#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1llb n PRO 5 N 0.00 2.17 -0.17 0.00 -0.02 -1.26 -4.71 135.00 131.01 1llb n PRO 5 Ca 0.00 0.76 0.22 0.00 -2.02 0.00 0.00 63.50 62.46 1llb n PRO 5 Cb 0.00 -2.36 0.61 0.00 -0.02 0.00 0.00 33.50 31.73 1llb n PRO 5 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1llb h GLN 6 N 2.71 0.21 -0.40 -0.52 4.15 -2.05 -1.21 115.11 117.99 1llb h GLN 6 Ca -0.46 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 58.93 1llb h GLN 6 Cb 1.28 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.90 1llb h GLN 6 CO 0.64 0.14 0.20 0.37 -1.93 0.00 0.00 178.83 178.24 1llb h GLN 7 N 0.21 0.58 -0.10 1.69 4.15 -1.99 0.12 115.11 119.77 1llb h GLN 7 Ca 0.41 -0.08 -0.03 0.00 0.77 0.00 0.00 58.65 59.71 1llb h GLN 7 Cb 1.27 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.85 1llb h GLN 7 CO -0.09 0.50 -0.05 0.82 -1.93 0.00 0.00 178.83 178.09 1llb h ILE 8 N 0.51 1.32 -0.10 2.39 2.04 -1.64 -1.45 117.51 120.59 1llb h ILE 8 Ca 0.14 -1.07 0.04 0.00 1.00 0.00 0.00 64.86 64.97 1llb h ILE 8 Cb 0.11 1.81 -0.06 0.00 -0.74 0.00 0.00 36.82 37.95 1llb h ILE 8 CO -0.02 0.30 -0.39 -1.13 0.00 0.00 0.00 178.15 176.92 1llb h ASN 9 N -0.14 -1.21 -0.25 1.72 -0.73 -1.04 -0.88 115.58 113.05 1llb h ASN 9 Ca 0.02 0.16 0.02 0.00 1.87 0.00 0.00 56.30 58.37 1llb h ASN 9 Cb 0.50 0.49 -0.02 0.00 0.27 0.00 0.00 38.32 39.56 1llb h ASN 9 CO 0.02 -0.41 0.11 0.44 -0.37 0.00 0.00 177.43 177.21 1llb h ASP 10 N -0.48 0.16 -0.59 1.15 3.45 -0.72 0.09 116.42 119.47 1llb h ASP 10 Ca 0.08 0.01 -0.06 0.00 0.43 0.00 0.00 57.03 57.49 1llb h ASP 10 Cb 0.61 -0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 39.34 1llb h ASP 10 CO -0.37 0.12 0.12 -0.29 -1.57 0.00 0.00 179.24 177.26 1llb h ILE 11 N 0.24 1.25 0.17 0.35 6.09 -1.07 0.18 117.51 124.71 1llb h ILE 11 Ca 0.10 -0.95 -0.01 0.00 -1.37 0.00 0.00 64.86 62.64 1llb h ILE 11 Cb 0.04 0.72 0.00 0.00 0.47 0.00 0.00 36.82 38.06 1llb h ILE 11 CO -0.08 0.35 -0.08 0.58 -3.07 0.00 0.00 178.15 175.85 1llb h VAL 12 N 0.87 0.90 -0.72 2.19 2.07 -0.97 -2.13 116.25 118.47 1llb h VAL 12 Ca 0.18 -0.29 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 1llb h VAL 12 Cb 0.38 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1llb h VAL 12 CO 0.01 0.07 0.23 0.45 0.02 0.00 0.00 177.57 178.35 1llb h HIS 13 N -0.36 1.16 0.00 1.57 3.86 -0.86 0.88 115.15 121.40 1llb h HIS 13 Ca -0.02 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 59.07 1llb h HIS 13 Cb 0.28 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.42 1llb h HIS 13 CO -0.02 0.91 0.00 0.00 0.86 0.00 0.00 177.93 179.68 1llb h ARG 14 N 1.07 0.00 0.02 2.45 3.08 -0.63 -2.26 114.38 118.11 1llb h ARG 14 Ca 0.23 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.91 1llb h ARG 14 Cb 0.29 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 1llb h ARG 14 CO -0.01 0.00 -2.10 2.41 -1.07 0.00 0.00 179.97 179.20 1llb n THR 15 N -3.07 1.57 0.05 2.04 -1.04 -0.80 -4.52 114.28 108.51 1llb n THR 15 Ca -0.00 -0.38 -0.14 0.00 -2.04 0.00 0.00 64.05 61.48 1llb n THR 15 Cb 0.24 -1.79 -0.04 0.00 -1.82 0.00 0.00 70.33 66.92 1llb n THR 15 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1llb h ILE 16 N -0.58 1.37 -0.11 12.58 1.08 -0.86 -3.16 117.51 127.83 1llb h ILE 16 Ca -0.53 -2.31 0.04 0.00 -0.39 0.00 0.00 64.86 61.67 1llb h ILE 16 Cb 1.68 2.30 -0.04 0.00 -3.07 0.00 0.00 36.82 37.68 1llb h ILE 16 CO -0.20 0.70 -0.15 0.74 -0.69 0.00 0.00 178.15 178.54 1llb h THR 17 N 0.29 0.59 -0.62 -0.27 2.02 -1.61 -0.04 112.91 113.27 1llb h THR 17 Ca -0.07 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 1llb h THR 17 Cb 1.52 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 68.49 1llb h THR 17 CO 0.16 0.00 0.31 -0.65 0.37 0.00 0.00 175.52 175.71 1llb h PRO 18 N -0.20 0.87 -0.14 6.66 0.11 -1.79 -2.36 132.00 135.15 1llb h PRO 18 Ca 0.09 -0.10 -0.00 0.00 0.11 0.00 0.00 66.00 66.09 1llb h PRO 18 Cb 0.33 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 1llb h PRO 18 CO -0.23 0.66 0.08 1.25 -0.21 0.00 0.00 178.00 179.55 1llb h LEU 19 N 0.87 0.17 -0.86 2.35 5.85 -1.31 0.56 115.31 122.94 1llb h LEU 19 Ca 0.22 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1llb h LEU 19 Cb 0.07 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 1llb h LEU 19 CO -0.03 0.20 0.57 0.40 -0.34 0.00 0.00 178.44 179.23 1llb h ILE 20 N 0.13 1.21 -0.07 4.05 2.04 -0.80 0.75 117.51 124.82 1llb h ILE 20 Ca 0.05 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 1llb h ILE 20 Cb 0.07 -0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.10 1llb h ILE 20 CO -0.01 0.21 -0.03 -0.08 0.00 0.00 0.00 178.15 178.24 1llb h GLU 21 N 1.15 0.14 -0.69 2.37 4.81 -1.21 0.11 114.58 121.26 1llb h GLU 21 Ca 0.32 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.43 1llb h GLU 21 Cb -0.11 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 1llb h GLU 21 CO -0.08 0.52 0.22 1.96 -0.73 0.00 0.00 179.01 180.91 1llb h GLN 22 N -0.24 1.05 -0.01 1.92 4.20 -0.68 -2.88 115.11 118.48 1llb h GLN 22 Ca 0.02 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.52 1llb h GLN 22 Cb 0.48 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1llb h GLN 22 CO 0.01 0.89 -0.32 1.04 -0.67 0.00 0.00 178.83 179.78 1llb n GLN 23 N -4.27 1.02 -3.65 1.46 1.13 0.24 -4.97 117.38 108.34 1llb n GLN 23 Ca 0.06 -0.70 -0.22 0.00 -1.94 0.00 0.00 57.00 54.19 1llb n GLN 23 Cb 0.21 -1.49 0.04 0.00 0.11 0.00 0.00 30.24 29.12 1llb n GLN 23 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1llb n LYS 24 N -0.38 -4.26 -2.89 -1.09 5.02 0.32 -4.95 118.16 109.94 1llb n LYS 24 Ca 0.11 0.63 -0.41 0.00 -2.02 0.00 0.00 58.31 56.62 1llb n LYS 24 Cb 0.39 -5.12 -0.04 0.00 -0.02 0.00 0.00 35.03 30.25 1llb n LYS 24 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1llb s ILE 25 N -3.62 4.93 0.15 -0.18 1.01 -0.81 -4.97 121.20 117.71 1llb s ILE 25 Ca 0.10 1.70 -0.09 0.00 0.00 0.00 0.00 60.65 62.36 1llb s ILE 25 Cb -0.03 -4.16 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 1llb s ILE 25 CO 0.81 0.14 1.48 -0.65 0.00 0.00 0.00 174.94 176.72 1llb h PRO 26 N 6.99 0.85 -3.10 2.79 0.11 -1.88 -3.46 132.00 134.29 1llb h PRO 26 Ca -0.36 -0.47 -0.13 0.00 0.11 0.00 0.00 66.00 65.15 1llb h PRO 26 Cb 1.18 0.03 -0.21 0.00 0.11 0.00 0.00 31.00 32.10 1llb h PRO 26 CO 0.79 1.11 -0.32 0.20 -0.21 0.00 0.00 178.00 179.57 1llb s GLY 27 N -3.92 -0.14 -0.08 -0.55 0.00 -1.20 -0.17 107.32 101.26 1llb s GLY 27 Ca -0.10 0.35 -0.19 0.00 0.00 0.00 0.00 44.72 44.78 1llb s GLY 27 CO 0.87 0.17 0.44 -0.29 0.00 0.00 0.00 173.10 174.29 1llb s MET 28 N -1.07 0.71 0.01 2.90 1.75 -0.55 -2.52 119.30 120.52 1llb s MET 28 Ca -0.11 0.19 0.04 0.00 -1.25 0.00 0.00 55.69 54.56 1llb s MET 28 Cb -0.05 0.33 -0.01 0.00 2.84 0.00 0.00 34.83 37.94 1llb s MET 28 CO 0.03 -0.17 -0.13 0.00 -0.65 0.00 0.00 175.02 174.10 1llb s ALA 29 N -0.76 1.04 0.00 4.11 0.00 -0.18 -1.18 121.76 124.79 1llb s ALA 29 Ca -0.08 -0.61 0.02 0.00 0.00 0.00 0.00 51.96 51.28 1llb s ALA 29 Cb -0.03 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 1llb s ALA 29 CO 0.04 0.23 -0.07 0.08 0.00 0.00 0.00 175.76 176.05 1llb s VAL 30 N -0.47 0.55 -0.06 0.00 1.01 0.05 -0.97 120.40 120.51 1llb s VAL 30 Ca 0.03 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 61.67 1llb s VAL 30 Cb -0.06 -0.48 0.01 0.00 0.00 0.00 0.00 36.38 35.85 1llb s VAL 30 CO 0.00 0.10 -0.16 0.00 0.00 0.00 0.00 175.10 175.04 1llb s ALA 31 N -0.28 1.48 -0.13 5.51 0.00 -0.46 -0.99 121.76 126.89 1llb s ALA 31 Ca 0.02 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.39 1llb s ALA 31 Cb -0.03 -0.58 -0.01 0.00 0.00 0.00 0.00 23.12 22.49 1llb s ALA 31 CO -0.00 0.19 -0.14 0.08 0.00 0.00 0.00 175.76 175.90 1llb s VAL 32 N 0.41 3.00 -0.26 0.00 1.01 -0.15 -1.07 120.40 123.35 1llb s VAL 32 Ca -0.12 -0.68 -0.10 0.00 0.00 0.00 0.00 61.98 61.08 1llb s VAL 32 Cb -0.15 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1llb s VAL 32 CO 0.04 0.53 0.15 -0.63 0.00 0.00 0.00 175.10 175.18 1llb s ILE 33 N 0.35 5.05 -0.07 2.22 1.09 0.68 -0.81 121.20 129.70 1llb s ILE 33 Ca -0.11 0.08 0.01 0.00 -1.10 0.00 0.00 60.65 59.52 1llb s ILE 33 Cb -0.16 -3.38 0.02 0.00 -1.06 0.00 0.00 42.46 37.88 1llb s ILE 33 CO 0.06 0.31 -0.08 -0.47 -0.10 0.00 0.00 174.94 174.65 1llb s TYR 34 N 1.46 1.24 -1.62 3.97 5.04 0.62 -1.54 117.35 126.52 1llb s TYR 34 Ca 0.07 -0.49 -0.15 0.00 -2.44 0.00 0.00 57.07 54.06 1llb s TYR 34 Cb -0.15 -1.00 0.12 0.00 0.35 0.00 0.00 41.96 41.28 1llb s TYR 34 CO 0.07 -0.32 0.82 1.04 -1.34 0.00 0.00 175.55 175.82 1llb n GLN 35 N 4.27 -3.97 0.00 4.97 6.02 -1.05 -0.78 117.38 126.84 1llb n GLN 35 Ca -0.19 0.45 0.00 0.00 -0.01 0.00 0.00 57.00 57.25 1llb n GLN 35 Cb 0.51 -5.18 0.00 0.00 1.02 0.00 0.00 30.24 26.59 1llb n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1llb n GLY 36 N -1.55 2.92 3.85 1.08 0.00 -1.09 -5.02 105.19 105.39 1llb n GLY 36 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1llb n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llb s LYS 37 N -0.04 3.27 0.09 1.61 1.02 0.04 -5.02 119.74 120.70 1llb s LYS 37 Ca 0.00 -0.42 -0.11 0.00 0.02 0.00 0.00 55.97 55.47 1llb s LYS 37 Cb 0.00 -2.98 -0.06 0.00 -0.52 0.00 0.00 37.83 34.27 1llb s LYS 37 CO 0.00 0.65 0.42 -1.25 -0.92 0.00 0.00 175.35 174.26 1llb s PRO 38 N -1.96 3.80 -0.08 -1.68 0.04 -1.26 -0.28 135.00 133.58 1llb s PRO 38 Ca 0.27 0.24 0.01 0.00 0.04 0.00 0.00 61.00 61.55 1llb s PRO 38 Cb -0.12 -3.00 0.02 0.00 0.04 0.00 0.00 34.50 31.44 1llb s PRO 38 CO 0.18 0.55 -0.10 0.71 0.04 0.00 0.00 177.00 178.39 1llb s TYR 39 N -1.39 1.42 0.06 0.56 2.02 0.01 -4.97 117.35 115.05 1llb s TYR 39 Ca 0.33 -0.60 0.03 0.00 -0.37 0.00 0.00 57.07 56.47 1llb s TYR 39 Cb -0.14 -1.11 -0.04 0.00 -0.40 0.00 0.00 41.96 40.27 1llb s TYR 39 CO 0.18 -0.37 0.05 0.71 -1.57 0.00 0.00 175.55 174.55 1llb s TYR 40 N 1.10 3.13 -0.02 2.71 1.51 -1.26 -0.98 117.35 123.55 1llb s TYR 40 Ca -0.06 0.07 -0.02 0.00 -1.01 0.00 0.00 57.07 56.05 1llb s TYR 40 Cb -0.14 -1.62 0.01 0.00 -0.11 0.00 0.00 41.96 40.09 1llb s TYR 40 CO -0.01 0.51 0.06 -0.06 -1.11 0.00 0.00 175.55 174.93 1llb s PHE 41 N -1.30 -0.06 0.02 2.71 0.08 -0.16 -5.00 117.98 114.26 1llb s PHE 41 Ca 0.26 0.17 -0.00 0.00 0.12 0.00 0.00 56.93 57.48 1llb s PHE 41 Cb -0.12 -0.01 -0.02 0.00 -0.57 0.00 0.00 43.02 42.31 1llb s PHE 41 CO 0.18 -0.04 -0.02 0.95 -0.10 0.00 0.00 175.22 176.19 1llb s THR 42 N 0.19 0.09 -0.01 0.64 -4.23 -1.26 -0.77 115.64 110.29 1llb s THR 42 Ca -0.01 -0.72 -0.07 0.00 -1.18 0.00 0.00 61.69 59.70 1llb s THR 42 Cb -0.02 -0.22 0.00 0.00 1.34 0.00 0.00 72.50 73.61 1llb s THR 42 CO -0.01 -0.40 0.15 0.26 -0.54 0.00 0.00 174.62 174.08 1llb s TRP 43 N -1.17 0.00 0.00 3.99 0.51 -0.32 -5.01 118.94 116.95 1llb s TRP 43 Ca -0.13 -0.04 0.00 0.00 -2.12 0.00 0.00 56.10 53.81 1llb s TRP 43 Cb -0.08 -0.03 0.00 0.00 -0.81 0.00 0.00 33.47 32.55 1llb s TRP 43 CO -0.01 -0.26 0.00 0.41 -0.51 0.00 0.00 176.95 176.58 1llb n GLY 44 N 1.66 0.28 3.45 0.98 0.00 -1.26 -1.48 105.19 108.81 1llb n GLY 44 Ca -0.21 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.60 1llb n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1llb s TYR 45 N 0.00 2.76 0.01 1.61 2.02 0.75 -1.39 117.35 123.13 1llb s TYR 45 Ca 0.00 -0.32 0.03 0.00 -0.37 0.00 0.00 57.07 56.41 1llb s TYR 45 Cb 0.00 -1.72 -0.25 0.00 -0.40 0.00 0.00 41.96 39.59 1llb s TYR 45 CO 0.00 0.05 0.89 0.00 -1.57 0.00 0.00 175.55 174.92 1llb h ALA 46 N 5.84 0.41 -2.88 3.71 0.00 -0.77 -3.19 119.26 122.39 1llb h ALA 46 Ca -0.39 -1.16 -0.43 0.00 0.00 0.00 0.00 54.91 52.93 1llb h ALA 46 Cb 1.18 0.24 -0.40 0.00 0.00 0.00 0.00 17.79 18.81 1llb h ALA 46 CO 0.53 1.27 -0.72 0.34 0.00 0.00 0.00 179.25 180.67 1llb s ASP 47 N -6.71 2.24 0.02 0.00 -1.08 -0.99 -1.06 116.67 109.09 1llb s ASP 47 Ca -0.06 -0.60 -0.25 0.00 -0.52 0.00 0.00 52.55 51.12 1llb s ASP 47 Cb 0.08 -0.09 -0.18 0.00 -1.46 0.00 0.00 42.92 41.26 1llb s ASP 47 CO 0.84 -0.36 1.45 0.40 0.52 0.00 0.00 175.17 178.02 1llb h ILE 48 N 6.39 1.20 -0.68 4.11 2.04 -1.85 -0.70 117.51 128.02 1llb h ILE 48 Ca -0.16 -0.67 0.05 0.00 1.00 0.00 0.00 64.86 65.07 1llb h ILE 48 Cb 1.13 1.66 -0.05 0.00 -0.74 0.00 0.00 36.82 38.82 1llb h ILE 48 CO 0.31 0.17 0.40 0.00 0.00 0.00 0.00 178.15 179.03 1llb h ALA 49 N 0.67 0.90 -0.29 1.87 0.00 -1.97 -2.29 119.26 118.14 1llb h ALA 49 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1llb h ALA 49 Cb 0.30 