#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1llf s PRO 2 N 0.00 4.12 0.10 0.00 0.02 -1.26 -4.86 135.00 133.12 1llf s PRO 2 Ca 0.00 2.40 0.01 0.00 0.02 0.00 0.00 61.00 63.44 1llf s PRO 2 Cb 0.00 -2.94 -0.04 0.00 0.02 0.00 0.00 34.50 31.54 1llf s PRO 2 CO 0.00 -0.46 -0.05 0.95 -0.33 0.00 0.00 177.00 177.11 1llf s THR 3 N -1.15 0.61 -0.17 0.99 -4.23 -1.26 -0.34 115.64 110.09 1llf s THR 3 Ca 0.53 -1.92 -0.15 0.00 -1.18 0.00 0.00 61.69 58.97 1llf s THR 3 Cb -0.43 -1.71 0.04 0.00 1.34 0.00 0.00 72.50 71.75 1llf s THR 3 CO 0.58 -0.85 0.44 0.00 -0.54 0.00 0.00 174.62 174.25 1llf s ALA 4 N -3.68 -1.09 -0.18 3.99 0.00 -0.34 -4.93 121.76 115.53 1llf s ALA 4 Ca 0.12 1.26 -0.13 0.00 0.00 0.00 0.00 51.96 53.21 1llf s ALA 4 Cb 0.06 -0.73 -0.05 0.00 0.00 0.00 0.00 23.12 22.40 1llf s ALA 4 CO -0.05 -0.21 0.27 0.21 0.00 0.00 0.00 175.76 175.99 1llf s LYS 5 N 0.30 4.21 0.78 0.00 2.20 -1.26 -0.67 119.74 125.30 1llf s LYS 5 Ca -0.01 0.02 -0.12 0.00 -0.36 0.00 0.00 55.97 55.51 1llf s LYS 5 Cb -0.03 -3.46 0.06 0.00 -1.51 0.00 0.00 37.83 32.89 1llf s LYS 5 CO -0.00 0.17 1.15 -0.51 -0.36 0.00 0.00 175.35 175.80 1llf s LEU 6 N 0.69 2.63 0.52 5.43 1.43 0.68 -4.26 118.68 125.79 1llf s LEU 6 Ca 0.15 0.86 0.18 0.00 -1.03 0.00 0.00 54.13 54.29 1llf s LEU 6 Cb -0.13 -3.44 1.28 0.00 0.03 0.00 0.00 46.19 43.93 1llf s LEU 6 CO 0.04 -1.74 2.10 0.00 0.23 0.00 0.00 176.35 176.98 1llf h ALA 7 N -0.92 2.13 -0.02 4.21 0.00 -1.85 0.30 119.26 123.10 1llf h ALA 7 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1llf h ALA 7 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1llf h ALA 7 CO 0.65 -0.17 0.00 0.27 0.00 0.00 0.00 179.25 180.00 1llf n ASN 8 N -4.49 0.62 0.00 0.00 0.23 -1.26 -4.89 115.26 105.48 1llf n ASN 8 Ca 0.01 -1.26 0.00 0.00 -0.53 0.00 0.00 54.58 52.80 1llf n ASN 8 Cb 0.24 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 1llf n ASN 8 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1llf n GLY 9 N 1.05 0.79 3.77 4.83 0.00 0.09 -5.05 105.19 110.67 1llf n GLY 9 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1llf n GLY 9 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1llf s ASP 10 N -1.80 6.30 -0.18 1.61 1.01 -1.26 -4.71 116.67 117.65 1llf s ASP 10 Ca 0.00 2.92 -0.04 0.00 0.71 0.00 0.00 52.55 56.13 1llf s ASP 10 Cb 0.00 -2.66 -0.02 0.00 1.01 0.00 0.00 42.92 41.25 1llf s ASP 10 CO 0.00 -0.89 -0.03 -0.89 0.21 0.00 0.00 175.17 173.57 1llf s THR 11 N -1.16 3.86 0.25 -1.27 2.01 -1.26 -0.23 115.64 117.84 1llf s THR 11 Ca 0.55 -0.36 0.11 0.00 0.31 0.00 0.00 61.69 62.30 1llf s THR 11 Cb -0.44 -2.71 -0.05 0.00 0.01 0.00 0.00 72.50 69.31 1llf s THR 11 CO 0.58 0.46 -0.15 0.27 -0.69 0.00 0.00 174.62 175.10 1llf s ILE 12 N 0.67 2.78 -0.05 1.82 -4.36 0.16 -0.24 121.20 121.98 1llf s ILE 12 Ca -0.02 -2.15 0.04 0.00 -0.26 0.00 0.00 60.65 58.26 1llf s ILE 12 Cb -0.14 -2.44 -0.02 0.00 1.25 0.00 0.00 42.46 41.10 1llf s ILE 12 CO 0.02 -0.32 -0.15 -0.89 0.24 0.00 0.00 174.94 173.84 1llf s THR 13 N -2.26 3.00 0.00 8.37 2.01 -0.67 -1.19 115.64 124.91 1llf s THR 13 Ca 0.28 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.54 1llf s THR 13 Cb -0.06 -2.18 0.00 0.00 0.01 0.00 0.00 72.50 70.27 1llf s THR 13 CO 0.15 0.59 0.00 0.61 -0.69 0.00 0.00 174.62 175.28 1llf n GLY 14 N 2.41 6.64 3.42 4.40 0.00 0.53 -0.66 105.19 121.94 1llf n GLY 14 Ca -0.17 -2.04 -0.33 0.00 0.00 0.00 0.00 46.02 43.48 1llf n GLY 14 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1llf s LEU 15 N 0.00 2.93 -0.66 0.99 2.96 0.13 -4.26 118.68 120.78 1llf s LEU 15 Ca 0.00 -0.25 -0.24 0.00 -0.22 0.00 0.00 54.13 53.43 1llf s LEU 15 Cb 0.00 -1.68 0.06 0.00 0.50 0.00 0.00 46.19 45.07 1llf s LEU 15 CO 0.00 0.17 1.03 0.21 -1.32 0.00 0.00 176.35 176.43 1llf s ASN 16 N 0.35 6.19 -0.05 3.68 2.47 -1.26 -1.01 114.94 125.31 1llf s ASN 16 Ca -0.08 -0.81 0.12 0.00 0.42 0.00 0.00 52.86 52.51 1llf s ASN 16 Cb -0.15 -2.45 0.44 0.00 -1.45 0.00 0.00 41.25 37.64 1llf s ASN 16 CO 0.05 -1.50 1.32 0.00 -3.72 0.00 0.00 177.10 173.24 1llf n ALA 17 N 8.03 2.75 0.00 1.71 0.00 0.09 -4.94 120.51 128.15 1llf n ALA 17 Ca -0.02 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.48 1llf n ALA 17 Cb 0.46 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.91 1llf n ALA 17 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1llf n ILE 18 N 0.69 0.00 1.01 0.00 2.08 -1.26 -4.16 119.36 117.71 1llf n ILE 18 Ca 0.16 0.00 0.14 0.00 0.56 0.00 0.00 62.75 63.61 1llf n ILE 18 Cb 0.54 0.00 0.57 0.00 -0.75 0.00 0.00 39.64 40.00 1llf n ILE 18 CO 0.00 0.00 0.00 2.30 0.56 0.00 0.00 176.55 179.41 1llf n ILE 19 N 0.00 0.00 -3.77 1.39 -5.35 -1.26 -4.77 119.36 105.60 1llf n ILE 19 Ca 0.00 -0.00 -0.03 0.00 -0.27 0.00 0.00 62.75 62.45 1llf n ILE 19 Cb 0.00 -0.39 -0.01 0.00 -1.74 0.00 0.00 39.64 37.50 1llf n ILE 19 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1llf s ASN 20 N -2.99 -0.14 -0.13 7.28 2.20 -1.26 -4.49 114.94 115.41 1llf s ASN 20 Ca 0.14 -0.46 0.01 0.00 -0.94 0.00 0.00 52.86 51.60 1llf s ASN 20 Cb 0.19 0.49 -0.01 0.00 -2.00 0.00 0.00 41.25 39.92 1llf s ASN 20 CO 0.55 -0.93 -0.15 -1.61 -2.94 0.00 0.00 177.10 172.03 1llf s GLU 21 N -3.08 3.31 -0.07 3.55 2.02 0.02 -0.73 118.70 123.73 1llf s GLU 21 Ca 0.14 -0.72 0.03 0.00 0.02 0.00 0.00 54.97 54.44 1llf s GLU 21 Cb -0.02 -2.58 0.01 0.00 0.10 0.00 0.00 34.13 31.64 1llf s GLU 21 CO 0.03 0.19 -0.16 0.00 0.02 0.00 0.00 175.26 175.34 1llf s ALA 22 N 0.39 1.50 -0.37 5.21 0.00 -0.18 -0.65 121.76 127.66 1llf s ALA 22 Ca -0.12 -0.59 0.01 0.00 0.00 0.00 0.00 51.96 51.26 1llf s ALA 22 Cb -0.16 -0.60 0.10 0.00 0.00 0.00 0.00 23.12 22.46 1llf s ALA 22 CO 0.06 0.19 0.11 -0.06 0.00 0.00 0.00 175.76 176.06 1llf s PHE 23 N 0.44 3.66 -0.09 0.00 0.40 0.77 0.23 117.98 123.38 1llf s PHE 23 Ca -0.13 -2.69 0.03 0.00 -0.60 0.00 0.00 56.93 53.54 1llf s PHE 23 Cb -0.15 -3.01 -0.02 0.00 0.51 0.00 0.00 43.02 40.36 1llf s PHE 23 CO 0.04 -0.95 -0.17 -0.51 0.70 0.00 0.00 175.22 174.33 1llf s LEU 24 N 1.03 2.52 0.00 -0.37 1.43 -0.31 -0.59 118.68 122.38 1llf s LEU 24 Ca 0.09 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 1llf s LEU 24 Cb -0.21 -1.53 0.00 0.00 0.03 0.00 0.00 46.19 44.49 1llf s LEU 24 CO -0.06 0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.36 1llf n GLY 25 N 3.10 0.81 3.65 -3.19 0.00 -1.21 -3.72 105.19 104.64 1llf n GLY 25 Ca -0.18 -0.64 -0.43 0.00 0.00 0.00 0.00 46.02 44.77 1llf n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1llf s ILE 26 N -2.00 4.48 0.23 -0.61 1.01 -0.72 -4.80 121.20 118.79 1llf s ILE 26 Ca 0.00 1.77 -0.30 0.00 0.00 0.00 0.00 60.65 62.12 1llf s ILE 26 Cb 0.00 -4.23 -0.09 0.00 0.01 0.00 0.00 42.46 38.15 1llf s ILE 26 CO 0.00 -0.25 1.36 -2.16 0.00 0.00 0.00 174.94 173.89 1llf s PRO 27 N 3.46 4.34 0.00 2.79 0.04 -1.26 -0.76 135.00 143.61 1llf s PRO 27 Ca 0.48 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.68 1llf s PRO 27 Cb -0.17 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.22 1llf s PRO 27 CO 0.12 -0.31 0.22 1.97 0.04 0.00 0.00 177.00 179.04 1llf n PHE 28 N 2.40 0.00 -4.10 0.56 -1.74 -0.64 -4.90 117.46 109.04 1llf n PHE 28 Ca 0.06 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.87 1llf n PHE 28 Cb 0.42 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.32 1llf n PHE 28 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1llf s ALA 29 N -0.54 0.60 0.48 1.98 0.00 -1.25 -2.41 121.76 120.62 1llf s ALA 29 Ca 0.00 -1.18 -0.23 0.00 0.00 0.00 0.00 51.96 50.54 1llf s ALA 29 Cb 0.00 0.23 -0.07 0.00 0.00 0.00 0.00 23.12 23.28 1llf s ALA 29 CO 0.00 -0.31 1.33 -1.21 0.00 0.00 0.00 175.76 175.57 1llf s GLU 30 N -3.63 3.52 -0.06 0.00 0.41 0.82 -4.52 118.70 115.24 1llf s GLU 30 Ca 0.06 2.18 -0.35 0.00 -0.41 0.00 0.00 54.97 56.45 1llf s GLU 30 Cb 0.05 -2.46 -0.13 0.00 -1.78 0.00 0.00 34.13 29.81 1llf s GLU 30 CO -0.08 -0.87 1.79 -2.30 -0.49 0.00 0.00 175.26 173.32 1llf n PRO 31 N -0.54 2.03 -1.34 0.39 -0.02 -1.26 -4.66 135.00 129.61 1llf n PRO 31 Ca 0.07 0.74 -0.29 0.00 -2.02 0.00 0.00 63.50 62.00 1llf n PRO 31 Cb 0.45 -2.55 -0.07 0.00 -0.02 0.00 0.00 33.50 31.30 1llf n PRO 31 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1llf n PRO 32 N 5.76 3.16 -3.68 0.52 -0.04 -1.26 -4.89 135.00 134.57 1llf n PRO 32 Ca 0.22 -2.03 -0.20 0.00 -0.04 0.00 0.00 63.50 61.45 1llf n PRO 32 Cb 0.27 -2.45 -0.02 0.00 -0.04 0.00 0.00 33.50 31.27 1llf n PRO 32 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1llf s VAL 33 N 0.79 4.07 0.00 0.52 -7.23 -1.26 -3.53 120.40 113.76 1llf s VAL 33 Ca 0.65 -1.14 0.00 0.00 -1.81 0.00 0.00 61.98 59.68 1llf s VAL 33 Cb 0.25 -3.39 0.00 0.00 0.56 0.00 0.00 36.38 33.79 1llf s VAL 33 CO -0.06 -0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 1llf n GLY 34 N -1.50 3.49 0.00 2.32 0.00 -1.26 -1.34 105.19 106.90 1llf n GLY 34 Ca -0.02 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.04 1llf n GLY 34 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1llf n ASN 35 N 4.68 0.00 -0.62 1.61 3.02 -1.26 -1.43 115.26 121.26 1llf n ASN 35 Ca 0.00 -0.14 0.12 0.00 -0.03 0.00 0.00 54.58 54.54 1llf n ASN 35 Cb 0.00 -0.18 0.23 0.00 -0.61 0.00 0.00 39.78 39.22 1llf n ASN 35 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1llf n LEU 36 N -1.18 2.08 -4.74 3.41 4.77 -0.45 -4.91 117.00 115.99 1llf n LEU 36 Ca 0.09 -0.70 -0.41 0.00 -0.03 0.00 0.00 56.01 54.96 1llf n LEU 36 Cb 0.10 -0.02 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 1llf n LEU 36 CO 0.11 0.36 1.01 0.54 -1.33 0.00 0.00 177.39 178.08 1llf n ARG 37 N 0.43 2.26 -0.10 3.23 1.74 -0.51 -2.32 116.66 121.39 1llf n ARG 37 Ca 0.14 0.80 0.00 0.00 -0.77 0.00 0.00 57.85 58.02 1llf n ARG 37 Cb 0.47 -2.53 0.00 0.00 -1.02 0.00 0.00 32.46 29.38 1llf n ARG 37 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1llf n PHE 38 N 0.03 0.00 -2.07 -1.55 3.72 -1.26 -4.98 117.46 111.35 1llf n PHE 38 Ca 0.04 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.15 