0.00 -0.02 0.00 0.00 33.50 32.01 1iel n PRO 5 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1iel h GLN 6 N 1.49 0.65 -0.45 -0.52 -0.00 -2.05 -1.18 115.11 113.04 1iel h GLN 6 Ca -0.42 -0.04 0.05 0.00 -0.00 0.00 0.00 58.65 58.25 1iel h GLN 6 Cb 1.35 -0.15 -0.05 0.00 0.00 0.00 0.00 27.48 28.64 1iel h GLN 6 CO 0.57 0.43 0.18 1.96 0.00 0.00 0.00 178.83 181.96 1iel h GLN 7 N 0.67 0.35 -0.09 1.69 1.08 -2.00 0.36 115.11 117.18 1iel h GLN 7 Ca 0.54 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.69 1iel h GLN 7 Cb 0.96 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 28.31 1iel h GLN 7 CO -0.30 0.23 -0.06 0.82 -0.95 0.00 0.00 178.83 178.58 1iel h ILE 8 N 0.36 1.34 -0.98 2.54 2.04 -1.57 -2.77 117.51 118.46 1iel h ILE 8 Ca 0.21 -1.12 0.06 0.00 1.00 0.00 0.00 64.86 65.01 1iel h ILE 8 Cb 0.19 1.90 -0.06 0.00 -0.74 0.00 0.00 36.82 38.11 1iel h ILE 8 CO -0.20 0.31 0.63 0.78 0.00 0.00 0.00 178.15 179.68 1iel h ASN 9 N -0.20 1.02 0.12 1.72 2.35 -1.22 -1.15 115.58 118.23 1iel h ASN 9 Ca 0.02 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1iel h ASN 9 Cb 0.53 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.68 1iel h ASN 9 CO 0.02 0.66 -0.06 -0.78 -1.65 0.00 0.00 177.43 175.62 1iel h ASP 10 N 1.17 -0.14 0.03 5.81 3.58 -0.91 -1.97 116.42 123.99 1iel h ASP 10 Ca 0.42 -0.21 -0.11 0.00 0.42 0.00 0.00 57.03 57.54 1iel h ASP 10 Cb 0.13 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 1iel h ASP 10 CO -0.16 0.14 -0.35 -0.29 -2.88 0.00 0.00 179.24 175.69 1iel h ILE 11 N -0.43 1.29 -0.16 2.25 6.09 -1.36 -1.74 117.51 123.45 1iel h ILE 11 Ca -0.02 -1.45 -0.05 0.00 -1.37 0.00 0.00 64.86 61.97 1iel h ILE 11 Cb 0.34 1.52 -0.00 0.00 0.47 0.00 0.00 36.82 39.15 1iel h ILE 11 CO 0.03 0.45 -0.08 0.58 -3.07 0.00 0.00 178.15 176.06 1iel h VAL 12 N 0.38 1.31 -0.59 2.19 2.07 -1.23 -2.13 116.25 118.26 1iel h VAL 12 Ca 0.04 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 1iel h VAL 12 Cb 0.80 1.71 -0.03 0.00 -1.52 0.00 0.00 31.29 32.26 1iel h VAL 12 CO 0.06 0.33 0.33 -0.74 0.02 0.00 0.00 177.57 177.58 1iel h HIS 13 N 0.02 0.80 0.00 1.57 -0.00 -1.30 0.11 115.15 116.35 1iel h HIS 13 Ca 0.04 -0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.37 1iel h HIS 13 Cb 0.56 -0.26 -0.00 0.00 -0.00 0.00 0.00 27.41 27.71 1iel h HIS 13 CO 0.07 0.58 -0.11 0.00 -0.00 0.00 0.00 177.93 178.46 1iel h ARG 14 N 0.79 0.00 0.00 5.26 3.08 -1.32 -3.10 114.38 119.09 1iel h ARG 14 Ca 0.21 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.81 1iel h ARG 14 Cb 0.03 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.02 1iel h ARG 14 CO -0.03 0.11 -2.48 2.41 -1.07 0.00 0.00 179.97 178.90 1iel n THR 15 N -3.31 1.46 -0.01 2.04 -1.04 -0.80 -4.48 114.28 108.14 1iel n THR 15 Ca -0.00 -0.37 -0.16 0.00 -2.04 0.00 0.00 64.05 61.48 1iel n THR 15 Cb 0.33 -1.86 -0.11 0.00 -1.82 0.00 0.00 70.33 66.86 1iel n THR 15 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1iel h ILE 16 N -0.95 1.48 -0.70 12.58 1.08 -0.95 -3.07 117.51 126.98 1iel h ILE 16 Ca -0.67 -1.98 0.07 0.00 -0.39 0.00 0.00 64.86 61.88 1iel h ILE 16 Cb 1.59 2.65 -0.06 0.00 -3.07 0.00 0.00 36.82 37.93 1iel h ILE 16 CO -0.41 0.56 0.38 0.74 -0.69 0.00 0.00 178.15 178.73 1iel h THR 17 N -0.29 0.92 -0.17 -0.27 2.02 -1.64 -0.05 112.91 113.42 1iel h THR 17 Ca -0.05 -0.23 -0.13 0.00 0.77 0.00 0.00 66.41 66.77 1iel h THR 17 Cb 1.14 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1iel h THR 17 CO 0.08 0.12 -0.45 -0.65 0.37 0.00 0.00 175.52 175.00 1iel h PRO 18 N 0.67 0.41 -0.27 6.66 0.11 -1.74 -2.66 132.00 135.18 1iel h PRO 18 Ca 0.33 -0.22 0.03 0.00 0.11 0.00 0.00 66.00 66.25 1iel h PRO 18 Cb 0.27 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 1iel h PRO 18 CO -0.22 0.78 0.07 1.25 -0.21 0.00 0.00 178.00 179.67 1iel h LEU 19 N 0.34 0.04 -1.05 2.35 5.85 -1.17 0.12 115.31 121.79 1iel h LEU 19 Ca 0.02 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.83 1iel h LEU 19 Cb 0.92 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.94 1iel h LEU 19 CO 0.08 0.06 0.64 0.40 -0.34 0.00 0.00 178.44 179.27 1iel h ILE 20 N 0.17 1.15 -0.33 4.05 2.04 -0.93 0.71 117.51 124.37 1iel h ILE 20 Ca 0.12 -0.41 -0.12 0.00 1.00 0.00 0.00 64.86 65.45 1iel h ILE 20 Cb 0.12 -0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.03 1iel h ILE 20 CO -0.15 0.22 -0.28 -0.33 0.00 0.00 0.00 178.15 177.61 1iel h GLU 21 N 1.20 0.77 -0.60 2.37 4.39 -1.01 0.14 114.58 121.84 1iel h GLU 21 Ca 0.39 -0.39 -0.10 0.00 0.34 0.00 0.00 59.36 59.61 1iel h GLU 21 Cb 0.05 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 1iel h GLU 21 CO -0.13 1.01 -0.02 1.96 -1.16 0.00 0.00 179.01 180.67 1iel h GLN 22 N 0.54 1.08 -0.00 2.33 4.20 -0.30 -3.16 115.11 119.79 1iel h GLN 22 Ca 0.06 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1iel h GLN 22 Cb 0.85 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.54 1iel h GLN 22 CO 0.07 1.06 -0.48 1.04 -0.67 0.00 0.00 178.83 179.85 1iel n GLN 23 N -4.17 0.46 -3.60 1.46 1.13 0.20 -4.97 117.38 107.88 1iel n GLN 23 Ca 0.03 -0.31 -0.20 0.00 -1.94 0.00 0.00 57.00 54.57 1iel n GLN 23 Cb 0.36 -1.49 0.06 0.00 0.11 0.00 0.00 30.24 29.28 1iel n GLN 23 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1iel n LYS 24 N -1.00 -5.77 -2.75 -1.09 2.85 0.43 -4.94 118.16 105.88 1iel n LYS 24 Ca 0.08 0.72 -0.42 0.00 -1.05 0.00 0.00 58.31 57.64 1iel n LYS 24 Cb 0.36 -5.50 -0.03 0.00 -0.65 0.00 0.00 35.03 29.21 1iel n LYS 24 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1iel s ILE 25 N -3.51 4.81 0.19 0.58 1.01 -0.77 -4.96 121.20 118.55 1iel s ILE 25 Ca 0.07 1.91 -0.11 0.00 0.00 0.00 0.00 60.65 62.52 1iel s ILE 25 Cb -0.03 -4.26 0.12 0.00 0.01 0.00 0.00 42.46 38.30 1iel s ILE 25 CO 0.78 0.01 1.80 -0.65 0.00 0.00 0.00 174.94 176.88 1iel h PRO 26 N 7.17 0.95 -2.72 2.79 0.11 -1.89 -3.46 132.00 134.95 1iel h PRO 26 Ca -0.30 -0.12 -0.10 0.00 0.11 0.00 0.00 66.00 65.59 1iel h PRO 26 Cb 1.14 -0.18 -0.20 0.00 0.11 0.00 0.00 31.00 31.87 1iel h PRO 26 CO 0.85 0.73 -0.14 0.20 -0.21 0.00 0.00 178.00 179.43 1iel s GLY 27 N -3.04 -0.28 -0.10 -0.55 0.00 -1.21 -1.19 107.32 100.94 1iel s GLY 27 Ca -0.13 0.67 -0.21 0.00 0.00 0.00 0.00 44.72 45.05 1iel s GLY 27 CO 0.79 0.42 0.52 -0.29 0.00 0.00 0.00 173.10 174.54 1iel s MET 28 N -1.18 0.77 -0.02 2.90 1.75 -0.75 -2.38 119.30 120.39 1iel s MET 28 Ca -0.12 0.34 0.04 0.00 -1.25 0.00 0.00 55.69 54.69 1iel s MET 28 Cb -0.04 0.36 -0.01 0.00 2.84 0.00 0.00 34.83 37.99 1iel s MET 28 CO 0.06 -0.18 -0.12 0.00 -0.65 0.00 0.00 175.02 174.12 1iel s ALA 29 N -0.61 1.06 -0.01 4.11 0.00 -0.29 -1.13 121.76 124.90 1iel s ALA 29 Ca -0.07 -0.51 0.02 0.00 0.00 0.00 0.00 51.96 51.40 1iel s ALA 29 Cb -0.03 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.78 1iel s ALA 29 CO 0.05 0.23 -0.07 0.08 0.00 0.00 0.00 175.76 176.05 1iel s VAL 30 N -0.13 0.56 -0.04 0.00 1.01 -0.02 -1.32 120.40 120.45 1iel s VAL 30 Ca 0.02 -0.29 0.05 0.00 0.00 0.00 0.00 61.98 61.76 1iel s VAL 30 Cb -0.07 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.83 1iel s VAL 30 CO 0.00 0.16 -0.21 0.00 0.00 0.00 0.00 175.10 175.06 1iel s ALA 31 N -0.09 1.77 -0.16 5.51 0.00 -0.54 -1.21 121.76 127.05 1iel s ALA 31 Ca 0.02 -0.86 0.02 0.00 0.00 0.00 0.00 51.96 51.14 1iel s ALA 31 Cb -0.04 -0.53 0.01 0.00 0.00 0.00 0.00 23.12 22.56 1iel s ALA 31 CO -0.00 0.36 -0.21 0.08 0.00 0.00 0.00 175.76 175.99 1iel s VAL 32 N -0.18 2.08 -0.25 0.00 1.01 -0.25 -0.93 120.40 121.88 1iel s VAL 32 Ca -0.00 -0.96 -0.16 0.00 0.00 0.00 0.00 61.98 60.86 1iel s VAL 32 Cb -0.11 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1iel s VAL 32 CO 0.02 0.54 0.41 -0.63 0.00 0.00 0.00 175.10 175.44 1iel s ILE 33 N 0.99 5.16 -0.09 2.22 1.09 0.25 -1.22 121.20 129.59 1iel s ILE 33 Ca -0.03 0.66 0.02 0.00 -1.10 0.00 0.00 60.65 60.21 1iel s ILE 33 Cb -0.15 -3.73 0.01 0.00 -1.06 0.00 0.00 42.46 37.54 1iel s ILE 33 CO -0.06 0.17 -0.15 -0.47 -0.10 0.00 0.00 174.94 174.33 1iel s TYR 34 N 1.93 1.85 -1.52 3.97 5.04 0.88 -1.92 117.35 127.59 1iel s TYR 34 Ca 0.17 -0.80 -0.05 0.00 -2.44 0.00 0.00 57.07 53.95 1iel s TYR 34 Cb -0.15 -1.33 0.04 0.00 0.35 0.00 0.00 41.96 40.86 1iel s TYR 34 CO 0.09 -0.40 0.41 1.04 -1.34 0.00 0.00 175.55 175.35 1iel n GLN 35 N 4.02 -2.68 -0.45 4.97 6.02 -0.91 0.09 117.38 128.44 1iel n GLN 35 Ca -0.20 0.32 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 1iel n GLN 35 Cb 0.52 -4.45 0.00 0.00 1.02 0.00 0.00 30.24 27.32 1iel n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1iel n GLY 36 N -1.96 1.07 3.66 1.08 0.00 -0.80 -4.99 105.19 103.25 1iel n GLY 36 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 1iel n GLY 36 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iel s LYS 37 N -0.24 2.85 0.12 1.61 -2.85 0.11 -5.01 119.74 116.33 1iel s LYS 37 Ca 0.00 -0.52 -0.23 0.00 -1.00 0.00 0.00 55.97 54.22 1iel s LYS 37 Cb 0.00 -2.70 -0.07 0.00 -2.06 0.00 0.00 37.83 33.00 1iel s LYS 37 CO 0.00 0.66 0.69 -1.25 0.10 0.00 0.00 175.35 175.55 1iel s PRO 38 N -1.16 4.42 -0.06 1.78 0.04 -1.26 -0.08 135.00 138.68 1iel s PRO 38 Ca 0.16 0.98 0.02 0.00 0.04 0.00 0.00 61.00 62.20 1iel s PRO 38 Cb -0.11 -3.26 0.02 0.00 0.04 0.00 0.00 34.50 31.19 1iel s PRO 38 CO 0.05 0.58 -0.09 0.71 0.04 0.00 0.00 177.00 178.30 1iel s TYR 39 N -1.06 1.16 0.08 0.56 2.02 -0.36 -4.97 117.35 114.78 1iel s TYR 39 Ca 0.33 -0.41 0.06 0.00 -0.37 0.00 0.00 57.07 56.68 1iel s TYR 39 Cb -0.22 -0.91 -0.04 0.00 -0.40 0.00 0.00 41.96 40.39 1iel s TYR 39 CO 0.23 -0.26 -0.07 0.71 -1.57 0.00 0.00 175.55 174.60 1iel s TYR 40 N 0.84 2.84 -0.03 2.71 1.51 -1.26 -1.09 117.35 122.87 1iel s TYR 40 Ca -0.12 -0.10 -0.02 0.00 -1.01 0.00 0.00 57.07 55.82 1iel s TYR 40 Cb -0.15 -1.50 0.01 0.00 -0.11 0.00 0.00 41.96 40.21 1iel s TYR 40 CO 0.01 0.43 0.07 -0.06 -1.11 0.00 0.00 175.55 174.89 1iel s PHE 41 N -1.19 -0.07 0.06 2.71 0.08 -0.35 -5.01 117.98 114.20 1iel s PHE 41 Ca 0.22 0.20 0.01 0.00 0.12 0.00 0.00 56.93 57.47 1iel s PHE 41 Cb -0.11 0.00 -0.03 0.00 -0.57 0.00 0.00 43.02 42.31 1iel s PHE 41 CO 0.14 -0.05 -0.05 0.95 -0.10 0.00 0.00 175.22 176.11 1iel s THR 42 N 0.18 0.42 0.04 0.64 -4.23 -1.26 -0.84 115.64 110.59 1iel s THR 42 Ca -0.01 -1.47 -0.14 0.00 -1.18 0.00 0.00 61.69 58.89 1iel s THR 42 Cb -0.02 -1.06 0.02 0.00 1.34 0.00 0.00 72.50 72.78 1iel s THR 42 CO -0.01 -0.70 0.31 0.26 -0.54 0.00 0.00 174.62 173.95 1iel s TRP 43 N -2.65 -0.12 0.00 3.99 0.51 -0.28 -5.01 118.94 115.38 1iel s TRP 43 Ca -0.01 0.01 0.00 0.00 -2.12 0.00 0.00 56.10 53.98 1iel s TRP 43 Cb -0.01 0.10 0.00 0.00 -0.81 0.00 0.00 33.47 32.75 1iel s TRP 43 CO -0.04 -0.49 0.00 0.41 -0.51 0.00 0.00 176.95 176.32 1iel n GLY 44 N 0.66 0.94 3.52 0.98 0.00 -1.26 -1.82 105.19 108.21 1iel n GLY 44 Ca -0.19 -0.71 -0.31 0.00 0.00 0.00 0.00 46.02 44.81 1iel n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1iel s TYR 45 N 0.00 2.66 0.03 1.61 4.12 -0.33 -1.78 117.35 123.65 1iel s TYR 45 Ca 0.00 -0.19 0.05 0.00 0.02 0.00 0.00 57.07 56.95 1iel s TYR 45 Cb 0.00 -1.47 -0.24 0.00 -1.52 0.00 0.00 41.96 38.73 1iel s TYR 45 CO 0.00 0.33 0.93 0.00 0.02 0.00 0.00 175.55 176.83 1iel h ALA 46 N 4.21 0.46 -3.00 3.71 0.00 -0.69 -3.19 119.26 120.77 1iel h ALA 46 Ca -0.48 -1.16 -0.48 0.00 0.00 0.00 0.00 54.91 52.79 1iel h ALA 46 Cb 1.16 0.21 -0.41 0.00 0.00 0.00 0.00 17.79 18.75 1iel h ALA 46 CO 0.50 1.33 -0.76 0.34 0.00 0.00 0.00 179.25 180.65 1iel s ASP 47 N -6.60 2.64 0.08 0.00 -1.08 -1.15 -0.99 116.67 109.57 1iel s ASP 47 Ca -0.04 -0.78 -0.23 0.00 -0.52 0.00 0.00 52.55 50.98 1iel s ASP 47 Cb 0.08 -0.28 -0.14 0.00 -1.46 0.00 0.00 42.92 41.12 1iel s ASP 47 CO 0.83 -0.37 1.67 0.40 0.52 0.00 0.00 175.17 178.22 1iel h ILE 48 N 6.42 1.08 -0.84 4.11 2.04 -1.86 0.17 117.51 128.63 1iel h ILE 48 Ca -0.16 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1iel h ILE 48 Cb 1.12 1.15 -0.04 0.00 -0.74 0.00 0.00 36.82 38.31 1iel h ILE 48 CO 0.33 0.06 0.49 0.00 0.00 0.00 0.00 178.15 179.03 1iel h ALA 49 N 0.93 1.08 -0.00 1.87 0.00 -1.98 -2.00 119.26 119.15 1iel h ALA 49 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1iel h ALA 49 Cb 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1iel h ALA 49 CO -0.00 0.56 -0.17 0.36 0.00 0.00 0.00 179.25 179.99 1iel n LYS 50 N -4.41 0.32 -3.77 0.00 0.00 -1.19 -4.92 118.16 104.18 1iel n LYS 50 Ca 0.09 -0.11 -0.29 0.00 -0.00 0.00 0.00 58.31 58.00 1iel n LYS 50 Cb 0.07 -1.50 0.03 0.00 -0.00 0.00 0.00 35.03 33.63 1iel n LYS 50 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1iel n LYS 51 N -1.25 -5.33 -2.91 -1.58 5.02 0.48 -4.93 118.16 107.67 1iel n LYS 51 Ca 0.10 0.61 -0.41 0.00 -2.02 0.00 0.00 58.31 56.59 1iel n LYS 51 Cb 0.31 -5.49 -0.04 0.00 -0.02 0.00 0.00 35.03 29.78 1iel n LYS 51 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1iel s GLN 52 N -6.48 4.29 0.73 1.97 -2.07 -0.48 -4.98 119.66 112.65 1iel s GLN 52 Ca 0.61 0.99 -0.11 0.00 -1.82 0.00 0.00 55.36 55.03 1iel s GLN 52 Cb -0.30 -3.57 0.03 0.00 -1.09 0.00 0.00 33.01 28.07 1iel s GLN 52 CO 0.75 -0.32 1.07 -1.25 -1.32 0.00 0.00 175.29 174.23 1iel s PRO 53 N 2.12 2.62 0.24 9.60 0.04 -1.26 -0.12 135.00 148.24 1iel s PRO 53 Ca 0.38 0.81 -0.30 0.00 0.04 0.00 0.00 61.00 61.93 1iel s PRO 53 Cb -0.16 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.32 1iel s PRO 53 CO 0.12 -1.29 1.06 0.08 0.04 0.00 0.00 177.00 177.01 1iel s VAL 54 N -3.10 3.76 0.39 -0.36 1.01 -0.73 -4.22 120.40 117.15 1iel s VAL 54 Ca 0.59 1.69 0.06 0.00 0.00 0.00 0.00 61.98 64.32 1iel s VAL 54 Cb -0.14 -4.08 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 1iel s VAL 54 CO 0.55 0.37 0.20 0.42 0.00 0.00 0.00 175.10 176.64 1iel s THR 55 N -0.89 0.29 -0.10 3.92 -4.23 -1.26 -4.77 115.64 108.60 1iel s THR 55 Ca 0.45 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.24 1iel s THR 55 Cb -0.30 -2.37 0.29 0.00 1.34 0.00 0.00 72.50 71.47 1iel s THR 55 CO 0.37 0.00 1.85 1.56 -0.54 0.00 0.00 174.62 177.86 1iel h GLN 56 N 1.88 0.00 -0.10 3.99 4.20 -1.98 -2.39 115.11 120.71 1iel h GLN 56 Ca -0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1iel h GLN 56 Cb 1.