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1llb h ALA 49 CO 0.00 0.12 0.00 1.63 0.00 0.00 0.00 179.25 181.01 1llb n LYS 50 N -4.73 1.93 -3.30 0.00 5.02 -1.21 -4.95 118.16 110.92 1llb n LYS 50 Ca 0.08 -1.42 -0.24 0.00 -2.02 0.00 0.00 58.31 54.71 1llb n LYS 50 Cb 0.13 -1.39 0.01 0.00 -0.02 0.00 0.00 35.03 33.77 1llb n LYS 50 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1llb n LYS 51 N 0.64 -4.09 -3.08 1.97 5.02 -0.40 -4.95 118.16 113.27 1llb n LYS 51 Ca 0.16 0.62 -0.40 0.00 -2.02 0.00 0.00 58.31 56.67 1llb n LYS 51 Cb 0.38 -5.40 -0.05 0.00 -0.02 0.00 0.00 35.03 29.93 1llb n LYS 51 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1llb s GLN 52 N -5.97 4.28 0.64 1.97 -1.52 -0.42 -4.97 119.66 113.66 1llb s GLN 52 Ca 0.39 0.73 -0.12 0.00 -1.95 0.00 0.00 55.36 54.41 1llb s GLN 52 Cb -0.20 -3.54 -0.02 0.00 -0.22 0.00 0.00 33.01 29.03 1llb s GLN 52 CO 0.49 -0.17 1.04 -1.25 -0.25 0.00 0.00 175.29 175.15 1llb s PRO 53 N 1.64 3.34 0.19 2.91 0.04 -1.26 -0.23 135.00 141.63 1llb s PRO 53 Ca 0.32 0.90 -0.30 0.00 0.04 0.00 0.00 61.00 61.96 1llb s PRO 53 Cb -0.16 -2.04 -0.08 0.00 0.04 0.00 0.00 34.50 32.25 1llb s PRO 53 CO 0.12 -0.78 1.14 0.08 0.04 0.00 0.00 177.00 177.61 1llb s VAL 54 N -2.99 3.71 0.35 -0.36 1.01 -0.48 -4.21 120.40 117.42 1llb s VAL 54 Ca 0.58 1.48 0.04 0.00 0.00 0.00 0.00 61.98 64.08 1llb s VAL 54 Cb -0.13 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.29 1llb s VAL 54 CO 0.50 0.26 0.14 0.35 0.00 0.00 0.00 175.10 176.35 1llb n THR 55 N 2.31 0.00 0.77 3.92 -2.24 -1.26 -4.66 114.28 113.12 1llb n THR 55 Ca 0.03 -2.09 0.09 0.00 -2.27 0.00 0.00 64.05 59.81 1llb n THR 55 Cb 0.45 0.79 0.43 0.00 -2.10 0.00 0.00 70.33 69.91 1llb n THR 55 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1llb n GLN 56 N -0.77 0.16 0.00 -0.78 6.02 -1.26 -2.39 117.38 118.36 1llb n GLN 56 Ca -0.03 0.14 0.09 0.00 -0.01 0.00 0.00 57.00 57.19 1llb n GLN 56 Cb 0.53 -1.50 -0.00 0.00 1.02 0.00 0.00 30.24 30.29 1llb n GLN 56 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1llb n GLN 57 N -1.37 1.46 -2.08 -1.09 3.00 -1.26 -3.82 117.38 112.22 1llb n GLN 57 Ca 0.07 -0.92 -0.41 0.00 -0.01 0.00 0.00 57.00 55.72 1llb n GLN 57 Cb 0.17 -1.37 -0.02 0.00 0.00 0.00 0.00 30.24 29.01 1llb n GLN 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1llb s THR 58 N -2.17 2.81 -0.09 5.09 2.01 -1.01 -4.85 115.64 117.44 1llb s THR 58 Ca 0.16 0.70 -0.16 0.00 0.31 0.00 0.00 61.69 62.69 1llb s THR 58 Cb 0.15 -3.44 -0.05 0.00 0.01 0.00 0.00 72.50 69.17 1llb s THR 58 CO 0.48 0.12 0.43 -0.76 -0.69 0.00 0.00 174.62 174.20 1llb s LEU 59 N -0.53 4.33 0.12 4.42 1.43 0.54 -4.11 118.68 124.88 1llb s LEU 59 Ca 0.57 0.81 0.10 0.00 -1.03 0.00 0.00 54.13 54.59 1llb s LEU 59 Cb -0.40 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 1llb s LEU 59 CO 0.43 0.11 -0.26 -0.36 0.23 0.00 0.00 176.35 176.51 1llb s PHE 60 N 0.08 2.23 -0.12 0.29 0.40 -0.20 -1.66 117.98 119.00 1llb s PHE 60 Ca 0.24 -0.39 -0.30 0.00 -0.60 0.00 0.00 56.93 55.88 1llb s PHE 60 Cb -0.15 -1.22 -0.02 0.00 0.51 0.00 0.00 43.02 42.15 1llb s PHE 60 CO 0.10 0.31 1.11 -1.21 0.70 0.00 0.00 175.22 176.23 1llb s GLU 61 N -2.00 4.35 0.37 0.44 2.02 -1.26 -1.70 118.70 120.92 1llb s GLU 61 Ca 0.13 1.51 0.25 0.00 0.02 0.00 0.00 54.97 56.88 1llb s GLU 61 Cb -0.10 -3.59 0.65 0.00 0.10 0.00 0.00 34.13 31.19 1llb s GLU 61 CO 0.06 -0.46 1.71 -0.07 0.02 0.00 0.00 175.26 176.52 1llb h LEU 62 N 8.52 0.00 0.00 1.80 3.38 -1.34 -3.43 115.31 124.23 1llb h LEU 62 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1llb h LEU 62 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1llb h LEU 62 CO 0.90 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.04 1llb n GLY 63 N 0.97 2.99 0.05 0.83 0.00 -1.23 -1.82 105.19 106.97 1llb n GLY 63 Ca 0.04 -0.33 0.05 0.00 0.00 0.00 0.00 46.02 45.79 1llb n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1llb n SER 64 N 1.27 0.18 0.25 1.61 7.64 -1.26 -1.14 113.62 122.17 1llb n SER 64 Ca 0.00 0.57 0.17 0.00 1.01 0.00 0.00 58.87 60.62 1llb n SER 64 Cb 0.00 -0.60 0.82 0.00 -1.01 0.00 0.00 64.21 63.42 1llb n SER 64 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1llb h VAL 65 N 0.00 0.00 -0.07 0.44 2.07 -1.45 -0.23 116.25 117.01 1llb h VAL 65 Ca 0.00 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.38 1llb h VAL 65 Cb 0.10 0.99 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1llb h VAL 65 CO 0.00 0.00 0.06 0.28 0.02 0.00 0.00 177.57 177.93 1llb h SER 66 N 0.00 0.00 0.16 0.57 0.02 -1.31 -1.67 113.55 111.32 1llb h SER 66 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1llb h SER 66 Cb 0.18 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 1llb h SER 66 CO 0.00 0.00 -0.02 0.11 -1.14 0.00 0.00 176.83 175.78 1llb h LYS 67 N 0.00 0.00 -0.28 3.45 1.57 -1.17 -1.03 116.57 119.10 1llb h LYS 67 Ca 0.03 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.69 1llb h LYS 67 Cb 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1llb h LYS 67 CO -0.00 0.02 -0.35 1.79 -0.57 0.00 0.00 179.45 180.34 1llb h THR 68 N 0.00 1.29 -0.38 -0.16 1.35 -1.49 -0.16 112.91 113.36 1llb h THR 68 Ca -0.00 -1.49 -0.08 0.00 -0.55 0.00 0.00 66.41 64.29 1llb h THR 68 Cb 0.11 1.45 -0.01 0.00 -1.73 0.00 0.00 68.15 67.96 1llb h THR 68 CO 0.00 0.48 -0.08 -0.26 -0.25 0.00 0.00 175.52 175.41 1llb h PHE 69 N 0.53 0.81 -0.75 4.73 -1.00 -1.35 -1.82 116.94 118.09 1llb h PHE 69 Ca 0.05 -0.17 0.00 0.00 2.81 0.00 0.00 57.97 60.67 1llb h PHE 69 Cb 0.85 -0.20 -0.04 0.00 3.61 0.00 0.00 35.95 40.18 1llb h PHE 69 CO 0.04 0.86 0.48 1.15 -1.61 0.00 0.00 178.31 179.22 1llb h THR 70 N 0.53 1.20 -0.64 -1.55 2.02 -1.22 0.31 112.91 113.55 1llb h THR 70 Ca 0.10 -0.40 -0.02 0.00 0.77 0.00 0.00 66.41 66.85 1llb h THR 70 Cb 0.59 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1llb h THR 70 CO 0.04 0.20 0.30 1.23 0.37 0.00 0.00 175.52 177.66 1llb h GLY 71 N 1.02 0.99 1.30 2.16 0.00 -0.90 -0.85 103.07 106.78 1llb h GLY 71 Ca 0.27 -0.49 -0.15 0.00 0.00 0.00 0.00 47.33 46.96 1llb h GLY 71 CO -0.06 0.47 -0.40 -2.08 0.00 0.00 0.00 176.54 174.47 1llb h VAL 72 N 0.88 1.29 -0.52 4.60 2.07 -0.95 -0.62 116.25 123.00 1llb h VAL 72 Ca 0.22 -1.58 -0.07 0.00 0.82 0.00 0.00 66.70 66.09 1llb h VAL 72 Cb 0.13 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1llb h VAL 72 CO -0.03 0.51 0.03 0.25 0.02 0.00 0.00 177.57 178.36 1llb h LEU 73 N 0.63 0.81 -0.42 2.57 5.85 -0.72 0.08 115.31 124.10 1llb h LEU 73 Ca 0.05 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.53 1llb h LEU 73 Cb 0.96 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1llb h LEU 73 CO 0.09 0.85 0.07 1.23 -0.34 0.00 0.00 178.44 180.34 1llb h GLY 74 N 0.98 0.75 1.34 3.75 0.00 -0.90 -1.79 103.07 107.20 1llb h GLY 74 Ca 0.16 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 1llb h GLY 74 CO 0.02 0.46 0.41 -1.33 0.00 0.00 0.00 176.54 176.09 1llb h GLY 75 N 0.55 0.94 1.35 4.60 0.00 -0.60 -1.00 103.07 108.90 1llb h GLY 75 Ca 0.13 -0.37 -0.09 0.00 0.00 0.00 0.00 47.33 47.00 1llb h GLY 75 CO 0.01 0.36 -0.08 -1.80 0.00 0.00 0.00 176.54 175.03 1llb h ASP 76 N 0.90 0.76 -0.21 0.19 3.58 -0.61 -0.07 116.42 120.96 1llb h ASP 76 Ca 0.24 -0.22 -0.11 0.00 0.42 0.00 0.00 57.03 57.36 1llb h ASP 76 Cb -0.06 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 40.77 1llb h ASP 76 CO -0.05 0.88 -0.24 0.00 -2.88 0.00 0.00 179.24 176.95 1llb h ALA 77 N 1.19 0.94 -0.19 -0.78 0.00 -0.44 -0.22 119.26 119.76 1llb h ALA 77 Ca 0.13 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1llb h ALA 77 Cb 0.55 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1llb h ALA 77 CO 0.03 0.61 0.04 0.82 0.00 0.00 0.00 179.25 180.75 1llb h ILE 78 N 0.59 1.22 -0.51 0.00 2.04 -0.79 -1.62 117.51 118.45 1llb h ILE 78 Ca 0.08 -0.70 0.01 0.00 1.00 0.00 0.00 64.86 65.26 1llb h ILE 78 Cb 0.72 1.31 -0.03 0.00 -0.74 0.00 0.00 36.82 38.09 1llb h ILE 78 CO 0.06 0.22 0.34 0.00 0.00 0.00 0.00 178.15 178.76 1llb h ALA 79 N 0.84 1.67 0.00 1.87 0.00 -0.70 -0.38 119.26 122.57 1llb h ALA 79 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1llb h ALA 79 Cb 0.29 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1llb h ALA 79 CO 0.00 0.30 0.00 0.54 0.00 0.00 0.00 179.25 180.09 1llb n ARG 80 N -4.46 0.04 -0.90 0.00 1.74 -0.12 -4.87 116.66 108.08 1llb n ARG 80 Ca 0.05 0.24 0.00 0.00 -0.77 0.00 0.00 57.85 57.37 1llb n ARG 80 Cb 0.08 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 1llb n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1llb n GLY 81 N 0.27 0.56 0.12 -0.13 0.00 -0.15 -4.93 105.19 100.93 1llb n GLY 81 Ca 0.04 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.99 1llb n GLY 81 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1llb h GLU 82 N 1.36 0.13 -4.06 1.61 5.08 -1.50 -3.47 114.58 113.72 1llb h GLU 82 Ca 0.00 -0.13 -0.13 0.00 -1.00 0.00 0.00 59.36 58.10 1llb h GLU 82 Cb 0.00 0.04 -0.13 0.00 0.50 0.00 0.00 28.75 29.15 1llb h GLU 82 CO 0.00 0.87 -0.43 0.96 -1.00 0.00 0.00 179.01 179.41 1llb s ILE 83 N -3.26 0.08 -0.00 3.13 -4.36 -1.21 -4.85 121.20 110.73 1llb s ILE 83 Ca -0.02 -1.55 0.04 0.00 -0.26 0.00 0.00 60.65 58.86 1llb s ILE 83 Cb 0.11 -1.88 -0.01 0.00 1.25 0.00 0.00 42.46 41.93 1llb s ILE 83 CO 0.81 -0.38 -0.13 -0.54 0.24 0.00 0.00 174.94 174.94 1llb s LYS 84 N -3.99 1.00 0.55 0.37 1.02 -1.26 -4.25 119.74 113.19 1llb s LYS 84 Ca 0.19 -0.51 0.32 0.00 0.02 0.00 0.00 55.97 55.99 1llb s LYS 84 Cb 0.05 -0.97 1.61 0.00 -0.52 0.00 0.00 37.83 37.99 1llb s LYS 84 CO -0.00 0.26 2.10 -0.07 -0.92 0.00 0.00 175.35 176.72 1llb h LEU 85 N 5.66 0.00 0.00 3.17 3.38 -1.98 -1.52 115.31 124.02 1llb h LEU 85 Ca -0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1llb h LEU 85 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1llb h LEU 85 CO 0.48 0.07 0.00 -1.54 0.09 0.00 0.00 178.44 177.54 1llb n SER 86 N -3.40 0.00 -4.75 -0.43 3.41 -1.26 -1.21 113.62 105.98 1llb n SER 86 Ca -0.01 0.10 -0.41 0.00 -0.26 0.00 0.00 58.87 58.29 1llb n SER 86 Cb 0.23 -0.36 -0.02 0.00 -0.26 0.00 0.00 64.21 63.79 1llb n SER 86 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1llb s ASP 87 N -2.72 6.75 0.56 4.04 -0.00 -0.57 -4.82 116.67 119.89 1llb s ASP 87 Ca 0.22 2.62 -0.19 0.00 -0.00 0.00 0.00 52.55 55.20 1llb s ASP 87 Cb 0.19 -2.63 -0.05 0.00 -0.00 0.00 0.00 42.92 40.43 1llb s ASP 87 CO 0.46 -0.61 1.13 -2.16 -0.00 0.00 0.00 175.17 173.99 1llb s PRO 88 N -0.82 3.28 0.35 8.23 0.04 -1.26 -1.15 135.00 143.67 1llb s PRO 88 Ca 0.55 1.59 0.04 0.00 0.04 0.00 0.00 61.00 63.22 1llb s PRO 88 Cb -0.40 -2.00 0.68 0.00 0.04 0.00 0.00 34.50 32.82 1llb s PRO 88 CO 0.46 -0.90 1.96 1.15 0.04 0.00 0.00 177.00 179.71 1llb h THR 89 N 1.05 1.06 0.00 1.26 2.02 -1.33 -2.02 112.91 114.96 1llb h THR 89 Ca -0.50 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.39 1llb h THR 89 Cb 1.26 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1llb h THR 89 CO 0.57 0.15 -0.03 0.71 0.37 0.00 0.00 175.52 177.29 1llb h THR 90 N 0.83 0.29 -0.50 3.16 1.35 -1.82 -1.38 112.91 114.84 1llb h THR 90 Ca 0.30 -0.16 0.06 0.00 -0.55 0.00 0.00 66.41 66.06 1llb h THR 90 Cb 0.16 1.12 -0.03 0.00 -1.73 0.00 0.00 68.15 67.67 1llb h THR 90 CO -0.10 0.03 0.33 0.50 -0.25 0.00 0.00 175.52 176.03 1llb h LYS 91 N 0.00 0.44 0.00 4.72 3.64 -1.73 -2.43 116.57 121.21 1llb h LYS 91 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1llb h LYS 91 Cb 0.12 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1llb h LYS 91 CO 0.00 0.29 -1.24 0.66 -2.27 0.00 0.00 179.45 176.90 1llb n TYR 92 N -4.47 0.00 -3.31 1.91 4.01 -0.56 -4.64 117.16 110.10 1llb n TYR 92 Ca 0.07 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.56 1llb n TYR 92 Cb 0.23 -0.12 -0.09 0.00 -0.31 0.00 0.00 39.34 39.05 1llb n TYR 92 CO 0.00 0.00 0.00 1.87 -0.46 0.00 0.00 176.86 178.27 1llb n TRP 93 N -1.68 -1.14 0.07 -0.72 -0.00 -0.98 -4.99 117.44 108.00 1llb n TRP 93 Ca 0.02 -3.16 0.18 0.00 -0.00 0.00 0.00 57.50 54.54 1llb n TRP 93 Cb 0.38 0.31 0.70 0.00 -0.00 0.00 0.00 31.31 32.70 1llb n TRP 93 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1llb h PRO 94 N 5.38 0.00 0.00 5.87 0.11 -1.71 -1.30 132.00 140.35 1llb h PRO 94 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1llb h PRO 94 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1llb h PRO 94 CO 0.35 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.07 1llb h GLU 95 N 0.00 0.00 -4.96 1.05 3.07 -1.94 -3.34 114.58 108.47 