1llf n PHE 38 Cb 0.39 -0.63 0.03 0.00 -0.94 0.00 0.00 39.48 38.34 1llf n PHE 38 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1llf s LYS 39 N -0.08 3.03 0.43 -1.08 1.02 -0.98 -4.68 119.74 117.39 1llf s LYS 39 Ca 0.00 0.36 -0.23 0.00 0.02 0.00 0.00 55.97 56.12 1llf s LYS 39 Cb 0.00 -2.12 -0.11 0.00 -0.52 0.00 0.00 37.83 35.08 1llf s LYS 39 CO 0.00 -0.82 0.79 -0.25 -0.92 0.00 0.00 175.35 174.15 1llf n ASP 40 N -2.81 0.22 -4.77 2.83 8.00 -1.26 -4.90 116.55 113.86 1llf n ASP 40 Ca 0.06 0.96 -0.39 0.00 0.71 0.00 0.00 54.79 56.13 1llf n ASP 40 Cb 0.57 -1.24 -0.02 0.00 -0.02 0.00 0.00 41.12 40.41 1llf n ASP 40 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1llf s PRO 41 N -1.85 4.17 -0.18 -0.24 0.04 -1.26 -5.01 135.00 130.66 1llf s PRO 41 Ca 0.64 1.99 -0.15 0.00 0.04 0.00 0.00 61.00 63.53 1llf s PRO 41 Cb -0.57 -2.85 -0.04 0.00 0.04 0.00 0.00 34.50 31.08 1llf s PRO 41 CO 0.57 -0.27 0.34 0.08 0.04 0.00 0.00 177.00 177.76 1llf s VAL 42 N -1.28 5.25 0.28 -0.36 1.01 -1.26 -5.00 120.40 119.04 1llf s VAL 42 Ca 0.54 0.61 -0.29 0.00 0.00 0.00 0.00 61.98 62.84 1llf s VAL 42 Cb -0.35 -3.68 -0.13 0.00 0.00 0.00 0.00 36.38 32.22 1llf s VAL 42 CO 0.45 0.32 1.27 -2.65 0.00 0.00 0.00 175.10 174.48 1llf n PRO 43 N 4.06 1.88 -1.85 2.72 -0.02 -1.26 -0.13 135.00 140.40 1llf n PRO 43 Ca -0.10 0.66 -0.42 0.00 -2.02 0.00 0.00 63.50 61.62 1llf n PRO 43 Cb 0.51 -2.23 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 1llf n PRO 43 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1llf s TYR 44 N -0.66 2.96 -0.49 6.00 5.04 -1.01 -4.29 117.35 124.90 1llf s TYR 44 Ca 0.62 0.58 0.18 0.00 -2.44 0.00 0.00 57.07 56.01 1llf s TYR 44 Cb -0.64 -4.01 -0.24 0.00 0.35 0.00 0.00 41.96 37.41 1llf s TYR 44 CO 0.57 -3.71 0.62 -1.13 -1.34 0.00 0.00 175.55 170.55 1llf n SER 45 N 3.61 0.79 -4.43 4.32 3.41 -1.26 -4.93 113.62 115.13 1llf n SER 45 Ca 0.13 -0.52 -0.27 0.00 -0.26 0.00 0.00 58.87 57.95 1llf n SER 45 Cb 0.37 1.38 0.14 0.00 -0.26 0.00 0.00 64.21 65.85 1llf n SER 45 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1llf s GLY 46 N -3.36 1.76 -0.04 5.00 0.00 -1.26 -5.06 107.32 104.35 1llf s GLY 46 Ca 0.01 -1.35 -0.13 0.00 0.00 0.00 0.00 44.72 43.25 1llf s GLY 46 CO 0.76 -0.70 0.33 -0.45 0.00 0.00 0.00 173.10 173.05 1llf s SER 47 N -4.79 6.68 -0.02 1.64 0.15 -1.26 -4.98 113.70 111.12 1llf s SER 47 Ca 0.70 0.81 0.12 0.00 0.70 0.00 0.00 55.95 58.27 1llf s SER 47 Cb -0.05 -2.20 0.35 0.00 -1.71 0.00 0.00 66.02 62.41 1llf s SER 47 CO 0.49 0.33 1.29 0.18 1.20 0.00 0.00 173.24 176.73 1llf n LEU 48 N 2.01 3.11 -4.73 3.45 4.77 -1.26 -5.04 117.00 119.30 1llf n LEU 48 Ca -0.15 -2.11 -0.42 0.00 -0.03 0.00 0.00 56.01 53.30 1llf n LEU 48 Cb 0.53 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.31 1llf n LEU 48 CO 0.36 0.74 1.32 -3.20 -1.33 0.00 0.00 177.39 175.28 1llf n ASN 49 N 0.48 3.94 0.00 -1.43 5.15 -1.26 -1.44 115.26 120.69 1llf n ASN 49 Ca 0.13 1.09 0.00 0.00 -0.60 0.00 0.00 54.58 55.21 1llf n ASN 49 Cb 0.49 -1.58 0.00 0.00 -0.53 0.00 0.00 39.78 38.16 1llf n ASN 49 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1llf n GLY 50 N 3.30 1.68 3.89 8.20 0.00 0.67 -4.93 105.19 118.01 1llf n GLY 50 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1llf n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1llf s GLN 51 N -0.12 3.62 -0.10 1.61 -0.21 -0.52 -4.87 119.66 119.06 1llf s GLN 51 Ca 0.00 0.43 -0.01 0.00 0.02 0.00 0.00 55.36 55.80 1llf s GLN 51 Cb 0.00 -2.28 -0.03 0.00 1.00 0.00 0.00 33.01 31.70 1llf s GLN 51 CO 0.00 -0.28 -0.04 0.15 -2.12 0.00 0.00 175.29 173.00 1llf s LYS 52 N -4.68 3.13 -0.54 2.91 1.02 -1.26 -1.66 119.74 118.65 1llf s LYS 52 Ca 0.51 -0.51 0.04 0.00 0.02 0.00 0.00 55.97 56.03 1llf s LYS 52 Cb -0.10 -2.75 0.17 0.00 -0.52 0.00 0.00 37.83 34.62 1llf s LYS 52 CO 0.45 0.52 0.40 -0.06 -0.92 0.00 0.00 175.35 175.74 1llf s PHE 53 N -0.41 2.26 0.00 3.18 0.08 0.16 -4.94 117.98 118.31 1llf s PHE 53 Ca 0.07 -2.78 0.00 0.00 0.12 0.00 0.00 56.93 54.34 1llf s PHE 53 Cb -0.12 -1.79 0.00 0.00 -0.57 0.00 0.00 43.02 40.54 1llf s PHE 53 CO 0.02 -0.70 0.63 0.25 -0.10 0.00 0.00 175.22 175.32 1llf n THR 54 N 2.52 0.34 -3.81 0.64 -2.24 -1.24 -1.17 114.28 109.32 1llf n THR 54 Ca 0.24 -0.61 -0.11 0.00 -2.27 0.00 0.00 64.05 61.30 1llf n THR 54 Cb 0.41 0.91 -0.08 0.00 -2.10 0.00 0.00 70.33 69.47 1llf n THR 54 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1llf s SER 55 N -0.34 -0.03 0.40 3.42 1.04 -1.26 -4.87 113.70 112.06 1llf s SER 55 Ca 0.00 -0.31 -0.26 0.00 0.48 0.00 0.00 55.95 55.86 1llf s SER 55 Cb 0.00 0.32 -0.09 0.00 0.10 0.00 0.00 66.02 66.35 1llf s SER 55 CO 0.00 -0.59 1.32 -0.31 0.98 0.00 0.00 173.24 174.64 1llf s TYR 56 N -2.60 2.82 0.99 5.02 2.02 -1.26 -3.82 117.35 120.52 1llf s TYR 56 Ca -0.05 1.39 -0.16 0.00 -0.37 0.00 0.00 57.07 57.89 1llf s TYR 56 Cb -0.01 -3.70 0.20 0.00 -0.40 0.00 0.00 41.96 38.05 1llf s TYR 56 CO -0.04 -2.14 1.24 0.20 -1.57 0.00 0.00 175.55 173.25 1llf s GLY 57 N -0.67 1.70 0.75 0.71 0.00 -1.26 -4.93 107.32 103.63 1llf s GLY 57 Ca 0.56 -1.02 -0.14 0.00 0.00 0.00 0.00 44.72 44.12 1llf s GLY 57 CO 0.50 -0.28 1.17 2.56 0.00 0.00 0.00 173.10 177.05 1llf s PRO 58 N -5.69 2.08 0.85 2.90 0.04 -1.26 -4.95 135.00 128.96 1llf s PRO 58 Ca 0.71 1.60 -0.11 0.00 0.04 0.00 0.00 61.00 63.24 1llf s PRO 58 Cb -0.07 -1.84 0.10 0.00 0.04 0.00 0.00 34.50 32.73 1llf s PRO 58 CO 0.53 -1.85 1.09 -1.54 0.04 0.00 0.00 177.00 175.28 1llf s SER 59 N -2.38 3.81 0.97 6.66 1.04 0.23 -4.78 113.70 119.26 1llf s SER 59 Ca 0.70 1.69 -0.12 0.00 0.48 0.00 0.00 55.95 58.71 1llf s SER 59 Cb -0.25 -2.36 0.17 0.00 0.10 0.00 0.00 66.02 63.68 1llf s SER 59 CO 0.48 -2.45 1.09 0.00 0.98 0.00 0.00 173.24 173.33 1llf n MET 61 N -4.22 2.61 -4.56 0.00 2.81 -1.22 -4.48 117.12 108.06 1llf n MET 61 Ca 0.07 0.91 -0.33 0.00 -1.81 0.00 0.00 57.70 56.54 1llf n MET 61 Cb 0.55 -2.63 -0.13 0.00 -0.71 0.00 0.00 33.22 30.30 1llf n MET 61 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1llf s GLN 62 N -2.09 3.47 0.17 0.03 -1.52 -1.26 -4.58 119.66 113.88 1llf s GLN 62 Ca 0.54 -0.58 -0.29 0.00 -1.95 0.00 0.00 55.36 53.07 1llf s GLN 62 Cb -0.49 -2.78 -0.07 0.00 -0.22 0.00 0.00 33.01 29.45 1llf s GLN 62 CO 0.64 0.28 0.93 -1.14 -0.25 0.00 0.00 175.29 175.75 1llf s GLN 63 N 0.22 4.76 -0.18 2.91 0.74 -0.49 -5.00 119.66 122.62 1llf s GLN 63 Ca -0.05 1.43 -0.36 0.00 0.05 0.00 0.00 55.36 56.44 1llf s GLN 63 Cb -0.14 -3.32 -0.13 0.00 1.10 0.00 0.00 33.01 30.52 1llf s GLN 63 CO 0.04 0.39 1.89 -1.71 -0.55 0.00 0.00 175.29 175.34 1llf n ASN 64 N 2.08 3.02 0.12 6.67 2.85 -1.26 -4.71 115.26 124.03 1llf n ASN 64 Ca -0.01 0.92 0.19 0.00 -0.11 0.00 0.00 54.58 55.58 1llf n ASN 64 Cb 0.48 -1.30 0.77 0.00 1.24 0.00 0.00 39.78 40.97 1llf n ASN 64 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1llf h PRO 65 N 9.15 0.00 -0.66 1.20 0.11 -1.94 0.61 132.00 140.46 1llf h PRO 65 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1llf h PRO 65 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1llf h PRO 65 CO 0.96 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 179.14 1llf n GLU 66 N -3.87 3.25 -1.40 1.05 -0.58 -1.26 -0.81 120.64 117.01 1llf n GLU 66 Ca 0.06 -2.75 -0.37 0.00 -0.42 0.00 0.00 57.16 53.67 1llf n GLU 66 Cb 0.51 -1.72 0.05 0.00 -0.57 0.00 0.00 31.44 29.71 1llf n GLU 66 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1llf n GLY 67 N 1.29 -1.38 3.62 0.62 0.00 0.21 -4.18 105.19 105.36 1llf n GLY 67 Ca 0.24 -0.25 -0.01 0.00 0.00 0.00 0.00 46.02 46.00 1llf n GLY 67 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1llf s THR 68 N -1.77 0.00 -1.09 2.61 -1.32 -0.67 -0.94 115.64 112.46 1llf s THR 68 Ca 0.68 -0.01 0.25 0.00 -1.21 0.00 0.00 61.69 61.40 1llf s THR 68 Cb -0.40 -1.28 0.25 0.00 -1.51 0.00 0.00 72.50 69.56 1llf s THR 68 CO 0.55 0.00 1.80 2.22 -2.21 0.00 0.00 174.62 176.97 1llf n PHE 69 N -0.15 0.00 -2.27 9.09 1.16 -1.00 -4.21 117.46 120.09 1llf n PHE 69 Ca 0.01 0.00 -0.28 0.00 -1.87 0.00 0.00 57.45 55.31 1llf n PHE 69 Cb 0.58 -0.46 0.03 0.00 -1.61 0.00 0.00 39.48 38.03 1llf n PHE 69 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 1llf s GLU 70 N -2.91 3.08 -0.07 3.97 2.02 -1.26 -5.08 118.70 118.45 1llf s GLU 70 Ca 0.14 0.21 0.01 0.00 0.02 0.00 0.00 54.97 55.36 1llf s GLU 70 Cb 0.16 -2.21 -0.03 0.00 0.10 0.00 0.00 34.13 32.15 1llf s GLU 70 CO 0.43 -0.68 -0.08 -1.21 0.02 0.00 0.00 175.26 173.74 1llf s GLU 71 N -5.05 2.76 0.14 1.61 0.41 -1.26 -5.06 118.70 112.24 1llf s GLU 71 Ca 0.54 -0.58 -0.25 0.00 -0.41 0.00 0.00 54.97 54.27 1llf s GLU 71 Cb -0.11 -2.56 0.07 0.00 -1.78 0.00 0.00 34.13 29.75 1llf s GLU 71 CO 0.47 0.63 0.80 0.54 -0.49 0.00 0.00 175.26 177.21 1llf s ASN 72 N -0.72 -0.35 0.46 -0.19 2.20 -1.26 -5.05 114.94 110.03 1llf s ASN 72 Ca 0.11 -0.23 0.21 0.00 -0.94 0.00 0.00 52.86 52.01 1llf s ASN 72 Cb -0.11 0.54 1.10 0.00 -2.00 0.00 0.00 41.25 40.77 1llf s ASN 72 CO 0.01 -0.93 1.95 -0.07 -2.94 0.00 0.00 177.10 175.12 1llf h LEU 73 N 2.00 0.00 -0.22 3.54 3.38 -1.99 -2.27 115.31 119.75 1llf h LEU 73 Ca -0.25 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.59 1llf h LEU 73 Cb 1.26 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.01 1llf h LEU 73 CO 0.30 0.22 -0.35 1.23 0.09 0.00 0.00 178.44 179.93 1llf h GLY 74 N 1.09 0.68 0.75 0.83 0.00 -1.96 0.18 103.07 104.64 1llf h GLY 74 Ca -0.00 -0.77 0.05 0.00 0.00 0.00 0.00 47.33 46.60 1llf h GLY 74 CO 0.03 0.70 0.37 1.70 0.00 0.00 0.00 176.54 179.33 1llf h LYS 75 N 0.32 0.68 -0.28 4.80 3.64 -1.67 -1.34 116.57 122.71 1llf h LYS 75 Ca 0.02 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1llf h LYS 75 Cb 0.94 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1llf h LYS 75 CO 0.08 0.45 0.11 1.15 -2.27 0.00 0.00 179.45 178.97 1llf h THR 76 N 0.70 1.18 -0.29 1.00 2.02 -1.16 -1.57 112.91 114.78 1llf h THR 76 Ca 0.28 -0.56 0.03 0.00 0.77 0.00 