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.04 1iel h GLN 56 CO 0.46 0.00 0.00 1.04 -0.67 0.00 0.00 178.83 179.66 1iel n GLN 57 N -2.52 2.37 -2.36 1.46 6.02 -1.26 -4.01 117.38 117.08 1iel n GLN 57 Ca -0.00 -2.01 -0.42 0.00 -0.01 0.00 0.00 57.00 54.56 1iel n GLN 57 Cb 0.14 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 29.91 1iel n GLN 57 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1iel s THR 58 N -1.89 3.99 -0.00 5.09 2.01 -0.90 -4.85 115.64 119.08 1iel s THR 58 Ca 0.30 1.36 -0.19 0.00 0.31 0.00 0.00 61.69 63.47 1iel s THR 58 Cb 0.21 -3.87 -0.05 0.00 0.01 0.00 0.00 72.50 68.79 1iel s THR 58 CO 0.30 0.02 0.56 -0.76 -0.69 0.00 0.00 174.62 174.05 1iel s LEU 59 N 2.07 4.43 0.15 4.42 1.02 -0.18 -4.14 118.68 126.43 1iel s LEU 59 Ca 0.60 1.12 0.11 0.00 0.02 0.00 0.00 54.13 55.97 1iel s LEU 59 Cb -0.28 -2.86 -0.04 0.00 0.02 0.00 0.00 46.19 43.03 1iel s LEU 59 CO 0.25 0.14 -0.25 -0.36 0.02 0.00 0.00 176.35 176.15 1iel s PHE 60 N -0.35 2.33 -0.13 0.29 0.40 0.81 -1.71 117.98 119.62 1iel s PHE 60 Ca 0.29 -0.36 -0.29 0.00 -0.60 0.00 0.00 56.93 55.97 1iel s PHE 60 Cb -0.18 -1.23 -0.01 0.00 0.51 0.00 0.00 43.02 42.11 1iel s PHE 60 CO 0.16 0.39 1.06 -1.21 0.70 0.00 0.00 175.22 176.32 1iel s GLU 61 N -2.25 4.36 0.33 0.44 2.02 -1.26 -1.34 118.70 121.00 1iel s GLU 61 Ca 0.16 1.44 0.25 0.00 0.02 0.00 0.00 54.97 56.85 1iel s GLU 61 Cb -0.09 -3.58 0.68 0.00 0.10 0.00 0.00 34.13 31.23 1iel s GLU 61 CO 0.08 -0.44 1.72 -0.07 0.02 0.00 0.00 175.26 176.57 1iel h LEU 62 N 8.52 0.00 0.00 1.80 3.38 -1.18 -3.44 115.31 124.39 1iel h LEU 62 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1iel h LEU 62 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1iel h LEU 62 CO 0.90 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.04 1iel n GLY 63 N 1.02 2.36 0.00 0.83 0.00 -1.24 -2.34 105.19 105.82 1iel n GLY 63 Ca 0.04 -0.48 0.05 0.00 0.00 0.00 0.00 46.02 45.64 1iel n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1iel n SER 64 N 0.73 0.00 0.30 1.61 7.64 -1.26 -1.39 113.62 121.25 1iel n SER 64 Ca 0.00 0.24 0.20 0.00 1.01 0.00 0.00 58.87 60.32 1iel n SER 64 Cb 0.00 -0.35 0.96 0.00 -1.01 0.00 0.00 64.21 63.81 1iel n SER 64 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1iel h VAL 65 N 0.00 0.00 0.00 0.44 2.07 -1.52 -1.19 116.25 116.05 1iel h VAL 65 Ca 0.00 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1iel h VAL 65 Cb 0.12 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1iel h VAL 65 CO 0.00 0.00 -0.04 0.28 0.02 0.00 0.00 177.57 177.83 1iel h SER 66 N 0.00 0.00 0.43 0.57 0.02 -1.41 -1.40 113.55 111.75 1iel h SER 66 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1iel h SER 66 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1iel h SER 66 CO 0.00 0.04 0.00 0.11 -1.14 0.00 0.00 176.83 175.84 1iel h LYS 67 N 0.00 0.00 -0.12 3.45 1.57 -1.35 -1.23 116.57 118.89 1iel h LYS 67 Ca -0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 1iel h LYS 67 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1iel h LYS 67 CO 0.01 0.00 -0.52 1.79 -0.57 0.00 0.00 179.45 180.15 1iel h THR 68 N 0.00 1.35 -0.23 -0.16 1.35 -1.44 0.35 112.91 114.12 1iel h THR 68 Ca 0.00 -1.78 -0.20 0.00 -0.55 0.00 0.00 66.41 63.87 1iel h THR 68 Cb 0.21 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1iel h THR 68 CO 0.00 0.54 -0.65 -0.26 -0.25 0.00 0.00 175.52 174.90 1iel h PHE 69 N 0.25 1.10 -0.58 4.73 0.04 -1.39 -2.08 116.94 119.01 1iel h PHE 69 Ca 0.01 -0.43 -0.04 0.00 2.80 0.00 0.00 57.97 60.31 1iel h PHE 69 Cb 1.00 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.94 1iel h PHE 69 CO 0.02 1.27 0.21 1.15 -0.60 0.00 0.00 178.31 180.37 1iel h THR 70 N 0.62 1.23 -0.55 -1.55 2.02 -1.21 -0.57 112.91 112.90 1iel h THR 70 Ca -0.01 -0.75 -0.01 0.00 0.77 0.00 0.00 66.41 66.41 1iel h THR 70 Cb 1.27 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 68.27 1iel h THR 70 CO 0.14 0.29 0.31 1.23 0.37 0.00 0.00 175.52 177.85 1iel h GLY 71 N 0.81 0.81 1.55 2.16 0.00 -0.89 -0.99 103.07 106.53 1iel h GLY 71 Ca 0.19 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 47.08 1iel h GLY 71 CO -0.01 0.35 -0.18 -2.08 0.00 0.00 0.00 176.54 174.61 1iel h VAL 72 N 0.74 1.25 -0.40 4.60 2.07 -1.10 0.97 116.25 124.38 1iel h VAL 72 Ca 0.19 -1.15 -0.09 0.00 0.82 0.00 0.00 66.70 66.47 1iel h VAL 72 Cb 0.03 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1iel h VAL 72 CO -0.03 0.37 -0.11 0.25 0.02 0.00 0.00 177.57 178.07 1iel h LEU 73 N 0.48 0.80 -0.24 2.57 5.85 -0.82 -0.19 115.31 123.76 1iel h LEU 73 Ca 0.08 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.42 1iel h LEU 73 Cb 0.59 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1iel h LEU 73 CO 0.04 0.99 0.12 1.23 -0.34 0.00 0.00 178.44 180.48 1iel h GLY 74 N 0.60 0.36 0.42 3.75 0.00 -0.91 -0.64 103.07 106.65 1iel h GLY 74 Ca 0.10 -0.17 0.14 0.00 0.00 0.00 0.00 47.33 47.39 1iel h GLY 74 CO 0.04 0.16 0.62 -1.33 0.00 0.00 0.00 176.54 176.04 1iel h GLY 75 N 0.26 1.60 1.03 4.60 0.00 -0.48 -1.08 103.07 109.00 1iel h GLY 75 Ca 0.08 -0.40 -0.08 0.00 0.00 0.00 0.00 47.33 46.93 1iel h GLY 75 CO -0.01 0.11 -0.01 -1.80 0.00 0.00 0.00 176.54 174.84 1iel h ASP 76 N 0.91 0.90 -0.10 0.19 3.58 -0.42 -1.58 116.42 119.90 1iel h ASP 76 Ca 0.50 -0.31 -0.06 0.00 0.42 0.00 0.00 57.03 57.58 1iel h ASP 76 Cb 0.59 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.39 1iel h ASP 76 CO -0.27 0.99 -0.10 0.00 -2.88 0.00 0.00 179.24 176.98 1iel h ALA 77 N 0.94 1.36 -0.27 -0.78 0.00 -0.09 0.88 119.26 121.30 1iel h ALA 77 Ca 0.15 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1iel h ALA 77 Cb 0.53 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1iel h ALA 77 CO 0.03 0.44 -0.23 0.82 0.00 0.00 0.00 179.25 180.31 1iel h ILE 78 N 0.39 1.31 -0.52 0.00 2.04 -0.97 -0.59 117.51 119.16 1iel h ILE 78 Ca 0.08 -1.38 -0.04 0.00 1.00 0.00 0.00 64.86 64.52 1iel h ILE 78 Cb 0.42 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 1iel h ILE 78 CO 0.02 0.44 0.16 0.00 0.00 0.00 0.00 178.15 178.77 1iel h ALA 79 N 0.71 1.30 0.00 1.87 0.00 -0.92 -0.81 119.26 121.41 1iel h ALA 79 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1iel h ALA 79 Cb 0.78 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1iel h ALA 79 CO 0.06 0.50 0.00 0.54 0.00 0.00 0.00 179.25 180.35 1iel n ARG 80 N -4.30 0.64 -1.15 0.00 1.74 0.27 -4.87 116.66 108.98 1iel n ARG 80 Ca 0.04 0.02 -0.05 0.00 -0.77 0.00 0.00 57.85 57.09 1iel n ARG 80 Cb 0.20 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.11 1iel n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iel n GLY 81 N 0.52 0.75 0.07 -0.13 0.00 -0.31 -4.91 105.19 101.18 1iel n GLY 81 Ca 0.16 -0.38 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 1iel n GLY 81 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1iel h GLU 82 N 0.24 0.05 -4.16 1.61 5.08 -1.32 -3.48 114.58 112.59 1iel h GLU 82 Ca -0.11 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.02 1iel h GLU 82 Cb 0.51 0.03 -0.13 0.00 0.50 0.00 0.00 28.75 29.66 1iel h GLU 82 CO 0.16 0.95 -0.44 0.96 -1.00 0.00 0.00 179.01 179.63 1iel s ILE 83 N -2.68 0.05 -0.01 3.13 -4.36 -1.20 -4.82 121.20 111.30 1iel s ILE 83 Ca -0.01 -1.68 0.02 0.00 -0.26 0.00 0.00 60.65 58.72 1iel s ILE 83 Cb 0.09 -2.12 -0.00 0.00 1.25 0.00 0.00 42.46 41.68 1iel s ILE 83 CO 0.83 -0.21 -0.07 -0.54 0.24 0.00 0.00 174.94 175.19 1iel s LYS 84 N -4.05 0.60 0.59 0.37 1.02 -1.26 -4.31 119.74 112.71 1iel s LYS 84 Ca 0.25 -0.23 0.38 0.00 0.02 0.00 0.00 55.97 56.39 1iel s LYS 84 Cb 0.05 -0.59 1.77 0.00 -0.52 0.00 0.00 37.83 38.54 1iel s LYS 84 CO 0.05 0.12 2.13 -0.07 -0.92 0.00 0.00 175.35 176.66 1iel h LEU 85 N 6.14 0.00 -0.12 3.17 3.38 -1.99 -1.67 115.31 124.22 1iel h LEU 85 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1iel h LEU 85 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1iel h LEU 85 CO 0.50 0.01 -0.07 -1.54 0.09 0.00 0.00 178.44 177.43 1iel n SER 86 N -3.11 0.25 -4.76 -0.43 3.41 -1.26 -0.87 113.62 106.85 1iel n SER 86 Ca -0.01 -0.37 -0.40 0.00 -0.26 0.00 0.00 58.87 57.83 1iel n SER 86 Cb 0.22 -0.16 -0.05 0.00 -0.26 0.00 0.00 64.21 63.96 1iel n SER 86 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1iel s ASP 87 N -2.53 7.35 0.48 4.04 -0.00 -0.63 -4.84 116.67 120.54 1iel s ASP 87 Ca 0.29 2.11 -0.24 0.00 -0.00 0.00 0.00 52.55 54.71 1iel s ASP 87 Cb 0.20 -2.61 -0.07 0.00 -0.00 0.00 0.00 42.92 40.44 1iel s ASP 87 CO 0.47 -0.07 1.39 -2.84 -0.00 0.00 0.00 175.17 174.12 1iel s PRO 88 N -1.49 3.53 0.31 8.23 0.02 -1.26 -1.47 135.00 142.87 1iel s PRO 88 Ca 0.45 2.32 0.03 0.00 0.02 0.00 0.00 61.00 63.82 1iel s PRO 88 Cb -0.28 -2.53 0.62 0.00 0.02 0.00 0.00 34.50 32.33 1iel s PRO 88 CO 0.36 -0.90 1.86 1.15 -0.33 0.00 0.00 177.00 179.14 1iel h THR 89 N 2.02 0.93 0.00 0.99 2.02 -1.36 -2.06 112.91 115.46 1iel h THR 89 Ca -0.51 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.36 1iel h THR 89 Cb 1.27 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 1iel h THR 89 CO 0.60 0.17 0.00 0.74 0.37 0.00 0.00 175.52 177.40 1iel h THR 90 N 0.92 0.00 -0.41 3.16 2.02 -1.82 -2.53 112.91 114.24 1iel h THR 90 Ca 0.46 -0.19 -0.05 0.00 0.77 0.00 0.00 66.41 67.40 1iel h THR 90 Cb 0.48 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 1iel h THR 90 CO -0.22 0.00 0.04 0.50 0.37 0.00 0.00 175.52 176.21 1iel h LYS 91 N 0.00 0.64 -0.02 6.66 3.64 -1.73 -2.59 116.57 123.16 1iel h LYS 91 Ca 0.00 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1iel h LYS 91 Cb 0.23 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1iel h LYS 91 CO 0.00 0.63 -0.14 0.66 -2.27 0.00 0.00 179.45 178.33 1iel n TYR 92 N -4.27 0.00 -3.11 1.91 4.02 -0.97 -4.53 117.16 110.20 1iel n TYR 92 Ca 0.02 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.71 1iel n TYR 92 Cb 0.24 -0.01 -0.05 0.00 -0.02 0.00 0.00 39.34 39.51 1iel n TYR 92 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 176.86 177.72 1iel n TRP 93 N 0.77 -1.19 -0.22 -0.72 -0.00 -1.06 -4.98 117.44 110.04 1iel n TRP 93 Ca 0.13 -3.07 0.31 0.00 -0.00 0.00 0.00 57.50 54.87 1iel n TRP 93 Cb 0.53 0.19 0.66 0.00 -0.00 0.00 0.00 31.31 32.69 1iel n TRP 93 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1iel h PRO 94 N 4.28 0.00 0.00 5.87 0.11 -1.71 0.26 132.00 140.82 1iel h PRO 94 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1iel h PRO 94 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1iel h PRO 94 CO 0.40 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.58 1iel n GLU 95 N -3.70 0.18 -2.66 1.05 -0.58 -1.26 -4.34 120.64 109.34 1iel n GLU 95 Ca 0.22 0.24 -0.43 0.00 -0.42 0.00 0.00 57.16 56.76 1iel n GLU 95 Cb 1.28 -1.75 0.00 0.00 -0.57 0.00 0.00 31.44 30.40 