1llb h GLU 95 Ca 0.19 0.00 -0.69 0.00 -0.50 0.00 0.00 59.36 58.36 1llb h GLU 95 Cb 0.78 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.63 1llb h GLU 95 CO -0.00 0.00 2.65 1.28 -1.40 0.00 0.00 179.01 181.53 1llb n LEU 96 N -2.38 5.84 0.01 1.33 4.77 -0.49 -4.66 117.00 121.42 1llb n LEU 96 Ca -0.00 -4.01 0.12 0.00 -0.03 0.00 0.00 56.01 52.09 1llb n LEU 96 Cb 0.12 -1.70 0.26 0.00 -2.33 0.00 0.00 43.42 39.78 1llb n LEU 96 CO 0.15 0.59 0.47 0.35 -1.33 0.00 0.00 177.39 177.62 1llb n THR 97 N 5.79 0.07 -1.72 -5.08 -2.24 -1.26 -4.85 114.28 105.00 1llb n THR 97 Ca 0.50 -0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.80 1llb n THR 97 Cb 0.43 0.11 -0.02 0.00 -2.10 0.00 0.00 70.33 68.75 1llb n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1llb n ALA 98 N -1.57 1.84 0.23 6.98 0.00 -1.26 -4.87 120.51 121.87 1llb n ALA 98 Ca 0.05 0.38 0.16 0.00 0.00 0.00 0.00 53.44 54.03 1llb n ALA 98 Cb 0.36 -2.36 0.83 0.00 0.00 0.00 0.00 19.45 18.28 1llb n ALA 98 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1llb h LYS 99 N 3.97 0.00 0.00 0.00 3.64 -1.93 -1.72 116.57 120.53 1llb h LYS 99 Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1llb h LYS 99 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1llb h LYS 99 CO 0.73 0.00 0.00 -0.56 -2.27 0.00 0.00 179.45 177.35 1llb h GLN 100 N 0.00 0.00 0.00 1.90 -0.00 -1.94 -1.93 115.11 113.15 1llb h GLN 100 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.71 1llb h GLN 100 Cb 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.78 1llb h GLN 100 CO -0.00 0.00 -0.07 0.91 -0.00 0.00 0.00 178.83 179.67 1llb n TRP 101 N -2.51 0.65 -1.87 0.06 7.02 -0.65 -4.70 117.44 115.45 1llb n TRP 101 Ca 0.00 0.19 -0.42 0.00 -1.02 0.00 0.00 57.50 56.25 1llb n TRP 101 Cb 0.16 -0.79 -0.03 0.00 -2.42 0.00 0.00 31.31 28.23 1llb n TRP 101 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1llb s ASN 102 N -4.10 6.57 0.00 -0.99 0.02 -0.73 -1.78 114.94 113.94 1llb s ASN 102 Ca 0.11 2.47 0.00 0.00 -1.02 0.00 0.00 52.86 54.42 1llb s ASN 102 Cb 0.14 -2.54 0.00 0.00 0.02 0.00 0.00 41.25 38.87 1llb s ASN 102 CO 0.60 -0.96 0.00 0.61 0.02 0.00 0.00 177.10 177.37 1llb n GLY 103 N 4.22 0.41 3.57 0.66 0.00 -1.26 -5.03 105.19 107.76 1llb n GLY 103 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1llb n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1llb s ILE 104 N -2.10 4.97 0.44 -0.61 1.01 -0.73 -4.90 121.20 119.27 1llb s ILE 104 Ca 0.00 0.48 0.08 0.00 0.00 0.00 0.00 60.65 61.21 1llb s ILE 104 Cb 0.00 -4.00 0.02 0.00 0.01 0.00 0.00 42.46 38.48 1llb s ILE 104 CO 0.00 -0.24 0.58 0.42 0.00 0.00 0.00 174.94 175.71 1llb s THR 105 N 2.52 2.90 0.47 2.92 -4.23 -1.26 -0.96 115.64 117.99 1llb s THR 105 Ca 0.21 -1.02 0.13 0.00 -1.18 0.00 0.00 61.69 59.83 1llb s THR 105 Cb -0.15 -2.91 0.28 0.00 1.34 0.00 0.00 72.50 71.06 1llb s THR 105 CO 0.14 0.00 2.09 -0.07 -0.54 0.00 0.00 174.62 176.24 1llb h LEU 106 N 0.61 0.22 -0.56 4.79 3.38 -1.11 -1.43 115.31 121.22 1llb h LEU 106 Ca -0.39 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.58 1llb h LEU 106 Cb 1.28 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 1llb h LEU 106 CO 0.45 0.16 0.35 0.25 0.09 0.00 0.00 178.44 179.74 1llb h LEU 107 N 0.26 0.67 -0.69 1.67 5.85 -1.43 -0.67 115.31 120.96 1llb h LEU 107 Ca 0.10 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.79 1llb h LEU 107 Cb 0.08 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1llb h LEU 107 CO -0.02 0.52 0.44 0.45 -0.34 0.00 0.00 178.44 179.49 1llb h HIS 108 N 0.76 0.83 -0.13 1.25 3.86 -1.56 -2.00 115.15 118.16 1llb h HIS 108 Ca 0.20 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.43 1llb h HIS 108 Cb -0.04 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.15 1llb h HIS 108 CO -0.03 0.49 0.04 -0.07 0.86 0.00 0.00 177.93 179.23 1llb h LEU 109 N 0.88 0.18 -2.12 2.43 3.38 -1.14 -0.78 115.31 118.14 1llb h LEU 109 Ca 0.27 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1llb h LEU 109 Cb -0.03 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1llb h LEU 109 CO -0.09 0.32 -0.08 0.00 0.09 0.00 0.00 178.44 178.68 1llb h ALA 110 N 0.87 1.33 -0.20 1.53 0.00 -0.88 -2.84 119.26 119.07 1llb h ALA 110 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1llb h ALA 110 Cb 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1llb h ALA 110 CO -0.00 0.10 0.00 0.25 0.00 0.00 0.00 179.25 179.59 1llb n THR 111 N -3.66 1.46 -2.03 0.00 -2.24 -0.77 -4.44 114.28 102.59 1llb n THR 111 Ca -0.02 -1.41 -0.17 0.00 -2.27 0.00 0.00 64.05 60.19 1llb n THR 111 Cb 0.19 0.20 -0.03 0.00 -2.10 0.00 0.00 70.33 68.59 1llb n THR 111 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1llb n TYR 112 N -0.25 -0.52 -1.10 4.78 0.53 -0.85 -4.83 117.16 114.91 1llb n TYR 112 Ca 0.12 0.00 0.06 0.00 -1.02 0.00 0.00 57.90 57.06 1llb n TYR 112 Cb 0.54 -3.20 0.23 0.00 -1.03 0.00 0.00 39.34 35.87 1llb n TYR 112 CO 0.00 0.00 0.00 0.25 -1.02 0.00 0.00 176.86 176.09 1llb n THR 113 N -3.50 2.28 0.35 -0.72 -2.24 -0.36 -1.66 114.28 108.44 1llb n THR 113 Ca -0.19 -2.12 0.14 0.00 -2.27 0.00 0.00 64.05 59.61 1llb n THR 113 Cb 0.61 -0.27 0.53 0.00 -2.10 0.00 0.00 70.33 69.11 1llb n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1llb h ALA 114 N 1.36 1.00 0.00 6.98 0.00 -1.80 0.23 119.26 127.03 1llb h ALA 114 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1llb h ALA 114 Cb 1.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1llb h ALA 114 CO 0.22 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.88 1llb n GLY 115 N 0.28 1.58 0.00 0.00 0.00 -1.26 -4.10 105.19 101.69 1llb n GLY 115 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1llb n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llb n GLY 116 N 0.00 1.54 3.70 -0.02 0.00 -1.26 -1.24 105.19 107.90 1llb n GLY 116 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1llb n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1llb n LEU 117 N 0.00 4.35 -4.77 0.99 4.77 -1.26 -4.79 117.00 116.29 1llb n LEU 117 Ca 0.00 1.02 -0.34 0.00 -0.03 0.00 0.00 56.01 56.66 1llb n LEU 117 Cb 0.00 -1.50 0.04 0.00 -2.33 0.00 0.00 43.42 39.63 1llb n LEU 117 CO 0.00 -0.85 0.76 -2.16 -1.33 0.00 0.00 177.39 173.80 1llb s PRO 118 N -2.48 2.90 0.21 3.23 0.04 -1.26 -4.76 135.00 132.88 1llb s PRO 118 Ca 0.66 1.47 -0.09 0.00 0.04 0.00 0.00 61.00 63.08 1llb s PRO 118 Cb -0.47 -1.96 0.28 0.00 0.04 0.00 0.00 34.50 32.39 1llb s PRO 118 CO 0.54 -1.18 1.75 1.25 0.04 0.00 0.00 177.00 179.40 1llb h LEU 119 N 0.31 0.28 -8.78 -3.56 5.85 -1.91 -3.22 115.31 104.28 1llb h LEU 119 Ca -0.48 0.07 -0.69 0.00 0.84 0.00 0.00 57.88 57.62 1llb h LEU 119 Cb 1.25 0.04 -0.26 0.00 0.37 0.00 0.00 40.66 42.06 1llb h LEU 119 CO 0.55 0.17 -0.87 -1.10 -0.34 0.00 0.00 178.44 176.84 1llb s GLN 120 N -6.09 1.80 0.03 1.25 -0.21 -1.26 0.18 119.66 115.36 1llb s GLN 120 Ca -0.13 -1.12 -0.29 0.00 0.02 0.00 0.00 55.36 53.85 1llb s GLN 120 Cb 0.17 -2.00 -0.04 0.00 1.00 0.00 0.00 33.01 32.14 1llb s GLN 120 CO 0.75 0.51 0.92 0.08 -2.12 0.00 0.00 175.29 175.43 1llb s VAL 121 N -0.84 4.78 0.53 1.09 1.01 -1.26 -4.82 120.40 120.89 1llb s VAL 121 Ca 0.12 1.95 -0.21 0.00 0.00 0.00 0.00 61.98 63.84 1llb s VAL 121 Cb -0.10 -4.27 -0.06 0.00 0.00 0.00 0.00 36.38 31.95 1llb s VAL 121 CO 0.03 0.23 1.10 -2.65 0.00 0.00 0.00 175.10 173.81 1llb n PRO 122 N 3.48 1.28 -0.01 2.72 -0.02 -1.26 -4.90 135.00 136.30 1llb n PRO 122 Ca 0.03 0.47 0.02 0.00 -2.02 0.00 0.00 63.50 62.01 1llb n PRO 122 Cb 0.50 -2.26 0.37 0.00 -0.02 0.00 0.00 33.50 32.10 1llb n PRO 122 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1llb h ASP 123 N 1.09 0.49 0.22 2.55 1.82 -2.01 -1.96 116.42 118.62 1llb h ASP 123 Ca -0.48 -0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.12 1llb h ASP 123 Cb 1.34 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 41.22 1llb h ASP 123 CO 0.54 0.44 0.00 -1.84 -1.61 0.00 0.00 179.24 176.77 1llb n GLU 124 N -4.40 0.00 -2.61 0.28 0.00 -1.26 -4.60 120.64 108.06 1llb n GLU 124 Ca 0.03 0.40 -0.43 0.00 0.00 0.00 0.00 57.16 57.15 1llb n GLU 124 Cb 0.13 -1.51 -0.02 0.00 0.00 0.00 0.00 31.44 30.04 1llb n GLU 124 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1llb s VAL 125 N -3.01 4.21 0.00 3.84 1.01 -0.74 -4.84 120.40 120.87 1llb s VAL 125 Ca 0.03 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.20 1llb s VAL 125 Cb 0.04 -4.60 0.00 0.00 0.00 0.00 0.00 36.38 31.82 1llb s VAL 125 CO 0.12 -1.01 0.00 0.29 0.00 0.00 0.00 175.10 174.50 1llb n LYS 126 N 7.83 0.00 -0.95 2.72 4.01 -1.26 -4.30 118.16 126.20 1llb n LYS 126 Ca 0.12 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.63 1llb n LYS 126 Cb 0.49 -0.17 0.20 0.00 -0.51 0.00 0.00 35.03 35.05 1llb n LYS 126 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1llb s SER 127 N -3.38 2.05 0.27 4.39 1.04 -1.26 -4.84 113.70 111.96 1llb s SER 127 Ca 0.00 1.31 0.02 0.00 0.48 0.00 0.00 55.95 57.75 1llb s SER 127 Cb 0.00 -2.01 0.37 0.00 0.10 0.00 0.00 66.02 64.48 1llb s SER 127 CO 0.00 -3.51 1.70 -1.28 0.98 0.00 0.00 173.24 171.13 1llb h SER 128 N -2.15 0.51 0.58 7.02 0.87 -1.99 -1.47 113.55 116.92 1llb h SER 128 Ca -0.57 -0.18 -0.12 0.00 -1.23 0.00 0.00 61.79 59.69 1llb h SER 128 Cb 1.33 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 63.13 1llb h SER 128 CO 0.55 0.77 -0.57 0.77 -0.53 0.00 0.00 176.83 177.82 1llb h SER 129 N 0.44 0.00 -0.45 6.23 4.64 -1.99 -0.58 113.55 121.84 1llb h SER 129 Ca 0.06 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.26 1llb h SER 129 Cb 0.70 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.78 1llb h SER 129 CO 0.05 0.57 -0.19 0.44 -0.87 0.00 0.00 176.83 176.83 1llb h ASP 130 N 0.00 0.97 -0.44 4.97 3.45 -1.78 -1.76 116.42 121.83 1llb h ASP 130 Ca -0.01 -0.35 -0.06 0.00 0.43 0.00 0.00 57.03 57.04 1llb h ASP 130 Cb 1.01 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 39.49 1llb h ASP 130 CO 0.07 1.13 0.04 0.25 -1.57 0.00 0.00 179.24 179.17 1llb h LEU 131 N 0.83 0.73 -0.70 1.55 5.85 -0.84 -1.30 115.31 121.43 1llb h LEU 131 Ca 0.11 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1llb h LEU 131 Cb 0.76 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 1llb h LEU 131 CO 0.06 0.83 0.38 0.25 -0.34 0.00 0.00 178.44 179.62 1llb h LEU 132 N 0.61 0.87 -0.48 2.25 5.85 -0.98 -1.96 115.31 121.47 1llb h LEU 132 Ca 0.13 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1llb h LEU 132 Cb 0.43 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1llb h LEU 132 CO 0.01 0.72 0.29 -0.09 -0.34 0.00 0.00 178.44 179.03 1llb h ARG 133 N 0.96 0.65 -0.17 1.25 2.43 -1.06 -0.22 114.38 118.23 1llb h ARG 133 Ca 0.25 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.39 1llb h ARG 133 Cb 0.04 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 1llb h ARG 133 CO -0.04 0.47 0.01 0.35 -1.51 0.00 0.00 179.97 179.25 1llb h PHE 134 N 0.64 0.01 -0.12 2.20 3.57 -0.77 -0.91 116.94 121.56 1llb h PHE 134 Ca 0.17 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.55 1llb h PHE 134 Cb -0.01 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 1llb h PHE 134 CO -0.03 -0.01 -0.50 1.88 -2.23 0.00 0.00 178.31 177.42 1llb h TYR 135 N 0.06 0.40 -0.55 0.41 0.05 -1.17 -2.07 116.97 114.10 1llb h TYR 135 Ca 0.08 -0.13 -0.10 0.00 0.05 0.00 0.00 58.73 58.63 1llb h TYR 135 Cb 0.09 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 1llb h TYR 135 CO -0.15 0.76 -0.04 1.96 -1.05 0.00 0.00 178.16 179.63 1llb h GLN 136 N 0.26 0.97 0.00 4.88 1.08 -0.82 -3.11 115.11 118.36 1llb h GLN 136 Ca 0.01 -0.31 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 1llb h GLN 136 Cb 0.97 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.31 1llb h GLN 136 CO 0.08 0.98 -0.30 0.09 -0.95 0.00 0.00 178.83 178.73 1llb n ASN 137 N -4.17 0.57 -4.74 1.46 5.03 -0.36 -4.85 115.26 108.19 1llb n ASN 137 Ca 0.02 0.26 -0.41 0.00 0.87 0.00 0.00 54.58 55.32 1llb n ASN 137 Cb 0.36 -0.23 -0.02 0.00 -1.02 0.00 0.00 39.78 38.87 1llb n ASN 137 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1llb s TRP 138 N -3.09 2.92 -0.24 3.10 -0.00 -0.79 -5.00 118.94 115.85 1llb s TRP 138 Ca 0.10 0.90 -0.03 0.00 -0.00 0.00 0.00 56.10 57.07 1llb s TRP 138 Cb 0.15 -3.93 0.01 0.00 -0.00 0.00 0.00 33.47 29.71 1llb s TRP 138 CO 0.64 -3.09 -0.05 -0.65 -0.00 0.00 0.00 176.95 173.81 1llb s GLN 139 N -0.30 3.03 0.55 5.86 -1.52 -1.26 -4.99 119.66 121.04 1llb s GLN 139 Ca 0.62 -0.85 -0.21 0.00 -1.95 0.00 0.00 55.36 52.97 1llb s GLN 139 Cb -0.44 -3.01 -0.04 0.00 -0.22 0.00 0.00 33.01 29.29 1llb s GLN 139 CO 0.44 -0.33 1.28 -1.25 -0.25 0.00 0.00 175.29 175.18 1llb s PRO 140 N 1.39 3.13 0.02 2.91 0.04 -1.26 -4.92 135.00 136.31 1llb s PRO 140 Ca 0.02 2.03 0.16 0.00 0.04 0.00 0.00 61.00 63.25 1llb s PRO 140 Cb -0.16 -2.15 -0.17 0.00 0.04 0.00 0.00 34.50 32.06 1llb s PRO 140 CO -0.04 -1.13 0.74 0.00 0.04 0.00 0.00 177.00 176.61 1llb n ALA 141 N -1.18 1.79 -2.16 8.56 0.00 -0.37 -4.96 120.51 122.18 1llb n ALA 141 Ca 0.11 -0.64 -0.10 0.00 0.00 0.00 0.00 53.44 52.81 1llb n ALA 141 Cb 0.47 -0.90 -0.10 0.00 0.00 0.00 0.00 19.45 18.92 1llb n ALA 141 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1llb s TRP 142 N -2.81 0.84 0.69 0.00 0.51 -1.11 -5.06 118.94 111.99 1llb s TRP 142 Ca -0.04 -0.96 -0.15 0.00 -2.12 0.00 0.00 56.10 52.83 1llb s TRP 142 Cb 0.08 -0.50 0.02 0.00 -0.81 0.00 0.00 33.47 32.26 1llb s TRP 142 CO 0.82 -0.21 1.14 0.00 -0.51 0.00 0.00 176.95 178.19 1llb s ALA 143 N -3.70 2.33 0.56 0.98 0.00 -1.26 -4.36 121.76 116.31 1llb s ALA 143 Ca 0.12 0.67 -0.21 0.00 0.00 0.00 0.00 51.96 52.54 1llb s ALA 143 Cb 0.06 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 1llb s ALA 143 CO -0.05 -1.50 1.33 -1.25 0.00 0.00 0.00 175.76 174.29 1llb s PRO 144 N -4.03 3.07 -1.40 0.00 0.04 -1.26 -3.32 135.00 128.10 1llb s PRO 144 Ca 0.70 2.17 0.00 0.00 0.04 0.00 0.00 61.00 63.90 1llb s PRO 144 Cb -0.24 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.12 1llb s PRO 144 CO 0.43 -1.23 0.00 0.41 0.04 0.00 0.00 177.00 176.65 1llb n GLY 145 N 0.73 -0.22 0.01 0.56 0.00 0.80 -4.89 105.19 102.17 1llb n GLY 145 Ca 0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 1llb n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1llb n THR 146 N -3.96 0.10 -4.10 2.61 -2.24 -1.21 -4.85 114.28 100.63 1llb n THR 146 Ca -0.19 -0.05 -0.14 0.00 -2.27 0.00 0.00 64.05 61.40 1llb n THR 146 Cb 0.64 -0.78 -0.12 0.00 -2.10 0.00 0.00 70.33 67.97 1llb n THR 146 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1llb s GLN 147 N -2.03 0.57 -0.17 -0.78 -0.21 -1.26 -1.50 119.66 114.26 1llb s GLN 147 Ca -0.01 -0.70 -0.06 0.00 0.02 0.00 0.00 55.36 54.60 1llb s GLN 147 Cb 0.00 -0.40 -0.04 0.00 1.00 0.00 0.00 33.01 33.58 1llb s GLN 147 CO 0.05 0.08 0.04 0.50 -2.12 0.00 0.00 175.29 173.84 1llb s ARG 148 N -1.38 3.90 -0.23 2.91 3.52 0.56 -4.29 118.95 123.94 1llb s ARG 148 Ca -0.07 -0.38 -0.03 0.00 -0.13 0.00 0.00 55.73 55.11 1llb s ARG 148 Cb -0.09 -3.14 0.08 0.00 -1.56 0.00 0.00 34.95 30.24 1llb s ARG 148 CO 0.01 0.28 0.08 -1.17 -0.81 0.00 0.00 175.30 173.68 1llb s LEU 149 N 0.34 1.01 0.05 -0.88 2.96 -0.66 -1.72 118.68 119.78 1llb s LEU 149 Ca 0.01 -1.02 -0.37 0.00 -0.22 0.00 0.00 54.13 52.54 1llb s LEU 149 Cb -0.13 -0.50 -0.16 0.00 0.50 0.00 0.00 46.19 45.90 1llb s LEU 149 CO 0.01 -0.37 1.40 0.00 -1.32 0.00 0.00 176.35 176.07 1llb n TYR 150 N 5.12 1.62 -3.67 5.38 4.19 -1.26 -4.77 117.16 123.76 1llb n TYR 150 Ca -0.07 0.60 -0.09 0.00 3.31 0.00 0.00 57.90 61.66 1llb n TYR 150 Cb 0.45 -2.36 -0.09 0.00 0.49 0.00 0.00 39.34 37.83 1llb n TYR 150 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1llb s ALA 151 N 0.85 -1.34 0.33 2.98 0.00 -1.26 -4.37 121.76 118.96 1llb s ALA 151 Ca 0.86 1.79 0.09 0.00 0.00 0.00 0.00 51.96 54.70 1llb s ALA 151 Cb -0.95 -1.19 0.59 0.00 0.00 0.00 0.00 23.12 21.57 1llb s ALA 151 CO 0.48 -0.44 1.78 -0.91 0.00 0.00 0.00 175.76 176.67 1llb h ASN 152 N 7.37 0.17 0.88 0.00 2.35 -0.39 -2.56 115.58 123.40 1llb h ASN 152 Ca -0.30 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.39 1llb h ASN 152 Cb 1.17 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.50 1llb h ASN 152 CO 0.21 0.51 0.00 -1.54 -1.65 0.00 0.00 177.43 174.97 1llb n SER 153 N -4.09 0.39 -0.04 5.81 3.41 -1.22 -0.84 113.62 117.05 1llb n SER 153 Ca -0.01 0.57 -0.02 0.00 -0.26 0.00 0.00 58.87 59.14 1llb n SER 153 Cb 0.42 -0.66 -0.01 0.00 -0.26 0.00 0.00 64.21 63.70 1llb n SER 153 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1llb h SER 154 N 0.00 0.00 0.73 4.04 0.87 -1.70 -3.24 113.55 114.25 1llb h SER 154 Ca 0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 1llb h SER 154 Cb 0.44 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 1llb h SER 154 CO 0.00 0.40 -0.20 -0.29 -0.53 0.00 0.00 176.83 176.21 1llb h ILE 155 N -0.56 0.57 -0.57 2.23 2.10 -1.37 -2.05 117.51 117.85 1llb h ILE 155 Ca 0.00 -0.95 -0.05 0.00 1.08 0.00 0.00 64.86 64.94 1llb h ILE 155 Cb 0.25 1.64 -0.02 0.00 -1.09 0.00 0.00 36.82 37.59 1llb h ILE 155 CO 0.00 0.20 0.18 1.23 -1.08 0.00 0.00 178.15 178.68 1llb h GLY 156 N 1.66 0.95 1.30 8.18 0.00 -1.17 -0.53 103.07 113.47 1llb h GLY 156 Ca -0.00 -0.56 -0.14 0.00 0.00 0.00 0.00 47.33 46.62 1llb h GLY 156 CO 0.03 0.53 -0.37 -2.00 0.00 0.00 0.00 176.54 174.73 1llb h LEU 157 N 0.80 0.82 -0.45 3.11 5.85 -1.48 -2.13 115.31 121.83 1llb h LEU 157 Ca 0.18 -0.36 0.06 0.00 0.84 0.00 0.00 57.88 58.60 1llb h LEU 157 Cb 0.28 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 1llb h LEU 157 CO -0.01 1.10 0.16 0.15 -0.34 0.00 0.00 178.44 179.50 1llb h PHE 158 N 0.64 0.27 -0.32 1.25 3.57 -0.92 -0.30 116.94 121.14 1llb h PHE 158 Ca 0.06 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 1llb h PHE 158 Cb 0.92 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 1llb h PHE 158 CO 0.05 0.09 0.20 0.78 -2.23 0.00 0.00 178.31 177.20 1llb h GLY 159 N 0.32 0.45 1.08 2.40 0.00 -0.86 0.45 103.07 106.92 1llb h GLY 159 Ca 0.21 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.33 1llb h GLY 159 CO -0.22 0.18 0.40 0.00 0.00 0.00 0.00 176.54 176.89 1llb h ALA 160 N 1.09 1.14 0.02 3.60 0.00 -0.96 -2.95 119.26 121.20 1llb h ALA 160 Ca 0.11 -0.16 -0.21 0.00 0.00 0.00 0.00 54.91 54.65 1llb h ALA 160 Cb -0.01 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1llb h ALA 160 CO -0.02 0.65 -0.97 -0.07 0.00 0.00 0.00 179.25 178.84 1llb h LEU 161 N 1.18 0.17 -1.96 0.00 3.38 -0.83 -3.29 115.31 113.97 1llb h LEU 161 Ca 0.28 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1llb h LEU 161 Cb 0.12 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1llb h LEU 161 CO -0.04 1.04 -0.08 0.00 0.09 0.00 0.00 178.44 179.45 1llb h ALA 162 N 0.94 1.68 -0.06 1.53 0.00 -0.73 -1.80 119.26 120.83 1llb h ALA 162 Ca -0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1llb h ALA 162 Cb 1.65 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.43 1llb h ALA 162 CO 0.14 0.11 0.00 1.33 0.00 0.00 0.00 179.25 180.83 1llb n VAL 163 N -4.18 0.05 -0.05 0.00 0.24 -1.21 -4.53 118.33 108.66 1llb n VAL 163 Ca -0.03 -0.40 -0.08 0.00 -2.04 0.00 0.00 64.34 61.79 1llb n VAL 163 Cb 0.17 0.97 -0.02 0.00 -1.47 0.00 0.00 33.84 33.48 1llb n VAL 163 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1llb h LYS 164 N 3.55 0.01 -0.36 7.34 1.79 -1.43 -2.55 116.57 124.92 1llb h LYS 164 Ca 0.00 -0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.50 1llb h LYS 164 Cb 0.76 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.39 1llb h LYS 164 CO 0.00 0.01 0.24 -1.35 -1.08 0.00 0.00 179.45 177.27 1llb h PRO 165 N 0.01 0.34 0.00 3.15 0.11 -1.79 -1.62 132.00 132.19 1llb h PRO 165 Ca 0.11 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.19 1llb h PRO 165 Cb 0.16 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.19 1llb h PRO 165 CO -0.22 0.23 -0.03 0.66 -0.21 0.00 0.00 178.00 178.43 1llb h SER 166 N 0.35 0.00 0.00 -2.05 4.64 -1.76 -3.46 113.55 111.28 1llb h SER 166 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1llb h SER 166 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1llb h SER 166 CO -0.03 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1llb n GLY 167 N -0.45 0.54 3.93 -0.77 0.00 -0.61 -4.99 105.19 102.84 1llb n GLY 167 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 1llb n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llb s LEU 168 N 0.00 4.16 0.75 0.99 1.43 -1.26 -5.08 118.68 119.67 1llb s LEU 168 Ca 0.00 0.42 -0.11 0.00 -1.03 0.00 0.00 54.13 53.40 1llb s LEU 168 Cb 0.00 -3.22 0.04 0.00 0.03 0.00 0.00 46.19 43.05 1llb s LEU 168 CO 0.00 -0.13 1.08 -0.94 0.23 0.00 0.00 176.35 176.59 1llb s SER 169 N -3.48 4.87 0.21 2.29 1.04 -1.26 -4.73 113.70 112.64 1llb s SER 169 Ca 0.39 1.47 -0.09 0.00 0.48 0.00 0.00 55.95 58.20 1llb s SER 169 Cb -0.10 -2.27 0.25 0.00 0.10 0.00 0.00 66.02 64.00 1llb s SER 169 CO 0.31 -1.75 1.81 0.15 0.98 0.00 0.00 173.24 174.74 1llb h PHE 170 N -0.93 0.72 -0.37 5.02 3.57 -1.93 0.17 116.94 123.19 1llb h PHE 170 Ca -0.45 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.04 1llb h PHE 170 Cb 1.24 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.74 1llb h PHE 170 CO 0.54 0.35 0.12 1.49 -2.23 0.00 0.00 178.31 178.57 1llb h GLU 171 N 0.72 0.58 -0.57 1.11 4.81 -1.99 0.13 114.58 119.38 1llb h GLU 171 Ca 0.31 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.38 1llb h GLU 171 Cb 0.18 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 1llb h GLU 171 CO -0.18 0.59 0.24 1.96 -0.73 0.00 0.00 179.01 180.89 1llb h GLN 172 N 0.46 0.84 -0.23 1.92 4.20 -1.82 -0.26 115.11 120.22 1llb h GLN 172 Ca 0.12 -0.15 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 1llb h GLN 172 Cb 0.25 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1llb h GLN 172 CO -0.00 0.72 0.12 0.00 -0.67 0.00 0.00 178.83 178.99 1llb h ALA 173 N 1.08 0.30 -0.25 3.87 0.00 -0.81 -0.77 119.26 122.69 1llb h ALA 173 Ca 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1llb h ALA 173 Cb 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1llb h ALA 173 CO -0.02 -0.16 0.16 1.98 0.00 0.00 0.00 179.25 181.22 1llb h MET 174 N 0.26 0.32 -0.12 0.00 1.85 -0.72 0.14 114.93 116.66 1llb h MET 174 Ca 0.08 -0.02 -0.00 0.00 -0.61 0.00 0.00 59.70 59.15 1llb h MET 174 Cb 0.09 -0.07 -0.01 0.00 0.43 0.00 0.00 31.60 32.04 1llb h MET 174 CO -0.01 0.21 0.07 1.96 -0.40 0.00 0.00 176.91 178.74 1llb h GLN 175 N 0.33 0.16 0.00 0.39 1.08 -0.93 -0.75 115.11 115.40 1llb h GLN 175 Ca 0.09 -0.01 -0.20 0.00 -1.45 0.00 0.00 58.65 57.08 1llb h GLN 175 Cb -0.04 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.33 1llb h GLN 175 CO -0.02 0.15 -0.95 1.79 -0.95 0.00 0.00 178.83 178.85 1llb h THR 176 N 0.12 1.66 0.00 -0.54 1.35 -1.04 0.75 112.91 115.21 1llb h THR 176 Ca 0.04 -3.19 -0.02 0.00 -0.55 0.00 0.00 66.41 62.69 1llb h THR 176 Cb 0.03 2.73 -0.00 0.00 -1.73 0.00 0.00 68.15 69.18 1llb h THR 176 CO -0.01 0.91 -1.89 0.54 -0.25 0.00 0.00 175.52 174.82 1llb n ARG 177 N -3.44 0.65 0.06 4.72 1.74 0.49 -4.42 116.66 116.47 1llb n ARG 177 Ca -0.01 -0.15 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 1llb n ARG 177 Cb 0.89 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 1llb n ARG 177 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1llb n VAL 178 N -2.34 1.03 0.28 1.55 0.31 -0.41 -4.73 118.33 114.01 1llb n VAL 178 Ca -0.05 0.34 -0.16 0.00 -0.01 0.00 0.00 64.34 64.46 1llb n VAL 178 Cb 0.60 -1.42 -0.08 0.00 -0.91 0.00 0.00 33.84 32.03 1llb n VAL 178 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1llb h PHE 179 N 0.00 -0.85 0.14 3.52 0.04 -1.25 -2.85 116.94 115.70 1llb h PHE 179 Ca 0.00 -0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.77 1llb h PHE 179 Cb 0.00 0.31 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 1llb h PHE 179 CO 0.00 -0.48 -0.19 1.96 -0.60 0.00 0.00 178.31 178.99 1llb h GLN 180 N -0.77 -0.38 -0.79 1.51 4.20 -1.08 0.17 115.11 117.98 1llb h GLN 180 Ca -0.05 0.03 0.10 0.00 0.06 0.00 0.00 58.65 58.79 1llb h GLN 180 Cb 0.64 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.45 1llb h GLN 180 CO 0.03 -0.25 0.52 -1.35 -0.67 0.00 0.00 178.83 177.11 1llb h PRO 181 N -0.39 0.68 -0.20 1.46 0.11 -1.77 -1.15 132.00 130.74 1llb h PRO 181 Ca 0.02 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1llb h PRO 181 Cb 0.39 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.35 1llb h PRO 181 CO -0.08 0.45 0.00 1.28 -0.21 0.00 0.00 178.00 179.44 1llb n LEU 182 N -4.51 1.68 -3.76 2.35 4.77 -1.08 -4.94 117.00 111.52 1llb n LEU 182 Ca 0.13 -0.73 -0.26 0.00 -0.03 0.00 0.00 56.01 55.11 1llb n LEU 182 Cb 0.34 -0.13 0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1llb n LEU 182 CO 0.32 0.37 0.13 0.29 -1.33 0.00 0.00 177.39 177.17 1llb n LYS 183 N 0.35 -6.30 -3.13 3.23 5.02 -0.44 -4.90 118.16 111.99 1llb n LYS 183 Ca 0.15 0.69 -0.44 0.00 -2.02 0.00 0.00 