0.00 66.41 66.93 1llf h THR 76 Cb 0.12 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 1llf h THR 76 CO -0.15 0.19 0.10 0.00 0.37 0.00 0.00 175.52 176.03 1llf h ALA 77 N 0.95 0.33 -0.07 6.16 0.00 -0.37 -1.11 119.26 125.15 1llf h ALA 77 Ca 0.09 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 1llf h ALA 77 Cb 0.19 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1llf h ALA 77 CO -0.01 -0.30 -0.54 -0.07 0.00 0.00 0.00 179.25 178.33 1llf h LEU 78 N 0.23 0.23 -0.22 0.00 3.38 -1.14 -2.27 115.31 115.52 1llf h LEU 78 Ca 0.13 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1llf h LEU 78 Cb 0.10 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1llf h LEU 78 CO -0.13 0.73 0.13 0.44 0.09 0.00 0.00 178.44 179.70 1llf h ASP 79 N 0.16 0.26 -0.40 -0.43 3.32 -0.91 0.59 116.42 119.02 1llf h ASP 79 Ca 0.00 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 1llf h ASP 79 Cb 1.01 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.47 1llf h ASP 79 CO 0.08 0.22 0.07 -0.07 -1.72 0.00 0.00 179.24 177.82 1llf h LEU 80 N 0.27 0.69 0.08 1.55 3.38 -1.07 -0.31 115.31 119.91 1llf h LEU 80 Ca 0.08 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1llf h LEU 80 Cb 0.01 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1llf h LEU 80 CO -0.02 0.72 -0.04 0.58 0.09 0.00 0.00 178.44 179.78 1llf h VAL 81 N 0.71 1.04 0.00 1.22 2.07 -1.12 -2.32 116.25 117.86 1llf h VAL 81 Ca 0.15 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1llf h VAL 81 Cb 0.34 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1llf h VAL 81 CO 0.01 0.11 0.00 0.24 0.02 0.00 0.00 177.57 177.94 1llf h MET 82 N -0.30 0.00 0.00 1.57 2.86 -0.58 -2.04 114.93 116.44 1llf h MET 82 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1llf h MET 82 Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1llf h MET 82 CO 0.02 0.00 -1.06 1.04 1.06 0.00 0.00 176.91 177.97 1llf n GLN 83 N -2.83 0.18 -1.48 1.72 1.13 -0.15 -4.49 117.38 111.46 1llf n GLN 83 Ca 0.00 -0.02 -0.35 0.00 -1.94 0.00 0.00 57.00 54.69 1llf n GLN 83 Cb 0.22 -1.54 0.09 0.00 0.11 0.00 0.00 30.24 29.13 1llf n GLN 83 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1llf s SER 84 N -3.51 4.21 0.34 1.08 1.04 -0.77 -4.79 113.70 111.30 1llf s SER 84 Ca 0.05 2.45 0.05 0.00 0.48 0.00 0.00 55.95 58.98 1llf s SER 84 Cb 0.15 -2.60 0.62 0.00 0.10 0.00 0.00 66.02 64.30 1llf s SER 84 CO 0.83 -2.26 1.88 0.11 0.98 0.00 0.00 173.24 174.78 1llf h LYS 85 N -0.13 0.51 -0.00 4.02 1.57 -1.92 -1.13 116.57 119.50 1llf h LYS 85 Ca -0.48 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.19 1llf h LYS 85 Cb 1.31 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.54 1llf h LYS 85 CO 0.50 0.54 0.00 -0.24 -0.57 0.00 0.00 179.45 179.68 1llf h VAL 86 N 0.49 1.18 -0.15 0.50 3.04 -1.92 0.37 116.25 119.76 1llf h VAL 86 Ca 0.11 -0.54 0.02 0.00 -1.01 0.00 0.00 66.70 65.28 1llf h VAL 86 Cb 0.31 1.54 -0.02 0.00 -2.01 0.00 0.00 31.29 31.12 1llf h VAL 86 CO 0.01 0.14 0.03 0.15 -1.01 0.00 0.00 177.57 176.89 1llf h PHE 87 N -0.23 0.06 0.00 3.17 3.04 -1.74 -2.56 116.94 118.67 1llf h PHE 87 Ca 0.00 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 1llf h PHE 87 Cb 0.23 -0.00 -0.00 0.00 2.56 0.00 0.00 35.95 38.73 1llf h PHE 87 CO 0.00 0.02 -0.03 1.96 -2.02 0.00 0.00 178.31 178.24 1llf h GLN 88 N 0.10 0.00 0.07 1.11 4.20 -1.06 0.35 115.11 119.87 1llf h GLN 88 Ca 0.07 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.54 1llf h GLN 88 Cb 0.06 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1llf h GLN 88 CO -0.09 0.03 -1.10 0.00 -0.67 0.00 0.00 178.83 177.00 1llf h ALA 89 N 1.97 0.24 0.14 3.87 0.00 -0.52 -3.11 119.26 121.86 1llf h ALA 89 Ca -0.00 -0.87 -0.23 0.00 0.00 0.00 0.00 54.91 53.81 1llf h ALA 89 Cb 0.09 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1llf h ALA 89 CO 0.00 1.06 -1.08 0.28 0.00 0.00 0.00 179.25 179.52 1llf h VAL 90 N 0.05 1.32 -2.12 0.00 2.07 -1.20 -3.41 116.25 112.97 1llf h VAL 90 Ca -0.08 -2.50 -0.58 0.00 0.82 0.00 0.00 66.70 64.36 1llf h VAL 90 Cb 1.83 3.01 -0.41 0.00 -1.52 0.00 0.00 31.29 34.21 1llf h VAL 90 CO 0.17 0.72 -0.79 0.18 0.02 0.00 0.00 177.57 177.86 1llf n LEU 91 N -4.03 2.46 -4.74 2.57 4.77 0.08 -5.11 117.00 113.00 1llf n LEU 91 Ca -0.18 -5.18 -0.35 0.00 -0.03 0.00 0.00 56.01 50.27 1llf n LEU 91 Cb 0.87 -0.17 0.06 0.00 -2.33 0.00 0.00 43.42 41.85 1llf n LEU 91 CO 0.47 2.08 0.80 -2.16 -1.33 0.00 0.00 177.39 177.25 1llf s PRO 92 N -2.07 2.59 0.13 3.23 0.04 -1.17 -4.64 135.00 133.11 1llf s PRO 92 Ca 0.39 1.69 0.06 0.00 0.04 0.00 0.00 61.00 63.18 1llf s PRO 92 Cb 0.17 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.77 1llf s PRO 92 CO -0.05 -1.47 -0.14 1.14 0.04 0.00 0.00 177.00 176.51 1llf s GLN 93 N -3.75 1.07 -0.08 4.56 -2.07 -1.26 -0.60 119.66 117.53 1llf s GLN 93 Ca 0.74 -1.29 -0.31 0.00 -1.82 0.00 0.00 55.36 52.68 1llf s GLN 93 Cb -0.27 -0.94 0.09 0.00 -1.09 0.00 0.00 33.01 30.80 1llf s GLN 93 CO 0.40 0.18 0.78 0.45 -1.32 0.00 0.00 175.29 175.78 1llf s SER 94 N -2.58 -0.57 0.48 12.60 0.15 -0.03 -4.88 113.70 118.87 1llf s SER 94 Ca 0.11 0.61 0.24 0.00 0.70 0.00 0.00 55.95 57.61 1llf s SER 94 Cb -0.04 0.46 1.22 0.00 -1.71 0.00 0.00 66.02 65.96 1llf s SER 94 CO 0.03 -0.53 1.99 -0.33 1.20 0.00 0.00 173.24 175.61 1llf h GLU 95 N 2.85 0.00 -5.76 5.44 5.08 -1.93 -3.22 114.58 117.04 1llf h GLU 95 Ca -0.24 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.44 1llf h GLU 95 Cb 1.15 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.32 1llf h GLU 95 CO 0.36 0.18 2.25 -3.47 -1.00 0.00 0.00 179.01 177.33 1llf n ASP 96 N -3.71 4.89 0.00 1.42 -0.08 -1.26 -4.25 116.55 113.56 1llf n ASP 96 Ca -0.02 -2.92 0.00 0.00 -1.51 0.00 0.00 54.79 50.35 1llf n ASP 96 Cb 0.30 -1.74 0.00 0.00 2.34 0.00 0.00 41.12 42.01 1llf n ASP 96 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1llf s LEU 98 N -0.21 4.89 0.26 0.00 1.43 -1.26 -4.67 118.68 119.11 1llf s LEU 98 Ca 0.00 -2.61 0.12 0.00 -1.03 0.00 0.00 54.13 50.61 1llf s LEU 98 Cb 0.00 -2.42 -0.05 0.00 0.03 0.00 0.00 46.19 43.75 1llf s LEU 98 CO 0.00 -0.90 -0.19 0.42 0.23 0.00 0.00 176.35 175.90 1llf s THR 99 N 2.25 2.54 0.10 5.49 -4.23 -1.26 -1.63 115.64 118.90 1llf s THR 99 Ca 0.41 -2.27 0.05 0.00 -1.18 0.00 0.00 61.69 58.70 1llf s THR 99 Cb -0.03 -2.31 -0.03 0.00 1.34 0.00 0.00 72.50 71.47 1llf s THR 99 CO -0.03 -0.33 -0.14 -0.51 -0.54 0.00 0.00 174.62 173.08 1llf s ILE 100 N -2.29 1.22 -0.06 2.99 2.07 0.06 -0.97 121.20 124.22 1llf s ILE 100 Ca 0.28 -1.57 0.01 0.00 -1.41 0.00 0.00 60.65 57.96 1llf s ILE 100 Cb -0.06 -1.36 0.02 0.00 0.13 0.00 0.00 42.46 41.19 1llf s ILE 100 CO 0.14 -0.37 -0.06 0.20 -1.91 0.00 0.00 174.94 172.94 1llf s ASN 101 N -2.21 1.40 -0.18 4.50 0.01 -0.68 -1.76 114.94 116.03 1llf s ASN 101 Ca 0.05 -0.19 0.01 0.00 -0.71 0.00 0.00 52.86 52.02 1llf s ASN 101 Cb -0.06 -0.59 0.01 0.00 0.41 0.00 0.00 41.25 41.02 1llf s ASN 101 CO 0.02 -0.06 -0.18 -0.69 -1.51 0.00 0.00 177.10 174.68 1llf s VAL 102 N 1.10 2.23 -0.15 1.60 1.01 0.24 -0.91 120.40 125.52 1llf s VAL 102 Ca -0.08 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.02 1llf s VAL 102 Cb -0.14 -1.94 0.02 0.00 0.00 0.00 0.00 36.38 34.32 1llf s VAL 102 CO -0.01 0.53 -0.14 -0.69 0.00 0.00 0.00 175.10 174.79 1llf s VAL 103 N 1.24 1.59 0.23 2.92 1.01 0.20 -0.16 120.40 127.42 1llf s VAL 103 Ca 0.03 -0.64 0.09 0.00 0.00 0.00 0.00 61.98 61.46 1llf s VAL 103 Cb -0.14 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.71 1llf s VAL 103 CO -0.10 0.46 -0.16 0.00 0.00 0.00 0.00 175.10 175.30 1llf s ARG 104 N 1.46 1.43 0.71 2.72 1.70 0.17 -1.07 118.95 126.07 1llf s ARG 104 Ca 0.04 -1.64 -0.16 0.00 -0.47 0.00 0.00 55.73 53.50 1llf s ARG 104 Cb -0.13 -1.29 0.02 0.00 -0.57 0.00 0.00 34.95 32.98 1llf s ARG 104 CO -0.10 0.22 1.22 -2.30 -1.08 0.00 0.00 175.30 173.26 1llf n PRO 105 N -0.45 0.75 -1.64 3.89 -0.02 -1.26 -0.80 135.00 135.47 1llf n PRO 105 Ca -0.07 0.32 -0.45 0.00 -2.02 0.00 0.00 63.50 61.28 1llf n PRO 105 Cb 0.60 -2.46 -0.02 0.00 -0.02 0.00 0.00 33.50 31.60 1llf n PRO 105 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1llf n PRO 106 N -2.31 1.74 -0.91 0.52 -0.02 -1.26 -2.45 135.00 130.30 1llf n PRO 106 Ca 0.15 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1llf n PRO 106 Cb 0.49 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1llf n PRO 106 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1llf n GLY 107 N 1.76 1.10 3.74 -1.23 0.00 -1.26 -5.00 105.19 104.30 1llf n GLY 107 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1llf n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1llf s THR 108 N -3.89 2.37 0.23 2.61 2.01 -1.03 -5.00 115.64 112.94 1llf s THR 108 Ca 0.00 0.29 0.10 0.00 0.31 0.00 0.00 61.69 62.39 1llf s THR 108 Cb 0.00 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.28 1llf s THR 108 CO 0.00 0.04 -0.12 -0.54 -0.69 0.00 0.00 174.62 173.31 1llf s LYS 109 N 0.16 1.96 0.04 4.92 -0.14 -1.26 -4.92 119.74 120.49 1llf s LYS 109 Ca 0.65 -1.45 -0.38 0.00 -1.36 0.00 0.00 55.97 53.43 1llf s LYS 109 Cb -0.45 -2.03 -0.19 0.00 -1.68 0.00 0.00 37.83 33.48 1llf s LYS 109 CO 0.40 0.39 1.07 0.00 -0.76 0.00 0.00 175.35 176.45 1llf n ALA 110 N -0.31 -3.01 0.00 5.17 0.00 -1.26 -1.27 120.51 119.83 1llf n ALA 110 Ca -0.09 0.56 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1llf n ALA 110 Cb 0.57 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.21 1llf n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llf n GLY 111 N 1.73 1.77 0.28 0.00 0.00 -1.23 -4.86 105.19 102.89 1llf n GLY 111 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.34 1llf n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llf h ALA 112 N 0.00 1.63 -6.09 4.61 0.00 -1.33 -3.46 119.26 114.61 1llf h ALA 112 Ca 0.00 -0.02 -0.43 0.00 0.00 0.00 0.00 54.91 54.46 1llf h ALA 112 Cb 0.00 -0.00 0.04 0.00 0.00 0.00 0.00 17.79 17.83 1llf h ALA 112 CO 0.00 