1iel n GLU 95 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 1iel n LEU 96 N -2.07 5.54 0.02 -4.62 7.94 0.92 -4.75 117.00 119.99 1iel n LEU 96 Ca 0.05 -4.34 0.11 0.00 -1.11 0.00 0.00 56.01 50.72 1iel n LEU 96 Cb 0.35 -1.63 0.07 0.00 0.53 0.00 0.00 43.42 42.73 1iel n LEU 96 CO 0.26 0.74 0.11 0.35 -1.11 0.00 0.00 177.39 177.74 1iel n THR 97 N 4.83 0.15 -1.69 1.96 -2.24 -1.26 -4.72 114.28 111.31 1iel n THR 97 Ca 0.41 -0.19 -0.43 0.00 -2.27 0.00 0.00 64.05 61.58 1iel n THR 97 Cb 0.42 0.24 -0.01 0.00 -2.10 0.00 0.00 70.33 68.88 1iel n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iel n ALA 98 N -1.75 1.24 0.16 6.98 0.00 -1.26 -4.89 120.51 120.99 1iel n ALA 98 Ca 0.03 0.37 0.16 0.00 0.00 0.00 0.00 53.44 54.00 1iel n ALA 98 Cb 0.41 -2.25 0.74 0.00 0.00 0.00 0.00 19.45 18.34 1iel n ALA 98 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1iel h LYS 99 N 2.88 0.00 0.00 0.00 2.10 -1.94 -2.35 116.57 117.25 1iel h LYS 99 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 1iel h LYS 99 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 1iel h LYS 99 CO 0.65 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 178.10 1iel n GLN 100 N -4.19 0.17 0.03 0.07 0.00 -1.26 -2.30 117.38 109.90 1iel n GLN 100 Ca 0.03 0.50 0.13 0.00 0.00 0.00 0.00 57.00 57.65 1iel n GLN 100 Cb 0.34 -1.89 0.32 0.00 0.00 0.00 0.00 30.24 29.02 1iel n GLN 100 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 1iel n TRP 101 N -2.22 0.26 -0.38 2.61 7.02 -0.88 -4.59 117.44 119.27 1iel n TRP 101 Ca 0.01 0.08 -0.03 0.00 -1.02 0.00 0.00 57.50 56.54 1iel n TRP 101 Cb 0.15 -0.50 0.02 0.00 -2.42 0.00 0.00 31.31 28.56 1iel n TRP 101 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1iel n ASN 102 N -1.76 -0.69 -1.29 -0.99 3.02 -0.97 -0.79 115.26 111.78 1iel n ASN 102 Ca 0.05 1.70 0.08 0.00 -0.03 0.00 0.00 54.58 56.39 1iel n ASN 102 Cb 0.38 -0.36 0.28 0.00 -0.61 0.00 0.00 39.78 39.47 1iel n ASN 102 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1iel n GLY 103 N -1.43 2.11 3.61 7.41 0.00 -1.26 -4.88 105.19 110.75 1iel n GLY 103 Ca 0.09 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 1iel n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iel s ILE 104 N -1.65 4.81 0.46 -0.61 1.01 0.03 -4.93 121.20 120.33 1iel s ILE 104 Ca 0.41 1.09 0.08 0.00 0.00 0.00 0.00 60.65 62.23 1iel s ILE 104 Cb 0.25 -4.13 0.02 0.00 0.01 0.00 0.00 42.46 38.61 1iel s ILE 104 CO 0.22 -0.26 0.52 0.42 0.00 0.00 0.00 174.94 175.84 1iel s THR 105 N 2.92 2.53 0.45 2.92 -4.23 -1.26 -1.03 115.64 117.94 1iel s THR 105 Ca 0.31 -1.19 0.12 0.00 -1.18 0.00 0.00 61.69 59.75 1iel s THR 105 Cb -0.14 -2.73 0.23 0.00 1.34 0.00 0.00 72.50 71.21 1iel s THR 105 CO 0.13 0.00 2.05 -0.07 -0.54 0.00 0.00 174.62 176.19 1iel h LEU 106 N 0.71 0.18 -0.57 4.79 3.38 -1.19 -1.75 115.31 120.85 1iel h LEU 106 Ca -0.38 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.59 1iel h LEU 106 Cb 1.28 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 1iel h LEU 106 CO 0.50 0.20 0.37 0.25 0.09 0.00 0.00 178.44 179.86 1iel h LEU 107 N 0.20 0.64 -0.19 1.67 5.85 -1.29 -1.25 115.31 120.94 1iel h LEU 107 Ca 0.05 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1iel h LEU 107 Cb 0.11 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1iel h LEU 107 CO -0.00 0.46 0.11 0.45 -0.34 0.00 0.00 178.44 179.12 1iel h HIS 108 N 0.76 0.21 -0.39 1.25 3.86 -1.61 -1.63 115.15 117.61 1iel h HIS 108 Ca 0.22 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.45 1iel h HIS 108 Cb -0.06 -0.07 -0.03 0.00 1.06 0.00 0.00 27.41 28.31 1iel h HIS 108 CO -0.04 0.13 0.22 -0.07 0.86 0.00 0.00 177.93 179.03 1iel h LEU 109 N 0.23 0.35 -1.63 2.43 3.38 -1.24 -0.11 115.31 118.73 1iel h LEU 109 Ca 0.07 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1iel h LEU 109 Cb -0.02 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1iel h LEU 109 CO -0.03 0.25 -0.19 0.00 0.09 0.00 0.00 178.44 178.56 1iel h ALA 110 N 1.18 1.28 -0.22 1.53 0.00 -0.96 -2.40 119.26 119.67 1iel h ALA 110 Ca 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1iel h ALA 110 Cb 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1iel h ALA 110 CO -0.08 0.24 0.00 0.25 0.00 0.00 0.00 179.25 179.66 1iel n THR 111 N -3.73 1.35 -2.15 0.00 -2.24 -0.63 -4.44 114.28 102.43 1iel n THR 111 Ca -0.02 -1.30 -0.16 0.00 -2.27 0.00 0.00 64.05 60.31 1iel n THR 111 Cb 0.31 0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.80 1iel n THR 111 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1iel n TYR 112 N -0.10 -0.61 -1.06 4.78 4.02 -0.61 -4.81 117.16 118.76 1iel n TYR 112 Ca 0.11 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 58.08 1iel n TYR 112 Cb 0.50 -3.14 0.23 0.00 -0.02 0.00 0.00 39.34 36.91 1iel n TYR 112 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1iel n THR 113 N -3.75 2.23 0.28 -0.72 -2.24 -0.15 -1.83 114.28 108.09 1iel n THR 113 Ca -0.18 -2.06 0.16 0.00 -2.27 0.00 0.00 64.05 59.71 1iel n THR 113 Cb 0.62 -0.26 0.73 0.00 -2.10 0.00 0.00 70.33 69.32 1iel n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iel h ALA 114 N 1.33 1.05 0.00 6.98 0.00 -1.80 0.11 119.26 126.92 1iel h ALA 114 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1iel h ALA 114 Cb 1.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1iel h ALA 114 CO 0.19 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.92 1iel n GLY 115 N -0.21 1.31 0.05 0.00 0.00 -1.26 -4.15 105.19 100.92 1iel n GLY 115 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1iel n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iel n GLY 116 N -0.01 1.54 3.77 -0.02 0.00 -1.26 -0.01 105.19 109.21 1iel n GLY 116 Ca 0.00 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1iel n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iel s LEU 117 N 0.00 4.16 0.53 0.99 1.43 -1.26 -4.70 118.68 119.83 1iel s LEU 117 Ca 0.00 2.98 -0.22 0.00 -1.03 0.00 0.00 54.13 55.85 1iel s LEU 117 Cb 0.00 -3.87 -0.05 0.00 0.03 0.00 0.00 46.19 42.30 1iel s LEU 117 CO 0.00 -1.12 1.37 -2.16 0.23 0.00 0.00 176.35 174.67 1iel s PRO 118 N -2.37 3.23 0.29 1.29 0.04 -1.26 -4.75 135.00 131.47 1iel s PRO 118 Ca 0.59 2.27 0.04 0.00 0.04 0.00 0.00 61.00 63.94 1iel s PRO 118 Cb -0.45 -2.32 0.68 0.00 0.04 0.00 0.00 34.50 32.45 1iel s PRO 118 CO 0.59 -1.13 1.78 1.25 0.04 0.00 0.00 177.00 179.53 1iel h LEU 119 N 1.60 0.76 -8.45 -3.56 5.85 -1.91 -3.18 115.31 106.43 1iel h LEU 119 Ca -0.51 0.09 -0.41 0.00 0.84 0.00 0.00 57.88 57.89 1iel h LEU 119 Cb 1.29 -0.04 -0.21 0.00 0.37 0.00 0.00 40.66 42.07 1iel h LEU 119 CO 0.58 0.29 -0.77 -1.10 -0.34 0.00 0.00 178.44 177.10 1iel s GLN 120 N -5.89 0.85 -0.09 1.25 -0.21 -1.26 -0.52 119.66 113.79 1iel s GLN 120 Ca -0.11 -1.01 -0.29 0.00 0.02 0.00 0.00 55.36 53.96 1iel s GLN 120 Cb 0.24 -0.83 -0.02 0.00 1.00 0.00 0.00 33.01 33.41 1iel s GLN 120 CO 0.80 0.18 0.97 0.08 -2.12 0.00 0.00 175.29 175.20 1iel s VAL 121 N -1.47 4.82 0.25 1.09 1.01 -1.26 -4.79 120.40 120.05 1iel s VAL 121 Ca 0.00 1.98 -0.28 0.00 0.00 0.00 0.00 61.98 63.68 1iel s VAL 121 Cb -0.09 -4.29 -0.15 0.00 0.00 0.00 0.00 36.38 31.85 1iel s VAL 121 CO 0.02 0.05 0.77 -2.65 0.00 0.00 0.00 175.10 173.29 1iel n PRO 122 N 4.78 0.72 -0.32 2.72 -0.02 -1.26 -4.86 135.00 136.75 1iel n PRO 122 Ca 0.07 0.25 0.02 0.00 -2.02 0.00 0.00 63.50 61.83 1iel n PRO 122 Cb 0.49 -1.45 0.21 0.00 -0.02 0.00 0.00 33.50 32.73 1iel n PRO 122 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1iel h ASP 123 N 1.50 0.96 0.45 2.55 3.58 -2.01 -2.05 116.42 121.41 1iel h ASP 123 Ca -0.34 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.11 1iel h ASP 123 Cb 1.39 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 42.23 1iel h ASP 123 CO 0.59 0.64 0.00 -0.33 -2.88 0.00 0.00 179.24 177.26 1iel h GLU 124 N 1.11 0.00 -6.13 0.28 3.07 -2.03 -3.41 114.58 107.46 1iel h GLU 124 Ca 0.38 0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 58.67 1iel h GLU 124 Cb 0.11 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 27.96 1iel h GLU 124 CO -0.13 0.00 0.80 0.08 -1.40 0.00 0.00 179.01 178.36 1iel s VAL 125 N -3.76 4.57 0.09 3.13 1.01 -0.77 -4.85 120.40 119.83 1iel s VAL 125 Ca -0.01 1.89 0.00 0.00 0.00 0.00 0.00 61.98 63.86 1iel s VAL 125 Cb 0.10 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1iel s VAL 125 CO 0.41 -0.14 0.00 0.29 0.00 0.00 0.00 175.10 175.66 1iel n LYS 126 N 6.20 0.00 -1.20 2.72 5.02 -1.26 -4.22 118.16 125.42 1iel n LYS 126 Ca 0.12 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.12 1iel n LYS 126 Cb 0.46 -0.09 0.15 0.00 -0.02 0.00 0.00 35.03 35.52 1iel n LYS 126 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1iel s SER 127 N -4.85 3.30 0.35 4.39 1.04 -1.26 -4.80 113.70 111.87 1iel s SER 127 Ca 0.00 1.41 0.04 0.00 0.48 0.00 0.00 55.95 57.88 1iel s SER 127 Cb 0.00 -2.09 0.67 0.00 0.10 0.00 0.00 66.02 64.70 1iel s SER 127 CO 0.00 -2.74 1.98 0.77 0.98 0.00 0.00 173.24 174.23 1iel h SER 128 N -1.62 0.72 -0.50 7.02 4.64 -2.00 -1.00 113.55 120.82 1iel h SER 128 Ca -0.51 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 60.71 1iel h SER 128 Cb 1.29 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 1iel h SER 128 CO 0.55 0.49 -0.07 -1.28 -0.87 0.00 0.00 176.83 175.65 1iel h SER 129 N 0.83 0.95 -0.37 4.97 0.87 -2.00 -1.41 113.55 117.40 1iel h SER 129 Ca 0.28 -0.29 -0.10 0.00 -1.23 0.00 0.00 61.79 60.45 1iel h SER 129 Cb 0.08 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.76 1iel h SER 129 CO -0.08 1.05 -0.13 0.44 -0.53 0.00 0.00 176.83 177.58 1iel h ASP 130 N 0.87 0.82 -0.07 6.23 3.45 -1.58 -2.60 116.42 123.54 1iel h ASP 130 Ca 0.14 -0.26 -0.01 0.00 0.43 0.00 0.00 57.03 57.34 1iel h ASP 130 Cb 0.61 -0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 39.16 1iel h ASP 130 CO 0.04 0.96 0.01 0.25 -1.57 0.00 0.00 179.24 178.93 1iel h LEU 131 N 0.74 0.11 -0.94 1.55 5.85 -0.94 0.23 115.31 121.91 1iel h LEU 131 Ca 0.12 -0.28 0.03 0.00 0.84 0.00 0.00 57.88 58.59 1iel h LEU 131 Cb 0.63 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 1iel h LEU 131 CO 0.04 0.36 0.61 0.25 -0.34 0.00 0.00 178.44 179.37 1iel h LEU 132 N -0.14 1.03 -0.42 2.25 5.85 -1.26 -1.21 115.31 121.41 1iel h LEU 132 Ca 0.02 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 1iel h LEU 132 Cb 0.30 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1iel h LEU 132 CO 0.00 0.71 0.08 -0.09 -0.34 0.00 0.00 178.44 178.80 1iel h ARG 133 N 1.20 0.69 0.14 1.25 2.43 -1.25 0.99 114.38 119.84 1iel h ARG 133 Ca 0.37 -0.18 0.02 0.00 -0.81 0.00 0.00 59.98 59.38 1iel h ARG 133 Cb -0.01 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 1iel h ARG 133 CO -0.12 0.72 -0.30 0.35 -1.51 0.00 0.00 179.97 179.12 1iel h PHE 134 N 0.55 -0.81 -0.36 2.20 3.57 -0.38 -0.26 116.94 121.45 1iel h PHE 134 Ca 0.13 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.55 1iel h PHE 134 Cb 0.36 0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 1iel h PHE 134 CO 0.02 -0.41 -0.15 1.88 -2.23 0.00 0.00 178.31 177.42 1iel h TYR 135 N -0.53 0.72 -0.09 0.41 0.05 -1.10 -0.91 116.97 115.51 1iel h TYR 135 Ca 0.02 -0.13 -0.07 0.00 0.05 0.00 0.00 58.73 58.61 1iel h TYR 135 Cb 0.55 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 38.10 1iel h TYR 135 CO -0.26 0.77 -0.24 1.96 -1.05 0.00 0.00 178.16 179.34 1iel h GLN 136 N 0.59 0.16 0.00 4.88 1.08 -0.59 -3.01 115.11 118.21 1iel h GLN 136 Ca 0.10 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 57.20 1iel h GLN 136 Cb 0.60 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.01 1iel h GLN 136 CO 0.04 0.40 -1.00 -0.91 -0.95 0.00 0.00 178.83 176.41 1iel h ASN 137 N 0.14 0.00 -3.18 1.46 2.35 -0.75 -3.46 115.58 112.15 1iel h ASN 137 Ca 0.02 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.23 1iel h ASN 137 Cb 0.52 0.00 0.09 0.00 0.05 0.00 0.00 38.32 38.97 1iel h ASN 137 CO 0.04 0.16 0.83 1.87 -1.65 0.00 0.00 177.43 178.68 1iel n TRP 138 N -2.79 2.73 -4.21 1.19 -0.00 -0.37 -5.00 117.44 109.00 1iel n TRP 138 Ca -0.02 0.29 -0.33 0.00 -0.00 0.00 0.00 57.50 57.43 1iel n TRP 138 Cb 0.63 -2.57 -0.15 0.00 -0.00 0.00 0.00 31.31 29.21 1iel n TRP 138 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 1iel s GLN 139 N -0.51 3.12 0.46 5.87 -1.52 -1.26 -4.97 119.66 120.85 1iel s GLN 139 Ca 0.65 -0.77 -0.24 0.00 -1.95 0.00 0.00 55.36 53.04 1iel s GLN 139 Cb -0.52 -2.66 -0.08 0.00 -0.22 0.00 0.00 33.01 29.52 