58.31 56.69 1llb n LYS 183 Cb 0.32 -5.60 0.00 0.00 -0.02 0.00 0.00 35.03 29.73 1llb n LYS 183 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1llb n LEU 184 N -4.71 5.49 -0.25 -0.35 4.77 -0.03 -4.80 117.00 117.12 1llb n LEU 184 Ca -0.03 -4.80 0.13 0.00 -0.03 0.00 0.00 56.01 51.28 1llb n LEU 184 Cb 0.56 -1.53 0.64 0.00 -2.33 0.00 0.00 43.42 40.77 1llb n LEU 184 CO 0.71 1.12 0.93 0.59 -1.33 0.00 0.00 177.39 179.40 1llb n ASN 185 N 3.85 0.77 -2.55 -1.43 3.02 -1.26 -3.69 115.26 113.97 1llb n ASN 185 Ca 0.30 -1.36 -0.09 0.00 -0.03 0.00 0.00 54.58 53.40 1llb n ASN 185 Cb 0.40 -0.02 0.04 0.00 -0.61 0.00 0.00 39.78 39.59 1llb n ASN 185 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1llb n HIS 186 N -0.35 1.79 -4.89 3.10 8.25 -1.26 -5.02 115.22 116.84 1llb n HIS 186 Ca 0.19 -2.18 -0.29 0.00 -0.26 0.00 0.00 57.72 55.19 1llb n HIS 186 Cb 0.22 -0.27 -0.17 0.00 1.12 0.00 0.00 29.99 30.89 1llb n HIS 186 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1llb s THR 187 N -4.09 1.63 0.02 1.59 2.01 -1.24 -3.50 115.64 112.05 1llb s THR 187 Ca 0.35 -0.76 -0.03 0.00 0.31 0.00 0.00 61.69 61.56 1llb s THR 187 Cb 0.35 -1.43 -0.01 0.00 0.01 0.00 0.00 72.50 71.41 1llb s THR 187 CO -0.01 0.46 0.04 0.26 -0.69 0.00 0.00 174.62 174.68 1llb s TRP 188 N 0.53 0.20 -0.15 4.92 0.52 0.23 -4.99 118.94 120.20 1llb s TRP 188 Ca -0.16 -0.43 -0.04 0.00 0.02 0.00 0.00 56.10 55.49 1llb s TRP 188 Cb -0.17 -0.15 -0.24 0.00 -1.15 0.00 0.00 33.47 31.76 1llb s TRP 188 CO 0.06 -0.26 0.25 -0.89 0.02 0.00 0.00 176.95 176.13 1llb n ILE 189 N 1.34 1.71 -4.13 2.03 5.41 -1.26 -0.55 119.36 123.92 1llb n ILE 189 Ca -0.22 -0.65 -0.31 0.00 1.00 0.00 0.00 62.75 62.57 1llb n ILE 189 Cb 0.56 -1.63 -0.16 0.00 -0.71 0.00 0.00 39.64 37.70 1llb n ILE 189 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1llb s ASN 190 N -6.88 2.88 -0.07 4.38 -0.87 -1.26 -4.75 114.94 108.36 1llb s ASN 190 Ca -0.24 -0.56 -0.30 0.00 -1.57 0.00 0.00 52.86 50.19 1llb s ASN 190 Cb 0.07 -1.31 -0.04 0.00 -0.02 0.00 0.00 41.25 39.94 1llb s ASN 190 CO 0.74 -0.02 1.47 -0.69 -2.57 0.00 0.00 177.10 176.03 1llb s VAL 191 N 1.34 3.82 0.64 1.60 1.01 -1.26 -4.99 120.40 122.56 1llb s VAL 191 Ca 0.04 1.05 -0.14 0.00 0.00 0.00 0.00 61.98 62.92 1llb s VAL 191 Cb -0.13 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 1llb s VAL 191 CO -0.11 -0.07 1.08 -2.84 0.00 0.00 0.00 175.10 173.16 1llb s PRO 192 N 3.44 3.00 0.33 2.72 0.02 -1.26 -4.88 135.00 138.37 1llb s PRO 192 Ca 0.65 1.23 0.08 0.00 0.02 0.00 0.00 61.00 62.98 1llb s PRO 192 Cb -0.29 -1.99 0.78 0.00 0.02 0.00 0.00 34.50 33.02 1llb s PRO 192 CO 0.24 -1.07 1.82 -1.35 -0.33 0.00 0.00 177.00 176.31 1llb h PRO 193 N 0.01 0.72 0.00 5.54 0.11 -2.01 0.05 132.00 136.42 1llb h PRO 193 Ca -0.46 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 1llb h PRO 193 Cb 1.23 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1llb h PRO 193 CO 0.56 0.47 -0.02 0.00 -0.21 0.00 0.00 178.00 178.80 1llb h ALA 194 N 1.61 1.10 -0.05 -0.75 0.00 -2.03 -2.63 119.26 116.52 1llb h ALA 194 Ca 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1llb h ALA 194 Cb 0.83 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1llb h ALA 194 CO -0.28 0.02 0.00 0.39 0.00 0.00 0.00 179.25 179.38 1llb n GLU 195 N -3.25 1.42 0.19 0.00 -0.58 -0.01 -4.53 120.64 113.88 1llb n GLU 195 Ca -0.02 -1.55 0.11 0.00 -0.42 0.00 0.00 57.16 55.28 1llb n GLU 195 Cb 0.13 -1.33 0.65 0.00 -0.57 0.00 0.00 31.44 30.32 1llb n GLU 195 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1llb h GLU 196 N 3.31 0.02 -0.12 3.49 5.08 -1.25 -0.58 114.58 124.53 1llb h GLU 196 Ca 0.00 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1llb h GLU 196 Cb 0.71 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 1llb h GLU 196 CO 0.00 0.01 0.13 1.57 -1.00 0.00 0.00 179.01 179.72 1llb h LYS 197 N 0.02 0.00 -0.01 2.33 2.10 -1.80 -1.75 116.57 117.46 1llb h LYS 197 Ca 0.07 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.72 1llb h LYS 197 Cb 0.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 1llb h LYS 197 CO -0.00 0.00 -0.66 0.09 -2.00 0.00 0.00 179.45 176.88 1llb n ASN 198 N -3.89 1.41 -4.59 7.07 4.13 -0.23 -4.91 115.26 114.26 1llb n ASN 198 Ca 0.00 -1.15 -0.43 0.00 1.68 0.00 0.00 54.58 54.68 1llb n ASN 198 Cb 0.24 0.63 -0.03 0.00 -1.54 0.00 0.00 39.78 39.08 1llb n ASN 198 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1llb s TYR 199 N -2.73 2.78 0.81 3.10 6.04 -0.66 -0.34 117.35 126.35 1llb s TYR 199 Ca 0.14 0.55 -0.12 0.00 0.04 0.00 0.00 57.07 57.69 1llb s TYR 199 Cb 0.17 -4.38 0.09 0.00 -1.04 0.00 0.00 41.96 36.80 1llb s TYR 199 CO 0.69 -1.33 1.15 0.00 -1.54 0.00 0.00 175.55 174.52 1llb s ALA 200 N 4.46 1.89 0.09 3.97 0.00 -0.66 -4.93 121.76 126.57 1llb s ALA 200 Ca 0.44 0.61 -0.08 0.00 0.00 0.00 0.00 51.96 52.93 1llb s ALA 200 Cb -0.08 -3.41 -0.06 0.00 0.00 0.00 0.00 23.12 19.57 1llb s ALA 200 CO 0.29 -2.20 0.37 -1.58 0.00 0.00 0.00 175.76 172.64 1llb s TRP 201 N -2.48 3.55 0.42 0.00 0.52 -0.22 -4.94 118.94 115.78 1llb s TRP 201 Ca 0.68 0.68 -0.02 0.00 0.02 0.00 0.00 56.10 57.45 1llb s TRP 201 Cb -0.23 -2.08 -0.03 0.00 -1.15 0.00 0.00 33.47 29.97 1llb s TRP 201 CO 0.53 0.51 0.67 0.20 0.02 0.00 0.00 176.95 178.87 1llb s GLY 202 N -1.97 1.42 -0.10 0.98 0.00 0.00 -4.83 107.32 102.83 1llb s GLY 202 Ca 0.35 -0.71 0.01 0.00 0.00 0.00 0.00 44.72 44.36 1llb s GLY 202 CO 0.20 -0.60 -0.11 -0.19 0.00 0.00 0.00 173.10 172.41 1llb s TYR 203 N -2.54 1.60 -0.13 1.90 1.51 -0.65 -0.08 117.35 118.96 1llb s TYR 203 Ca 0.44 -0.75 -0.01 0.00 -1.01 0.00 0.00 57.07 55.74 1llb s TYR 203 Cb -0.10 -1.24 0.04 0.00 -0.11 0.00 0.00 41.96 40.55 1llb s TYR 203 CO 0.41 -0.45 -0.02 0.50 -1.11 0.00 0.00 175.55 174.87 1llb s ARG 204 N 1.28 1.03 -1.46 -0.62 3.52 -0.36 -4.41 118.95 117.93 1llb s ARG 204 Ca -0.02 -0.24 -0.09 0.00 -0.13 0.00 0.00 55.73 55.25 1llb s ARG 204 Cb -0.14 -1.60 0.06 0.00 -1.56 0.00 0.00 34.95 31.71 1llb s ARG 204 CO -0.04 -0.39 0.87 0.39 -0.81 0.00 0.00 175.30 175.32 1llb n GLU 205 N 5.01 -5.24 -0.47 5.12 1.02 -1.26 -1.37 120.64 123.46 1llb n GLU 205 Ca -0.10 0.60 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 1llb n GLU 205 Cb 0.49 -5.35 0.00 0.00 -0.02 0.00 0.00 31.44 26.56 1llb n GLU 205 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1llb n GLY 206 N -1.67 1.46 3.85 0.62 0.00 -1.26 -5.00 105.19 103.18 1llb n GLY 206 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 1llb n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llb s LYS 207 N -0.13 3.62 -0.04 1.61 1.02 -0.47 -5.05 119.74 120.30 1llb s LYS 207 Ca 0.00 -0.09 -0.30 0.00 0.02 0.00 0.00 55.97 55.60 1llb s LYS 207 Cb 0.00 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 34.03 1llb s LYS 207 CO 0.00 0.68 1.30 0.00 -0.92 0.00 0.00 175.35 176.41 1llb s ALA 208 N -0.77 3.55 0.04 5.17 0.00 -1.26 -1.23 121.76 127.26 1llb s ALA 208 Ca 0.15 0.72 -0.03 0.00 0.00 0.00 0.00 51.96 52.80 1llb s ALA 208 Cb -0.12 -3.57 -0.02 0.00 0.00 0.00 0.00 23.12 19.41 1llb s ALA 208 CO 0.04 -0.88 0.03 0.14 0.00 0.00 0.00 175.76 175.09 1llb s VAL 209 N 2.46 0.15 0.16 0.00 -7.23 0.88 -4.92 120.40 111.91 1llb s VAL 209 Ca 0.60 -1.23 0.07 0.00 -1.81 0.00 0.00 61.98 59.61 1llb s VAL 209 Cb -0.27 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.72 1llb s VAL 209 CO 0.23 -0.68 -0.16 -1.00 -0.31 0.00 0.00 175.10 173.18 1llb s HIS 210 N -2.68 1.67 0.37 2.82 3.76 -1.26 -0.81 115.29 119.16 1llb s HIS 210 Ca -0.04 -0.53 -0.28 0.00 -0.15 0.00 0.00 55.06 54.06 1llb s HIS 210 Cb -0.01 -0.83 -0.11 0.00 1.11 0.00 0.00 32.58 32.75 1llb s HIS 210 CO -0.05 0.28 1.44 0.54 -0.85 0.00 0.00 174.74 176.10 1llb s VAL 211 N -2.33 2.21 0.28 -0.90 0.11 -1.26 -4.99 120.40 113.52 1llb s VAL 211 Ca 0.16 0.21 -0.16 0.00 -2.93 0.00 0.00 61.98 59.26 1llb s VAL 211 Cb -0.04 -3.13 -0.09 0.00 -1.53 0.00 0.00 36.38 31.59 1llb s VAL 211 CO 0.05 0.05 0.71 -0.44 -3.33 0.00 0.00 175.10 172.15 1llb s SER 212 N -0.27 6.86 0.59 3.54 0.01 -1.26 -5.05 113.70 118.12 1llb s SER 212 Ca 0.53 1.30 -0.20 0.00 1.31 0.00 0.00 55.95 58.89 1llb s SER 212 Cb -0.45 -2.38 -0.03 0.00 0.21 0.00 0.00 66.02 63.37 1llb s SER 212 CO 0.60 -0.10 1.28 -2.84 0.41 0.00 0.00 173.24 172.59 1llb s PRO 213 N -2.59 2.94 0.10 12.44 0.02 -1.26 -5.02 135.00 141.63 1llb s PRO 213 Ca 0.49 2.03 -0.26 0.00 0.02 0.00 0.00 61.00 63.29 1llb s PRO 213 Cb -0.13 -2.04 0.08 0.00 0.02 0.00 0.00 34.50 32.43 1llb s PRO 213 CO 0.19 -1.28 0.77 0.20 -0.33 0.00 0.00 177.00 176.55 1llb s GLY 214 N -1.31 -0.47 0.26 0.52 0.00 -1.26 -5.08 107.32 99.99 1llb s GLY 214 Ca 0.76 0.61 -0.30 0.00 0.00 0.00 0.00 44.72 45.79 1llb s GLY 214 CO 0.40 0.20 1.51 0.00 0.00 0.00 0.00 173.10 175.21 1llb s ALA 215 N -3.44 3.69 -1.51 3.20 0.00 -1.26 -2.08 121.76 120.35 1llb s ALA 215 Ca 0.05 1.43 -0.02 0.00 0.00 0.00 0.00 51.96 53.41 1llb s ALA 215 Cb -0.01 -3.60 0.01 0.00 0.00 0.00 0.00 23.12 19.52 1llb s ALA 215 CO -0.08 -0.84 0.21 1.28 0.00 0.00 0.00 175.76 176.34 1llb n LEU 216 N 2.40 -1.92 -0.09 0.00 4.77 -1.26 -4.85 117.00 116.04 1llb n LEU 216 Ca 0.08 -0.08 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 1llb n LEU 216 Cb 0.39 -2.69 -0.04 0.00 -2.33 0.00 0.00 43.42 38.75 1llb n LEU 216 CO 0.62 -0.04 0.52 -2.24 -1.33 0.00 0.00 177.39 174.92 1llb h ASP 217 N -0.48 0.87 -0.63 -1.43 3.04 -1.84 -2.53 116.42 113.43 1llb h ASP 217 Ca -0.45 -0.49 0.06 0.00 -3.24 0.00 0.00 57.03 52.90 1llb h ASP 217 Cb 1.33 -0.25 -0.05 0.00 -1.04 0.00 0.00 39.33 39.31 1llb h ASP 217 CO 0.52 1.19 0.33 0.00 -2.04 0.00 0.00 179.24 179.24 1llb h ALA 218 N 0.71 0.83 -0.04 4.15 0.00 -1.89 0.31 119.26 123.32 1llb h ALA 218 Ca 0.04 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1llb h ALA 218 Cb 0.98 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1llb h ALA 218 CO 0.09 -0.01 -0.58 0.93 0.00 0.00 0.00 179.25 179.67 1llb h GLU 219 N 0.61 0.12 0.00 0.00 3.07 -1.89 -3.33 114.58 113.17 1llb h GLU 219 Ca 0.29 -0.08 -0.26 0.00 -0.50 0.00 0.00 59.36 58.81 1llb h GLU 219 Cb 0.20 0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 28.08 1llb h GLU 219 CO -0.19 0.67 -1.96 0.00 -1.40 0.00 0.00 179.01 176.13 1llb n ALA 220 N -2.45 1.65 -1.99 3.43 0.00 -0.96 -4.56 120.51 115.64 1llb n ALA 220 Ca -0.02 -0.92 0.00 0.00 0.00 0.00 0.00 53.44 52.51 1llb n ALA 220 Cb 0.60 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 20.00 1llb n ALA 220 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1llb n TYR 221 N -2.54 0.00 -0.09 0.00 0.18 0.09 -4.07 117.16 110.73 1llb n TYR 221 Ca -0.23 0.00 0.10 0.00 1.88 0.00 0.00 57.90 59.65 1llb n TYR 221 Cb 0.95 0.21 0.29 0.00 -0.38 0.00 0.00 39.34 40.41 1llb n TYR 221 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1llb n GLY 222 N 0.00 2.07 3.81 -7.48 0.00 0.85 -3.52 105.19 100.92 1llb n GLY 222 Ca 0.00 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 1llb n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1llb s VAL 223 N -1.28 4.65 0.00 1.61 1.01 -1.26 -4.48 120.40 120.64 1llb s VAL 223 Ca 0.43 1.27 0.08 0.00 0.00 0.00 0.00 61.98 63.76 1llb s VAL 223 Cb 0.24 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 1llb s VAL 223 CO 0.28 0.42 -0.24 -0.54 0.00 0.00 0.00 175.10 175.02 1llb s LYS 224 N -1.44 1.84 0.27 2.72 3.01 0.29 -0.96 119.74 125.47 1llb s LYS 224 Ca 0.35 -0.91 -0.15 0.00 -1.01 0.00 0.00 55.97 54.25 1llb s LYS 224 Cb -0.19 -1.84 0.01 0.00 -1.01 0.00 0.00 37.83 34.80 1llb s LYS 224 CO 0.21 0.50 0.57 0.45 0.51 0.00 0.00 175.35 177.59 1llb s SER 225 N -0.76 -0.10 0.33 2.83 0.15 -0.69 -0.60 113.70 114.86 1llb s SER 225 Ca 0.09 -0.86 0.07 0.00 0.70 0.00 0.00 55.95 55.95 1llb s SER 225 Cb -0.09 0.65 -0.01 0.00 -1.71 0.00 0.00 66.02 64.85 1llb s SER 225 CO -0.00 -1.24 0.44 0.42 1.20 0.00 0.00 173.24 174.06 1llb s THR 226 N -3.86 4.06 0.40 6.45 -4.23 -1.23 -1.04 115.64 116.19 1llb s THR 226 Ca 0.19 -1.04 0.16 0.00 -1.18 0.00 0.00 61.69 59.81 1llb s THR 226 Cb -0.03 -3.40 0.16 0.00 1.34 0.00 0.00 72.50 70.57 1llb s THR 226 CO 0.09 -0.17 1.92 -0.29 -0.54 0.00 0.00 174.62 175.63 1llb h ILE 227 N 0.95 1.10 -0.19 2.99 6.09 -1.73 -0.72 117.51 126.01 1llb h ILE 227 Ca -0.46 -0.94 -0.09 0.00 -1.37 0.00 0.00 64.86 62.00 1llb h ILE 227 Cb 1.25 1.52 -0.00 0.00 0.47 0.00 0.00 36.82 40.06 1llb h ILE 227 CO 0.54 0.26 -0.23 -0.33 -3.07 0.00 0.00 178.15 175.32 1llb h GLU 228 N 0.00 0.49 -0.18 2.19 5.08 -1.94 -1.10 114.58 119.12 