0.03 -0.78 0.09 0.00 0.00 0.00 179.25 178.59 1llf n ASN 113 N -4.03 -3.08 -4.80 0.00 3.02 -0.71 -4.95 115.26 100.71 1llf n ASN 113 Ca -0.03 -0.75 -0.35 0.00 -0.03 0.00 0.00 54.58 53.42 1llf n ASN 113 Cb 0.11 -4.21 -0.05 0.00 -0.61 0.00 0.00 39.78 35.01 1llf n ASN 113 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1llf s LEU 114 N -6.93 4.01 0.58 3.41 1.43 0.09 -4.26 118.68 117.02 1llf s LEU 114 Ca 0.29 1.87 -0.20 0.00 -1.03 0.00 0.00 54.13 55.06 1llf s LEU 114 Cb -0.14 -4.39 -0.04 0.00 0.03 0.00 0.00 46.19 41.64 1llf s LEU 114 CO 0.80 -0.49 1.19 -2.65 0.23 0.00 0.00 176.35 175.44 1llf n PRO 115 N -0.45 1.28 -4.82 1.29 -0.02 -1.26 -0.54 135.00 130.48 1llf n PRO 115 Ca 0.07 0.48 -0.33 0.00 -2.02 0.00 0.00 63.50 61.70 1llf n PRO 115 Cb 0.52 -2.40 -0.15 0.00 -0.02 0.00 0.00 33.50 31.45 1llf n PRO 115 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1llf s VAL 116 N -1.38 2.74 -0.37 -1.45 1.01 -0.31 -1.24 120.40 119.39 1llf s VAL 116 Ca 0.75 -0.77 -0.11 0.00 0.00 0.00 0.00 61.98 61.86 1llf s VAL 116 Cb -0.42 -2.13 0.03 0.00 0.00 0.00 0.00 36.38 33.86 1llf s VAL 116 CO 0.47 0.53 0.20 -0.04 0.00 0.00 0.00 175.10 176.26 1llf s MET 117 N 0.46 2.81 -0.45 2.72 -1.94 0.27 -0.76 119.30 122.41 1llf s MET 117 Ca -0.11 -1.09 -0.15 0.00 -1.71 0.00 0.00 55.69 52.62 1llf s MET 117 Cb -0.16 -3.71 0.05 0.00 2.01 0.00 0.00 34.83 33.02 1llf s MET 117 CO 0.05 -0.70 0.36 -1.17 -0.01 0.00 0.00 175.02 173.56 1llf s LEU 118 N 1.54 5.40 -0.02 -0.03 0.20 0.15 -1.17 118.68 124.75 1llf s LEU 118 Ca 0.02 -1.14 -0.23 0.00 0.69 0.00 0.00 54.13 53.46 1llf s LEU 118 Cb -0.19 -2.18 -0.05 0.00 -0.43 0.00 0.00 46.19 43.34 1llf s LEU 118 CO 0.06 -0.57 0.70 0.86 -0.29 0.00 0.00 176.35 177.11 1llf s TRP 119 N 1.68 3.65 -0.29 5.38 -0.11 0.13 -1.03 118.94 128.34 1llf s TRP 119 Ca 0.05 1.31 0.01 0.00 1.22 0.00 0.00 56.10 58.69 1llf s TRP 119 Cb -0.22 -2.77 0.06 0.00 -1.50 0.00 0.00 33.47 29.04 1llf s TRP 119 CO 0.08 0.19 -0.04 0.42 -4.62 0.00 0.00 176.95 172.99 1llf s ILE 120 N 0.35 2.54 0.82 5.86 1.01 0.32 -3.08 121.20 129.04 1llf s ILE 120 Ca 0.37 -1.63 -0.10 0.00 0.00 0.00 0.00 60.65 59.28 1llf s ILE 120 Cb -0.19 -2.53 0.09 0.00 0.01 0.00 0.00 42.46 39.84 1llf s ILE 120 CO 0.19 -0.15 1.11 0.72 0.00 0.00 0.00 174.94 176.82 1llf s PHE 121 N 1.14 2.24 0.28 3.97 -0.12 -1.26 -3.66 117.98 120.57 1llf s PHE 121 Ca -0.05 1.64 0.10 0.00 -0.05 0.00 0.00 56.93 58.57 1llf s PHE 121 Cb -0.20 -3.15 -0.05 0.00 -0.63 0.00 0.00 43.02 38.99 1llf s PHE 121 CO -0.04 -2.15 -0.06 0.20 -0.05 0.00 0.00 175.22 173.12 1llf s GLY 122 N -3.14 1.78 0.00 1.99 0.00 -1.22 -3.34 107.32 103.38 1llf s GLY 122 Ca 0.63 -1.76 0.00 0.00 0.00 0.00 0.00 44.72 43.59 1llf s GLY 122 CO 0.57 -1.82 0.00 0.61 0.00 0.00 0.00 173.10 172.46 1llf n GLY 123 N -0.82 0.00 2.53 0.20 0.00 -1.25 -4.63 105.19 101.22 1llf n GLY 123 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 1llf n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llf n GLY 124 N 0.00 0.70 2.46 -0.02 0.00 -1.26 -0.85 105.19 106.22 1llf n GLY 124 Ca 0.00 -0.17 -0.19 0.00 0.00 0.00 0.00 46.02 45.66 1llf n GLY 124 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1llf n PHE 125 N -2.47 -0.34 0.00 1.61 3.72 -1.26 -4.77 117.46 113.95 1llf n PHE 125 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1llf n PHE 125 Cb 0.37 -3.41 0.00 0.00 -0.94 0.00 0.00 39.48 35.50 1llf n PHE 125 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1llf n GLU 126 N -2.45 2.59 -4.34 -1.08 1.02 -0.42 -0.05 120.64 115.91 1llf n GLU 126 Ca -0.20 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.73 1llf n GLU 126 Cb 0.64 -0.60 -0.08 0.00 -0.02 0.00 0.00 31.44 31.38 1llf n GLU 126 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1llf s ILE 127 N -0.85 0.15 0.00 -3.67 -4.36 -0.03 -1.39 121.20 111.05 1llf s ILE 127 Ca 0.00 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.39 1llf s ILE 127 Cb 0.00 -2.46 0.00 0.00 1.25 0.00 0.00 42.46 41.25 1llf s ILE 127 CO 0.00 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.79 1llf n GLY 128 N -0.67 2.10 3.68 6.27 0.00 -1.26 -3.79 105.19 111.52 1llf n GLY 128 Ca 0.04 -2.01 -0.02 0.00 0.00 0.00 0.00 46.02 44.02 1llf n GLY 128 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1llf s SER 129 N 0.00 -0.16 0.58 1.61 1.04 -1.26 -4.60 113.70 110.91 1llf s SER 129 Ca 0.00 -0.26 0.28 0.00 0.48 0.00 0.00 55.95 56.45 1llf s SER 129 Cb 0.00 0.36 1.76 0.00 0.10 0.00 0.00 66.02 68.24 1llf s SER 129 CO 0.00 -0.66 2.23 -0.65 0.98 0.00 0.00 173.24 175.14 1llf h PRO 130 N 2.00 0.00 -0.92 4.02 0.11 -1.92 -3.20 132.00 132.08 1llf h PRO 130 Ca -0.25 0.00 0.11 0.00 0.11 0.00 0.00 66.00 65.97 1llf h PRO 130 Cb 1.22 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 1llf h PRO 130 CO 0.27 0.00 0.59 1.15 -0.21 0.00 0.00 178.00 179.80 1llf h THR 131 N 0.00 0.92 -0.55 -1.15 2.02 -1.96 -2.85 112.91 109.35 1llf h THR 131 Ca 0.01 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.89 1llf h THR 131 Cb 0.08 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.46 1llf h THR 131 CO -0.00 0.16 0.00 2.30 0.37 0.00 0.00 175.52 178.35 1llf n ILE 132 N -4.56 1.84 -3.37 3.11 -5.35 -1.21 -4.44 119.36 105.38 1llf n ILE 132 Ca 0.17 -1.08 -0.26 0.00 -0.27 0.00 0.00 62.75 61.30 1llf n ILE 132 Cb 0.36 -0.04 -0.08 0.00 -1.74 0.00 0.00 39.64 38.14 1llf n ILE 132 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1llf n PHE 133 N 0.85 3.00 -1.72 4.28 3.72 -1.08 -5.09 117.46 121.43 1llf n PHE 133 Ca 0.23 -4.06 -0.42 0.00 -0.05 0.00 0.00 57.45 53.16 1llf n PHE 133 Cb 0.88 -0.52 -0.03 0.00 -0.94 0.00 0.00 39.48 38.87 1llf n PHE 133 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1llf s PRO 134 N -2.30 4.13 0.00 -1.08 0.04 -1.26 -4.89 135.00 129.63 1llf s PRO 134 Ca 0.39 2.61 0.30 0.00 0.04 0.00 0.00 61.00 64.34 1llf s PRO 134 Cb 0.16 -3.36 1.39 0.00 0.04 0.00 0.00 34.50 32.72 1llf s PRO 134 CO -0.03 -0.80 1.96 -0.35 0.04 0.00 0.00 177.00 177.82 1llf n PRO 135 N 4.93 0.57 -0.24 0.56 -0.04 -1.26 -4.42 135.00 135.10 1llf n PRO 135 Ca 0.17 -0.11 -0.03 0.00 -0.04 0.00 0.00 63.50 63.49 1llf n PRO 135 Cb 0.37 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.41 1llf n PRO 135 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1llf h ALA 136 N 3.53 0.89 -0.29 0.55 0.00 -1.90 -1.45 119.26 120.59 1llf h ALA 136 Ca 0.00 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1llf h ALA 136 Cb 0.31 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1llf h ALA 136 CO 0.00 0.18 0.08 0.37 0.00 0.00 0.00 179.25 179.88 1llf h GLN 137 N 0.82 0.19 -0.15 0.00 4.15 -1.82 0.60 115.11 118.90 1llf h GLN 137 Ca 0.28 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.69 1llf h GLN 137 Cb 0.03 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 1llf h GLN 137 CO -0.11 0.13 0.10 1.98 -1.93 0.00 0.00 178.83 178.99 1llf h MET 138 N 0.20 0.20 -0.19 1.69 4.05 -1.65 -1.57 114.93 117.65 1llf h MET 138 Ca 0.13 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.51 1llf h MET 138 Cb 0.12 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 1llf h MET 138 CO -0.16 0.14 -0.01 0.28 0.23 0.00 0.00 176.91 177.39 1llf h VAL 139 N 0.20 1.26 -0.57 -5.77 2.07 -0.98 -1.09 116.25 111.37 1llf h VAL 139 Ca 0.05 -0.91 0.04 0.00 0.82 0.00 0.00 66.70 66.71 1llf h VAL 139 Cb -0.02 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1llf h VAL 139 CO -0.01 0.28 0.32 0.74 0.02 0.00 0.00 177.57 178.91 1llf h THR 140 N 0.09 1.00 -0.79 2.57 2.02 -0.89 -2.26 112.91 114.64 1llf h THR 140 Ca 0.05 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 1llf h THR 140 Cb 0.42 0.33 -0.04 0.00 -1.74 0.00 0.00 68.15 67.12 1llf h THR 140 CO 0.01 0.11 0.46 0.50 0.37 0.00 0.00 175.52 176.97 1llf h LYS 141 N 0.61 1.09 -0.95 6.66 1.63 -1.10 -1.96 116.57 122.55 1llf h LYS 141 Ca 0.25 -0.11 0.01 0.00 -0.85 0.00 0.00 60.65 59.95 1llf h LYS 141 Cb 0.11 -0.22 -0.05 0.00 -0.60 0.00 0.00 32.23 31.47 1llf h LYS 141 CO -0.14 0.78 0.63 0.66 -3.45 0.00 0.00 179.45 177.93 1llf h SER 142 N 1.09 1.09 -0.37 4.20 4.64 -0.63 -0.66 113.55 122.90 1llf h SER 142 Ca 0.28 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.54 1llf h SER 142 Cb -0.01 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 61.80 1llf h SER 142 CO -0.05 0.78 0.09 0.58 -0.87 0.00 0.00 176.83 177.36 1llf h VAL 143 N 1.28 1.23 -0.81 0.95 2.07 -1.21 -0.83 116.25 118.93 1llf h VAL 143 Ca 0.35 -0.77 0.12 0.00 0.82 0.00 0.00 66.70 67.22 1llf h VAL 143 Cb -0.14 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 1llf h VAL 143 CO -0.08 0.27 0.53 -0.07 0.02 0.00 0.00 177.57 178.24 1llf h LEU 144 N 0.46 0.60 0.00 2.57 3.38 -0.56 0.17 115.31 121.93 1llf h LEU 144 Ca 0.12 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1llf h LEU 144 Cb 0.31 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1llf h LEU 144 CO 0.00 0.34 0.00 0.23 0.09 0.00 0.00 178.44 179.10 1llf n MET 145 N -4.52 0.04 -1.14 1.13 2.81 -0.34 -4.89 117.12 110.22 1llf n MET 145 Ca 0.15 0.01 -0.05 0.00 -1.81 0.00 0.00 57.70 56.00 1llf n MET 145 Cb 0.41 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.40 1llf n MET 145 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1llf n GLY 146 N 1.44 0.73 2.58 3.03 0.00 0.05 -4.93 105.19 108.08 1llf n GLY 146 Ca 0.08 -0.58 -0.23 0.00 0.00 0.00 0.00 46.02 45.29 1llf n GLY 146 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1llf n LYS 147 N -2.56 2.18 -1.80 1.61 5.02 -0.34 -5.03 118.16 117.23 1llf n LYS 147 Ca -0.05 -4.18 -0.41 0.00 -2.02 0.00 0.00 58.31 51.66 1llf n LYS 147 Cb 0.19 -1.98 0.00 0.00 -0.02 0.00 0.00 35.03 33.22 1llf n LYS 147 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1llf s PRO 148 N -2.93 3.99 0.19 1.97 0.04 -1.12 -4.55 135.00 132.59 1llf s PRO 148 Ca 0.44 2.54 0.05 0.00 0.04 0.00 0.00 61.00 64.07 1llf s PRO 148 Cb 0.30 -2.88 -0.05 0.00 0.04 0.00 0.00 34.50 31.91 1llf s PRO 148 CO -0.11 -0.62 -0.08 0.96 0.04 0.00 0.00 177.00 177.19 1llf s ILE 149 N -1.14 1.28 -0.16 0.56 -5.25 -1.26 -4.27 121.20 110.96 1llf s ILE 149 Ca 0.55 -2.09 -0.04 0.00 -0.99 0.00 0.00 60.65 58.08 1llf s ILE 149 Cb -0.46 -2.06 -0.03 0.00 2.95 0.00 0.00 42.46 42.87 1llf s ILE 149 CO 0.62 -0.58 -0.03 -0.63 -1.79 0.00 0.00 174.94 172.53 1llf s ILE 150 N -3.26 3.96 -0.24 8.37 1.01 -0.38 -4.21 121.20 126.46 1llf s ILE 150 Ca 0.22 -0.33 -0.12 0.00 0.00 0.00 0.00 60.65 60.41 1llf s ILE 150 Cb 0.03 -2.74 -0.05 0.00 0.01 0.00 0.00 42.46 39.71 1llf s ILE 150 CO 0.05 0.49 0.25 -2.28 0.00 0.00 0.00 174.94 173.44 1llf s HIS 151 N 0.42 3.31 -0.11 3.97 5.65 -0.23 -0.56 115.29 127.74 1llf s HIS 151 Ca -0.03 0.33 0.03 0.00 0.25 0.00 0.00 55.06 55.64 1llf s HIS 151 Cb -0.14 -2.38 0.00 0.00 -1.18 0.00 0.00 32.58 28.88 1llf s HIS 151 CO 0.03 -0.01 -0.23 0.08 -0.65 0.00 0.00 174.74 173.96 1llf s VAL 152 N 1.30 2.13 -0.14 0.89 1.01 -0.32 -0.63 120.40 124.65 1llf s VAL 152 Ca 0.11 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.12 1llf s VAL 152 Cb -0.14 -1.83 0.02 0.00 0.00 0.00 0.00 36.38 34.43 1llf s VAL 152 CO 0.07 0.55 -0.18 0.00 0.00 0.00 0.00 175.10 175.54 1llf s ALA 153 N 0.44 2.07 -0.15 5.51 0.00 -0.09 0.17 121.76 129.71 1llf s ALA 153 Ca -0.16 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 50.68 1llf s ALA 153 Cb -0.17 -1.01 -0.05 0.00 0.00 0.00 0.00 23.12 21.89 1llf s ALA 153 CO 0.06 -0.19 0.23 0.54 0.00 0.00 0.00 175.76 176.41 1llf s VAL 154 N 1.10 5.34 0.50 0.00 0.11 -1.18 -1.68 120.40 124.60 1llf s VAL 154 Ca -0.02 0.42 -0.17 0.00 -2.93 0.00 0.00 61.98 59.29 1llf s VAL 154 Cb -0.14 -3.56 -0.08 0.00 -1.53 0.00 0.00 36.38 31.07 1llf s VAL 154 CO -0.06 0.46 0.98 0.21 -3.33 0.00 0.00 175.10 173.36 1llf s ASN 155 N 0.02 6.65 0.03 3.54 2.47 -0.14 -4.65 114.94 122.87 1llf s ASN 155 Ca 0.15 1.58 -0.19 0.00 0.42 0.00 0.00 52.86 54.82 1llf s ASN 155 Cb -0.13 -2.51 0.04 0.00 -1.45 0.00 0.00 41.25 37.20 1llf s ASN 155 CO 0.03 -0.56 0.43 -0.72 -3.72 0.00 0.00 177.10 172.56 1llf s TYR 156 N -2.58 -0.29 0.27 0.43 1.13 -1.26 -4.62 117.35 110.43 1llf s TYR 156 Ca 0.59 0.30 -0.29 0.00 -1.41 0.00 0.00 57.07 56.25 1llf s TYR 156 Cb -0.10 0.23 -0.09 0.00 -1.10 0.00 0.00 41.96 40.90 1llf s TYR 156 CO 0.29 -0.56 1.17 1.03 -2.51 0.00 0.00 175.55 174.97 1llf s ARG 157 N -2.31 4.54 0.47 -3.49 0.52 -1.26 -4.74 118.95 112.67 1llf s ARG 157 Ca -0.06 1.92 0.04 0.00 -0.52 0.00 0.00 55.73 57.11 1llf s ARG 157 Cb -0.01 -3.17 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 1llf s ARG 157 CO -0.01 0.05 0.05 0.14 0.02 0.00 0.00 175.30 175.54 1llf s VAL 158 N -0.89 1.60 0.00 3.52 -7.23 -1.26 -4.14 120.40 112.00 1llf s VAL 158 Ca 0.48 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.71 1llf s VAL 158 Cb -0.34 -2.54 0.00 0.00 0.56 0.00 0.00 36.38 34.06 1llf s VAL 158 CO 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 175.22 1llf n ALA 159 N -1.19 0.00 -0.06 1.32 0.00 0.92 -2.04 120.51 119.47 1llf n ALA 159 Ca -0.11 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.32 1llf n ALA 159 Cb 0.67 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.38 1llf n ALA 159 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1llf h SER 160 N 5.83 0.60 -0.21 0.00 4.64 -1.89 0.11 113.55 122.64 1llf h SER 160 Ca 0.00 -0.10 -0.06 0.00 -0.47 0.00 0.00 61.79 61.17 1llf h SER 160 Cb 0.00 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 1llf h SER 160 CO 0.00 0.62 -0.04 -0.50 -0.87 0.00 0.00 176.83 176.04 1llf h TRP 161 N 0.63 0.55 0.00 4.77 6.55 -1.87 -2.63 115.95 123.95 1llf h TRP 161 Ca 0.14 -0.06 -0.10 0.00 0.95 0.00 0.00 58.89 59.82 1llf h TRP 161 Cb 0.26 -0.16 -0.02 0.00 -0.86 0.00 0.00 29.16 28.39 1llf h TRP 161 CO 0.01 0.56 -1.90 0.41 -1.05 0.00 0.00 178.44 176.48 1llf n GLY 162 N -0.80 -0.79 1.98 1.49 0.00 -0.87 -4.24 105.19 101.96 1llf n GLY 162 Ca 0.01 -0.37 0.02 0.00 0.00 0.00 0.00 46.02 45.69 1llf n GLY 162 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1llf n PHE 163 N -2.26 0.50 -1.93 1.61 3.72 0.36 -0.81 117.46 118.64 1llf n PHE 163 Ca -0.11 -1.14 -0.38 0.00 -0.05 0.00 0.00 57.45 55.77 1llf n PHE 163 Cb 0.64 -0.18 0.02 0.00 -0.94 0.00 0.00 39.48 39.02 1llf n PHE 163 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1llf s LEU 164 N -1.51 3.91 0.00 4.37 2.96 -0.99 -4.43 118.68 122.99 1llf s LEU 164 Ca 0.32 2.63 0.00 0.00 -0.22 0.00 0.00 54.13 56.86 1llf s LEU 164 Cb 0.36 -4.25 0.00 0.00 0.50 0.00 0.00 46.19 42.80 1llf s LEU 164 CO -0.12 -1.36 0.00 0.00 -1.32 0.00 0.00 176.35 173.55 1llf n ALA 165 N -0.84 0.00 0.00 5.97 0.00 -1.26 -4.58 120.51 119.80 1llf n ALA 165 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1llf n ALA 165 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1llf n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llf n GLY 166 N 1.16 0.02 0.33 0.00 0.00 0.31 -4.43 105.19 102.58 1llf n GLY 166 Ca 0.00 -1.95 -0.06 0.00 0.00 0.00 0.00 46.02 44.00 1llf n GLY 166 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1llf h ASP 167 N 0.00 1.06 -0.24 1.61 3.32 -1.86 -1.52 116.42 118.79 1llf h ASP 167 Ca 0.00 -0.20 -0.12 0.00 0.02 0.00 0.00 57.03 56.73 1llf h ASP 167 Cb 0.00 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.27 1llf h ASP 167 CO 0.00 0.99 -0.30 0.44 -1.72 0.00 0.00 179.24 178.64 1llf h ASP 168 N 1.08 0.68 -0.18 6.45 3.32 -1.97 -1.04 116.42 124.76 1llf h ASP 168 Ca 0.23 -0.50 0.01 0.00 0.02 0.00 0.00 57.03 56.79 1llf h ASP 168 Cb 0.32 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1llf h ASP 168 CO -0.01 1.05 0.10 0.40 -1.72 0.00 0.00 179.24 179.06 1llf h ILE 169 N 0.33 1.01 -0.64 0.35 1.08 -1.74 -1.94 117.51 115.97 1llf h ILE 169 Ca 0.03 -0.07 0.01 0.00 -0.39 0.00 0.00 64.86 64.43 1llf h ILE 169 Cb 0.88 0.79 -0.03 0.00 -3.07 0.00 0.00 36.82 35.39 1llf h ILE 169 CO 0.07 0.04 0.42 0.50 -0.69 0.00 0.00 178.15 178.49 1llf h LYS 170 N 0.20 0.84 -0.09 2.37 1.63 -1.11 -1.66 116.57 118.75 1llf h LYS 170 Ca 0.07 -0.05 -0.07 0.00 -0.85 0.00 0.00 60.65 59.75 1llf h LYS 170 Cb 0.00 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 31.44 1llf h LYS 170 CO -0.04 0.56 -0.25 0.00 -3.45 0.00 0.00 179.45 176.27 1llf h ALA 171 N 1.23 1.41 0.00 5.00 0.00 -0.91 -1.92 119.26 124.07 1llf h ALA 171 Ca 0.23 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1llf h ALA 171 Cb -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1llf h ALA 171 CO -0.05 0.42 0.00 1.49 0.00 0.00 0.00 179.25 181.11 1llf h GLU 172 N 0.15 0.00 0.00 0.00 4.81 -1.05 -3.47 114.58 115.02 1llf h GLU 172 Ca 0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1llf h GLU 172 Cb 0.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1llf h GLU 172 CO 0.04 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.73 1llf n GLY 173 N 0.84 0.43 1.44 1.92 0.00 -0.72 -4.98 105.19 104.13 1llf n GLY 173 Ca 0.04 -0.89 -0.04 0.00 0.00 0.00 0.00 46.02 45.12 1llf n GLY 173 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1llf n SER 174 N 1.92 3.58 -4.77 1.61 7.64 -0.68 -4.86 113.62 118.07 1llf n SER 174 Ca 0.00 -3.43 -0.35 0.00 1.01 0.00 0.00 58.87 56.10 1llf n SER 174 Cb 0.38 -0.67 0.02 0.00 -1.01 0.00 0.00 64.21 62.93 1llf n SER 174 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1llf s GLY 175 N -1.86 2.59 -1.40 0.23 0.00 -1.26 -4.01 107.32 101.62 1llf s GLY 175 Ca 0.48 0.84 -0.09 0.00 0.00 0.00 0.00 44.72 45.95 1llf s GLY 175 CO 0.07 1.21 1.08 0.70 0.00 0.00 0.00 173.10 176.15 1llf n ASN 176 N -1.57 -5.17 -0.27 1.64 3.02 -1.26 -4.88 115.26 106.77 1llf n ASN 176 Ca 0.12 -0.64 0.07 0.00 -0.03 0.00 0.00 54.58 54.10 1llf n ASN 176 Cb 0.51 -4.60 0.21 0.00 -0.61 0.00 0.00 39.78 35.29 1llf n ASN 176 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1llf h ALA 177 N 0.98 1.09 -0.11 5.41 0.00 -1.51 -1.03 119.26 124.10 1llf h ALA 177 Ca -0.58 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.40 1llf h ALA 177 Cb 1.37 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1llf h ALA 177 CO 0.59 -0.31 -0.32 0.78 0.00 0.00 0.00 179.25 180.00 1llf h GLY 178 N 0.34 0.22 1.41 0.00 0.00 -1.13 -0.13 103.07 103.77 1llf h GLY 178 Ca 0.45 -0.18 -0.09 0.00 0.00 0.00 0.00 47.33 47.51 1llf h GLY 178 CO -0.49 0.16 -0.12 1.41 0.00 0.00 0.00 176.54 177.50 1llf h LEU 179 N 0.18 0.69 -1.11 3.11 3.38 -1.49 -2.17 115.31 117.91 1llf h LEU 179 Ca 0.02 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1llf h LEU 179 Cb 0.66 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1llf h LEU 179 CO 0.05 0.84 0.06 0.11 0.09 0.00 0.00 178.44 179.59 1llf h LYS 180 N 0.64 0.69 -0.17 1.13 1.57 -0.48 -0.25 116.57 119.69 1llf h LYS 180 Ca 0.11 -0.15 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1llf h LYS 180 Cb 0.58 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 1llf h LYS 180 CO 0.04 0.66 0.05 -0.44 -0.57 0.00 0.00 179.45 179.19 1llf h ASP 181 N 0.66 0.06 -0.60 0.86 3.32 -0.81 0.46 116.42 120.37 1llf h ASP 181 Ca 0.14 0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.23 1llf h ASP 181 Cb 0.32 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.85 1llf h ASP 181 CO 0.01 0.06 0.37 1.56 -1.72 0.00 0.00 179.24 179.52 1llf h GLN 182 N 0.13 0.72 -0.65 3.56 4.20 -1.01 -1.13 115.11 120.93 1llf h GLN 182 Ca 0.07 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.69 1llf h GLN 182 Cb 0.05 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.64 1llf h GLN 182 CO -0.08 0.48 0.23 -0.09 -0.67 0.00 0.00 178.83 178.70 1llf h ARG 183 N 0.74 1.00 -0.79 1.46 9.65 -0.70 -0.77 114.38 124.96 1llf h ARG 183 Ca 0.24 -0.20 -0.03 0.00 -1.10 0.00 0.00 59.98 58.88 1llf h ARG 183 Cb -0.01 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.39 1llf h ARG 183 CO -0.09 0.85 0.36 1.25 2.80 0.00 0.00 179.97 185.15 1llf h LEU 184 N 0.93 1.05 -1.13 3.80 5.85 -0.63 -1.36 115.31 123.82 1llf h LEU 184 Ca 0.21 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1llf