1iel s GLN 139 CO 0.49 -0.15 1.20 -2.30 -0.25 0.00 0.00 175.29 174.28 1iel n PRO 140 N 4.50 1.65 0.10 2.91 -0.02 -1.26 -4.94 135.00 137.94 1iel n PRO 140 Ca -0.20 0.60 0.12 0.00 -2.02 0.00 0.00 63.50 61.99 1iel n PRO 140 Cb 0.51 -2.32 0.03 0.00 -0.02 0.00 0.00 33.50 31.70 1iel n PRO 140 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iel h ALA 141 N 1.67 0.53 -2.78 3.55 0.00 -0.71 -3.48 119.26 118.04 1iel h ALA 141 Ca -0.48 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.34 1iel h ALA 141 Cb 1.31 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 19.00 1iel h ALA 141 CO 0.58 0.00 -0.22 -1.58 0.00 0.00 0.00 179.25 178.02 1iel s TRP 142 N -3.33 0.51 0.71 0.00 0.51 -1.11 -5.01 118.94 111.23 1iel s TRP 142 Ca 0.01 -0.85 -0.12 0.00 -2.12 0.00 0.00 56.10 53.02 1iel s TRP 142 Cb 0.10 0.04 0.02 0.00 -0.81 0.00 0.00 33.47 32.82 1iel s TRP 142 CO 0.78 -0.91 1.08 0.00 -0.51 0.00 0.00 176.95 177.38 1iel s ALA 143 N -4.04 2.49 0.49 0.98 0.00 -1.26 -4.53 121.76 115.89 1iel s ALA 143 Ca 0.25 0.23 -0.23 0.00 0.00 0.00 0.00 51.96 52.22 1iel s ALA 143 Cb 0.01 -3.23 -0.07 0.00 0.00 0.00 0.00 23.12 19.83 1iel s ALA 143 CO 0.09 -1.41 1.29 -2.14 0.00 0.00 0.00 175.76 173.60 1iel s PRO 144 N -4.80 3.51 -0.98 0.00 0.02 -1.26 -3.37 135.00 128.12 1iel s PRO 144 Ca 0.61 2.09 0.00 0.00 0.02 0.00 0.00 61.00 63.71 1iel s PRO 144 Cb -0.16 -2.42 0.00 0.00 0.02 0.00 0.00 34.50 31.94 1iel s PRO 144 CO 0.52 -0.84 0.00 0.41 -0.33 0.00 0.00 177.00 176.76 1iel n GLY 145 N 0.62 0.71 0.01 0.52 0.00 0.38 -4.90 105.19 102.51 1iel n GLY 145 Ca 0.08 -0.54 -0.01 0.00 0.00 0.00 0.00 46.02 45.55 1iel n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iel n THR 146 N -3.19 0.07 -4.38 2.61 -2.24 -1.22 -4.88 114.28 101.05 1iel n THR 146 Ca -0.11 -0.04 -0.19 0.00 -2.27 0.00 0.00 64.05 61.45 1iel n THR 146 Cb 0.42 -0.87 -0.14 0.00 -2.10 0.00 0.00 70.33 67.65 1iel n THR 146 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1iel s GLN 147 N -2.02 0.81 -0.23 -0.78 -1.52 -1.26 -2.09 119.66 112.57 1iel s GLN 147 Ca -0.01 -0.48 -0.08 0.00 -1.95 0.00 0.00 55.36 52.84 1iel s GLN 147 Cb 0.00 -0.78 -0.04 0.00 -0.22 0.00 0.00 33.01 31.98 1iel s GLN 147 CO 0.04 0.21 0.09 0.50 -0.25 0.00 0.00 175.29 175.88 1iel s ARG 148 N -0.54 3.87 -0.27 2.91 3.52 0.32 -4.26 118.95 124.50 1iel s ARG 148 Ca 0.02 -0.38 -0.01 0.00 -0.13 0.00 0.00 55.73 55.23 1iel s ARG 148 Cb -0.05 -3.35 0.08 0.00 -1.56 0.00 0.00 34.95 30.07 1iel s ARG 148 CO 0.00 0.02 0.06 -1.17 -0.81 0.00 0.00 175.30 173.40 1iel s LEU 149 N 1.09 2.10 0.12 -0.88 2.96 -0.76 -1.44 118.68 121.87 1iel s LEU 149 Ca 0.05 -1.37 -0.35 0.00 -0.22 0.00 0.00 54.13 52.23 1iel s LEU 149 Cb -0.14 -0.87 -0.16 0.00 0.50 0.00 0.00 46.19 45.52 1iel s LEU 149 CO 0.04 -0.36 1.28 0.00 -1.32 0.00 0.00 176.35 175.99 1iel n TYR 150 N 4.85 1.44 -3.66 5.38 4.19 -1.26 -4.79 117.16 123.31 1iel n TYR 150 Ca -0.05 0.65 -0.08 0.00 3.31 0.00 0.00 57.90 61.73 1iel n TYR 150 Cb 0.44 -2.31 -0.08 0.00 0.49 0.00 0.00 39.34 37.87 1iel n TYR 150 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1iel s ALA 151 N 0.25 -1.60 0.29 2.98 0.00 -1.26 -4.44 121.76 117.98 1iel s ALA 151 Ca 0.80 2.11 0.01 0.00 0.00 0.00 0.00 51.96 54.88 1iel s ALA 151 Cb -0.92 -1.29 0.45 0.00 0.00 0.00 0.00 23.12 21.37 1iel s ALA 151 CO 0.49 -0.38 1.83 -0.91 0.00 0.00 0.00 175.76 176.78 1iel h ASN 152 N 7.12 0.67 0.74 0.00 2.35 -0.93 -2.67 115.58 122.86 1iel h ASN 152 Ca -0.31 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 1iel h ASN 152 Cb 1.21 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 39.40 1iel h ASN 152 CO 0.20 0.71 0.00 0.77 -1.65 0.00 0.00 177.43 177.46 1iel h SER 153 N 0.69 0.00 0.00 5.81 4.64 -1.67 0.18 113.55 123.19 1iel h SER 153 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1iel h SER 153 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1iel h SER 153 CO 0.01 0.00 -0.18 -1.28 -0.87 0.00 0.00 176.83 174.51 1iel h SER 154 N 0.00 0.00 0.47 4.97 0.87 -1.72 -3.26 113.55 114.88 1iel h SER 154 Ca 0.00 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 1iel h SER 154 Cb 0.37 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1iel h SER 154 CO 0.00 0.33 -0.16 -0.29 -0.53 0.00 0.00 176.83 176.18 1iel h ILE 155 N -0.49 0.62 -0.28 2.23 2.10 -1.33 -1.98 117.51 118.38 1iel h ILE 155 Ca 0.00 -0.70 0.00 0.00 1.08 0.00 0.00 64.86 65.24 1iel h ILE 155 Cb 0.18 1.45 -0.01 0.00 -1.09 0.00 0.00 36.82 37.34 1iel h ILE 155 CO 0.00 0.16 0.19 1.23 -1.08 0.00 0.00 178.15 178.64 1iel h GLY 156 N 1.10 0.40 1.31 8.18 0.00 -0.82 -1.05 103.07 112.19 1iel h GLY 156 Ca -0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 47.33 47.05 1iel h GLY 156 CO 0.02 0.15 -0.30 -2.00 0.00 0.00 0.00 176.54 174.40 1iel h LEU 157 N 0.38 0.81 -0.38 3.11 5.85 -1.51 -2.63 115.31 120.94 1iel h LEU 157 Ca 0.10 -0.33 0.07 0.00 0.84 0.00 0.00 57.88 58.56 1iel h LEU 157 Cb -0.04 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 40.70 1iel h LEU 157 CO -0.02 1.05 0.01 0.15 -0.34 0.00 0.00 178.44 179.29 1iel h PHE 158 N 0.66 -0.00 -0.47 1.25 3.57 -0.93 -0.35 116.94 120.67 1iel h PHE 158 Ca 0.08 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.64 1iel h PHE 158 Cb 0.84 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.59 1iel h PHE 158 CO 0.04 -0.06 0.23 0.78 -2.23 0.00 0.00 178.31 177.08 1iel h GLY 159 N 0.12 0.65 1.00 2.40 0.00 -1.05 0.17 103.07 106.36 1iel h GLY 159 Ca 0.18 -0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.31 1iel h GLY 159 CO -0.30 0.11 0.23 0.00 0.00 0.00 0.00 176.54 176.58 1iel h ALA 160 N 1.25 0.79 -0.00 3.60 0.00 -1.02 -2.96 119.26 120.91 1iel h ALA 160 Ca 0.20 -0.18 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 1iel h ALA 160 Cb 0.11 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1iel h ALA 160 CO -0.14 0.42 -0.78 -0.07 0.00 0.00 0.00 179.25 178.68 1iel h LEU 161 N 0.84 0.07 -1.72 0.00 3.38 -0.79 -3.26 115.31 113.83 1iel h LEU 161 Ca 0.20 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.17 1iel h LEU 161 Cb 0.23 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1iel h LEU 161 CO -0.01 0.81 0.28 0.00 0.09 0.00 0.00 178.44 179.61 1iel h ALA 162 N 1.18 1.94 -0.01 1.53 0.00 -0.49 -2.39 119.26 121.02 1iel h ALA 162 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1iel h ALA 162 Cb 1.37 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1iel h ALA 162 CO 0.11 -0.00 -0.20 1.33 0.00 0.00 0.00 179.25 180.48 1iel n VAL 163 N -4.48 0.00 -0.10 0.00 0.24 -1.23 -4.45 118.33 108.31 1iel n VAL 163 Ca 0.05 -0.18 -0.05 0.00 -2.04 0.00 0.00 64.34 62.11 1iel n VAL 163 Cb 0.22 0.54 0.01 0.00 -1.47 0.00 0.00 33.84 33.14 1iel n VAL 163 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1iel h LYS 164 N 1.72 0.05 -0.38 7.34 1.79 -1.52 -2.31 116.57 123.25 1iel h LYS 164 Ca 0.00 -0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.50 1iel h LYS 164 Cb 0.54 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.16 1iel h LYS 164 CO 0.00 0.03 0.26 -1.35 -1.08 0.00 0.00 179.45 177.31 1iel h PRO 165 N 0.05 0.37 0.00 3.15 0.11 -1.79 -2.03 132.00 131.86 1iel h PRO 165 Ca 0.17 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 1iel h PRO 165 Cb 0.25 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.28 1iel h PRO 165 CO -0.33 0.25 -0.06 0.66 -0.21 0.00 0.00 178.00 178.31 1iel h SER 166 N 0.38 0.00 0.00 -2.05 4.64 -1.71 -3.46 113.55 111.35 1iel h SER 166 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1iel h SER 166 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1iel h SER 166 CO -0.04 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 1iel n GLY 167 N -0.00 2.56 3.88 -0.77 0.00 -0.76 -5.01 105.19 105.07 1iel n GLY 167 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1iel n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iel s LEU 168 N 0.00 3.64 0.79 0.99 1.43 -1.26 -5.06 118.68 119.21 1iel s LEU 168 Ca 0.00 1.19 -0.11 0.00 -1.03 0.00 0.00 54.13 54.18 1iel s LEU 168 Cb 0.00 -4.13 0.06 0.00 0.03 0.00 0.00 46.19 42.15 1iel s LEU 168 CO 0.00 -0.56 1.09 -0.94 0.23 0.00 0.00 176.35 176.17 1iel s SER 169 N -3.59 4.53 0.14 2.29 1.04 -1.26 -4.72 113.70 112.13 1iel s SER 169 Ca 0.52 1.46 -0.18 0.00 0.48 0.00 0.00 55.95 58.23 1iel s SER 169 Cb -0.10 -2.22 -0.00 0.00 0.10 0.00 0.00 66.02 63.80 1iel s SER 169 CO 0.39 -1.97 1.75 0.15 0.98 0.00 0.00 173.24 174.54 1iel h PHE 170 N -1.08 0.15 -0.60 5.02 3.57 -1.93 -0.89 116.94 121.18 1iel h PHE 170 Ca -0.46 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.08 1iel h PHE 170 Cb 1.25 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.92 1iel h PHE 170 CO 0.51 0.07 0.37 1.49 -2.23 0.00 0.00 178.31 178.51 1iel h GLU 171 N 0.20 0.71 -0.50 1.11 4.81 -1.99 -0.58 114.58 118.34 1iel h GLU 171 Ca 0.12 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.22 1iel h GLU 171 Cb 0.09 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1iel h GLU 171 CO -0.12 0.47 -0.02 1.96 -0.73 0.00 0.00 179.01 180.57 1iel h GLN 172 N 0.73 0.90 -0.14 1.92 1.08 -1.87 0.24 115.11 117.97 1iel h GLN 172 Ca 0.24 -0.30 0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1iel h GLN 172 Cb 0.02 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 1iel h GLN 172 CO -0.10 0.94 0.04 0.00 -0.95 0.00 0.00 178.83 178.76 1iel h ALA 173 N 0.93 0.15 -0.38 3.87 0.00 -0.89 -1.21 119.26 121.73 1iel h ALA 173 Ca 0.14 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1iel h ALA 173 Cb 0.54 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1iel h ALA 173 CO 0.03 -0.40 0.24 1.98 0.00 0.00 0.00 179.25 181.09 1iel h MET 174 N 0.11 0.50 -0.01 0.00 1.85 -0.90 -0.13 114.93 116.35 1iel h MET 174 Ca 0.06 -0.04 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 1iel h MET 174 Cb 0.04 -0.11 -0.00 0.00 0.43 0.00 0.00 31.60 31.95 1iel h MET 174 CO -0.06 0.36 -0.01 1.96 -0.40 0.00 0.00 176.91 178.75 1iel h GLN 175 N 0.50 -0.02 0.00 0.39 4.20 -0.70 -1.44 115.11 118.05 1iel h GLN 175 Ca 0.14 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.78 1iel h GLN 175 Cb -0.02 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 1iel h GLN 175 CO -0.03 -0.01 -0.36 1.79 -0.67 0.00 0.00 178.83 179.55 1iel h THR 176 N -0.02 0.50 0.00 -0.54 1.35 -1.16 0.88 112.91 113.92 1iel h THR 176 Ca 0.01 -1.72 0.00 0.00 -0.55 0.00 0.00 66.41 64.15 1iel h THR 176 Cb 0.03 2.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1iel h THR 176 CO -0.02 0.29 -1.32 0.54 -0.25 0.00 0.00 175.52 174.75 1iel n ARG 177 N -3.15 1.03 0.05 4.72 1.74 -0.07 -4.47 116.66 116.51 1iel n ARG 177 Ca 0.02 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 1iel n ARG 177 Cb 0.66 -1.33 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 1iel n ARG 177 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1iel n VAL 178 N -1.77 0.41 0.13 1.55 0.31 -0.63 -4.75 118.33 113.58 1iel n VAL 178 Ca -0.00 0.14 -0.14 0.00 -0.01 0.00 0.00 64.34 64.32 1iel n VAL 178 Cb 0.35 -0.91 -0.07 0.00 -0.91 0.00 0.00 33.84 32.30 1iel n VAL 178 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1iel h PHE 179 N 0.00 -0.98 -0.06 3.52 0.04 -1.32 -2.70 116.94 115.44 1iel h PHE 179 Ca 0.00 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 1iel h PHE 179 Cb 0.00 0.41 -0.00 0.00 2.20 0.00 0.00 35.95 38.56 1iel h PHE 179 CO 0.00 -0.47 0.03 1.96 -0.60 0.00 0.00 178.31 179.24 1iel h GLN 180 N -0.60 0.09 -0.07 1.51 4.20 -1.06 0.54 115.11 119.72 1iel h GLN 180 Ca 0.02 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.73 1iel h GLN 180 Cb 0.62 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 1iel h GLN 180 CO -0.19 0.15 0.04 -1.35 -0.67 0.00 0.00 178.83 176.81 1iel h PRO 181 N 0.01 0.06 -0.16 1.46 0.11 -1.77 0.17 132.00 131.87 1iel h PRO 181 Ca 0.02 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1iel h PRO 181 Cb 0.08 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1iel h PRO 181 CO -0.00 0.04 0.00 1.28 -0.21 0.00 0.00 178.00 179.10 1iel n LEU 182 N -4.53 2.03 -3.70 2.35 4.77 -1.02 -4.94 117.00 111.96 1iel n LEU 182 Ca -0.02 -0.80 -0.25 0.00 -0.03 0.00 0.00 56.01 54.90 1iel n LEU 182 Cb 0.11 -0.10 0.06 0.00 -2.33 0.00 0.00 43.42 41.16 1iel n LEU 182 CO 0.34 0.40 0.17 0.29 -1.33 0.00 0.00 177.39 177.27 1iel n LYS 183 N 0.57 -6.89 -2.88 3.23 5.02 0.05 -4.88 118.16 112.37 1iel n LYS 183 Ca 0.17 0.74 -0.44 0.00 -2.02 0.00 0.00 58.31 56.76 1iel n LYS 183 