1llb h GLU 228 Ca -0.00 -0.27 -0.10 0.00 -1.00 0.00 0.00 59.36 57.99 1llb h GLU 228 Cb 0.50 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1llb h GLU 228 CO 0.03 0.86 -0.33 -0.44 -1.00 0.00 0.00 179.01 178.14 1llb h ASP 229 N 0.14 0.37 0.38 1.42 3.45 -1.84 -2.02 116.42 118.32 1llb h ASP 229 Ca 0.02 -0.14 -0.14 0.00 0.43 0.00 0.00 57.03 57.21 1llb h ASP 229 Cb 0.79 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.44 1llb h ASP 229 CO 0.05 0.68 -0.59 0.24 -1.57 0.00 0.00 179.24 178.05 1llb h MET 230 N 0.31 0.21 -0.63 3.56 2.86 -1.02 0.67 114.93 120.90 1llb h MET 230 Ca 0.04 -0.14 -0.08 0.00 -2.06 0.00 0.00 59.70 57.46 1llb h MET 230 Cb 0.73 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.39 1llb h MET 230 CO 0.06 0.74 0.08 0.00 1.06 0.00 0.00 176.91 178.84 1llb h ALA 231 N 1.23 0.84 -0.25 6.32 0.00 -0.88 -0.88 119.26 125.64 1llb h ALA 231 Ca -0.00 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 1llb h ALA 231 Cb 1.08 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1llb h ALA 231 CO 0.09 0.62 -0.26 -0.09 0.00 0.00 0.00 179.25 179.61 1llb h ARG 232 N 0.97 0.47 -0.48 0.00 2.43 -0.95 -0.20 114.38 116.61 1llb h ARG 232 Ca 0.19 -0.18 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 1llb h ARG 232 Cb 0.47 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 1llb h ARG 232 CO 0.02 0.69 0.14 2.35 -1.51 0.00 0.00 179.97 181.66 1llb h TRP 233 N 0.42 0.79 -0.51 2.20 -0.00 -0.43 -0.88 115.95 117.54 1llb h TRP 233 Ca 0.06 -0.08 -0.04 0.00 -0.00 0.00 0.00 58.89 58.83 1llb h TRP 233 Cb 0.67 -0.23 -0.02 0.00 -0.00 0.00 0.00 29.16 29.58 1llb h TRP 233 CO 0.02 0.70 0.17 0.28 -0.00 0.00 0.00 178.44 179.61 1llb h VAL 234 N 0.65 1.23 -0.73 2.65 2.07 -0.75 -1.74 116.25 119.63 1llb h VAL 234 Ca 0.15 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 1llb h VAL 234 Cb 0.29 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1llb h VAL 234 CO -0.00 0.28 0.39 1.56 0.02 0.00 0.00 177.57 179.82 1llb h GLN 235 N 0.68 1.01 -0.47 1.57 4.20 -0.78 -0.31 115.11 121.02 1llb h GLN 235 Ca 0.16 -0.11 -0.09 0.00 0.06 0.00 0.00 58.65 58.68 1llb h GLN 235 Cb 0.26 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1llb h GLN 235 CO -0.01 0.75 -0.06 0.77 -0.67 0.00 0.00 178.83 179.61 1llb h SER 236 N 1.02 0.79 1.55 1.46 0.02 -0.81 -1.33 113.55 116.26 1llb h SER 236 Ca 0.26 -0.22 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 1llb h SER 236 Cb 0.03 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1llb h SER 236 CO -0.04 0.90 -0.33 0.78 -1.14 0.00 0.00 176.83 176.99 1llb h ASN 237 N 0.75 0.00 -0.11 3.07 2.35 -0.85 -2.87 115.58 117.92 1llb h ASN 237 Ca 0.13 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.65 1llb h ASN 237 Cb 0.54 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.92 1llb h ASN 237 CO 0.03 0.33 -0.85 -0.07 -1.65 0.00 0.00 177.43 175.22 1llb h LEU 238 N 0.00 0.94 -6.22 1.61 3.38 -0.79 -3.39 115.31 110.83 1llb h LEU 238 Ca -0.00 -0.65 -0.58 0.00 0.09 0.00 0.00 57.88 56.73 1llb h LEU 238 Cb 1.19 -0.28 -0.40 0.00 0.09 0.00 0.00 40.66 41.26 1llb h LEU 238 CO 0.04 1.45 -0.85 0.29 0.09 0.00 0.00 178.44 179.47 1llb n LYS 239 N -3.91 1.45 0.29 1.13 5.02 -0.53 -4.82 118.16 116.79 1llb n LYS 239 Ca -0.08 -3.89 0.15 0.00 -2.02 0.00 0.00 58.31 52.47 1llb n LYS 239 Cb 0.79 -1.76 0.88 0.00 -0.02 0.00 0.00 35.03 34.92 1llb n LYS 239 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1llb h PRO 240 N 4.37 0.00 0.00 1.97 0.13 -1.72 -2.46 132.00 134.30 1llb h PRO 240 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1llb h PRO 240 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1llb h PRO 240 CO 0.62 0.04 0.00 -0.07 -0.23 0.00 0.00 178.00 178.36 1llb h LEU 241 N 0.00 0.00 -0.15 1.56 3.38 -1.90 -1.56 115.31 116.65 1llb h LEU 241 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1llb h LEU 241 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1llb h LEU 241 CO 0.01 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.01 1llb n ASP 242 N -2.98 0.68 -4.70 -0.43 10.43 -0.92 -4.76 116.55 113.87 1llb n ASP 242 Ca -0.00 0.59 -0.42 0.00 2.57 0.00 0.00 54.79 57.52 1llb n ASP 242 Cb 0.22 -0.76 -0.03 0.00 1.84 0.00 0.00 41.12 42.39 1llb n ASP 242 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1llb s ILE 243 N -3.13 4.53 0.15 0.53 1.01 -0.59 -4.94 121.20 118.75 1llb s ILE 243 Ca 0.10 1.82 0.04 0.00 0.00 0.00 0.00 60.65 62.60 1llb s ILE 243 Cb 0.12 -4.17 -0.17 0.00 0.01 0.00 0.00 42.46 38.26 1llb s ILE 243 CO 0.54 0.07 1.34 0.78 0.00 0.00 0.00 174.94 177.67 1llb h ASN 244 N 7.05 0.16 -3.04 3.58 2.35 -1.87 -3.43 115.58 120.37 1llb h ASN 244 Ca -0.37 -0.14 -0.57 0.00 -0.55 0.00 0.00 56.30 54.68 1llb h ASN 244 Cb 1.18 -0.05 -0.04 0.00 0.05 0.00 0.00 38.32 39.46 1llb h ASN 244 CO 0.82 1.00 1.00 -1.61 -1.65 0.00 0.00 177.43 176.99 1llb s GLU 245 N -3.02 3.93 0.11 0.81 8.01 -1.26 -4.92 118.70 122.36 1llb s GLU 245 Ca -0.01 1.38 -0.26 0.00 0.01 0.00 0.00 54.97 56.09 1llb s GLU 245 Cb 0.10 -3.90 -0.08 0.00 -4.31 0.00 0.00 34.13 25.94 1llb s GLU 245 CO 0.82 -1.11 1.65 0.87 0.01 0.00 0.00 175.26 177.50 1llb h LYS 246 N 9.47 -0.40 0.00 1.61 1.57 -2.00 -1.24 116.57 125.58 1llb h LYS 246 Ca -0.28 0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.49 1llb h LYS 246 Cb 1.11 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 1llb h LYS 246 CO 1.02 -0.27 -0.18 1.79 -0.57 0.00 0.00 179.45 181.24 1llb h THR 247 N -0.42 0.93 -0.03 -0.16 1.35 -1.92 -1.64 112.91 111.04 1llb h THR 247 Ca 0.03 -0.66 -0.26 0.00 -0.55 0.00 0.00 66.41 64.98 1llb h THR 247 Cb 0.45 1.38 0.02 0.00 -1.73 0.00 0.00 68.15 68.26 1llb h THR 247 CO -0.14 0.18 -0.99 0.25 -0.25 0.00 0.00 175.52 174.57 1llb h LEU 248 N 0.00 0.88 -0.53 3.87 5.85 -1.82 0.15 115.31 123.71 1llb h LEU 248 Ca -0.00 -0.68 0.03 0.00 0.84 0.00 0.00 57.88 58.06 1llb h LEU 248 Cb 0.36 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1llb h LEU 248 CO 0.02 1.48 0.32 -0.61 -0.34 0.00 0.00 178.44 179.31 1llb h GLN 249 N 0.41 0.61 -0.30 1.25 4.15 -0.88 -1.02 115.11 119.32 1llb h GLN 249 Ca -0.11 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.23 1llb h GLN 249 Cb 1.63 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 29.17 1llb h GLN 249 CO 0.19 0.40 0.04 1.96 -1.93 0.00 0.00 178.83 179.49 1llb h GLN 250 N 0.63 0.51 -0.97 1.69 4.20 -1.22 -2.70 115.11 117.24 1llb h GLN 250 Ca 0.22 -0.14 0.06 0.00 0.06 0.00 0.00 58.65 58.84 1llb h GLN 250 Cb 0.03 -0.06 -0.06 0.00 0.30 0.00 0.00 27.48 27.69 1llb h GLN 250 CO -0.10 0.62 0.62 0.78 -0.67 0.00 0.00 178.83 180.08 1llb h GLY 251 N 0.32 1.46 0.98 3.46 0.00 -0.31 0.48 103.07 109.46 1llb h GLY 251 Ca 0.09 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 1llb h GLY 251 CO 0.01 0.34 0.26 -2.22 0.00 0.00 0.00 176.54 174.93 1llb h ILE 252 N 1.15 1.20 -0.75 2.60 2.04 -1.12 -1.39 117.51 121.24 1llb h ILE 252 Ca 0.41 -0.56 -0.05 0.00 1.00 0.00 0.00 64.86 65.66 1llb h ILE 252 Cb 0.13 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 1llb h ILE 252 CO -0.16 0.22 0.29 1.56 0.00 0.00 0.00 178.15 180.06 1llb h GLN 253 N 0.72 1.12 -0.05 2.37 4.20 -0.98 -2.46 115.11 120.02 1llb h GLN 253 Ca 0.18 -0.20 -0.09 0.00 0.06 0.00 0.00 58.65 58.60 1llb h GLN 253 Cb 0.12 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 1llb h GLN 253 CO -0.02 0.92 -0.37 -0.07 -0.67 0.00 0.00 178.83 178.61 1llb h LEU 254 N 1.09 0.10 -1.62 1.46 3.38 -0.59 -2.19 115.31 116.94 1llb h LEU 254 Ca 0.25 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1llb h LEU 254 Cb 0.22 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1llb h LEU 254 CO -0.02 0.47 -0.05 0.00 0.09 0.00 0.00 178.44 178.93 1llb h ALA 255 N 1.54 1.03 -0.39 1.53 0.00 -0.78 -2.51 119.26 119.68 1llb h ALA 255 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1llb h ALA 255 Cb 0.70 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1llb h ALA 255 CO 0.05 0.06 0.00 1.04 0.00 0.00 0.00 179.25 180.40 1llb n GLN 256 N -3.19 2.50 -1.93 0.00 6.02 -0.85 -0.94 117.38 118.99 1llb n GLN 256 Ca -0.00 -2.29 -0.34 0.00 -0.01 0.00 0.00 57.00 54.36 1llb n GLN 256 Cb 0.29 -1.51 0.03 0.00 1.02 0.00 0.00 30.24 30.08 1llb n GLN 256 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1llb s SER 257 N -1.47 5.28 -0.39 1.08 0.01 -0.95 -3.95 113.70 113.31 1llb s SER 257 Ca 0.38 2.10 -0.15 0.00 1.31 0.00 0.00 55.95 59.60 1llb s SER 257 Cb 0.23 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.90 1llb s SER 257 CO 0.31 -1.52 0.33 -0.13 0.41 0.00 0.00 173.24 172.64 1llb s ARG 258 N -3.75 3.18 -0.17 12.44 0.52 0.32 -4.09 118.95 127.41 1llb s ARG 258 Ca 0.70 -0.80 0.11 0.00 -0.52 0.00 0.00 55.73 55.21 1llb s ARG 258 Cb -0.23 -3.92 -0.23 0.00 0.52 0.00 0.00 34.95 31.09 1llb s ARG 258 CO 0.36 -0.68 0.18 0.66 0.02 0.00 0.00 175.30 175.84 1llb n TYR 259 N 5.28 0.38 -3.88 -0.53 4.01 -0.52 -2.16 117.16 119.74 1llb n TYR 259 Ca -0.10 0.12 -0.10 0.00 -0.16 0.00 0.00 57.90 57.65 1llb n TYR 259 Cb 0.48 -1.06 -0.09 0.00 -0.31 0.00 0.00 39.34 38.36 1llb n TYR 259 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1llb s TRP 260 N -2.53 0.11 -0.03 -0.72 0.52 -1.24 -1.79 118.94 113.25 1llb s TRP 260 Ca -0.15 -0.34 0.04 0.00 0.02 0.00 0.00 56.10 55.67 1llb s TRP 260 Cb 0.07 -0.08 -0.01 0.00 -1.15 0.00 0.00 33.47 32.31 1llb s TRP 260 CO 0.77 -0.38 -0.17 -1.14 0.02 0.00 0.00 176.95 176.06 1llb s GLN 261 N -2.36 1.65 -0.16 4.98 0.74 -0.38 -1.16 119.66 122.96 1llb s GLN 261 Ca -0.07 -0.60 -0.05 0.00 0.05 0.00 0.00 55.36 54.70 1llb s GLN 261 Cb -0.02 -1.47 0.06 0.00 1.10 0.00 0.00 33.01 32.68 1llb s GLN 261 CO -0.03 0.27 0.10 -0.08 -0.55 0.00 0.00 175.29 175.00 1llb s THR 262 N -0.07 -0.12 0.00 -0.34 -1.32 -0.01 -1.53 115.64 112.26 1llb s THR 262 Ca -0.01 -0.11 0.00 0.00 -1.21 0.00 0.00 61.69 60.36 1llb s THR 262 Cb -0.10 -0.55 0.00 0.00 -1.51 0.00 0.00 72.50 70.34 1llb s THR 262 CO 0.01 -0.24 0.00 0.61 -2.21 0.00 0.00 174.62 172.80 1llb n GLY 263 N 5.29 3.81 1.06 6.08 0.00 -1.26 -1.56 105.19 118.61 1llb n GLY 263 Ca -0.07 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.06 1llb n GLY 263 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1llb n ASP 264 N 8.71 3.21 -4.80 1.61 8.00 -1.26 -4.95 116.55 127.07 1llb n ASP 264 Ca 0.00 -1.97 -0.32 0.00 0.71 0.00 0.00 54.79 53.21 1llb n ASP 264 Cb 0.00 -0.18 -0.06 0.00 -0.02 0.00 0.00 41.12 40.86 1llb n ASP 264 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1llb s MET 265 N -1.64 3.09 -0.05 -1.24 1.75 -0.60 -4.45 119.30 116.16 1llb s MET 265 Ca 0.36 -0.51 0.06 0.00 -1.25 0.00 0.00 55.69 54.35 1llb s MET 265 Cb 0.22 -2.87 -0.02 0.00 2.84 0.00 0.00 34.83 35.01 1llb s MET 265 CO 0.31 0.63 -0.23 0.71 -0.65 0.00 0.00 175.02 175.80 1llb s TYR 266 N -1.27 2.48 -0.23 4.11 1.51 0.56 -0.83 117.35 123.69 1llb s TYR 266 Ca 0.25 -0.57 -0.16 0.00 -1.01 0.00 0.00 57.07 55.59 1llb s TYR 266 Cb -0.12 -1.60 -0.04 0.00 -0.11 0.00 0.00 41.96 40.09 1llb s TYR 266 CO 0.17 -0.11 0.41 -1.14 -1.11 0.00 0.00 175.55 173.77 1llb s GLN 267 N -0.31 4.12 0.00 -0.62 2.00 -0.31 -0.84 119.66 123.70 1llb s GLN 267 Ca 0.01 0.19 0.00 0.00 -2.00 0.00 0.00 55.36 53.56 1llb s GLN 267 Cb -0.13 -3.58 0.00 0.00 0.80 0.00 0.00 33.01 30.10 1llb s GLN 267 CO 0.02 -0.15 0.00 0.41 -0.50 0.00 0.00 175.29 175.07 1llb n GLY 268 N 4.18 2.41 3.29 2.59 0.00 -0.25 -1.43 105.19 115.99 1llb n GLY 268 Ca -0.08 -1.93 -0.45 0.00 0.00 0.00 0.00 46.02 43.57 1llb n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llb s LEU 269 N 0.00 6.01 0.00 0.99 1.43 -0.11 -4.61 118.68 122.38 1llb s LEU 269 Ca 0.00 -1.77 0.00 0.00 -1.03 0.00 0.00 54.13 51.33 1llb s LEU 269 Cb 0.00 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 44.06 1llb s LEU 269 CO 0.00 -0.80 0.00 0.61 0.23 0.00 0.00 176.35 176.39 1llb n GLY 270 N 5.16 1.96 3.76 -3.19 0.00 -1.26 -4.25 105.19 107.37 1llb n GLY 270 Ca -0.12 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 1llb n GLY 270 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1llb s TRP 271 N 0.00 2.45 0.07 1.61 0.52 -1.26 -4.67 118.94 117.66 1llb s TRP 271 Ca 0.00 1.56 0.08 0.00 0.02 0.00 0.00 56.10 57.75 1llb s TRP 271 Cb 0.00 -3.32 -0.03 0.00 -1.15 0.00 0.00 33.47 28.97 1llb s TRP 271 CO 0.00 -1.98 -0.21 -1.21 0.02 0.00 0.00 176.95 173.57 1llb s GLU 272 N -3.77 1.30 0.05 4.98 2.02 -0.90 -1.09 118.70 121.30 1llb s GLU 272 Ca 0.72 -1.03 0.01 0.00 0.02 0.00 0.00 54.97 54.68 1llb s GLU 272 