h LEU 184 Cb 0.25 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1llf h LEU 184 CO -0.01 0.91 0.59 1.23 -0.34 0.00 0.00 178.44 180.81 1llf h GLY 185 N 1.13 1.28 1.04 3.75 0.00 -0.68 0.05 103.07 109.63 1llf h GLY 185 Ca 0.27 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 1llf h GLY 185 CO -0.03 0.41 0.48 -0.33 0.00 0.00 0.00 176.54 177.07 1llf h MET 186 N 1.15 1.26 -0.71 4.80 2.86 -0.58 -0.06 114.93 123.65 1llf h MET 186 Ca 0.35 -0.15 -0.06 0.00 -2.06 0.00 0.00 59.70 57.77 1llf h MET 186 Cb -0.04 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.35 1llf h MET 186 CO -0.09 0.92 0.19 1.96 1.06 0.00 0.00 176.91 180.95 1llf h GLN 187 N 1.26 1.12 -0.62 1.72 4.20 -0.75 -1.28 115.11 120.75 1llf h GLN 187 Ca 0.31 -0.26 0.01 0.00 0.06 0.00 0.00 58.65 58.77 1llf h GLN 187 Cb 0.04 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.63 1llf h GLN 187 CO -0.05 0.97 0.41 2.35 -0.67 0.00 0.00 178.83 181.85 1llf h TRP 188 N 1.07 0.78 -0.35 2.96 7.01 -0.51 -1.36 115.95 125.55 1llf h TRP 188 Ca 0.23 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.24 1llf h TRP 188 Cb 0.35 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 27.12 1llf h TRP 188 CO 0.03 0.50 0.19 0.28 -2.79 0.00 0.00 178.44 176.65 1llf h VAL 189 N 0.84 1.13 -0.71 2.65 2.07 -0.72 0.71 116.25 122.23 1llf h VAL 189 Ca 0.23 -0.34 0.10 0.00 0.82 0.00 0.00 66.70 67.51 1llf h VAL 189 Cb -0.09 0.73 -0.07 0.00 -1.52 0.00 0.00 31.29 30.33 1llf h VAL 189 CO -0.05 0.14 0.34 0.00 0.02 0.00 0.00 177.57 178.01 1llf h ALA 190 N 1.06 0.97 0.03 1.67 0.00 -0.74 0.02 119.26 122.28 1llf h ALA 190 Ca 0.12 0.06 -0.23 0.00 0.00 0.00 0.00 54.91 54.87 1llf h ALA 190 Cb 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1llf h ALA 190 CO -0.02 -0.08 -1.10 -0.44 0.00 0.00 0.00 179.25 177.61 1llf h ASP 191 N 0.57 0.09 0.00 0.00 3.32 -0.94 -3.41 116.42 116.06 1llf h ASP 191 Ca 0.35 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1llf h ASP 191 Cb 0.40 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1llf h ASP 191 CO -0.29 1.08 -1.07 0.59 -1.72 0.00 0.00 179.24 177.84 1llf n ASN 192 N -3.37 3.71 0.23 6.45 3.02 0.21 -4.36 115.26 121.15 1llf n ASN 192 Ca -0.03 -0.06 0.09 0.00 -0.03 0.00 0.00 54.58 54.55 1llf n ASN 192 Cb 0.96 1.16 0.52 0.00 -0.61 0.00 0.00 39.78 41.81 1llf n ASN 192 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1llf h ILE 193 N 0.00 0.67 -0.85 2.41 6.09 -1.15 -2.77 117.51 121.92 1llf h ILE 193 Ca 0.00 -1.01 0.08 0.00 -1.37 0.00 0.00 64.86 62.56 1llf h ILE 193 Cb 0.16 1.65 -0.06 0.00 0.47 0.00 0.00 36.82 39.04 1llf h ILE 193 CO 0.00 0.22 0.55 0.00 -3.07 0.00 0.00 178.15 175.85 1llf h ALA 194 N 1.77 1.64 0.00 0.18 0.00 -1.80 -0.42 119.26 120.63 1llf h ALA 194 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1llf h ALA 194 Cb 0.63 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1llf h ALA 194 CO 0.03 0.20 0.00 0.78 0.00 0.00 0.00 179.25 180.26 1llf h GLY 195 N 0.87 0.00 0.26 0.00 0.00 -1.67 -1.87 103.07 100.65 1llf h GLY 195 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1llf h GLY 195 CO -0.15 0.00 -0.93 0.69 0.00 0.00 0.00 176.54 176.15 1llf n PHE 196 N -2.96 0.02 0.00 5.60 3.01 -0.22 -4.07 117.46 118.83 1llf n PHE 196 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1llf n PHE 196 Cb 0.11 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.48 1llf n PHE 196 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1llf n GLY 197 N 1.48 1.14 3.92 1.37 0.00 -0.71 -4.47 105.19 107.93 1llf n GLY 197 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1llf n GLY 197 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1llf s GLY 198 N -1.85 1.87 -0.47 -0.02 0.00 -0.89 -0.73 107.32 105.23 1llf s GLY 198 Ca 0.00 -0.79 -0.17 0.00 0.00 0.00 0.00 44.72 43.77 1llf s GLY 198 CO 0.00 -0.74 0.46 -0.35 0.00 0.00 0.00 173.10 172.47 1llf s ASP 199 N -3.05 6.17 0.41 1.64 -1.08 0.30 -3.50 116.67 117.56 1llf s ASP 199 Ca 0.39 -1.10 0.28 0.00 -0.52 0.00 0.00 52.55 51.60 1llf s ASP 199 Cb -0.11 -2.22 1.45 0.00 -1.46 0.00 0.00 42.92 40.58 1llf s ASP 199 CO 0.28 -0.69 1.86 1.55 0.52 0.00 0.00 175.17 178.69 1llf h PRO 200 N 8.81 0.00 -0.12 4.34 0.13 -1.88 -0.11 132.00 143.18 1llf h PRO 200 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1llf h PRO 200 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1llf h PRO 200 CO 0.88 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 179.08 1llf n SER 201 N -2.51 1.60 -2.64 1.44 7.64 -1.26 -4.01 113.62 113.89 1llf n SER 201 Ca -0.01 -1.64 -0.21 0.00 1.01 0.00 0.00 58.87 58.02 1llf n SER 201 Cb 0.09 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1llf n SER 201 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1llf n LYS 202 N 0.27 2.60 -3.39 1.43 5.02 -0.05 -4.77 118.16 119.26 1llf n LYS 202 Ca 0.17 -4.13 -0.38 0.00 -2.02 0.00 0.00 58.31 51.96 1llf n LYS 202 Cb 0.34 -1.93 -0.07 0.00 -0.02 0.00 0.00 35.03 33.35 1llf n LYS 202 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1llf s VAL 203 N -4.51 5.20 -0.21 -0.18 1.01 -1.26 -1.16 120.40 119.29 1llf s VAL 203 Ca 0.42 0.73 -0.06 0.00 0.00 0.00 0.00 61.98 63.07 1llf s VAL 203 Cb 0.40 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 1llf s VAL 203 CO -0.11 0.27 0.02 -0.89 0.00 0.00 0.00 175.10 174.39 1llf s THR 204 N 1.16 4.06 0.04 3.92 2.01 0.06 -0.56 115.64 126.32 1llf s THR 204 Ca 0.20 -0.27 -0.18 0.00 0.31 0.00 0.00 61.69 61.75 1llf s THR 204 Cb -0.15 -2.85 -0.06 0.00 0.01 0.00 0.00 72.50 69.45 1llf s THR 204 CO 0.08 0.41 0.51 0.27 -0.69 0.00 0.00 174.62 175.20 1llf s ILE 205 N 1.12 4.87 0.02 1.82 -4.36 -0.73 -0.67 121.20 123.27 1llf s ILE 205 Ca 0.03 1.07 -0.09 0.00 -0.26 0.00 0.00 60.65 61.40 1llf s ILE 205 Cb -0.14 -3.83 0.00 0.00 1.25 0.00 0.00 42.46 39.74 1llf s ILE 205 CO 0.02 0.55 0.18 0.72 0.24 0.00 0.00 174.94 176.65 1llf s PHE 206 N -0.98 0.04 0.07 1.37 -0.71 -0.20 -0.74 117.98 116.83 1llf s PHE 206 Ca 0.27 -0.20 -0.27 0.00 -1.04 0.00 0.00 56.93 55.69 1llf s PHE 206 Cb -0.18 -0.03 0.09 0.00 -1.21 0.00 0.00 43.02 41.68 1llf s PHE 206 CO 0.17 -0.38 1.01 0.20 -1.34 0.00 0.00 175.22 174.88 1llf s GLY 207 N -1.81 -0.32 -0.03 1.99 0.00 -1.02 -0.52 107.32 105.61 1llf s GLY 207 Ca -0.09 0.51 0.05 0.00 0.00 0.00 0.00 44.72 45.19 1llf s GLY 207 CO -0.01 0.13 -0.19 1.85 0.00 0.00 0.00 173.10 174.87 1llf s GLU 208 N -3.05 1.79 6.35 2.90 -6.30 -1.24 -1.42 118.70 117.73 1llf s GLU 208 Ca 0.11 -0.68 0.00 0.00 -2.50 0.00 0.00 54.97 51.90 1llf s GLU 208 Cb -0.00 -1.62 0.00 0.00 0.00 0.00 0.00 34.13 32.51 1llf s GLU 208 CO -0.02 0.33 0.00 0.45 0.02 0.00 0.00 175.26 176.04 1llf n SER 209 N 2.90 0.00 0.26 -1.70 2.88 0.07 -0.66 113.62 117.37 1llf n SER 209 Ca -0.17 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.45 1llf n SER 209 Cb 0.53 0.00 0.64 0.00 -0.75 0.00 0.00 64.21 64.63 1llf n SER 209 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1llf h ALA 210 N -0.92 1.99 0.00 -1.46 0.00 -1.86 0.02 119.26 117.02 1llf h ALA 210 Ca 0.00 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1llf h ALA 210 Cb 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1llf h ALA 210 CO 0.00 0.00 -0.52 0.78 0.00 0.00 0.00 179.25 179.51 1llf h GLY 211 N 0.01 0.00 0.62 0.00 0.00 -0.89 -0.11 103.07 102.70 1llf h GLY 211 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 1llf h GLY 211 CO 0.00 0.00 -0.22 0.23 0.00 0.00 0.00 176.54 176.55 1llf h SER 212 N 0.00 0.31 -0.63 0.19 0.87 -1.06 -1.83 113.55 111.41 1llf h SER 212 Ca -0.01 -0.62 0.02 0.00 -1.23 0.00 0.00 61.79 59.96 1llf h SER 212 Cb 0.94 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.78 1llf h SER 212 CO 0.07 0.87 0.42 0.24 -0.53 0.00 0.00 176.83 177.90 1llf h MET 213 N -0.24 0.78 -0.68 2.24 2.86 -1.11 -1.46 114.93 117.32 1llf h MET 213 Ca -0.01 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1llf h MET 213 Cb 0.85 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 32.30 1llf h MET 213 CO 0.05 0.51 0.37 0.77 1.06 0.00 0.00 176.91 179.67 1llf h SER 214 N 0.80 0.85 -0.45 1.22 0.02 -0.90 -0.26 113.55 114.84 1llf h SER 214 Ca 0.24 -0.10 0.05 0.00 -0.84 0.00 0.00 61.79 61.14 1llf h SER 214 Cb -0.01 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.26 1llf h SER 214 CO -0.06 0.70 0.19 0.58 -1.14 0.00 0.00 176.83 177.11 1llf h VAL 215 N 0.94 0.91 -0.44 2.27 2.07 -0.41 0.69 116.25 122.27 1llf h VAL 215 Ca 0.24 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.68 1llf h VAL 215 Cb 0.04 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 1llf h VAL 215 CO -0.04 0.07 0.18 0.25 0.02 0.00 0.00 177.57 178.05 1llf h LEU 216 N 0.39 0.23 -1.10 2.57 7.12 -0.72 -1.47 115.31 122.31 1llf h LEU 216 Ca 0.20 0.04 0.07 0.00 0.13 0.00 0.00 57.88 58.33 1llf h LEU 216 Cb 0.16 0.01 -0.06 0.00 -0.53 0.00 0.00 40.66 40.23 1llf h LEU 216 CO -0.18 0.17 0.61 0.00 -0.13 0.00 0.00 178.44 178.91 1llf h HIS 218 N 1.05 0.00 -0.42 0.00 3.86 0.00 0.45 115.15 120.09 1llf h HIS 218 Ca 0.42 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.49 1llf h HIS 218 Cb 0.24 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.70 1llf h HIS 218 CO -0.00 0.24 -0.28 -0.07 0.86 0.00 0.00 177.93 178.69 1llf h LEU 219 N 0.00 0.94 -1.13 2.43 3.38 -0.05 -3.28 115.31 117.61 1llf h LEU 219 Ca -0.00 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1llf h LEU 219 Cb 0.55 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1llf h LEU 219 CO 0.03 1.16 -0.28 2.30 0.09 0.00 0.00 178.44 181.74 1llf n ILE 220 N -4.09 0.00 -1.67 1.22 -6.64 -0.81 -1.11 119.36 106.26 1llf n ILE 220 Ca -0.01 -0.29 -0.44 0.00 -1.77 0.00 0.00 62.75 60.24 1llf n ILE 220 Cb 0.48 1.08 -0.02 0.00 -1.44 0.00 0.00 39.64 39.74 1llf n ILE 220 CO 0.00 0.00 0.00 1.87 -1.77 0.00 0.00 176.55 176.65 1llf n TRP 221 N 0.21 2.09 -3.95 4.28 -0.00 0.12 -1.52 117.44 118.67 1llf n TRP 221 Ca 0.12 0.50 -0.31 0.00 -0.00 0.00 0.00 57.50 57.82 1llf