Cb 0.40 -5.71 -0.00 0.00 -0.02 0.00 0.00 35.03 29.70 1iel n LYS 183 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1iel s LEU 184 N -7.20 4.84 0.00 -0.35 1.43 0.06 -4.83 118.68 112.63 1iel s LEU 184 Ca 0.54 -2.77 0.23 0.00 -1.03 0.00 0.00 54.13 51.10 1iel s LEU 184 Cb -0.25 -2.43 1.26 0.00 0.03 0.00 0.00 46.19 44.80 1iel s LEU 184 CO 0.77 -0.86 1.75 0.59 0.23 0.00 0.00 176.35 178.83 1iel n ASN 185 N 6.23 0.00 -2.39 2.29 3.02 -1.26 -3.51 115.26 119.64 1iel n ASN 185 Ca 0.37 -0.35 -0.03 0.00 -0.03 0.00 0.00 54.58 54.54 1iel n ASN 185 Cb 0.44 -0.16 0.05 0.00 -0.61 0.00 0.00 39.78 39.50 1iel n ASN 185 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1iel n HIS 186 N -1.16 1.26 -4.83 3.10 8.25 -1.26 -5.04 115.22 115.54 1iel n HIS 186 Ca 0.14 -1.86 -0.30 0.00 -0.26 0.00 0.00 57.72 55.43 1iel n HIS 186 Cb 0.14 -0.24 -0.17 0.00 1.12 0.00 0.00 29.99 30.84 1iel n HIS 186 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1iel s THR 187 N -3.31 1.79 -0.01 1.59 2.01 -1.23 -3.73 115.64 112.75 1iel s THR 187 Ca 0.33 -0.84 -0.04 0.00 0.31 0.00 0.00 61.69 61.45 1iel s THR 187 Cb 0.35 -1.58 -0.00 0.00 0.01 0.00 0.00 72.50 71.28 1iel s THR 187 CO -0.05 0.50 0.07 0.26 -0.69 0.00 0.00 174.62 174.71 1iel s TRP 188 N 0.64 0.05 -0.06 4.92 0.52 -0.46 -5.01 118.94 119.54 1iel s TRP 188 Ca -0.13 -0.11 -0.11 0.00 0.02 0.00 0.00 56.10 55.77 1iel s TRP 188 Cb -0.16 -0.06 -0.30 0.00 -1.15 0.00 0.00 33.47 31.80 1iel s TRP 188 CO 0.03 -0.18 0.62 0.82 0.02 0.00 0.00 176.95 178.27 1iel h ILE 189 N 4.63 0.89 -3.75 2.03 2.04 -1.85 -0.38 117.51 121.11 1iel h ILE 189 Ca -0.29 -2.48 -0.67 0.00 1.00 0.00 0.00 64.86 62.42 1iel h ILE 189 Cb 1.20 2.73 -0.37 0.00 -0.74 0.00 0.00 36.82 39.64 1iel h ILE 189 CO 0.42 0.86 -0.81 0.20 0.00 0.00 0.00 178.15 178.83 1iel s ASN 190 N -7.26 4.26 -0.06 1.72 0.01 -1.26 -4.77 114.94 107.58 1iel s ASN 190 Ca -0.17 -1.29 -0.30 0.00 -0.71 0.00 0.00 52.86 50.39 1iel s ASN 190 Cb 0.06 -1.54 -0.05 0.00 0.41 0.00 0.00 41.25 40.12 1iel s ASN 190 CO 0.84 -0.16 1.64 -0.69 -1.51 0.00 0.00 177.10 177.22 1iel s VAL 191 N 1.13 3.61 0.63 1.60 1.01 -1.26 -4.99 120.40 122.12 1iel s VAL 191 Ca -0.07 0.74 -0.14 0.00 0.00 0.00 0.00 61.98 62.51 1iel s VAL 191 Cb -0.19 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 1iel s VAL 191 CO -0.06 -0.07 1.06 -2.16 0.00 0.00 0.00 175.10 173.87 1iel s PRO 192 N 4.02 3.19 0.31 2.72 0.04 -1.26 -4.89 135.00 139.12 1iel s PRO 192 Ca 0.73 1.10 0.07 0.00 0.04 0.00 0.00 61.00 62.94 1iel s PRO 192 Cb -0.33 -2.02 0.81 0.00 0.04 0.00 0.00 34.50 33.01 1iel s PRO 192 CO 0.29 -0.91 1.72 -1.35 0.04 0.00 0.00 177.00 176.79 1iel h PRO 193 N 0.01 0.50 -0.01 0.56 0.11 -2.01 -0.09 132.00 131.06 1iel h PRO 193 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1iel h PRO 193 Cb 1.21 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1iel h PRO 193 CO 0.57 0.33 0.01 0.00 -0.21 0.00 0.00 178.00 178.70 1iel h ALA 194 N 1.72 1.56 -0.02 -0.75 0.00 -2.03 -1.65 119.26 118.09 1iel h ALA 194 Ca 0.61 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.52 1iel h ALA 194 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1iel h ALA 194 CO -0.49 -0.01 -0.32 0.39 0.00 0.00 0.00 179.25 178.81 1iel n GLU 195 N -3.88 1.36 -0.30 0.00 -0.58 -0.06 -4.41 120.64 112.76 1iel n GLU 195 Ca -0.03 -1.06 0.10 0.00 -0.42 0.00 0.00 57.16 55.75 1iel n GLU 195 Cb 0.09 -1.48 0.33 0.00 -0.57 0.00 0.00 31.44 29.81 1iel n GLU 195 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1iel h GLU 196 N 2.58 0.78 0.00 3.49 5.08 -1.12 -0.25 114.58 125.14 1iel h GLU 196 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1iel h GLU 196 Cb 0.73 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1iel h GLU 196 CO 0.00 0.52 0.00 1.57 -1.00 0.00 0.00 179.01 180.10 1iel h LYS 197 N 0.81 0.00 -0.01 2.33 2.10 -1.78 -2.44 116.57 117.58 1iel h LYS 197 Ca 0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.10 1iel h LYS 197 Cb 0.60 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 1iel h LYS 197 CO -0.22 0.00 -0.60 0.09 -2.00 0.00 0.00 179.45 176.73 1iel n ASN 198 N -2.89 1.35 -4.59 7.07 3.02 -0.15 -4.91 115.26 114.17 1iel n ASN 198 Ca -0.01 -1.18 -0.42 0.00 -0.03 0.00 0.00 54.58 52.94 1iel n ASN 198 Cb 0.16 0.72 -0.02 0.00 -0.61 0.00 0.00 39.78 40.03 1iel n ASN 198 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1iel s TYR 199 N -2.38 2.43 0.70 3.10 6.04 -0.92 -1.01 117.35 125.30 1iel s TYR 199 Ca 0.11 0.56 -0.16 0.00 0.04 0.00 0.00 57.07 57.62 1iel s TYR 199 Cb 0.14 -4.39 0.02 0.00 -1.04 0.00 0.00 41.96 36.69 1iel s TYR 199 CO 0.59 -1.83 1.22 0.00 -1.54 0.00 0.00 175.55 173.99 1iel s ALA 200 N 5.52 2.22 0.21 3.97 0.00 -0.70 -4.93 121.76 128.06 1iel s ALA 200 Ca 0.53 0.95 -0.10 0.00 0.00 0.00 0.00 51.96 53.35 1iel s ALA 200 Cb -0.11 -3.48 -0.07 0.00 0.00 0.00 0.00 23.12 19.46 1iel s ALA 200 CO 0.28 -1.73 0.54 -1.58 0.00 0.00 0.00 175.76 173.27 1iel s TRP 201 N -1.83 3.45 0.27 0.00 0.52 -0.16 -4.93 118.94 116.27 1iel s TRP 201 Ca 0.76 0.88 0.01 0.00 0.02 0.00 0.00 56.10 57.76 1iel s TRP 201 Cb -0.31 -2.26 -0.04 0.00 -1.15 0.00 0.00 33.47 29.72 1iel s TRP 201 CO 0.43 0.30 0.46 0.20 0.02 0.00 0.00 176.95 178.35 1iel s GLY 202 N -2.28 1.49 -0.09 0.98 0.00 0.14 -4.82 107.32 102.75 1iel s GLY 202 Ca 0.46 -0.93 0.02 0.00 0.00 0.00 0.00 44.72 44.26 1iel s GLY 202 CO 0.21 -0.89 -0.12 -0.19 0.00 0.00 0.00 173.10 172.11 1iel s TYR 203 N -2.08 1.65 -0.10 1.90 1.51 -0.68 -0.25 117.35 119.30 1iel s TYR 203 Ca 0.38 -0.71 -0.01 0.00 -1.01 0.00 0.00 57.07 55.72 1iel s TYR 203 Cb -0.10 -1.23 0.03 0.00 -0.11 0.00 0.00 41.96 40.55 1iel s TYR 203 CO 0.32 -0.39 -0.02 0.50 -1.11 0.00 0.00 175.55 174.85 1iel s ARG 204 N 0.98 0.89 -1.52 -0.62 3.52 -0.96 -4.34 118.95 116.89 1iel s ARG 204 Ca -0.08 -0.05 -0.05 0.00 -0.13 0.00 0.00 55.73 55.42 1iel s ARG 204 Cb -0.15 -1.27 0.02 0.00 -1.56 0.00 0.00 34.95 31.99 1iel s ARG 204 CO -0.00 -0.33 0.49 0.39 -0.81 0.00 0.00 175.30 175.04 1iel n GLU 205 N 5.08 -4.17 -0.14 5.12 -0.58 -1.26 -1.38 120.64 123.31 1iel n GLU 205 Ca -0.09 0.84 0.00 0.00 -0.42 0.00 0.00 57.16 57.49 1iel n GLU 205 Cb 0.50 -5.65 0.00 0.00 -0.57 0.00 0.00 31.44 25.72 1iel n GLU 205 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1iel n GLY 206 N -1.38 2.00 3.76 0.62 0.00 -1.26 -4.99 105.19 103.93 1iel n GLY 206 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 1iel n GLY 206 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iel s LYS 207 N -0.04 4.31 0.08 1.61 0.00 -0.48 -5.03 119.74 120.19 1iel s LYS 207 Ca 0.00 0.70 -0.31 0.00 0.00 0.00 0.00 55.97 56.36 1iel s LYS 207 Cb 0.00 -3.36 -0.07 0.00 0.00 0.00 0.00 37.83 34.40 1iel s LYS 207 CO 0.00 0.33 1.37 0.00 0.00 0.00 0.00 175.35 177.06 1iel s ALA 208 N -0.05 3.56 0.02 0.59 0.00 -1.26 -2.28 121.76 122.35 1iel s ALA 208 Ca 0.31 1.03 -0.05 0.00 0.00 0.00 0.00 51.96 53.24 1iel s ALA 208 Cb -0.18 -3.54 -0.01 0.00 0.00 0.00 0.00 23.12 19.39 1iel s ALA 208 CO 0.16 -0.67 0.09 0.14 0.00 0.00 0.00 175.76 175.48 1iel s VAL 209 N 1.45 0.11 0.18 0.00 -7.23 0.66 -4.93 120.40 110.64 1iel s VAL 209 Ca 0.64 -0.91 0.09 0.00 -1.81 0.00 0.00 61.98 59.99 1iel s VAL 209 Cb -0.35 -0.61 -0.04 0.00 0.56 0.00 0.00 36.38 35.94 1iel s VAL 209 CO 0.29 -0.50 -0.19 -1.00 -0.31 0.00 0.00 175.10 173.39 1iel s HIS 210 N -1.94 1.92 0.45 2.82 3.76 -1.26 -0.68 115.29 120.36 1iel s HIS 210 Ca -0.11 -0.45 -0.24 0.00 -0.15 0.00 0.00 55.06 54.11 1iel s HIS 210 Cb -0.05 -0.95 -0.07 0.00 1.11 0.00 0.00 32.58 32.62 1iel s HIS 210 CO -0.01 0.38 1.29 0.54 -0.85 0.00 0.00 174.74 176.09 1iel s VAL 211 N -2.06 2.58 0.21 -0.90 0.11 -1.26 -4.97 120.40 114.11 1iel s VAL 211 Ca 0.18 0.48 0.01 0.00 -2.93 0.00 0.00 61.98 59.71 1iel s VAL 211 Cb -0.06 -3.26 -0.04 0.00 -1.53 0.00 0.00 36.38 31.49 1iel s VAL 211 CO 0.08 0.04 0.38 -0.94 -3.33 0.00 0.00 175.10 171.33 1iel s SER 212 N -0.92 6.36 0.60 3.54 1.04 -1.26 -5.07 113.70 117.99 1iel s SER 212 Ca 0.62 0.33 -0.19 0.00 0.48 0.00 0.00 55.95 57.19 1iel s SER 212 Cb -0.37 -1.98 -0.04 0.00 0.10 0.00 0.00 66.02 63.74 1iel s SER 212 CO 0.46 -0.05 1.20 -0.81 0.98 0.00 0.00 173.24 175.01 1iel n PRO 213 N -0.81 1.22 -3.47 4.02 -0.04 -1.26 -5.02 135.00 129.64 1iel n PRO 213 Ca -0.06 0.47 -0.10 0.00 -0.04 0.00 0.00 63.50 63.77 1iel n PRO 213 Cb 0.54 -2.41 -0.02 0.00 -0.04 0.00 0.00 33.50 31.57 1iel n PRO 213 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1iel s GLY 214 N -1.18 -0.52 0.25 0.55 0.00 -1.26 -5.08 107.32 100.08 1iel s GLY 214 Ca 0.77 0.83 -0.31 0.00 0.00 0.00 0.00 44.72 46.00 1iel s GLY 214 CO 0.46 0.28 1.61 0.00 0.00 0.00 0.00 173.10 175.44 1iel s ALA 215 N -3.34 3.79 -1.81 3.20 0.00 -1.26 -2.00 121.76 120.35 1iel s ALA 215 Ca 0.03 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.51 1iel s ALA 215 Cb -0.01 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1iel s ALA 215 CO -0.10 -0.91 0.00 1.28 0.00 0.00 0.00 175.76 176.03 1iel n LEU 216 N 2.95 -1.81 -0.12 0.00 4.77 -1.26 -4.85 117.00 116.68 1iel n LEU 216 Ca 0.11 0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 56.08 1iel n LEU 216 Cb 0.37 -2.87 -0.02 0.00 -2.33 0.00 0.00 43.42 38.57 1iel n LEU 216 CO 0.63 -0.37 0.81 -2.24 -1.33 0.00 0.00 177.39 174.89 1iel h ASP 217 N 0.00 0.55 -0.66 -1.43 3.04 -1.82 -2.20 116.42 113.91 1iel h ASP 217 Ca -0.47 -0.27 0.04 0.00 -3.24 0.00 0.00 57.03 53.09 1iel h ASP 217 Cb 1.35 -0.15 -0.05 0.00 -1.04 0.00 0.00 39.33 39.45 1iel h ASP 217 CO 0.57 0.69 0.39 0.00 -2.04 0.00 0.00 179.24 178.85 1iel h ALA 218 N 0.89 0.86 -0.16 4.15 0.00 -1.89 0.43 119.26 123.55 1iel h ALA 218 Ca 0.10 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1iel h ALA 218 Cb 0.38 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1iel h ALA 218 CO 0.01 0.12 -0.42 0.93 0.00 0.00 0.00 179.25 179.89 1iel h GLU 219 N 0.75 0.36 0.00 0.00 3.07 -1.86 -3.26 114.58 113.65 1iel h GLU 219 Ca 0.27 -0.18 -0.36 0.00 -0.50 0.00 0.00 59.36 58.59 1iel h GLU 219 Cb 0.08 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 27.92 1iel h GLU 219 CO -0.13 0.72 -2.37 0.00 -1.40 0.00 0.00 179.01 175.83 1iel n ALA 220 N -2.48 1.50 -2.00 3.43 0.00 -0.84 -4.53 120.51 115.59 1iel n ALA 220 Ca -0.02 -1.22 0.00 0.00 0.00 0.00 0.00 53.44 52.20 1iel n ALA 220 Cb 0.50 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1iel n ALA 220 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1iel n TYR 221 N -2.88 0.00 0.91 0.00 0.18 -0.03 -4.05 117.16 111.29 1iel n TYR 221 Ca -0.36 0.00 0.09 0.00 1.88 0.00 0.00 57.90 59.52 1iel n TYR 221 Cb 1.09 0.22 0.29 0.00 -0.38 0.00 0.00 39.34 40.55 1iel n TYR 221 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1iel n GLY 222 N 0.00 0.71 3.78 -7.48 0.00 0.13 -3.66 105.19 98.68 1iel n GLY 222 Ca 0.00 -0.47 -0.39 0.00 0.00 0.00 0.00 46.02 45.16 1iel n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iel s VAL 223 N -1.63 4.76 -0.08 1.61 1.01 -1.26 -4.52 120.40 120.28 1iel s VAL 223 Ca 0.32 1.33 0.03 0.00 0.00 0.00 0.00 61.98 63.65 1iel s VAL 223 Cb 0.17 -3.96 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 1iel s VAL 223 CO 0.24 0.48 -0.17 -0.54 0.00 0.00 0.00 175.10 175.11 1iel s LYS 224 N -0.64 2.86 0.20 2.72 3.01 -0.15 -0.66 119.74 127.06 1iel s LYS 224 Ca 0.32 -0.75 -0.11 0.00 -1.01 0.00 0.00 55.97 54.41 1iel s LYS 224 Cb -0.20 -2.41 -0.00 0.00 -1.01 0.00 0.00 37.83 34.21 1iel s LYS 224 CO 0.20 0.40 0.37 0.45 0.51 0.00 0.00 175.35 177.27 1iel s SER 225 N -0.15 -0.03 0.34 2.83 0.15 -0.45 -1.36 113.70 115.02 1iel s SER 225 Ca -0.02 -0.87 0.05 0.00 0.70 0.00 0.00 55.95 55.81 1iel s SER 225 Cb -0.14 0.50 -0.01 0.00 -1.71 0.00 0.00 66.02 64.66 1iel s SER 225 CO 0.04 -0.99 0.49 0.42 1.20 0.00 0.00 173.24 174.40 1iel s THR 226 N -3.98 4.41 0.42 6.45 -4.23 -1.24 -0.13 115.64 117.33 1iel s THR 226 Ca 0.19 -0.86 0.15 0.00 -1.18 0.00 0.00 61.69 59.99 1iel s THR 226 Cb 0.02 -3.56 0.16 0.00 1.34 0.00 0.00 72.50 70.46 1iel s THR 226 CO 0.03 -0.26 1.95 -0.29 -0.54 0.00 0.00 174.62 175.50 1iel h ILE 227 N 0.85 1.13 -0.07 2.99 6.09 -1.73 -0.33 117.51 126.44 1iel h ILE 227 Ca -0.48 -0.82 -0.04 0.00 -1.37 0.00 0.00 64.86 62.15 1iel h ILE 227 Cb 1.25 1.45 -0.00 0.00 0.47 0.00 0.00 36.82 39.99 1iel h ILE 227 CO 0.56 0.23 -0.13 -0.08 -3.07 0.00 0.00 178.15 175.67 1iel h GLU 228 N 0.00 0.22 -0.75 2.19 4.81 -1.94 -1.30 114.58 117.80 1iel h GLU 228 Ca -0.00 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.04 