Cb -0.25 -1.48 -0.03 0.00 0.10 0.00 0.00 34.13 32.47 1llb s GLU 272 CO 0.38 0.37 -0.05 -1.64 0.02 0.00 0.00 175.26 174.34 1llb s MET 273 N -1.44 0.55 0.06 1.61 -1.94 -0.02 -0.89 119.30 117.22 1llb s MET 273 Ca 0.07 -0.96 0.01 0.00 -1.71 0.00 0.00 55.69 53.10 1llb s MET 273 Cb -0.09 -0.01 -0.03 0.00 2.01 0.00 0.00 34.83 36.70 1llb s MET 273 CO 0.03 -0.04 -0.05 -0.51 -0.01 0.00 0.00 175.02 174.44 1llb s LEU 274 N -2.21 2.41 0.34 -0.03 1.02 -0.26 -0.32 118.68 119.63 1llb s LEU 274 Ca -0.03 -0.83 -0.27 0.00 0.02 0.00 0.00 54.13 53.02 1llb s LEU 274 Cb -0.02 0.04 -0.09 0.00 0.02 0.00 0.00 46.19 46.14 1llb s LEU 274 CO -0.04 -0.44 1.17 -1.81 0.02 0.00 0.00 176.35 175.25 1llb s ASP 275 N -2.45 6.86 -0.10 2.29 -0.00 -1.26 -0.51 116.67 121.49 1llb s ASP 275 Ca 0.01 2.38 -0.02 0.00 -0.00 0.00 0.00 52.55 54.93 1llb s ASP 275 Cb 0.01 -2.63 -0.03 0.00 -0.00 0.00 0.00 42.92 40.27 1llb s ASP 275 CO -0.05 -0.44 -0.00 0.86 -0.00 0.00 0.00 175.17 175.53 1llb s TRP 276 N -1.27 3.14 0.38 4.23 -0.11 -0.53 -3.26 118.94 121.52 1llb s TRP 276 Ca 0.51 0.14 -0.26 0.00 1.22 0.00 0.00 56.10 57.70 1llb s TRP 276 Cb -0.33 -1.81 -0.09 0.00 -1.50 0.00 0.00 33.47 29.74 1llb s TRP 276 CO 0.42 0.40 1.24 -1.25 -4.62 0.00 0.00 176.95 173.14 1llb s PRO 277 N -0.71 4.11 0.20 5.86 0.04 -1.26 -4.73 135.00 138.51 1llb s PRO 277 Ca 0.11 2.02 0.05 0.00 0.04 0.00 0.00 61.00 63.22 1llb s PRO 277 Cb -0.12 -2.81 -0.03 0.00 0.04 0.00 0.00 34.50 31.58 1llb s PRO 277 CO 0.02 -0.33 0.27 0.14 0.04 0.00 0.00 177.00 177.15 1llb s VAL 278 N -1.29 5.02 -0.38 -0.36 -7.23 -1.20 -5.05 120.40 109.91 1llb s VAL 278 Ca 0.55 -0.98 -0.24 0.00 -1.81 0.00 0.00 61.98 59.50 1llb s VAL 278 Cb -0.35 -3.66 0.01 0.00 0.56 0.00 0.00 36.38 32.95 1llb s VAL 278 CO 0.45 -0.22 0.81 0.21 -0.31 0.00 0.00 175.10 176.04 1llb s ASN 279 N -3.58 6.55 0.47 4.85 3.04 -1.26 -4.92 114.94 120.09 1llb s ASN 279 Ca 0.33 0.33 0.21 0.00 0.04 0.00 0.00 52.86 53.78 1llb s ASN 279 Cb -0.10 -2.41 1.22 0.00 -1.54 0.00 0.00 41.25 38.43 1llb s ASN 279 CO 0.27 -0.79 1.92 1.55 -3.04 0.00 0.00 177.10 177.02 1llb h PRO 280 N 8.57 0.22 0.00 0.43 0.13 -2.00 0.53 132.00 139.88 1llb h PRO 280 Ca -0.24 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1llb h PRO 280 Cb 1.09 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1llb h PRO 280 CO 0.93 0.15 0.00 -0.44 -0.23 0.00 0.00 178.00 178.41 1llb h ASP 281 N 0.23 0.00 0.81 1.44 5.19 -1.98 0.33 116.42 122.43 1llb h ASP 281 Ca 0.37 0.00 -0.18 0.00 -0.62 0.00 0.00 57.03 56.59 1llb h ASP 281 Cb 1.10 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.58 1llb h ASP 281 CO -0.08 0.00 -0.86 -1.28 -3.12 0.00 0.00 179.24 173.90 1llb h SER 282 N 0.00 0.04 0.00 6.45 0.87 -0.33 -3.11 113.55 117.47 1llb h SER 282 Ca 0.00 -0.04 -0.34 0.00 -1.23 0.00 0.00 61.79 60.18 1llb h SER 282 Cb 0.55 -0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 62.43 1llb h SER 282 CO 0.00 0.88 -2.29 2.30 -0.53 0.00 0.00 176.83 177.19 1llb n ILE 283 N -3.55 1.29 0.25 2.23 -5.35 -0.98 -3.25 119.36 110.00 1llb n ILE 283 Ca -0.01 -0.56 -0.16 0.00 -0.27 0.00 0.00 62.75 61.75 1llb n ILE 283 Cb 0.81 -1.13 -0.08 0.00 -1.74 0.00 0.00 39.64 37.50 1llb n ILE 283 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1llb h ILE 284 N 0.00 0.55 -0.41 7.28 2.04 -0.52 -0.77 117.51 125.68 1llb h ILE 284 Ca -0.50 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 1llb h ILE 284 Cb 1.86 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.48 1llb h ILE 284 CO -0.05 0.00 0.10 0.78 0.00 0.00 0.00 178.15 178.98 1llb h ASN 285 N -0.59 0.62 -0.13 1.72 2.35 -1.73 -2.89 115.58 114.92 1llb h ASN 285 Ca -0.06 -0.23 0.04 0.00 -0.55 0.00 0.00 56.30 55.51 1llb h ASN 285 Cb 0.46 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1llb h ASN 285 CO 0.08 0.68 0.14 1.23 -1.65 0.00 0.00 177.43 177.92 1llb h GLY 286 N 0.52 0.00 1.52 2.83 0.00 -1.49 -2.23 103.07 104.23 1llb h GLY 286 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.34 1llb h GLY 286 CO 0.00 0.00 -0.35 1.76 0.00 0.00 0.00 176.54 177.95 1llb h SER 287 N 0.00 0.56 -1.90 0.19 0.02 -0.92 -3.04 113.55 108.46 1llb h SER 287 Ca 0.06 -0.23 -0.65 0.00 -0.84 0.00 0.00 61.79 60.14 1llb h SER 287 Cb 0.34 -0.16 0.05 0.00 0.14 0.00 0.00 62.40 62.77 1llb h SER 287 CO -0.00 0.87 0.63 -0.67 -1.14 0.00 0.00 176.83 176.52 1llb n ASP 288 N -4.06 2.29 0.25 3.07 -0.08 -0.84 -4.45 116.55 112.74 1llb n ASP 288 Ca -0.01 1.10 0.05 0.00 -1.51 0.00 0.00 54.79 54.41 1llb n ASP 288 Cb 0.48 -1.28 0.25 0.00 2.34 0.00 0.00 41.12 42.91 1llb n ASP 288 CO 0.00 0.00 0.00 0.78 0.12 0.00 0.00 177.20 178.10 1llb h ASN 289 N 5.42 0.00 -0.66 1.67 2.35 -1.89 0.38 115.58 122.86 1llb h ASN 289 Ca -0.47 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.27 1llb h ASN 289 Cb 1.30 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.64 1llb h ASN 289 CO 0.84 0.00 0.35 0.07 -1.65 0.00 0.00 177.43 177.04 1llb h LYS 290 N 0.00 0.92 0.00 0.81 2.10 -1.91 -2.78 116.57 115.71 1llb h LYS 290 Ca 0.00 -0.11 -0.36 0.00 -2.00 0.00 0.00 60.65 58.17 1llb h LYS 290 Cb 1.29 -0.18 -0.07 0.00 -0.90 0.00 0.00 32.23 32.38 1llb h LYS 290 CO 0.00 0.70 -2.38 -0.89 -2.00 0.00 0.00 179.45 174.88 1llb n ILE 291 N -4.52 1.39 0.01 0.07 5.41 0.12 -4.04 119.36 117.81 1llb n ILE 291 Ca 0.05 -0.64 -0.00 0.00 1.00 0.00 0.00 62.75 63.16 1llb n ILE 291 Cb 0.09 -1.06 0.30 0.00 -0.71 0.00 0.00 39.64 38.26 1llb n ILE 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1llb h ALA 292 N 0.33 1.37 -0.02 -1.39 0.00 -1.17 -3.18 119.26 115.20 1llb h ALA 292 Ca -0.54 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1llb h ALA 292 Cb 1.97 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1llb h ALA 292 CO -0.05 0.44 -0.08 1.28 0.00 0.00 0.00 179.25 180.84 1llb n LEU 293 N -4.27 2.35 -4.70 0.00 4.77 -1.05 -4.53 117.00 109.58 1llb n LEU 293 Ca 0.01 -0.95 -0.30 0.00 -0.03 0.00 0.00 56.01 54.75 1llb n LEU 293 Cb 0.26 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.50 1llb n LEU 293 CO 0.39 0.42 0.66 0.00 -1.33 0.00 0.00 177.39 177.52 1llb s ALA 294 N -1.65 1.39 -0.17 -1.18 0.00 -1.20 -4.56 121.76 114.39 1llb s ALA 294 Ca 0.20 -0.03 -0.23 0.00 0.00 0.00 0.00 51.96 51.90 1llb s ALA 294 Cb 0.15 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 1llb s ALA 294 CO 0.28 -2.49 0.72 0.00 0.00 0.00 0.00 175.76 174.27 1llb s ALA 295 N -2.88 3.51 -0.05 0.00 0.00 -1.26 -4.57 121.76 116.51 1llb s ALA 295 Ca 0.64 -0.09 0.02 0.00 0.00 0.00 0.00 51.96 52.52 1llb s ALA 295 Cb -0.19 -3.08 0.02 0.00 0.00 0.00 0.00 23.12 19.87 1llb s ALA 295 CO 0.58 -0.54 -0.08 1.03 0.00 0.00 0.00 175.76 176.74 1llb s ARG 296 N 1.88 1.21 0.45 0.00 1.81 -0.70 -4.97 118.95 118.64 1llb s ARG 296 Ca 0.34 -0.26 -0.24 0.00 -1.72 0.00 0.00 55.73 53.85 1llb s ARG 296 Cb -0.16 -1.08 -0.07 0.00 -0.45 0.00 0.00 34.95 33.18 1llb s ARG 296 CO 0.12 -0.01 1.28 -2.14 -0.68 0.00 0.00 175.30 173.87 1llb s PRO 297 N 0.71 3.72 0.11 3.54 0.02 -1.26 -0.32 135.00 141.52 1llb s PRO 297 Ca -0.12 2.07 0.10 0.00 0.02 0.00 0.00 61.00 63.08 1llb s PRO 297 Cb -0.14 -2.55 -0.04 0.00 0.02 0.00 0.00 34.50 31.79 1llb s PRO 297 CO 0.02 -0.67 -0.26 0.14 -0.33 0.00 0.00 177.00 175.89 1llb s VAL 298 N -1.35 2.18 -0.21 3.83 -7.23 -0.56 -4.70 120.40 112.36 1llb s VAL 298 Ca 0.62 -1.66 -0.07 0.00 -1.81 0.00 0.00 61.98 59.05 1llb s VAL 298 Cb -0.36 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 1llb s VAL 298 CO 0.45 0.13 0.06 -0.54 -0.31 0.00 0.00 175.10 174.89 1llb s LYS 299 N -1.88 3.82 0.35 4.82 1.02 -0.58 -4.80 119.74 122.49 1llb s LYS 299 Ca 0.13 -0.41 -0.28 0.00 0.02 0.00 0.00 55.97 55.43 1llb s LYS 299 Cb -0.10 -3.24 -0.10 0.00 -0.52 0.00 0.00 37.83 33.87 1llb s LYS 299 CO 0.05 0.07 1.27 0.00 -0.92 0.00 0.00 175.35 175.82 1llb s ALA 300 N 0.91 3.39 -0.43 5.17 0.00 -1.26 -1.25 121.76 128.29 1llb s ALA 300 Ca 0.03 1.18 -0.12 0.00 0.00 0.00 0.00 51.96 53.06 1llb s ALA 300 Cb -0.14 -3.45 0.07 0.00 0.00 0.00 0.00 23.12 19.60 1llb s ALA 300 CO 0.03 -0.62 0.30 0.42 0.00 0.00 0.00 175.76 175.89 1llb s ILE 301 N -1.21 4.63 -0.35 0.00 1.01 -0.74 -4.90 121.20 119.65 1llb s ILE 301 Ca 0.51 -1.22 -0.00 0.00 0.00 0.00 0.00 60.65 59.94 1llb s ILE 301 Cb -0.37 -3.78 0.08 0.00 0.01 0.00 0.00 42.46 38.40 1llb s ILE 301 CO 0.49 -0.50 0.08 -0.89 0.00 0.00 0.00 174.94 174.11 1llb s THR 302 N 1.52 2.87 0.70 2.92 2.01 -1.26 -1.70 115.64 122.69 1llb s THR 302 Ca 0.03 -1.87 -0.07 0.00 0.31 0.00 0.00 61.69 60.10 1llb s THR 302 Cb -0.23 -2.87 0.06 0.00 0.01 0.00 0.00 72.50 69.47 1llb s THR 302 CO 0.04 -0.42 1.02 -2.16 -0.69 0.00 0.00 174.62 172.41 1llb s PRO 303 N 1.12 2.25 0.45 4.92 0.04 -1.26 -5.09 135.00 137.43 1llb s PRO 303 Ca 0.03 -0.20 -0.24 0.00 0.04 0.00 0.00 61.00 60.63 1llb s PRO 303 Cb -0.21 -2.16 -0.09 0.00 0.04 0.00 0.00 34.50 32.08 1llb s PRO 303 CO -0.04 -1.21 1.24 -2.30 0.04 0.00 0.00 177.00 174.72 1llb n PRO 304 N -2.92 1.79 -2.73 0.56 -0.02 -0.69 -4.95 135.00 126.04 1llb n PRO 304 Ca 0.08 0.64 -0.42 0.00 -2.02 0.00 0.00 63.50 61.78 1llb n PRO 304 Cb 0.60 -2.36 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 1llb n PRO 304 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1llb s THR 305 N -1.24 4.88 0.75 3.45 2.01 -0.92 -4.81 115.64 119.76 1llb s THR 305 Ca 0.63 2.02 -0.14 0.00 0.31 0.00 0.00 61.69 64.51 1llb s THR 305 Cb -0.50 -4.30 0.05 0.00 0.01 0.00 0.00 72.50 67.76 1llb s THR 305 CO 0.56 0.17 1.18 -2.84 -0.69 0.00 0.00 174.62 173.00 1llb s PRO 306 N 0.99 2.07 -0.42 4.92 0.02 -1.26 -0.52 135.00 140.80 1llb s PRO 306 Ca 0.51 1.64 -0.46 0.00 0.02 0.00 0.00 61.00 62.71 1llb s PRO 306 Cb -0.21 -1.84 -0.20 0.00 0.02 0.00 0.00 34.50 32.27 1llb s PRO 306 CO 0.27 -1.86 1.53 0.00 -0.33 0.00 0.00 177.00 176.61 1llb n ALA 307 N -2.96 -1.65 -2.60 -1.55 0.00 -1.25 -4.71 120.51 105.79 1llb n ALA 307 Ca 0.12 0.51 -0.41 0.00 0.00 0.00 0.00 53.44 53.67 1llb n ALA 307 Cb 0.51 -1.91 -0.07 0.00 0.00 0.00 0.00 19.45 17.98 1llb n ALA 307 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1llb s VAL 308 N 2.59 4.97 0.25 0.00 1.01 -1.26 -4.98 120.40 122.98 1llb s VAL 308 Ca 1.03 0.80 -0.04 0.00 0.00 0.00 0.00 61.98 63.76 1llb s VAL 308 Cb -1.45 -3.96 0.23 0.00 0.00 0.00 0.00 36.38 31.19 1llb s VAL 308 CO 0.78 -0.10 1.84 0.03 0.00 0.00 0.00 175.10 177.64 1llb h ARG 309 N 8.19 0.90 -3.68 2.72 3.08 -1.97 -3.13 114.38 120.48 1llb h ARG 309 Ca -0.27 -0.05 -0.72 0.00 0.07 0.00 0.00 59.98 59.01 1llb h ARG 309 Cb 1.12 -0.20 -0.06 0.00 0.08 0.00 0.00 29.97 30.91 1llb h ARG 309 CO 0.78 0.59 2.96 0.00 -1.07 0.00 0.00 179.97 183.24 1llb n ALA 310 N -2.36 5.86 -2.48 0.04 0.00 -1.26 -1.10 120.51 119.20 1llb n ALA 310 Ca 0.14 -3.94 -0.13 0.00 0.00 0.00 0.00 53.44 49.51 1llb n ALA 310 Cb 0.24 -3.36 -0.11 0.00 0.00 0.00 0.00 19.45 16.22 1llb n ALA 310 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1llb s SER 311 N 2.40 1.30 -0.30 0.00 0.01 -1.18 -1.45 113.70 114.48 1llb s SER 311 Ca 0.49 -0.81 -0.10 0.00 1.31 0.00 0.00 55.95 56.84 1llb s SER 311 Cb 0.14 0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.38 1llb s SER 311 CO -0.07 -0.29 0.15 0.86 0.41 0.00 0.00 173.24 174.31 1llb s TRP 312 N -2.50 3.18 -0.13 2.43 -0.11 0.33 -4.06 118.94 118.07 1llb s TRP 312 Ca 0.04 -0.48 -0.01 0.00 1.22 0.00 0.00 56.10 56.87 1llb s TRP 312 Cb -0.02 -2.35 -0.02 0.00 -1.50 0.00 0.00 33.47 29.57 1llb s TRP 312 CO -0.01 -0.42 -0.10 0.08 -4.62 0.00 0.00 176.95 171.88 1llb s VAL 313 N 1.63 3.35 0.28 5.86 1.01 -0.21 -1.10 120.40 131.22 1llb s VAL 313 Ca 0.05 -0.56 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 1llb s VAL 313 Cb -0.17 -2.43 0.01 0.00 0.00 0.00 0.00 36.38 33.80 1llb s VAL 313 CO 0.07 0.52 0.60 -1.38 0.00 0.00 0.00 175.10 174.91 1llb s HIS 314 N 0.30 0.18 -0.27 5.22 -3.43 -0.07 -0.64 115.29 116.57 1llb s HIS 314 Ca -0.08 -0.60 -0.18 0.00 -0.80 0.00 0.00 55.06 53.40 1llb s HIS 314 Cb -0.15 0.44 0.08 0.00 -1.43 0.00 0.00 32.58 31.51 1llb s HIS 314 CO 0.05 -1.16 0.68 0.21 -2.00 0.00 0.00 174.74 172.51 1llb s LYS 315 N -3.72 0.72 0.20 -0.38 2.47 -0.53 -2.11 119.74 116.39 1llb s LYS 315 Ca 0.18 1.13 0.05 0.00 -1.56 0.00 0.00 55.97 55.76 1llb s LYS 315 Cb -0.03 0.21 -0.03 0.00 -1.46 0.00 0.00 37.83 36.51 1llb s LYS 315 CO 0.09 -0.13 0.26 0.95 0.16 0.00 0.00 175.35 176.68 1llb s THR 316 N 1.24 4.98 -0.06 3.43 -4.23 -1.26 -1.66 115.64 118.08 1llb s THR 316 Ca -0.07 -0.99 -0.28 0.00 -1.18 0.00 0.00 61.69 59.17 1llb s THR 