n TRP 221 Cb 0.47 -2.42 0.02 0.00 -0.00 0.00 0.00 31.31 29.37 1llf n TRP 221 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1llf n ASN 222 N 1.65 -4.19 -2.25 5.87 3.02 0.51 -0.78 115.26 119.09 1llf n ASN 222 Ca 0.09 -0.83 -0.15 0.00 -0.03 0.00 0.00 54.58 53.67 1llf n ASN 222 Cb 0.33 -3.68 -0.02 0.00 -0.61 0.00 0.00 39.78 35.79 1llf n ASN 222 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1llf n ASP 223 N -2.82 -4.32 0.00 6.41 8.00 -0.57 -2.11 116.55 121.14 1llf n ASP 223 Ca 0.01 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.70 1llf n ASP 223 Cb 0.53 -3.70 0.00 0.00 -0.02 0.00 0.00 41.12 37.94 1llf n ASP 223 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1llf n GLY 224 N -0.75 0.65 3.55 0.44 0.00 0.04 -3.68 105.19 105.44 1llf n GLY 224 Ca -0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1llf n GLY 224 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1llf s ASP 225 N -2.72 6.24 -0.25 1.61 -1.08 -0.90 -3.07 116.67 116.50 1llf s ASP 225 Ca 0.00 -0.33 0.14 0.00 -0.52 0.00 0.00 52.55 51.84 1llf s ASP 225 Cb 0.00 -2.55 0.82 0.00 -1.46 0.00 0.00 42.92 39.74 1llf s ASP 225 CO 0.00 -1.72 1.77 -0.46 0.52 0.00 0.00 175.17 175.28 1llf n ASN 226 N 9.02 5.72 -4.92 -0.34 6.94 -1.26 -4.68 115.26 125.74 1llf n ASN 226 Ca 0.04 -2.96 -0.27 0.00 -0.02 0.00 0.00 54.58 51.37 1llf n ASN 226 Cb 0.49 -0.70 -0.01 0.00 -2.36 0.00 0.00 39.78 37.20 1llf n ASN 226 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1llf s THR 227 N -2.80 4.99 -0.06 5.53 -4.23 -1.26 -0.23 115.64 117.58 1llf s THR 227 Ca 0.55 -0.02 -0.02 0.00 -1.18 0.00 0.00 61.69 61.01 1llf s THR 227 Cb 0.42 -3.83 0.04 0.00 1.34 0.00 0.00 72.50 70.47 1llf s THR 227 CO 0.16 -0.62 0.12 -0.47 -0.54 0.00 0.00 174.62 173.27 1llf s TYR 228 N -2.44 -0.11 -1.37 3.99 5.04 0.32 -4.78 117.35 118.01 1llf s TYR 228 Ca 0.44 0.45 -0.06 0.00 -2.44 0.00 0.00 57.07 55.46 1llf s TYR 228 Cb -0.10 -0.22 0.03 0.00 0.35 0.00 0.00 41.96 42.02 1llf s TYR 228 CO 0.38 -0.20 0.43 1.63 -1.34 0.00 0.00 175.55 176.46 1llf n LYS 229 N 4.74 -3.67 -0.98 4.97 5.02 -1.26 -1.57 118.16 125.41 1llf n LYS 229 Ca -0.16 0.67 0.00 0.00 -2.02 0.00 0.00 58.31 56.80 1llf n LYS 229 Cb 0.51 -5.41 0.00 0.00 -0.02 0.00 0.00 35.03 30.10 1llf n LYS 229 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1llf n GLY 230 N -1.23 0.90 3.39 0.72 0.00 -1.26 -5.01 105.19 102.69 1llf n GLY 230 Ca -0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 1llf n GLY 230 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llf s LYS 231 N -0.05 2.78 0.34 1.61 1.02 -0.61 -4.98 119.74 119.85 1llf s LYS 231 Ca 0.00 -0.75 -0.28 0.00 0.02 0.00 0.00 55.97 54.97 1llf s LYS 231 Cb 0.00 -2.40 -0.12 0.00 -0.52 0.00 0.00 37.83 34.79 1llf s LYS 231 CO 0.00 0.44 1.22 -2.30 -0.92 0.00 0.00 175.35 173.79 1llf n PRO 232 N 2.83 1.93 0.12 -1.68 -0.02 -1.26 -0.52 135.00 136.40 1llf n PRO 232 Ca -0.17 0.68 0.13 0.00 -2.02 0.00 0.00 63.50 62.11 1llf n PRO 232 Cb 0.52 -2.22 0.42 0.00 -0.02 0.00 0.00 33.50 32.20 1llf n PRO 232 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1llf h LEU 233 N 2.37 0.00 -7.00 2.45 3.38 -0.93 -3.46 115.31 112.13 1llf h LEU 233 Ca -0.45 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 1llf h LEU 233 Cb 1.30 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.90 1llf h LEU 233 CO 0.62 0.00 0.26 0.72 0.09 0.00 0.00 178.44 180.13 1llf s PHE 234 N -3.17 -0.53 -0.05 1.13 -0.12 -1.26 -4.77 117.98 109.21 1llf s PHE 234 Ca 0.09 0.48 0.00 0.00 -0.05 0.00 0.00 56.93 57.45 1llf s PHE 234 Cb 0.11 0.52 0.00 0.00 -0.63 0.00 0.00 43.02 43.03 1llf s PHE 234 CO 0.55 -0.74 0.48 2.89 -0.05 0.00 0.00 175.22 178.35 1llf n ARG 235 N -0.06 -0.34 -3.49 1.99 1.85 0.27 -4.96 116.66 111.91 1llf n ARG 235 Ca -0.16 -0.49 -0.09 0.00 -1.00 0.00 0.00 57.85 56.12 1llf n ARG 235 Cb 0.63 -0.97 -0.02 0.00 -1.05 0.00 0.00 32.46 31.05 1llf n ARG 235 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1llf s ALA 236 N -0.11 -1.78 0.02 2.89 0.00 -1.23 -4.23 121.76 117.32 1llf s ALA 236 Ca 0.00 0.90 0.02 0.00 0.00 0.00 0.00 51.96 52.88 1llf s ALA 236 Cb 0.00 0.51 -0.02 0.00 0.00 0.00 0.00 23.12 23.62 1llf s ALA 236 CO 0.01 -0.71 -0.06 0.20 0.00 0.00 0.00 175.76 175.20 1llf s GLY 237 N -2.54 0.37 -0.11 0.00 0.00 -1.01 -1.77 107.32 102.25 1llf s GLY 237 Ca 0.04 -0.51 0.01 0.00 0.00 0.00 0.00 44.72 44.26 1llf s GLY 237 CO -0.10 -0.53 -0.13 -0.42 0.00 0.00 0.00 173.10 171.92 1llf s ILE 238 N -0.86 1.38 -0.38 0.90 1.01 0.08 -1.62 121.20 121.72 1llf s ILE 238 Ca -0.06 -0.55 -0.01 0.00 0.00 0.00 0.00 60.65 60.03 1llf s ILE 238 Cb -0.07 -1.29 0.10 0.00 0.01 0.00 0.00 42.46 41.21 1llf s ILE 238 CO 0.00 0.42 0.14 -0.04 0.00 0.00 0.00 174.94 175.46 1llf s MET 239 N 1.19 1.95 -0.76 2.79 -1.94 0.12 -2.44 119.30 120.22 1llf s MET 239 Ca -0.03 -1.76 -0.21 0.00 -1.71 0.00 0.00 55.69 51.99 1llf s MET 239 Cb -0.14 -3.45 0.10 0.00 2.01 0.00 0.00 34.83 33.35 1llf s MET 239 CO -0.04 -0.98 1.00 -0.65 -0.01 0.00 0.00 175.02 174.34 1llf s GLN 240 N 1.11 3.29 -0.25 2.03 -0.21 -0.51 -1.24 119.66 123.87 1llf s GLN 240 Ca 0.07 -1.23 -0.04 0.00 0.02 0.00 0.00 55.36 54.18 1llf s GLN 240 Cb -0.22 -4.50 0.00 0.00 1.00 0.00 0.00 33.01 29.30 1llf s GLN 240 CO -0.05 -1.78 0.15 0.43 -2.12 0.00 0.00 175.29 171.92 1llf n SER 241 N 7.16 -6.39 0.00 5.90 7.64 0.05 -0.75 113.62 127.23 1llf n SER 241 Ca 0.06 0.83 0.00 0.00 1.01 0.00 0.00 58.87 60.77 1llf n SER 241 Cb 0.46 -4.19 0.00 0.00 -1.01 0.00 0.00 64.21 59.48 1llf n SER 241 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1llf n GLY 242 N 0.22 4.31 0.00 0.23 0.00 -1.26 -2.24 105.19 106.45 1llf n GLY 242 Ca 0.03 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1llf n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llf n ALA 243 N -0.62 0.00 -1.73 4.61 0.00 -1.26 -3.76 120.51 117.75 1llf n ALA 243 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1llf n ALA 243 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 1llf n ALA 243 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1llf n MET 244 N 0.00 1.94 -2.86 0.00 2.81 -1.26 -4.32 117.12 113.43 1llf n MET 244 Ca 0.00 0.70 -0.42 0.00 -1.81 0.00 0.00 57.70 56.17 1llf n MET 244 Cb 0.00 -2.51 -0.04 0.00 -0.71 0.00 0.00 33.22 29.97 1llf n MET 244 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1llf s VAL 245 N -1.23 4.85 -1.32 2.03 1.01 -1.26 -4.96 120.40 119.52 1llf s VAL 245 Ca 0.64 1.68 -0.12 0.00 0.00 0.00 0.00 61.98 64.18 1llf s VAL 245 Cb -0.46 -4.16 0.12 0.00 0.00 0.00 0.00 36.38 31.88 1llf s VAL 245 CO 0.55 -0.01 1.88 -0.81 0.00 0.00 0.00 175.10 176.71 1llf n PRO 246 N 5.46 3.33 -4.62 2.72 -0.04 -1.26 -4.59 135.00 136.00 1llf n PRO 246 Ca 0.06 -3.31 -0.22 0.00 -0.04 0.00 0.00 63.50 59.98 1llf n PRO 246 Cb 0.48 -3.10 -0.15 0.00 -0.04 0.00 0.00 33.50 30.69 1llf n PRO 246 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1llf s SER 247 N 2.19 1.71 0.97 3.54 1.04 -1.26 -1.08 113.70 120.81 1llf s SER 247 Ca 0.44 -0.30 -0.11 0.00 0.48 0.00 0.00 55.95 56.46 1llf s SER 247 Cb 0.08 -0.18 0.17 0.00 0.10 0.00 0.00 66.02 66.20 1llf s SER 247 CO -0.01 0.15 1.10 -1.81 0.98 0.00 0.00 173.24 173.65 1llf s ASP 248 N -0.49 2.63 1.03 7.02 1.01 -1.26 -4.54 116.67 122.07 1llf s ASP 248 Ca 0.05 1.81 -0.12 0.00 0.71 0.00 0.00 52.55 55.01 1llf s ASP 248 Cb -0.06 -2.40 0.21 0.00 1.01 0.00 0.00 42.92 41.68 1llf s ASP 248 CO -0.00 -3.22 1.08 -2.84 0.21 0.00 0.00 175.17 170.40 1llf s PRO 249 N -4.68 0.10 0.29 8.23 0.02 -1.26 -4.07 135.00 133.63 1llf s PRO 249 Ca 0.66 1.10 0.04 0.00 0.02 0.00 0.00 61.00 62.82 1llf s PRO 249 Cb -0.22 -1.65 0.71 0.00 0.02 0.00 0.00 34.50 33.36 1llf s PRO 249 CO 0.59 -3.11 1.74 0.28 -0.33 0.00 0.00 177.00 176.17 1llf h VAL 250 N -2.19 0.61 -0.58 3.83 2.07 -1.17 -0.93 116.25 117.87 1llf h VAL 250 Ca -0.53 -0.20 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 1llf h VAL 250 Cb 1.30 -0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1llf h VAL 250 CO 0.48 0.11 0.07 -0.90 0.02 0.00 0.00 177.57 177.35 1llf n ASP 251 N -4.90 5.21 -2.23 0.57 5.75 -1.26 -0.53 116.55 119.15 1llf n ASP 251 Ca 0.22 -2.94 0.00 0.00 -0.01 0.00 0.00 54.79 52.06 1llf n ASP 251 Cb 0.60 -0.69 0.00 0.00 -1.03 0.00 0.00 41.12 39.99 1llf n ASP 251 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1llf n GLY 252 N 0.39 -0.61 0.34 6.12 0.00 -0.36 -4.77 105.19 106.29 1llf n GLY 252 Ca 0.29 -1.71 -0.16 0.00 0.00 0.00 0.00 46.02 44.44 1llf n GLY 252 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1llf h THR 253 N -0.55 0.33 0.00 2.61 2.02 -1.92 -2.48 112.91 112.92 1llf h THR 253 Ca 0.00 -0.24 -0.18 0.00 0.77 0.00 0.00 66.41 66.77 1llf h THR 253 Cb 0.00 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 1llf h THR 253 CO 0.00 0.03 -0.84 0.22 0.37 0.00 0.00 175.52 175.30 1llf h TYR 254 N -0.98 0.00 -0.72 3.16 3.20 -1.93 0.04 116.97 119.75 1llf h TYR 254 Ca -0.08 0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.83 1llf h TYR 254 Cb 0.67 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.89 1llf h TYR 254 CO -0.01 0.84 0.44 0.78 -1.64 0.00 0.00 178.16 178.58 1llf h GLY 255 N 2.82 1.06 1.42 1.82 0.00 -1.79 -0.44 103.07 107.95 1llf h GLY 255 Ca -0.01 -0.32 -0.15 0.00 0.00 0.00 0.00 47.33 46.85 1llf h GLY 255 CO 0.11 0.24 -0.47 3.43 0.00 0.00 0.00 176.54 179.86 1llf h ASN 256 N 0.83 0.68 -0.33 0.19 2.35 -1.25 -1.80 115.58 116.26 1llf h ASN 256 Ca 0.30 -0.33 -0.04 0.00 -0.55 0.00 0.00 56.30 55.68 1llf h ASN 256 Cb 0.09 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 1llf h ASN 256 CO -0.14 1.04 0.05 -0.08 -1.65 0.00 0.00 177.43 176.66 1llf h GLU 257 N 0.50 0.54 -0.49 0.81 4.81 -0.57 0.02 114.58 120.21 1llf h GLU 257 Ca 0.03 -0.15 -0.10 0.00 -0.13 0.00 0.00 59.36 59.01 1llf h GLU 257 Cb 1.00 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.31 1llf h GLU 257 CO 0.09 0.63 -0.08 0.82 -0.73 0.00 0.00 179.01 179.74 1llf h ILE 258 