1iel h GLU 228 Cb 0.43 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 1iel h GLU 228 CO 0.03 0.71 0.25 -0.44 -0.73 0.00 0.00 179.01 178.83 1iel h ASP 229 N -0.25 1.08 0.01 1.04 3.45 -1.80 -2.16 116.42 117.78 1iel h ASP 229 Ca 0.00 -0.19 -0.08 0.00 0.43 0.00 0.00 57.03 57.20 1iel h ASP 229 Cb 0.70 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 39.17 1iel h ASP 229 CO 0.03 0.98 -0.21 0.24 -1.57 0.00 0.00 179.24 178.72 1iel h MET 230 N 1.11 0.35 -0.48 3.56 2.86 -1.04 0.15 114.93 121.44 1iel h MET 230 Ca 0.25 -0.11 -0.11 0.00 -2.06 0.00 0.00 59.70 57.66 1iel h MET 230 Cb 0.28 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 1iel h MET 230 CO -0.01 0.55 -0.14 0.00 1.06 0.00 0.00 176.91 178.37 1iel h ALA 231 N 1.47 0.84 -0.36 6.32 0.00 -0.89 -0.57 119.26 126.07 1iel h ALA 231 Ca 0.05 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 1iel h ALA 231 Cb 0.55 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1iel h ALA 231 CO 0.04 0.65 -0.24 -0.09 0.00 0.00 0.00 179.25 179.60 1iel h ARG 232 N 0.81 0.72 -0.61 0.00 2.43 -0.76 -1.32 114.38 115.66 1iel h ARG 232 Ca 0.12 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1iel h ARG 232 Cb 0.67 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.16 1iel h ARG 232 CO 0.05 0.90 0.38 2.35 -1.51 0.00 0.00 179.97 182.14 1iel h TRP 233 N 0.63 0.78 -0.64 2.20 -0.00 -0.29 -1.53 115.95 117.11 1iel h TRP 233 Ca 0.08 0.01 -0.08 0.00 -0.00 0.00 0.00 58.89 58.91 1iel h TRP 233 Cb 0.74 -0.26 -0.02 0.00 -0.00 0.00 0.00 29.16 29.62 1iel h TRP 233 CO 0.04 0.51 0.09 0.28 -0.00 0.00 0.00 178.44 179.37 1iel h VAL 234 N 0.82 1.26 -0.70 2.65 2.07 -0.69 -2.20 116.25 119.47 1iel h VAL 234 Ca 0.22 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 1iel h VAL 234 Cb -0.06 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 1iel h VAL 234 CO -0.04 0.38 0.35 1.56 0.02 0.00 0.00 177.57 179.84 1iel h GLN 235 N 0.97 0.99 -0.32 1.57 4.20 -0.99 0.76 115.11 122.30 1iel h GLN 235 Ca 0.19 -0.13 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 1iel h GLN 235 Cb 0.45 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 1iel h GLN 235 CO 0.01 0.76 -0.21 0.77 -0.67 0.00 0.00 178.83 179.48 1iel h SER 236 N 0.99 0.60 1.62 1.46 0.02 -1.03 -1.81 113.55 115.41 1iel h SER 236 Ca 0.25 -0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1iel h SER 236 Cb 0.08 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.45 1iel h SER 236 CO -0.03 0.82 -0.38 0.78 -1.14 0.00 0.00 176.83 176.87 1iel h ASN 237 N 0.53 0.00 -0.08 3.07 2.35 -0.91 -2.95 115.58 117.60 1iel h ASN 237 Ca 0.08 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.73 1iel h ASN 237 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.04 1iel h ASN 237 CO 0.05 0.10 -0.34 -0.07 -1.65 0.00 0.00 177.43 175.52 1iel h LEU 238 N 0.00 0.44 -6.42 1.61 3.38 -0.63 -3.40 115.31 110.28 1iel h LEU 238 Ca -0.01 -0.63 -0.59 0.00 0.09 0.00 0.00 57.88 56.74 1iel h LEU 238 Cb 1.08 -0.13 -0.40 0.00 0.09 0.00 0.00 40.66 41.31 1iel h LEU 238 CO 0.01 1.00 -0.87 0.29 0.09 0.00 0.00 178.44 178.96 1iel n LYS 239 N -4.40 0.96 0.29 1.13 5.02 -0.70 -4.80 118.16 115.66 1iel n LYS 239 Ca -0.08 -3.67 0.16 0.00 -2.02 0.00 0.00 58.31 52.70 1iel n LYS 239 Cb 0.51 -1.78 0.93 0.00 -0.02 0.00 0.00 35.03 34.67 1iel n LYS 239 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1iel h PRO 240 N 5.03 0.00 0.00 1.97 0.13 -1.74 -2.51 132.00 134.88 1iel h PRO 240 Ca 0.19 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.30 1iel h PRO 240 Cb 0.84 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.96 1iel h PRO 240 CO 0.53 0.00 -0.08 -0.07 -0.23 0.00 0.00 178.00 178.14 1iel h LEU 241 N 0.00 0.00 0.00 1.56 3.38 -1.89 -1.46 115.31 116.90 1iel h LEU 241 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1iel h LEU 241 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1iel h LEU 241 CO -0.00 0.08 0.00 0.47 0.09 0.00 0.00 178.44 179.08 1iel n ASP 242 N -3.64 0.00 -4.60 -0.43 10.43 -0.95 -4.74 116.55 112.63 1iel n ASP 242 Ca -0.02 -0.62 -0.42 0.00 2.57 0.00 0.00 54.79 56.31 1iel n ASP 242 Cb 0.20 -0.08 -0.06 0.00 1.84 0.00 0.00 41.12 43.02 1iel n ASP 242 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1iel s ILE 243 N -2.16 4.84 0.17 0.53 1.09 -0.55 -4.98 121.20 120.14 1iel s ILE 243 Ca 0.35 0.97 -0.15 0.00 -1.10 0.00 0.00 60.65 60.72 1iel s ILE 243 Cb 0.18 -4.10 0.05 0.00 -1.06 0.00 0.00 42.46 37.53 1iel s ILE 243 CO 0.32 -0.24 1.80 0.78 -0.10 0.00 0.00 174.94 177.50 1iel h ASN 244 N 8.23 0.43 -2.43 3.58 2.35 -1.88 -3.41 115.58 122.46 1iel h ASN 244 Ca -0.25 0.01 -0.55 0.00 -0.55 0.00 0.00 56.30 54.95 1iel h ASN 244 Cb 1.10 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 39.36 1iel h ASN 244 CO 0.85 0.31 1.31 -1.61 -1.65 0.00 0.00 177.43 176.64 1iel s GLU 245 N -6.15 3.07 0.21 0.81 8.01 -1.26 -4.89 118.70 118.51 1iel s GLU 245 Ca -0.13 1.16 -0.13 0.00 0.01 0.00 0.00 54.97 55.88 1iel s GLU 245 Cb 0.12 -4.27 0.26 0.00 -4.31 0.00 0.00 34.13 25.93 1iel s GLU 245 CO 0.73 -2.18 1.63 1.57 0.01 0.00 0.00 175.26 177.01 1iel h LYS 246 N 13.75 0.01 0.00 1.61 -0.00 -2.00 -0.41 116.57 129.53 1iel h LYS 246 Ca -0.31 -0.00 -0.09 0.00 -0.00 0.00 0.00 60.65 60.25 1iel h LYS 246 Cb 1.17 -0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.38 1iel h LYS 246 CO 1.10 0.01 -0.43 1.79 -0.00 0.00 0.00 179.45 181.91 1iel h THR 247 N 0.01 1.24 -0.06 0.07 1.35 -1.92 -2.03 112.91 111.57 1iel h THR 247 Ca 0.32 -1.51 -0.18 0.00 -0.55 0.00 0.00 66.41 64.48 1iel h THR 247 Cb 0.49 1.83 0.01 0.00 -1.73 0.00 0.00 68.15 68.75 1iel h THR 247 CO -0.66 0.42 -0.67 0.25 -0.25 0.00 0.00 175.52 174.62 1iel h LEU 248 N 0.00 0.69 -0.27 3.87 5.85 -1.64 0.63 115.31 124.43 1iel h LEU 248 Ca -0.00 -0.70 0.06 0.00 0.84 0.00 0.00 57.88 58.08 1iel h LEU 248 Cb 0.80 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.55 1iel h LEU 248 CO 0.06 1.28 -0.21 -0.61 -0.34 0.00 0.00 178.44 178.62 1iel h GLN 249 N 0.15 -0.19 -0.41 1.25 4.15 -1.00 -0.22 115.11 118.85 1iel h GLN 249 Ca -0.07 0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.30 1iel h GLN 249 Cb 1.33 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 29.05 1iel h GLN 249 CO 0.13 -0.12 -0.02 0.37 -1.93 0.00 0.00 178.83 177.26 1iel h GLN 250 N -0.19 0.67 -0.65 1.69 4.15 -1.36 -2.47 115.11 116.95 1iel h GLN 250 Ca 0.15 -0.17 -0.08 0.00 0.77 0.00 0.00 58.65 59.32 1iel h GLN 250 Cb 0.42 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 28.00 1iel h GLN 250 CO -0.38 0.70 0.10 0.78 -1.93 0.00 0.00 178.83 178.09 1iel h GLY 251 N 0.93 1.16 0.99 2.39 0.00 0.05 0.34 103.07 108.94 1iel h GLY 251 Ca 0.13 -0.78 -0.05 0.00 0.00 0.00 0.00 47.33 46.62 1iel h GLY 251 CO 0.02 0.72 0.12 -2.22 0.00 0.00 0.00 176.54 175.18 1iel h ILE 252 N 0.99 1.24 -0.58 2.60 2.04 -0.93 -1.66 117.51 121.23 1iel h ILE 252 Ca 0.20 -0.87 -0.05 0.00 1.00 0.00 0.00 64.86 65.13 1iel h ILE 252 Cb 0.45 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1iel h ILE 252 CO 0.01 0.32 0.17 1.56 0.00 0.00 0.00 178.15 180.21 1iel h GLN 253 N 0.74 0.90 -0.23 2.37 4.20 -1.09 -2.80 115.11 119.20 1iel h GLN 253 Ca 0.16 -0.20 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 1iel h GLN 253 Cb 0.34 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 1iel h GLN 253 CO 0.00 0.82 -0.06 -0.07 -0.67 0.00 0.00 178.83 178.85 1iel h LEU 254 N 0.81 0.34 -1.15 1.46 3.38 -0.67 -1.95 115.31 117.54 1iel h LEU 254 Ca 0.18 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1iel h LEU 254 Cb 0.30 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1iel h LEU 254 CO -0.00 0.44 0.00 0.00 0.09 0.00 0.00 178.44 178.97 1iel h ALA 255 N 1.60 1.00 -0.54 1.53 0.00 -1.04 -2.29 119.26 119.51 1iel h ALA 255 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1iel h ALA 255 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1iel h ALA 255 CO 0.01 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.30 1iel n GLN 256 N -2.63 2.65 -1.96 0.00 6.02 -0.74 -1.21 117.38 119.50 1iel n GLN 256 Ca 0.01 -2.38 -0.33 0.00 -0.01 0.00 0.00 57.00 54.29 1iel n GLN 256 Cb 0.25 -1.47 0.02 0.00 1.02 0.00 0.00 30.24 30.06 1iel n GLN 256 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1iel s SER 257 N -1.08 5.52 -0.41 1.08 0.01 -0.86 -3.82 113.70 114.13 1iel s SER 257 Ca 0.39 1.93 -0.16 0.00 1.31 0.00 0.00 55.95 59.42 1iel s SER 257 Cb 0.21 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.91 1iel s SER 257 CO 0.28 -1.35 0.36 -0.13 0.41 0.00 0.00 173.24 172.81 1iel s ARG 258 N -3.98 3.05 -0.11 12.44 0.52 0.11 -4.18 118.95 126.80 1iel s ARG 258 Ca 0.66 -0.88 0.08 0.00 -0.52 0.00 0.00 55.73 55.06 1iel s ARG 258 Cb -0.19 -3.97 -0.24 0.00 0.52 0.00 0.00 34.95 31.08 1iel s ARG 258 CO 0.37 -0.78 0.39 0.66 0.02 0.00 0.00 175.30 175.95 1iel n TYR 259 N 5.36 0.78 -4.00 -0.53 4.01 -0.79 -2.57 117.16 119.41 1iel n TYR 259 Ca -0.09 0.23 -0.08 0.00 -0.16 0.00 0.00 57.90 57.80 1iel n TYR 259 Cb 0.47 -1.13 -0.10 0.00 -0.31 0.00 0.00 39.34 38.28 1iel n TYR 259 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1iel s TRP 260 N -2.56 0.33 0.01 -0.72 0.52 -1.25 -2.01 118.94 113.26 1iel s TRP 260 Ca -0.13 -0.72 0.06 0.00 0.02 0.00 0.00 56.10 55.33 1iel s TRP 260 Cb 0.07 -0.25 -0.02 0.00 -1.15 0.00 0.00 33.47 32.13 1iel s TRP 260 CO 0.79 -0.32 -0.19 -1.14 0.02 0.00 0.00 176.95 176.10 1iel s GLN 261 N -2.78 1.41 -0.17 4.98 0.74 -0.72 -1.73 119.66 121.39 1iel s GLN 261 Ca -0.04 -0.79 -0.04 0.00 0.05 0.00 0.00 55.36 54.54 1iel s GLN 261 Cb -0.00 -1.44 0.08 0.00 1.10 0.00 0.00 33.01 32.75 1iel s GLN 261 CO -0.06 0.38 0.25 -0.08 -0.55 0.00 0.00 175.29 175.23 1iel s THR 262 N -0.63 -0.38 0.00 -0.34 -1.32 -0.22 -1.61 115.64 111.15 1iel s THR 262 Ca 0.07 0.09 0.00 0.00 -1.21 0.00 0.00 61.69 60.64 1iel s THR 262 Cb -0.08 -0.56 0.00 0.00 -1.51 0.00 0.00 72.50 70.35 1iel s THR 262 CO 0.01 -0.04 0.00 0.61 -2.21 0.00 0.00 174.62 172.99 1iel n GLY 263 N 5.34 3.08 1.78 6.08 0.00 -1.26 -1.11 105.19 119.09 1iel n GLY 263 Ca -0.05 -0.24 0.08 0.00 0.00 0.00 0.00 46.02 45.80 1iel n GLY 263 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1iel n ASP 264 N 4.16 5.37 -4.63 1.61 5.75 -1.26 -4.93 116.55 122.62 1iel n ASP 264 Ca 0.00 -2.74 -0.32 0.00 -0.01 0.00 0.00 54.79 51.72 1iel n ASP 264 Cb 0.00 -0.65 -0.10 0.00 -1.03 0.00 0.00 41.12 39.35 1iel n ASP 264 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 1iel s MET 265 N -2.40 2.63 -0.04 0.11 1.75 -0.27 -4.43 119.30 116.64 1iel s MET 265 Ca 0.54 -0.70 0.05 0.00 -1.25 0.00 0.00 55.69 54.33 1iel s MET 265 Cb 0.38 -2.56 -0.01 0.00 2.84 0.00 0.00 34.83 35.49 1iel s MET 265 CO 0.20 0.60 -0.20 0.71 -0.65 0.00 0.00 175.02 175.68 1iel s TYR 266 N -1.05 1.99 -0.19 4.11 1.51 0.12 -1.05 117.35 122.78 1iel s TYR 266 Ca 0.19 -0.55 -0.18 0.00 -1.01 0.00 0.00 57.07 55.52 1iel s TYR 266 Cb -0.11 -1.31 -0.03 0.00 -0.11 0.00 0.00 41.96 40.39 1iel s TYR 266 CO 0.09 -0.16 0.48 -1.14 -1.11 0.00 0.00 175.55 173.71 1iel s GLN 267 N -0.12 4.20 0.00 -0.62 2.00 -0.71 -0.27 119.66 124.14 1iel s GLN 267 Ca -0.02 0.36 0.00 0.00 -2.00 0.00 0.00 55.36 53.70 1iel s GLN 267 Cb -0.12 -3.54 0.00 0.00 0.80 0.00 0.00 33.01 30.15 1iel s GLN 267 CO 0.02 -0.09 0.00 0.41 -0.50 0.00 0.00 175.29 175.13 1iel n GLY 268 N 3.84 2.70 3.31 2.59 0.00 0.38 -1.89 105.19 116.13 1iel n GLY 268 Ca -0.06 -1.95 -0.46 0.00 0.00 0.00 0.00 46.02 43.55 1iel n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iel s LEU 269 N 0.00 6.26 0.00 0.99 1.43 -0.35 -4.59 118.68 122.42 1iel s LEU 269 Ca 0.00 -1.91 0.00 0.00 -1.03 0.00 0.00 54.13 51.19 1iel s LEU 269 Cb 0.00 -2.21 0.00 0.00 0.03 0.00 0.00 46.19 44.01 1iel s LEU 269 CO 0.00 -0.82 0.00 0.61 0.23 0.00 0.00 176.35 176.37 1iel n GLY 270 N 5.09 2.06 3.77 -3.19 0.00 -1.26 -4.27 105.19 107.38 1iel n GLY 270 Ca -0.10 -0.31 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 1iel n GLY 270 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1iel s TRP 271 N 0.00 2.66 0.13 1.61 0.52 -1.26 -4.69 118.94 117.91 1iel s TRP 271 Ca 0.00 1.51 0.09 0.00 0.02 0.00 0.00 56.10 57.72 1iel s TRP 271 Cb 0.00 -3.44 -0.04 0.00 -1.15 0.00 0.00 33.47 28.84 1iel s TRP 271 CO 0.00 -1.85 -0.17 -1.21 0.02 0.00 0.00 176.95 173.75 1iel s GLU 272 N -2.96 1.82 0.04 4.98 2.02 -0.99 -0.47 118.70 123.14 1iel s GLU 272 Ca 0.69 -1.22 -0.01 0.00 0.02 0.00 0.00 54.97 54.46 1iel s GLU 272 