316 Cb -0.05 -3.63 0.06 0.00 1.34 0.00 0.00 72.50 70.22 1llb s THR 316 CO -0.13 -0.21 0.63 -0.83 -0.54 0.00 0.00 174.62 173.53 1llb s GLY 317 N -3.54 -0.51 0.05 3.99 0.00 -0.57 -3.78 107.32 102.95 1llb s GLY 317 Ca 0.33 1.22 -0.16 0.00 0.00 0.00 0.00 44.72 46.11 1llb s GLY 317 CO 0.27 0.89 0.37 0.00 0.00 0.00 0.00 173.10 174.63 1llb s ALA 318 N -1.10 -0.88 0.41 3.20 0.00 -1.26 -0.24 121.76 121.90 1llb s ALA 318 Ca -0.11 0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.06 1llb s ALA 318 Cb -0.01 0.36 -0.02 0.00 0.00 0.00 0.00 23.12 23.44 1llb s ALA 318 CO 0.09 -0.45 0.15 0.95 0.00 0.00 0.00 175.76 176.49 1llb s THR 319 N -2.58 0.52 0.48 0.00 -4.23 -0.37 -4.00 115.64 105.46 1llb s THR 319 Ca -0.05 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 58.65 1llb s THR 319 Cb -0.01 -2.32 0.36 0.00 1.34 0.00 0.00 72.50 71.87 1llb s THR 319 CO -0.03 0.00 1.99 1.23 -0.54 0.00 0.00 174.62 177.27 1llb h GLY 320 N 1.77 0.30 -0.37 3.99 0.00 -1.97 -2.88 103.07 103.91 1llb h GLY 320 Ca -0.34 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1llb h GLY 320 CO 0.54 0.04 0.00 0.61 0.00 0.00 0.00 176.54 177.74 1llb n GLY 321 N -1.57 2.15 3.04 4.60 0.00 -1.26 -4.52 105.19 107.62 1llb n GLY 321 Ca 0.09 -0.11 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 1llb n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1llb s PHE 322 N -0.86 0.48 -0.05 1.61 0.40 -1.09 -1.62 117.98 116.85 1llb s PHE 322 Ca 0.07 -0.63 0.00 0.00 -0.60 0.00 0.00 56.93 55.77 1llb s PHE 322 Cb 0.04 -0.31 0.03 0.00 0.51 0.00 0.00 43.02 43.28 1llb s PHE 322 CO 0.05 -0.18 -0.01 0.20 0.70 0.00 0.00 175.22 175.97 1llb s GLY 323 N -1.84 0.38 0.14 4.36 0.00 -0.63 -1.24 107.32 108.49 1llb s GLY 323 Ca -0.08 0.01 0.05 0.00 0.00 0.00 0.00 44.72 44.69 1llb s GLY 323 CO -0.02 0.70 -0.10 -1.35 0.00 0.00 0.00 173.10 172.32 1llb s SER 324 N 1.26 1.78 -0.22 1.64 1.04 0.67 -1.43 113.70 118.43 1llb s SER 324 Ca -0.06 -0.98 -0.19 0.00 0.48 0.00 0.00 55.95 55.20 1llb s SER 324 Cb -0.13 -0.01 0.06 0.00 0.10 0.00 0.00 66.02 66.03 1llb s SER 324 CO -0.02 -0.31 0.58 -0.47 0.98 0.00 0.00 173.24 174.00 1llb s TYR 325 N -3.16 -0.68 -0.02 5.02 5.04 -0.26 -1.51 117.35 121.78 1llb s TYR 325 Ca 0.15 1.59 0.02 0.00 -2.44 0.00 0.00 57.07 56.39 1llb s TYR 325 Cb 0.01 0.27 0.01 0.00 0.35 0.00 0.00 41.96 42.60 1llb s TYR 325 CO 0.01 -0.33 -0.06 0.08 -1.34 0.00 0.00 175.55 173.91 1llb s VAL 326 N 0.55 0.53 -0.05 3.14 1.01 -0.66 -0.66 120.40 124.26 1llb s VAL 326 Ca -0.02 -0.22 -0.14 0.00 0.00 0.00 0.00 61.98 61.60 1llb s VAL 326 Cb -0.05 -0.49 0.03 0.00 0.00 0.00 0.00 36.38 35.87 1llb s VAL 326 CO -0.03 0.18 0.33 0.00 0.00 0.00 0.00 175.10 175.58 1llb s ALA 327 N 0.30 -0.83 0.12 5.51 0.00 -0.68 -1.46 121.76 124.72 1llb s ALA 327 Ca -0.04 0.54 -0.17 0.00 0.00 0.00 0.00 51.96 52.29 1llb s ALA 327 Cb -0.08 -0.12 0.04 0.00 0.00 0.00 0.00 23.12 22.97 1llb s ALA 327 CO -0.00 -0.23 0.43 -0.59 0.00 0.00 0.00 175.76 175.37 1llb s PHE 328 N -0.88 -0.26 -0.31 0.00 -0.12 0.18 -0.60 117.98 115.99 1llb s PHE 328 Ca -0.10 -0.02 0.01 0.00 -0.05 0.00 0.00 56.93 56.77 1llb s PHE 328 Cb -0.04 0.30 0.09 0.00 -0.63 0.00 0.00 43.02 42.74 1llb s PHE 328 CO 0.03 -0.71 0.07 0.42 -0.05 0.00 0.00 175.22 174.98 1llb s ILE 329 N -3.68 1.32 0.19 -4.49 1.01 0.71 -1.05 121.20 115.21 1llb s ILE 329 Ca 0.02 -1.61 -0.15 0.00 0.00 0.00 0.00 60.65 58.90 1llb s ILE 329 Cb 0.01 -1.94 0.18 0.00 0.01 0.00 0.00 42.46 40.72 1llb s ILE 329 CO -0.11 -0.58 1.64 -0.65 0.00 0.00 0.00 174.94 175.24 1llb h PRO 330 N 7.95 -0.01 -0.76 2.79 0.11 -1.70 -1.84 132.00 138.54 1llb h PRO 330 Ca -0.11 0.00 0.20 0.00 0.11 0.00 0.00 66.00 66.20 1llb h PRO 330 Cb 1.03 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 1llb h PRO 330 CO 0.47 -0.01 0.53 1.49 -0.21 0.00 0.00 178.00 180.27 1llb h GLU 331 N -0.02 0.12 -0.16 1.05 4.81 -1.43 -1.15 114.58 117.82 1llb h GLU 331 Ca 0.26 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1llb h GLU 331 Cb 0.41 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.76 1llb h GLU 331 CO -0.56 0.08 0.00 1.63 -0.73 0.00 0.00 179.01 179.43 1llb n LYS 332 N -4.38 2.03 -4.01 1.92 4.76 -0.74 -4.97 118.16 112.78 1llb n LYS 332 Ca 0.15 -1.88 -0.32 0.00 -2.87 0.00 0.00 58.31 53.39 1llb n LYS 332 Cb 0.74 -1.41 0.01 0.00 -1.84 0.00 0.00 35.03 32.53 1llb n LYS 332 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1llb n GLU 333 N 1.19 -4.64 -5.02 1.97 -0.58 -0.43 -4.56 120.64 108.56 1llb n GLU 333 Ca 0.14 0.52 -0.27 0.00 -0.42 0.00 0.00 57.16 57.12 1llb n GLU 333 Cb 0.52 -5.30 -0.16 0.00 -0.57 0.00 0.00 31.44 25.93 1llb n GLU 333 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1llb s LEU 334 N -7.24 2.04 0.20 -4.62 2.96 -1.15 -2.53 118.68 108.36 1llb s LEU 334 Ca 0.63 -0.39 -0.23 0.00 -0.22 0.00 0.00 54.13 53.92 1llb s LEU 334 Cb -0.32 -1.08 0.05 0.00 0.50 0.00 0.00 46.19 45.33 1llb s LEU 334 CO 0.86 0.26 0.72 -0.83 -1.32 0.00 0.00 176.35 176.04 1llb s GLY 335 N -0.52 -0.32 -0.05 7.98 0.00 -0.59 -0.21 107.32 113.61 1llb s GLY 335 Ca 0.08 0.12 -0.14 0.00 0.00 0.00 0.00 44.72 44.78 1llb s GLY 335 CO -0.01 0.04 0.32 -1.50 0.00 0.00 0.00 173.10 171.95 1llb s ILE 336 N -3.73 0.04 -0.06 0.90 2.07 0.23 -0.23 121.20 120.42 1llb s ILE 336 Ca 0.07 -0.32 0.02 0.00 -1.41 0.00 0.00 60.65 59.01 1llb s ILE 336 Cb -0.03 -0.57 0.01 0.00 0.13 0.00 0.00 42.46 42.00 1llb s ILE 336 CO -0.02 -0.18 -0.11 -0.69 -1.91 0.00 0.00 174.94 172.04 1llb s VAL 337 N -0.84 1.06 -0.20 4.00 1.01 -0.23 -1.69 120.40 123.51 1llb s VAL 337 Ca -0.09 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.46 1llb s VAL 337 Cb -0.04 -0.98 0.04 0.00 0.00 0.00 0.00 36.38 35.40 1llb s VAL 337 CO 0.03 0.34 -0.11 -0.04 0.00 0.00 0.00 175.10 175.32 1llb s MET 338 N 0.68 2.05 -0.12 2.72 -1.94 0.16 -1.35 119.30 121.49 1llb s MET 338 Ca -0.14 -0.83 0.02 0.00 -1.71 0.00 0.00 55.69 53.03 1llb s MET 338 Cb -0.16 -2.40 -0.00 0.00 2.01 0.00 0.00 34.83 34.28 1llb s MET 338 CO 0.03 -0.42 -0.19 -0.51 -0.01 0.00 0.00 175.02 173.92 1llb s LEU 339 N 1.40 2.34 0.02 -0.03 1.43 -0.14 -1.10 118.68 122.59 1llb s LEU 339 Ca -0.01 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 1llb s LEU 339 Cb -0.16 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.55 1llb s LEU 339 CO -0.08 0.15 -0.04 0.00 0.23 0.00 0.00 176.35 176.60 1llb s ALA 340 N 0.44 0.30 -0.76 4.21 0.00 -0.52 -1.02 121.76 124.41 1llb s ALA 340 Ca -0.14 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.28 1llb s ALA 340 Cb -0.17 0.06 0.34 0.00 0.00 0.00 0.00 23.12 23.35 1llb s ALA 340 CO 0.06 -0.06 2.10 0.27 0.00 0.00 0.00 175.76 178.13 1llb n ASN 341 N 1.93 7.46 -3.66 0.00 6.94 -1.05 -1.60 115.26 125.28 1llb n ASN 341 Ca -0.21 -3.75 -0.11 0.00 -0.02 0.00 0.00 54.58 50.49 1llb n ASN 341 Cb 0.56 -1.06 -0.08 0.00 -2.36 0.00 0.00 39.78 36.83 1llb n ASN 341 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1llb s LYS 342 N -3.76 0.66 -0.29 -3.83 2.20 -0.64 -1.64 119.74 112.44 1llb s LYS 342 Ca 0.55 0.96 -0.26 0.00 -0.36 0.00 0.00 55.97 56.86 1llb s LYS 342 Cb 0.45 0.23 0.01 0.00 -1.51 0.00 0.00 37.83 37.00 1llb s LYS 342 CO -0.30 -0.12 0.91 1.21 -0.36 0.00 0.00 175.35 176.68 1llb s ASN 343 N 0.91 6.81 0.21 1.43 2.47 -1.25 -2.44 114.94 123.08 1llb s ASN 343 Ca -0.05 0.90 0.07 0.00 0.42 0.00 0.00 52.86 54.21 1llb s ASN 343 Cb -0.05 -2.46 -0.05 0.00 -1.45 0.00 0.00 41.25 37.24 1llb s ASN 343 CO -0.08 -0.69 -0.13 -0.72 -3.72 0.00 0.00 177.10 171.76 1llb s TYR 344 N 3.17 1.71 -0.02 0.43 1.13 -1.26 -4.94 117.35 117.57 1llb s TYR 344 Ca 0.38 -0.60 -0.39 0.00 -1.41 0.00 0.00 57.07 55.04 1llb s TYR 344 Cb -0.14 -0.82 -0.18 0.00 -1.10 0.00 0.00 41.96 39.72 1llb s TYR 344 CO 0.12 0.33 1.26 -2.30 -2.51 0.00 0.00 175.55 172.45 1llb n PRO 345 N -0.39 0.52 -0.27 -3.49 -0.02 -1.26 -4.90 135.00 125.20 1llb n PRO 345 Ca -0.08 0.19 0.05 0.00 -2.02 0.00 0.00 63.50 61.64 1llb n PRO 345 Cb 0.61 -1.76 0.18 0.00 -0.02 0.00 0.00 33.50 32.51 1llb n PRO 345 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1llb h ASN 346 N 4.03 0.42 -0.85 2.55 2.35 -1.96 -2.38 115.58 119.74 1llb h ASN 346 Ca -0.49 0.09 0.10 0.00 -0.55 0.00 0.00 56.30 55.45 1llb h ASN 346 Cb 1.38 0.03 -0.06 0.00 0.05 0.00 0.00 38.32 39.72 1llb h ASN 346 CO 0.74 0.19 0.55 -0.65 -1.65 0.00 0.00 177.43 176.62 1llb h PRO 347 N 0.55 0.76 -0.38 0.81 0.11 -1.88 -0.68 132.00 131.29 1llb h PRO 347 Ca 0.41 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.40 1llb h PRO 347 Cb 0.56 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.48 1llb h PRO 347 CO -0.35 0.50 -0.09 0.00 -0.21 0.00 0.00 178.00 177.86 1llb h ALA 348 N 1.58 1.13 0.05 -0.75 0.00 -1.77 0.81 119.26 120.32 1llb h ALA 348 Ca 0.40 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1llb h ALA 348 Cb 0.47 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1llb h ALA 348 CO -0.16 0.55 -0.03 0.00 0.00 0.00 0.00 179.25 179.61 1llb h ARG 349 N 0.61 -0.07 -0.69 0.00 3.08 -1.09 -2.47 114.38 113.75 1llb h ARG 349 Ca 0.11 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.09 1llb h ARG 349 Cb 0.51 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.55 1llb h ARG 349 CO 0.03 0.27 0.13 0.28 -1.07 0.00 0.00 179.97 179.61 1llb h VAL 350 N -0.42 1.26 -0.26 2.04 2.07 -1.08 -1.64 116.25 118.22 1llb h VAL 350 Ca -0.01 -1.02 0.03 0.00 0.82 0.00 0.00 66.70 66.53 1llb h VAL 350 Cb 0.37 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 1llb h VAL 350 CO 0.01 0.39 0.06 -0.78 0.02 0.00 0.00 177.57 177.27 1llb h ASP 351 N 1.06 0.02 -0.39 0.57 3.58 -0.84 0.49 116.42 120.90 1llb h ASP 351 Ca 0.21 0.04 -0.02 0.00 0.42 0.00 0.00 57.03 57.68 1llb h ASP 351 Cb 0.42 0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.50 1llb h ASP 351 CO 0.01 0.05 0.18 0.00 -2.88 0.00 0.00 179.24 176.60 1llb h ALA 352 N 1.19 0.51 -0.52 -0.78 0.00 -1.29 -0.39 119.26 117.98 1llb h ALA 352 Ca 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1llb h ALA 352 Cb 0.12 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1llb h ALA 352 CO -0.15 0.08 0.25 0.00 0.00 0.00 0.00 179.25 179.42 1llb h ALA 353 N 1.03 0.68 -0.40 0.00 0.00 -1.00 -1.63 119.26 117.93 1llb h ALA 353 Ca 0.13 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1llb h ALA 353 Cb 0.14 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1llb h ALA 353 CO -0.02 0.25 0.12 2.35 0.00 0.00 0.00 179.25 181.95 1llb h TRP 354 N 0.70 0.64 -0.58 0.00 2.91 -0.73 0.03 115.95 118.92 1llb h TRP 354 Ca 0.18 -0.07 0.05 0.00 1.13 0.00 0.00 58.89 60.19 1llb h TRP 354 Cb 0.13 -0.18 -0.05 0.00 -0.51 0.00 0.00 29.16 28.55 1llb h TRP 354 CO -0.00 0.60 0.30 1.96 -1.03 0.00 0.00 178.44 180.27 1llb h GLN 355 N 0.49 0.55 -0.00 2.65 1.08 -0.85 0.16 115.11 119.19 1llb h GLN 355 Ca 0.13 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.29 1llb h GLN 355 Cb 0.26 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1llb h GLN 355 CO -0.00 0.37 -0.00 0.82 -0.95 0.00 0.00 178.83 179.06 1llb h ILE 356 N 0.57 1.32 -0.40 2.54 2.04 -1.07 -2.60 117.51 119.92 1llb h ILE 356 Ca 0.26 -0.96 -0.11 0.00 1.00 0.00 0.00 64.86 65.05 1llb h ILE 356 Cb 0.17 1.97 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 1llb h ILE 356 CO -0.18 0.25 -0.22 -0.07 0.00 0.00 0.00 178.15 177.94 1llb h LEU 357 N -0.40 0.79 -0.89 1.44 3.38 -0.89 -2.68 115.31 116.07 1llb h LEU 357 Ca 0.00 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 1llb h LEU 357 Cb 0.41 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1llb h LEU 357 CO 0.00 0.99 0.26 -1.13 0.09 0.00 0.00 178.44 178.65 1llb h ASN 358 N 0.68 1.00 0.33 -0.43 -0.00 -0.74 -2.32 115.58 114.09 1llb h ASN 358 Ca 0.10 -0.16 -0.04 0.00 -0.00 0.00 0.00 56.30 56.19 1llb h ASN 358 Cb 0.73 -0.26 -0.01 0.00 -0.00 0.00 0.00 38.32 38.78 1llb h ASN 358 CO 0.06 0.90 -0.21 0.00 -0.00 0.00 0.00 177.43 178.18 1llb h ALA 359 N 1.23 1.44 -0.31 1.57 0.00 -1.21 -2.42 119.26 119.56 1llb h ALA 359 Ca 0.24 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1llb h ALA 359 Cb 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1llb h ALA 359 CO -0.02 0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.78 1llb n LEU 360 N -3.98 2.88 0.00 0.00 4.77 -0.88 -5.11 117.00 114.68 1llb n LEU 360 Ca -0.02 -1.46 0.00 0.00 -0.03 0.00 0.00 56.01 54.50 1llb n LEU 360 Cb 0.29 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1llb n LEU 360 CO 0.35 0.46 0.00 0.00 -1.33 0.00 0.00 177.39 176.86