Cb -0.30 -2.11 -0.03 0.00 0.10 0.00 0.00 34.13 31.79 1iel s GLU 272 CO 0.35 0.47 -0.03 -1.64 0.02 0.00 0.00 175.26 174.42 1iel s MET 273 N -2.31 0.50 0.00 1.61 -1.94 0.62 -1.63 119.30 116.15 1iel s MET 273 Ca 0.20 -0.98 -0.06 0.00 -1.71 0.00 0.00 55.69 53.14 1iel s MET 273 Cb -0.10 0.16 -0.00 0.00 2.01 0.00 0.00 34.83 36.90 1iel s MET 273 CO 0.11 -0.08 0.10 -0.51 -0.01 0.00 0.00 175.02 174.63 1iel s LEU 274 N -2.35 1.69 0.38 -0.03 1.02 -0.52 0.14 118.68 119.02 1iel s LEU 274 Ca -0.02 -0.22 -0.27 0.00 0.02 0.00 0.00 54.13 53.63 1iel s LEU 274 Cb 0.01 0.53 -0.10 0.00 0.02 0.00 0.00 46.19 46.66 1iel s LEU 274 CO -0.06 -0.33 1.36 -1.81 0.02 0.00 0.00 176.35 175.53 1iel s ASP 275 N -1.26 6.40 -0.13 2.29 -0.00 -1.26 0.54 116.67 123.24 1iel s ASP 275 Ca -0.14 2.79 -0.06 0.00 -0.00 0.00 0.00 52.55 55.14 1iel s ASP 275 Cb -0.07 -2.65 -0.04 0.00 -0.00 0.00 0.00 42.92 40.16 1iel s ASP 275 CO 0.01 -0.81 0.10 0.86 -0.00 0.00 0.00 175.17 175.33 1iel s TRP 276 N -1.19 3.43 0.61 4.23 -0.11 0.02 -3.46 118.94 122.47 1iel s TRP 276 Ca 0.54 0.37 -0.17 0.00 1.22 0.00 0.00 56.10 58.06 1iel s TRP 276 Cb -0.41 -1.95 -0.03 0.00 -1.50 0.00 0.00 33.47 29.58 1iel s TRP 276 CO 0.54 0.54 1.13 -1.25 -4.62 0.00 0.00 176.95 173.29 1iel s PRO 277 N -0.62 3.04 0.24 5.86 0.04 -1.26 -4.77 135.00 137.53 1iel s PRO 277 Ca 0.12 1.52 0.08 0.00 0.04 0.00 0.00 61.00 62.76 1iel s PRO 277 Cb -0.12 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 1iel s PRO 277 CO 0.02 -1.08 0.05 0.54 0.04 0.00 0.00 177.00 176.58 1iel s VAL 278 N -2.04 3.81 -0.33 -0.36 0.11 -1.22 -5.07 120.40 115.30 1iel s VAL 278 Ca 0.70 -1.63 -0.24 0.00 -2.93 0.00 0.00 61.98 57.88 1iel s VAL 278 Cb -0.23 -3.01 0.00 0.00 -1.53 0.00 0.00 36.38 31.62 1iel s VAL 278 CO 0.35 -0.29 0.81 0.21 -3.33 0.00 0.00 175.10 172.84 1iel s ASN 279 N -3.52 6.64 0.23 3.54 3.84 -1.26 -4.94 114.94 119.46 1iel s ASN 279 Ca 0.31 0.58 -0.07 0.00 0.21 0.00 0.00 52.86 53.89 1iel s ASN 279 Cb -0.08 -2.41 0.36 0.00 -0.55 0.00 0.00 41.25 38.57 1iel s ASN 279 CO 0.21 -0.68 1.73 1.55 -2.79 0.00 0.00 177.10 177.13 1iel h PRO 280 N 8.25 0.41 -0.50 0.43 0.13 -2.01 0.27 132.00 138.98 1iel h PRO 280 Ca -0.24 -0.02 0.08 0.00 -0.87 0.00 0.00 66.00 64.94 1iel h PRO 280 Cb 1.09 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 32.10 1iel h PRO 280 CO 0.90 0.27 0.34 -0.44 -0.23 0.00 0.00 178.00 178.84 1iel h ASP 281 N 0.42 0.32 -0.39 1.44 3.32 -1.98 -0.62 116.42 118.92 1iel h ASP 281 Ca 0.36 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.31 1iel h ASP 281 Cb 0.50 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1iel h ASP 281 CO -0.36 0.20 -0.15 -1.28 -1.72 0.00 0.00 179.24 175.93 1iel h SER 282 N 0.36 0.80 0.91 6.45 0.87 -1.34 0.18 113.55 121.78 1iel h SER 282 Ca 0.23 -0.39 -0.23 0.00 -1.23 0.00 0.00 61.79 60.17 1iel h SER 282 Cb 0.43 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.15 1iel h SER 282 CO -0.06 1.01 -1.06 0.16 -0.53 0.00 0.00 176.83 176.36 1iel h ILE 283 N 0.59 1.66 0.37 2.23 3.07 -1.32 -1.76 117.51 122.37 1iel h ILE 283 Ca 0.09 -3.34 -0.02 0.00 1.55 0.00 0.00 64.86 63.15 1iel h ILE 283 Cb 0.69 2.88 0.00 0.00 -0.27 0.00 0.00 36.82 40.12 1iel h ILE 283 CO 0.05 0.96 -0.18 0.40 -1.05 0.00 0.00 178.15 178.33 1iel h ILE 284 N 0.02 0.49 -0.72 0.16 2.04 -1.11 -2.18 117.51 116.21 1iel h ILE 284 Ca -0.04 -0.63 -0.04 0.00 1.00 0.00 0.00 64.86 65.14 1iel h ILE 284 Cb 1.82 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 38.60 1iel h ILE 284 CO 0.15 0.09 0.27 0.78 0.00 0.00 0.00 178.15 179.44 1iel h ASN 285 N -0.93 0.98 0.27 1.72 -0.26 -1.09 -2.40 115.58 113.88 1iel h ASN 285 Ca -0.05 -0.15 -0.00 0.00 -0.56 0.00 0.00 56.30 55.54 1iel h ASN 285 Cb 0.54 -0.26 -0.00 0.00 -1.06 0.00 0.00 38.32 37.54 1iel h ASN 285 CO 0.08 0.88 -0.00 1.23 -1.06 0.00 0.00 177.43 178.57 1iel h GLY 286 N 1.10 0.00 1.57 2.83 0.00 -1.28 -1.47 103.07 105.82 1iel h GLY 286 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.57 1iel h GLY 286 CO -0.02 0.00 -0.24 -1.14 0.00 0.00 0.00 176.54 175.15 1iel n SER 287 N -3.12 0.34 -4.77 0.19 3.41 -0.83 -3.16 113.62 105.69 1iel n SER 287 Ca -0.02 0.22 -0.41 0.00 -0.26 0.00 0.00 58.87 58.40 1iel n SER 287 Cb 0.13 -0.21 -0.02 0.00 -0.26 0.00 0.00 64.21 63.85 1iel n SER 287 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1iel s ASP 288 N -3.32 6.83 0.54 4.04 -1.08 -0.56 -4.62 116.67 118.50 1iel s ASP 288 Ca 0.12 2.64 0.21 0.00 -0.52 0.00 0.00 52.55 54.99 1iel s ASP 288 Cb 0.17 -2.65 1.41 0.00 -1.46 0.00 0.00 42.92 40.40 1iel s ASP 288 CO 0.62 -0.49 2.14 0.78 0.52 0.00 0.00 175.17 178.74 1iel h ASN 289 N 3.47 0.00 0.50 -0.34 -0.26 -1.88 0.40 115.58 117.47 1iel h ASN 289 Ca -0.49 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.25 1iel h ASN 289 Cb 1.22 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.48 1iel h ASN 289 CO 0.66 0.00 0.00 0.07 -1.06 0.00 0.00 177.43 177.10 1iel h LYS 290 N 0.00 0.00 0.00 0.81 2.10 -1.93 -1.61 116.57 115.94 1iel h LYS 290 Ca 0.04 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.63 1iel h LYS 290 Cb 0.19 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.51 1iel h LYS 290 CO -0.00 0.00 -1.03 -0.89 -2.00 0.00 0.00 179.45 175.53 1iel n ILE 291 N -3.03 1.41 0.03 0.07 5.41 -0.52 -4.17 119.36 118.55 1iel n ILE 291 Ca -0.01 0.11 0.20 0.00 1.00 0.00 0.00 62.75 64.05 1iel n ILE 291 Cb 0.18 -2.13 0.70 0.00 -0.71 0.00 0.00 39.64 37.69 1iel n ILE 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1iel h ALA 292 N -0.79 2.41 -0.02 -1.39 0.00 -0.92 -0.45 119.26 118.10 1iel h ALA 292 Ca -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1iel h ALA 292 Cb 0.91 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1iel h ALA 292 CO -0.06 -0.62 -0.18 1.28 0.00 0.00 0.00 179.25 179.67 1iel n LEU 293 N -4.28 2.33 -4.81 0.00 4.77 -0.61 -4.48 117.00 109.92 1iel n LEU 293 Ca 0.09 -0.80 -0.35 0.00 -0.03 0.00 0.00 56.01 54.93 1iel n LEU 293 Cb 0.58 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.59 1iel n LEU 293 CO 0.35 0.40 0.62 0.00 -1.33 0.00 0.00 177.39 177.44 1iel s ALA 294 N -2.21 3.14 0.35 -1.18 0.00 -0.18 -4.69 121.76 116.99 1iel s ALA 294 Ca 0.26 0.41 -0.27 0.00 0.00 0.00 0.00 51.96 52.35 1iel s ALA 294 Cb 0.19 -3.12 -0.09 0.00 0.00 0.00 0.00 23.12 20.10 1iel s ALA 294 CO 0.42 0.17 1.21 0.00 0.00 0.00 0.00 175.76 177.56 1iel s ALA 295 N -1.93 3.34 -0.06 0.00 0.00 -1.26 -4.71 121.76 117.14 1iel s ALA 295 Ca 0.56 1.07 -0.05 0.00 0.00 0.00 0.00 51.96 53.55 1iel s ALA 295 Cb -0.13 -3.41 0.02 0.00 0.00 0.00 0.00 23.12 19.60 1iel s ALA 295 CO 0.18 -0.50 0.15 1.03 0.00 0.00 0.00 175.76 176.62 1iel s ARG 296 N -1.93 0.16 0.44 0.00 0.52 -0.52 -4.96 118.95 112.66 1iel s ARG 296 Ca 0.51 0.26 -0.25 0.00 -0.52 0.00 0.00 55.73 55.74 1iel s ARG 296 Cb -0.35 0.01 -0.08 0.00 0.52 0.00 0.00 34.95 35.06 1iel s ARG 296 CO 0.45 -0.06 1.31 -1.25 0.02 0.00 0.00 175.30 175.76 1iel s PRO 297 N 0.40 3.79 0.17 3.54 0.04 -1.26 -0.52 135.00 141.16 1iel s PRO 297 Ca -0.03 2.15 0.11 0.00 0.04 0.00 0.00 61.00 63.27 1iel s PRO 297 Cb -0.04 -2.63 -0.04 0.00 0.04 0.00 0.00 34.50 31.83 1iel s PRO 297 CO -0.02 -0.63 -0.24 0.14 0.04 0.00 0.00 177.00 176.29 1iel s VAL 298 N -1.30 2.37 -0.16 -0.36 -7.23 -0.89 -4.64 120.40 108.19 1iel s VAL 298 Ca 0.60 -1.93 -0.03 0.00 -1.81 0.00 0.00 61.98 58.81 1iel s VAL 298 Cb -0.38 -2.11 -0.02 0.00 0.56 0.00 0.00 36.38 34.43 1iel s VAL 298 CO 0.48 -0.05 -0.06 -1.59 -0.31 0.00 0.00 175.10 173.57 1iel s LYS 299 N -2.49 3.57 0.27 4.82 0.00 -0.63 -4.86 119.74 120.42 1iel s LYS 299 Ca 0.19 -0.57 -0.29 0.00 0.00 0.00 0.00 55.97 55.29 1iel s LYS 299 Cb -0.09 -2.88 -0.10 0.00 0.00 0.00 0.00 37.83 34.77 1iel s LYS 299 CO 0.09 0.16 1.35 0.00 0.00 0.00 0.00 175.35 176.95 1iel s ALA 300 N 0.55 3.55 -0.48 0.59 0.00 -1.26 -1.76 121.76 122.95 1iel s ALA 300 Ca -0.04 1.25 -0.10 0.00 0.00 0.00 0.00 51.96 53.06 1iel s ALA 300 Cb -0.15 -3.50 0.12 0.00 0.00 0.00 0.00 23.12 19.59 1iel s ALA 300 CO 0.03 -0.65 0.37 0.42 0.00 0.00 0.00 175.76 175.93 1iel s ILE 301 N -0.48 4.40 -0.32 0.00 1.01 -0.85 -4.92 121.20 120.04 1iel s ILE 301 Ca 0.54 -1.70 -0.01 0.00 0.00 0.00 0.00 60.65 59.48 1iel s ILE 301 Cb -0.40 -3.87 0.07 0.00 0.01 0.00 0.00 42.46 38.28 1iel s ILE 301 CO 0.46 -0.77 0.03 0.42 0.00 0.00 0.00 174.94 175.08 1iel s THR 302 N 1.41 2.87 0.72 2.92 -4.23 -1.26 -1.75 115.64 116.32 1iel s THR 302 Ca 0.05 -1.64 -0.05 0.00 -1.18 0.00 0.00 61.69 58.87 1iel s THR 302 Cb -0.27 -2.76 0.09 0.00 1.34 0.00 0.00 72.50 70.90 1iel s THR 302 CO 0.00 -0.26 1.01 -2.16 -0.54 0.00 0.00 174.62 172.68 1iel s PRO 303 N 1.18 1.93 0.28 3.99 0.04 -1.26 -5.10 135.00 136.05 1iel s PRO 303 Ca -0.02 -0.55 -0.30 0.00 0.04 0.00 0.00 61.00 60.18 1iel s PRO 303 Cb -0.20 -2.21 -0.12 0.00 0.04 0.00 0.00 34.50 32.00 1iel s PRO 303 CO -0.03 -1.36 1.46 -2.30 0.04 0.00 0.00 177.00 174.82 1iel n PRO 304 N -2.92 2.32 -2.58 0.56 -0.02 -0.72 -4.94 135.00 126.70 1iel n PRO 304 Ca 0.10 0.82 -0.42 0.00 -2.02 0.00 0.00 63.50 61.99 1iel n PRO 304 Cb 0.60 -2.52 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 1iel n PRO 304 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1iel s THR 305 N -0.24 4.41 0.74 3.45 2.01 -1.06 -4.81 115.64 120.13 1iel s THR 305 Ca 0.64 1.78 -0.15 0.00 0.31 0.00 0.00 61.69 64.27 1iel s THR 305 Cb -0.57 -4.14 0.04 0.00 0.01 0.00 0.00 72.50 67.84 1iel s THR 305 CO 0.52 0.17 1.23 -2.84 -0.69 0.00 0.00 174.62 173.01 1iel s PRO 306 N 0.80 2.06 -0.24 4.92 0.02 -1.26 -0.71 135.00 140.59 1iel s PRO 306 Ca 0.54 1.85 -0.43 0.00 0.02 0.00 0.00 61.00 62.97 1iel s PRO 306 Cb -0.25 -1.81 -0.20 0.00 0.02 0.00 0.00 34.50 32.25 1iel s PRO 306 CO 0.29 -1.92 1.34 0.00 -0.33 0.00 0.00 177.00 176.38 1iel n ALA 307 N -2.71 -2.47 -2.58 -1.55 0.00 -1.25 -4.72 120.51 105.23 1iel n ALA 307 Ca 0.14 0.55 -0.41 0.00 0.00 0.00 0.00 53.44 53.72 1iel n ALA 307 Cb 0.50 -1.85 -0.08 0.00 0.00 0.00 0.00 19.45 18.02 1iel n ALA 307 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1iel s VAL 308 N 1.50 5.05 0.21 0.00 1.01 -1.26 -4.98 120.40 121.94 1iel s VAL 308 Ca 0.98 0.55 -0.09 0.00 0.00 0.00 0.00 61.98 63.42 1iel s VAL 308 Cb -1.37 -3.89 0.15 0.00 0.00 0.00 0.00 36.38 31.27 1iel s VAL 308 CO 0.69 -0.07 1.80 0.03 0.00 0.00 0.00 175.10 177.55 1iel h ARG 309 N 8.28 0.63 -3.80 2.72 3.08 -1.97 -3.16 114.38 120.16 1iel h ARG 309 Ca -0.29 -0.04 -0.72 0.00 0.07 0.00 0.00 59.98 59.01 1iel h ARG 309 Cb 1.13 -0.14 -0.07 0.00 0.08 0.00 0.00 29.97 30.98 1iel h ARG 309 CO 0.74 0.42 2.89 0.00 -1.07 0.00 0.00 179.97 182.95 1iel n ALA 310 N -2.37 5.63 -2.62 0.04 0.00 -1.26 -1.21 120.51 118.72 1iel n ALA 310 Ca 0.09 -3.97 -0.13 0.00 0.00 0.00 0.00 53.44 49.43 1iel n ALA 310 Cb 0.21 -3.38 -0.11 0.00 0.00 0.00 0.00 19.45 16.17 1iel n ALA 310 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1iel s SER 311 N 2.52 1.07 -0.32 0.00 0.01 -1.20 -0.80 113.70 114.99 1iel s SER 311 Ca 0.46 -0.71 -0.14 0.00 1.31 0.00 0.00 55.95 56.88 1iel s SER 311 Cb 0.13 0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.38 1iel s SER 311 CO -0.07 -0.27 0.33 0.86 0.41 0.00 0.00 173.24 174.50 1iel s TRP 312 N -2.08 3.22 -0.14 2.43 -0.11 0.19 -4.09 118.94 118.36 1iel s TRP 312 Ca -0.02 0.07 -0.01 0.00 1.22 0.00 0.00 56.10 57.36 1iel s TRP 312 Cb -0.05 -2.59 -0.02 0.00 -1.50 0.00 0.00 33.47 29.31 1iel s TRP 312 CO -0.01 -0.34 -0.11 0.08 -4.62 0.00 0.00 176.95 171.95 1iel s VAL 313 N 1.96 3.23 0.32 5.86 1.01 0.45 -1.44 120.40 131.80 1iel s VAL 313 Ca 0.11 -0.60 -0.18 0.00 0.00 0.00 0.00 61.98 61.32 1iel s VAL 313 Cb -0.16 -2.37 0.03 0.00 0.00 0.00 0.00 36.38 33.88 1iel s VAL 313 CO 0.11 0.52 0.73 -1.38 0.00 0.00 0.00 175.10 175.07 1iel s HIS 314 N 0.36 0.01 -0.28 5.22 -3.43 -0.65 -0.12 115.29 116.41 1iel s HIS 314 Ca -0.09 -0.55 -0.18 0.00 -0.80 0.00 0.00 55.06 53.44 1iel s HIS 314 Cb -0.16 0.71 0.11 0.00 -1.43 0.00 0.00 32.58 31.81 1iel s HIS 314 CO 0.05 -1.36 0.86 0.21 -2.00 0.00 0.00 174.74 172.51 1iel s LYS 315 N -3.24 0.54 0.40 -0.38 2.47 -0.60 -2.35 119.74 116.58 1iel s LYS 315 Ca 0.14 0.88 0.01 0.00 -1.56 0.00 0.00 55.97 55.44 1iel s LYS 315 Cb -0.05 0.14 -0.01 0.00 -1.46 0.00 0.00 37.83 36.44 1iel s LYS 315 CO 0.09 -0.10 0.61 0.95 0.16 0.00 0.00 175.35 177.06 1iel s THR 316 N 1.26 4.41 -0.20 3.43 -4.23 -1.26 -2.52 115.64 116.53 1iel s THR 316 Ca -0.07 -0.53 -0.29 0.00 -1.18 0.00 0.00 61.69 59.62 1iel s THR 316 Cb -0.04 -3.61 0.14 0.00 1.34 0.00 0.00 72.50 70.32 1iel s THR 316 CO -0.15 -0.40 1.08 -0.83 -0.54 0.00 0.00 174.62 173.78 1iel s GLY 317 N -4.15 -0.17 0.08 3.99 0.00 -1.00 -3.58 107.32 102.50 1iel s GLY 317 Ca 0.45 2.29 -0.26 0.00 0.00 0.00 0.00 44.72 47.21 1iel s GLY 317 CO 0.37 1.15 0.69 0.00 0.00 0.00 0.00 173.10 175.30 1iel s ALA 318 N -0.93 -1.69 0.24 3.20 0.00 -1.26 -0.68 121.76 120.65 1iel s ALA 318 Ca 0.01 0.77 0.02 0.00 0.00 0.00 0.00 51.96 52.76 1iel s ALA 318 Cb -0.01 0.59 -0.01 0.00 0.00 0.00 0.00 23.12 23.69 1iel s ALA 318 CO -0.01 -0.67 0.08 0.25 0.00 0.00 0.00 175.76 175.40 1iel n THR 319 N -0.12 0.00 -0.18 0.00 -2.24 -0.60 -4.15 114.28 106.99 1iel n THR 319 Ca -0.15 -1.37 0.11 0.00 -2.27 0.00 0.00 64.05 60.37 1iel n THR 319 Cb 0.63 0.47 0.43 0.00 -2.10 0.00 0.00 70.33 69.76 1iel n THR 319 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1iel h GLY 320 N 0.91 0.89 -0.21 3.38 0.00 -1.97 -3.16 103.07 102.91 1iel h GLY 320 Ca -0.19 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1iel h GLY 320 CO 0.30 0.12 0.00 0.61 0.00 0.00 0.00 176.54 177.57 1iel n GLY 321 N -1.48 3.60 3.02 4.60 0.00 -1.26 -4.49 105.19 109.17 1iel n GLY 321 Ca 0.13 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 1iel n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1iel s PHE 322 N -1.66 0.43 -0.05 1.61 0.40 -1.19 -1.41 117.98 116.11 1iel s PHE 322 Ca 0.14 -0.56 -0.00 0.00 -0.60 0.00 0.00 56.93 55.91 1iel s PHE 322 Cb 0.11 -0.28 0.02 0.00 0.51 0.00 0.00 43.02 43.39 1iel s PHE 322 CO 0.03 -0.16 -0.02 0.20 0.70 0.00 0.00 175.22 175.97 1iel s GLY 323 N -1.62 0.44 0.11 4.36 0.00 -0.21 -1.55 107.32 108.84 1iel s GLY 323 Ca -0.12 -0.06 0.02 0.00 0.00 0.00 0.00 44.72 44.57 1iel s GLY 323 CO -0.01 0.74 -0.08 -1.35 0.00 0.00 0.00 173.10 172.41 1iel s SER 324 N 1.36 1.28 -0.20 1.64 1.04 0.15 -1.30 113.70 117.67 1iel s SER 324 Ca -0.04 -0.97 -0.23 0.00 0.48 0.00 0.00 55.95 55.18 1iel s SER 324 Cb -0.13 0.06 0.06 0.00 0.10 0.00 0.00 66.02 66.11 1iel s SER 324 CO -0.02 -0.41 0.63 -0.47 0.98 0.00 0.00 173.24 173.95 1iel s TYR 325 N -3.37 -0.68 -0.02 5.02 5.04 -0.28 -2.38 117.35 120.68 1iel s TYR 325 Ca 0.11 1.57 0.00 0.00 -2.44 0.00 0.00 57.07 56.32 1iel s TYR 325 Cb 0.03 0.26 0.03 0.00 0.35 0.00 0.00 41.96 42.63 1iel s TYR 325 CO -0.03 -0.38 0.02 0.08 -1.34 0.00 0.00 175.55 173.90 1iel s VAL 326 N 0.04 -0.02 -0.03 3.14 1.01 -1.05 -0.44 120.40 123.05 1iel s VAL 326 Ca -0.02 0.19 -0.05 0.00 0.00 0.00 0.00 61.98 62.11 1iel s VAL 326 Cb -0.04 -0.11 0.01 0.00 0.00 0.00 0.00 36.38 36.24 1iel s VAL 326 CO 0.02 0.10 0.11 0.00 0.00 0.00 0.00 175.10 175.33 1iel s ALA 327 N 1.04 -0.27 0.06 5.51 0.00 -0.86 -1.55 121.76 125.69 1iel s ALA 327 Ca -0.09 0.16 -0.15 0.00 0.00 0.00 0.00 51.96 51.87 1iel s ALA 327 Cb -0.13 -0.10 0.03 0.00 0.00 0.00 0.00 23.12 22.92 1iel s ALA 327 CO -0.03 -0.10 0.35 -0.59 0.00 0.00 0.00 175.76 175.39 1iel s PHE 328 N -0.40 -0.17 -0.31 0.00 -0.12 0.83 -0.88 117.98 116.94 1iel s PHE 328 Ca -0.05 0.02 0.02 0.00 -0.05 0.00 0.00 56.93 56.87 1iel s PHE 328 Cb -0.03 0.16 0.09 0.00 -0.63 0.00 0.00 43.02 42.61 1iel s PHE 328 CO 0.00 -0.56 0.04 0.42 -0.05 0.00 0.00 175.22 175.07 1iel s ILE 329 N -2.80 1.61 0.16 -4.49 1.01 0.91 -0.41 121.20 117.19 1iel s ILE 329 Ca -0.03 -1.76 -0.20 0.00 0.00 0.00 0.00 60.65 58.66 1iel s ILE 329 Cb -0.00 -2.13 0.05 0.00 0.01 0.00 0.00 42.46 40.40 1iel s ILE 329 CO -0.05 -0.51 1.65 -0.65 0.00 0.00 0.00 174.94 175.38 1iel h PRO 330 N 7.86 -0.14 0.00 2.79 0.11 -1.70 -1.28 132.00 139.64 1iel h PRO 330 Ca -0.11 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1iel h PRO 330 Cb 1.03 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1iel h PRO 330 CO 0.48 -0.09 0.15 1.49 -0.21 0.00 0.00 178.00 179.82 1iel h GLU 331 N -0.14 0.00 -0.01 1.05 4.81 -1.49 -2.01 114.58 116.80 1iel h GLU 331 Ca 0.16 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1iel h GLU 331 Cb 0.38 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.76 1iel h GLU 331 CO -0.39 0.00 -0.20 1.63 -0.73 0.00 0.00 179.01 179.32 1iel n LYS 332 N -2.75 2.04 -3.73 1.92 5.02 -0.56 -4.99 118.16 115.11 1iel n LYS 332 Ca -0.02 -0.61 -0.25 0.00 -2.02 0.00 0.00 58.31 55.41 1iel n LYS 332 Cb 0.20 -1.08 0.04 0.00 -0.02 0.00 0.00 35.03 34.17 1iel n LYS 332 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1iel n GLU 333 N -0.23 -5.82 -4.64 1.97 1.02 -0.73 -4.51 120.64 107.70 1iel n GLU 333 Ca 0.04 0.67 -0.23 0.00 -0.02 0.00 0.00 57.16 57.62 1iel n GLU 333 Cb 0.21 -5.48 -0.15 0.00 -0.02 0.00 0.00 31.44 25.99 1iel n GLU 333 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1iel s LEU 334 N -6.97 1.92 0.24 -4.62 2.96 -1.12 -1.91 118.68 109.19 1iel s LEU 334 Ca 0.34 -0.27 -0.22 0.00 -0.22 0.00 0.00 54.13 53.76 1iel s LEU 334 Cb -0.16 -0.75 0.03 0.00 0.50 0.00 0.00 46.19 45.81 1iel s LEU 334 CO 0.80 0.14 0.79 -0.83 -1.32 0.00 0.00 176.35 175.92 1iel s GLY 335 N -0.07 -0.15 -0.08 7.98 0.00 -0.81 -0.06 107.32 114.14 1iel s GLY 335 Ca 0.00 -0.16 -0.17 0.00 0.00 0.00 0.00 44.72 44.39 1iel s GLY 335 CO 0.01 -0.05 0.41 -1.50 0.00 0.00 0.00 173.10 171.97 1iel s ILE 336 N -3.73 0.03 -0.07 0.90 2.07 -0.06 -0.58 121.20 119.76 1iel s ILE 336 Ca 0.11 -0.22 0.02 0.00 -1.41 0.00 0.00 60.65 59.15 1iel s ILE 336 Cb -0.05 -0.67 0.01 0.00 0.13 0.00 0.00 42.46 41.89 1iel s ILE 336 CO 0.05 -0.12 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.15 1iel s VAL 337 N -0.72 1.14 -0.17 4.00 1.01 -0.11 -2.03 120.40 123.52 1iel s VAL 337 Ca -0.08 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.42 1iel s VAL 337 Cb -0.04 -1.04 0.04 0.00 0.00 0.00 0.00 36.38 35.34 1iel s VAL 337 CO 0.04 0.36 -0.09 -0.04 0.00 0.00 0.00 175.10 175.36 1iel s MET 338 N 0.68 1.85 -0.14 2.72 -1.94 0.42 -1.46 119.30 121.42 1iel s MET 338 Ca -0.14 -0.64 0.02 0.00 -1.71 0.00 0.00 55.69 53.22 1iel s MET 338 Cb -0.16 -2.16 0.01 0.00 2.01 0.00 0.00 34.83 34.53 1iel s MET 338 CO 0.04 -0.38 -0.19 -0.51 -0.01 0.00 0.00 175.02 173.97 1iel s LEU 339 N 1.51 1.97 0.01 -0.03 1.43 -0.44 -1.13 118.68 122.01 1iel s LEU 339 Ca 0.01 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.59 1iel s LEU 339 Cb -0.15 -1.33 -0.01 0.00 0.03 0.00 0.00 46.19 44.72 1iel s LEU 339 CO -0.09 0.04 -0.11 0.00 0.23 0.00 0.00 176.35 176.42 1iel s ALA 340 N 1.01 0.88 -0.56 4.21 0.00 -0.42 -1.13 121.76 125.75 1iel s ALA 340 Ca -0.04 -0.56 -0.03 0.00 0.00 0.00 0.00 51.96 51.34 1iel s ALA 340 Cb -0.15 -0.18 0.15 0.00 0.00 0.00 0.00 23.12 22.95 1iel s ALA 340 CO -0.05 0.19 2.54 0.27 0.00 0.00 0.00 175.76 178.71 1iel n ASN 341 N 2.47 6.77 -3.64 0.00 6.94 -1.00 -1.04 115.26 125.76 1iel n ASN 341 Ca -0.15 -3.38 -0.09 0.00 -0.02 0.00 0.00 54.58 50.94 1iel n ASN 341 Cb 0.56 -1.18 -0.07 0.00 -2.36 0.00 0.00 39.78 36.73 1iel n ASN 341 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1iel s LYS 342 N -2.38 0.64 -0.38 -3.83 2.20 -0.50 -1.76 119.74 113.73 1iel s LYS 342 Ca 0.56 0.91 -0.25 0.00 -0.36 0.00 0.00 55.97 56.83 1iel s LYS 342 Cb 0.40 0.23 0.02 0.00 -1.51 0.00 0.00 37.83 36.96 1iel s LYS 342 CO -0.26 -0.10 0.91 1.21 -0.36 0.00 0.00 175.35 176.74 1iel s ASN 343 N 0.90 6.64 0.19 1.43 3.84 -1.26 -2.21 114.94 124.47 1iel s ASN 343 Ca -0.04 0.49 0.08 0.00 0.21 0.00 0.00 52.86 53.59 1iel s ASN 343 Cb -0.05 -2.45 -0.04 0.00 -0.55 0.00 0.00 41.25 38.15 1iel s ASN 343 CO -0.10 -0.87 -0.15 -0.72 -2.79 0.00 0.00 177.10 172.48 1iel s TYR 344 N 3.46 1.67 -0.04 0.43 1.13 -1.26 -4.94 117.35 117.80 1iel s TYR 344 Ca 0.37 -0.56 -0.40 0.00 -1.41 0.00 0.00 57.07 55.07 1iel s TYR 344 Cb -0.12 -0.80 -0.19 0.00 -1.10 0.00 0.00 41.96 39.76 1iel s TYR 344 CO 0.19 0.32 1.24 -2.30 -2.51 0.00 0.00 175.55 172.50 1iel n PRO 345 N -0.17 0.41 -0.25 -3.49 -0.02 -1.26 -4.91 135.00 125.31 1iel n PRO 345 Ca -0.10 0.15 0.02 0.00 -2.02 0.00 0.00 63.50 61.56 1iel n PRO 345 Cb 0.59 -1.70 0.15 0.00 -0.02 0.00 0.00 33.50 32.52 1iel n PRO 345 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1iel h ASN 346 N 3.92 0.40 -0.65 2.55 2.35 -1.98 -1.99 115.58 120.18 1iel h ASN 346 Ca -0.49 0.07 0.07 0.00 -0.55 0.00 0.00 56.30 55.41 1iel h ASN 346 Cb 1.39 0.01 -0.04 0.00 0.05 0.00 0.00 38.32 39.73 1iel h ASN 346 CO 0.74 0.21 0.43 -0.65 -1.65 0.00 0.00 177.43 176.51 1iel h PRO 347 N 0.55 0.57 -0.52 0.81 0.11 -1.82 -0.12 132.00 131.58 1iel h PRO 347 Ca 0.37 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.37 1iel h PRO 347 Cb 0.44 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 1iel h PRO 347 CO -0.31 0.38 0.03 0.00 -0.21 0.00 0.00 178.00 177.89 1iel h ALA 348 N 1.66 1.06 0.05 -0.75 0.00 -1.73 -0.94 119.26 118.61 1iel h ALA 348 Ca 0.29 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1iel h ALA 348 Cb 0.36 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1iel h ALA 348 CO -0.09 0.59 -0.03 0.00 0.00 0.00 0.00 179.25 179.73 1iel h ARG 349 N 0.81 -0.07 -0.90 0.00 3.08 -1.00 -2.52 114.38 113.79 1iel h ARG 349 Ca 0.16 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.23 1iel h ARG 349 Cb 0.45 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.47 1iel h ARG 349 CO 0.02 0.35 0.59 0.28 -1.07 0.00 0.00 179.97 180.13 1iel h VAL 350 N -0.51 1.20 -0.42 2.04 2.07 -1.15 -0.70 116.25 118.79 1iel h VAL 350 Ca -0.01 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 1iel h VAL 350 Cb 0.45 -0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 1iel h VAL 350 CO 0.01 0.22 0.12 -0.78 0.02 0.00 0.00 177.57 177.15 1iel h ASP 351 N 1.18 0.62 -0.69 0.57 3.58 -1.19 -0.41 116.42 120.09 1iel h ASP 351 Ca 0.34 -0.22 -0.05 0.00 0.42 0.00 0.00 57.03 57.52 1iel h ASP 351 Cb -0.09 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 40.77 1iel h ASP 351 CO -0.09 0.67 0.23 0.00 -2.88 0.00 0.00 179.24 177.18 1iel h ALA 352 N 0.97 1.08 -0.44 -0.78 0.00 -1.18 -1.75 119.26 117.16 1iel h ALA 352 Ca 0.13 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1iel h ALA 352 Cb 0.29 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1iel h ALA 352 CO -0.00 0.63 -0.07 0.00 0.00 0.00 0.00 179.25 179.81 1iel h ALA 353 N 1.21 0.60 -0.55 0.00 0.00 -0.76 -2.19 119.26 117.57 1iel h ALA 353 Ca 0.23 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1iel h ALA 353 Cb 0.27 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1iel h ALA 353 CO -0.01 0.45 -0.07 2.35 0.00 0.00 0.00 179.25 181.98 1iel h TRP 354 N 0.65 1.09 -0.93 0.00 7.01 -0.94 -0.19 115.95 122.65 1iel h TRP 354 Ca 0.12 -0.20 0.02 0.00 2.11 0.00 0.00 58.89 60.93 1iel h TRP 354 Cb 0.59 -0.28 -0.05 0.00 -2.10 0.00 0.00 29.16 27.32 1iel h TRP 354 CO 0.05 1.00 0.61 1.96 -2.79 0.00 0.00 178.44 179.26 1iel h GLN 355 N 0.89 1.19 0.05 2.65 4.20 -1.19 0.21 115.11 123.11 1iel h GLN 355 Ca 0.15 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 1iel h GLN 355 Cb 0.61 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1iel h GLN 355 CO 0.04 0.79 -0.02 0.82 -0.67 0.00 0.00 178.83 179.79 1iel h ILE 356 N 1.23 1.30 -0.14 2.54 2.04 -0.92 -2.63 117.51 120.93 1iel h ILE 356 Ca 0.35 -1.22 -0.10 0.00 1.00 0.00 0.00 64.86 64.89 1iel h ILE 356 Cb -0.10 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 1iel h ILE 356 CO -0.09 0.30 -0.35 -0.07 0.00 0.00 0.00 178.15 177.94 1iel h LEU 357 N -0.61 0.30 -0.98 1.44 3.38 -0.95 -2.56 115.31 115.33 1iel h LEU 357 Ca -0.01 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 1iel h LEU 357 Cb 0.54 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1iel h LEU 357 CO 0.01 0.64 -0.38 -1.13 0.09 0.00 0.00 178.44 177.67 1iel h ASN 358 N 0.25 0.26 0.87 -0.43 -1.24 -0.66 -0.41 115.58 114.22 1iel h ASN 358 Ca 0.03 -0.10 -0.07 0.00 0.71 0.00 0.00 56.30 56.87 1iel h ASN 358 Cb 0.75 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.71 1iel h ASN 358 CO 0.06 0.63 -0.33 0.00 -1.29 0.00 0.00 177.43 176.49 1iel h ALA 359 N 1.39 1.01 -0.00 1.57 0.00 -1.08 -2.95 119.26 119.20 1iel h ALA 359 Ca 0.02 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1iel h ALA 359 Cb 0.77 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1iel h ALA 359 CO 0.06 0.42 -0.81 1.28 0.00 0.00 0.00 179.25 180.20 1iel n LEU 360 N -3.50 0.81 0.00 0.00 4.77 -0.92 -5.11 117.00 113.05 1iel n LEU 360 Ca -0.00 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 1iel n LEU 360 Cb 0.49 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1iel n LEU 360 CO 0.36 0.20 0.00 0.00 -1.33 0.00 0.00 177.39 176.62