N 0.37 1.27 -0.54 2.32 1.08 -1.12 -1.95 117.51 118.94 1llf h ILE 258 Ca 0.10 -1.21 0.05 0.00 -0.39 0.00 0.00 64.86 63.41 1llf h ILE 258 Cb 0.35 1.04 -0.05 0.00 -3.07 0.00 0.00 36.82 35.09 1llf h ILE 258 CO 0.01 0.42 0.27 0.22 -0.69 0.00 0.00 178.15 178.38 1llf h TYR 259 N 0.78 0.50 -0.74 1.37 3.20 -1.07 0.37 116.97 121.40 1llf h TYR 259 Ca 0.13 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.96 1llf h TYR 259 Cb 0.63 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.72 1llf h TYR 259 CO 0.05 0.24 0.24 -0.44 -1.64 0.00 0.00 178.16 176.61 1llf h ASP 260 N 0.53 1.07 -0.33 -2.11 3.32 -0.80 0.92 116.42 119.02 1llf h ASP 260 Ca 0.24 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 1llf h ASP 260 Cb 0.15 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1llf h ASP 260 CO -0.17 0.99 0.12 0.25 -1.72 0.00 0.00 179.24 178.71 1llf h LEU 261 N 1.09 0.47 0.21 1.55 5.85 -0.91 -1.56 115.31 122.01 1llf h LEU 261 Ca 0.24 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1llf h LEU 261 Cb 0.29 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1llf h LEU 261 CO -0.01 0.54 -0.14 0.15 -0.34 0.00 0.00 178.44 178.63 1llf h PHE 262 N 0.38 -0.37 -0.49 1.25 3.57 -0.62 0.13 116.94 120.79 1llf h PHE 262 Ca 0.11 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.69 1llf h PHE 262 Cb 0.22 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.03 1llf h PHE 262 CO 0.00 -0.22 0.09 0.28 -2.23 0.00 0.00 178.31 176.24 1llf h VAL 263 N -0.35 0.72 -0.39 1.41 2.07 -0.77 -0.38 116.25 118.56 1llf h VAL 263 Ca -0.01 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 1llf h VAL 263 Cb 0.30 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1llf h VAL 263 CO 0.01 0.04 0.10 0.28 0.02 0.00 0.00 177.57 178.02 1llf h SER 264 N 0.23 0.59 0.39 0.57 0.02 -1.07 -0.65 113.55 113.63 1llf h SER 264 Ca 0.25 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 1llf h SER 264 Cb 0.33 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1llf h SER 264 CO -0.33 0.67 -0.20 0.28 -1.14 0.00 0.00 176.83 176.11 1llf h SER 265 N 0.49 0.00 -0.05 3.07 0.02 -0.54 -2.11 113.55 114.43 1llf h SER 265 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1llf h SER 265 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1llf h SER 265 CO 0.00 0.20 0.00 0.00 -1.14 0.00 0.00 176.83 175.89 1llf n ALA 266 N -2.36 2.59 -0.94 3.77 0.00 -0.19 -4.62 120.51 118.77 1llf n ALA 266 Ca -0.02 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1llf n ALA 266 Cb 0.30 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1llf n ALA 266 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llf n GLY 267 N 1.00 0.46 0.98 0.00 0.00 -0.79 -4.95 105.19 101.89 1llf n GLY 267 Ca 0.18 -0.66 0.08 0.00 0.00 0.00 0.00 46.02 45.61 1llf n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llf h GLY 269 N 2.29 0.00 -1.59 0.00 0.00 -1.80 -1.78 103.07 100.19 1llf h GLY 269 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1llf h GLY 269 CO 0.18 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.16 1llf n SER 270 N -3.25 2.55 -4.74 0.19 7.64 -1.26 -4.95 113.62 109.78 1llf n SER 270 Ca -0.01 -1.88 -0.40 0.00 1.01 0.00 0.00 58.87 57.58 1llf n SER 270 Cb 0.21 -0.21 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 1llf n SER 270 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1llf s ALA 271 N -1.58 3.32 0.08 -0.43 0.00 -0.67 -4.93 121.76 117.55 1llf s ALA 271 Ca 0.35 0.66 0.11 0.00 0.00 0.00 0.00 51.96 53.07 1llf s ALA 271 Cb 0.19 -3.26 0.03 0.00 0.00 0.00 0.00 23.12 20.08 1llf s ALA 271 CO 0.27 0.06 1.41 0.66 0.00 0.00 0.00 175.76 178.16 1llf h SER 272 N 4.62 0.00 -3.78 0.00 4.64 -1.92 -3.38 113.55 113.72 1llf h SER 272 Ca -0.45 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.24 1llf h SER 272 Cb 1.21 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.88 1llf h SER 272 CO 0.69 0.76 -0.59 -0.62 -0.87 0.00 0.00 176.83 176.21 1llf s ASP 273 N -6.65 4.59 0.21 4.97 -1.08 -1.26 -4.96 116.67 112.49 1llf s ASP 273 Ca 0.01 -3.41 -0.05 0.00 -0.52 0.00 0.00 52.55 48.57 1llf s ASP 273 Cb 0.10 -1.65 0.17 0.00 -1.46 0.00 0.00 42.92 40.08 1llf s ASP 273 CO 0.78 -0.16 1.64 0.11 0.52 0.00 0.00 175.17 178.06 1llf h LYS 274 N 5.99 0.85 -0.54 4.34 1.57 -1.90 -1.39 116.57 125.49 1llf h LYS 274 Ca 0.03 -0.31 -0.10 0.00 -1.87 0.00 0.00 60.65 58.39 1llf h LYS 274 Cb 0.83 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 1llf h LYS 274 CO 0.71 0.95 -0.07 -0.07 -0.57 0.00 0.00 179.45 180.40 1llf h LEU 275 N 0.76 1.00 -0.90 2.94 3.38 -1.97 -0.36 115.31 120.16 1llf h LEU 275 Ca 0.12 -0.34 -0.06 0.00 0.09 0.00 0.00 57.88 57.69 1llf h LEU 275 Cb 0.67 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 1llf h LEU 275 CO 0.05 1.10 0.12 0.00 0.09 0.00 0.00 178.44 179.80 1llf h ALA 276 N 0.93 1.10 -0.25 1.53 0.00 -1.93 -0.05 119.26 120.58 1llf h ALA 276 Ca 0.15 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1llf h ALA 276 Cb 0.63 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1llf h ALA 276 CO 0.04 0.59 0.12 0.00 0.00 0.00 0.00 179.25 180.01 1llf h LEU 278 N 0.28 0.99 -2.01 0.00 3.38 -0.86 -2.07 115.31 115.02 1llf h LEU 278 Ca 0.09 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1llf h LEU 278 Cb 0.12 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1llf h LEU 278 CO -0.01 0.74 -0.05 0.03 0.09 0.00 0.00 178.44 179.24 1llf h ARG 279 N 1.15 0.00 0.00 1.13 3.08 -0.73 -2.29 114.38 116.72 1llf h ARG 279 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1llf h ARG 279 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.96 1llf h ARG 279 CO -0.06 0.05 -0.58 0.43 -1.07 0.00 0.00 179.97 178.74 1llf n SER 280 N -3.27 0.56 -4.80 7.04 7.64 -0.78 -4.29 113.62 115.71 1llf n SER 280 Ca -0.01 -0.23 -0.32 0.00 1.01 0.00 0.00 58.87 59.32 1llf n SER 280 Cb 0.23 0.32 0.05 0.00 -1.01 0.00 0.00 64.21 63.80 1llf n SER 280 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1llf s ALA 281 N -3.04 2.57 0.78 -0.43 0.00 -0.86 -5.02 121.76 115.76 1llf s ALA 281 Ca 0.10 0.24 -0.11 0.00 0.00 0.00 0.00 51.96 52.19 1llf s ALA 281 Cb 0.17 -3.23 0.06 0.00 0.00 0.00 0.00 23.12 20.12 1llf s ALA 281 CO 0.72 -1.28 1.10 -1.54 0.00 0.00 0.00 175.76 174.76 1llf s SER 282 N -3.36 4.32 0.19 0.00 1.04 -1.26 -4.89 113.70 109.74 1llf s SER 282 Ca 0.61 1.91 -0.12 0.00 0.48 0.00 0.00 55.95 58.83 1llf s SER 282 Cb -0.16 -2.53 0.17 0.00 0.10 0.00 0.00 66.02 63.60 1llf s SER 282 CO 0.50 -2.16 1.80 -1.28 0.98 0.00 0.00 173.24 173.07 1llf h SER 283 N -1.10 0.44 -0.59 7.02 0.87 -1.97 -2.19 113.55 116.03 1llf h SER 283 Ca -0.44 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.12 1llf h SER 283 Cb 1.24 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1llf h SER 283 CO 0.50 0.30 0.25 0.44 -0.53 0.00 0.00 176.83 177.79 1llf h ASP 284 N 0.58 0.83 -0.17 6.23 3.32 -1.99 -0.89 116.42 124.32 1llf h ASP 284 Ca 0.25 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 1llf h ASP 284 Cb 0.14 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1llf h ASP 284 CO -0.16 0.74 0.10 0.74 -1.72 0.00 0.00 179.24 178.93 1llf h THR 285 N 0.89 1.10 -0.21 0.35 2.02 -1.85 -0.17 112.91 115.03 1llf h THR 285 Ca 0.21 -0.26 -0.12 0.00 0.77 0.00 0.00 66.41 67.02 1llf h THR 285 Cb 0.17 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 1llf h THR 285 CO -0.02 0.09 -0.36 -0.07 0.37 0.00 0.00 175.52 175.53 1llf h LEU 286 N 0.18 0.48 0.02 2.58 3.38 -0.93 -0.72 115.31 120.30 1llf h LEU 286 Ca 0.06 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 1llf h LEU 286 Cb 0.06 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1llf h LEU 286 CO -0.01 0.80 -0.01 0.25 0.09 0.00 0.00 178.44 179.56 1llf h LEU 287 N 0.39 -0.02 -0.86 1.67 5.85 -0.93 -0.59 115.31 120.82 1llf h LEU 287 Ca 0.04 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1llf h LEU 287 Cb 0.82 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 1llf h LEU 287 CO 0.07 0.08 0.51 0.44 -0.34 0.00 0.00 178.44 179.20 1llf h ASP 288 N -0.12 1.05 -0.76 1.25 3.32 -0.91 -1.05 116.42 119.19 1llf h ASP 288 Ca -0.00 -0.08 -0.04 0.00 0.02 0.00 0.00 57.03 56.93 1llf h ASP 288 Cb 0.12 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 1llf h ASP 288 CO 0.00 0.82 0.32 0.00 -1.72 0.00 0.00 179.24 178.67 1llf h ALA 289 N 1.27 0.99 -0.83 3.45 0.00 -0.98 -1.96 119.26 121.20 1llf h ALA 289 Ca 0.31 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1llf h ALA 289 Cb -0.03 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.42 1llf h ALA 289 CO -0.06 0.60 0.46 1.15 0.00 0.00 0.00 179.25 181.40 1llf h THR 290 N 1.10 1.24 0.00 0.00 2.02 -0.57 -1.85 112.91 114.85 1llf h THR 290 Ca 0.26 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.85 1llf h THR 290 Cb 0.19 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.71 1llf h THR 290 CO -0.02 0.27 0.00 0.59 0.37 0.00 0.00 175.52 176.72 1llf n ASN 291 N -4.35 0.00 -0.94 4.18 3.02 -0.45 -1.60 115.26 115.12 1llf n ASN 291 Ca 0.09 -0.06 0.09 0.00 -0.03 0.00 0.00 54.58 54.67 1llf n ASN 291 Cb 0.09 -0.30 0.25 0.00 -0.61 0.00 0.00 39.78 39.21 1llf n ASN 291 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1llf n ASN 292 N -1.30 2.75 -4.48 6.41 5.15 -0.70 -1.67 115.26 121.42 1llf n ASN 292 Ca 0.12 -1.97 -0.29 0.00 -0.60 0.00 0.00 54.58 51.84 1llf n ASN 292 Cb 0.22 -0.32 -0.12 0.00 -0.53 0.00 0.00 39.78 39.04 1llf n ASN 292 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1llf s THR 293 N -1.37 2.76 0.33 -0.44 -4.23 -0.63 -2.37 115.64 109.70 1llf s THR 293 Ca 0.35 -1.53 -0.29 0.00 -1.18 0.00 0.00 61.69 59.04 1llf s THR 293 Cb 0.19 -2.26 -0.11 0.00 1.34 0.00 0.00 72.50 71.66 1llf s THR 293 CO 0.25 0.10 1.51 -2.84 -0.54 0.00 0.00 174.62 173.10 1llf s PRO 294 N -2.12 4.14 0.53 3.99 0.02 -1.26 -2.79 135.00 137.52 1llf s PRO 294 Ca 0.17 2.53 0.02 0.00 0.02 0.00 0.00 61.00 63.74 1llf s PRO 294 Cb -0.10 -3.01 0.03 0.00 0.02 0.00 0.00 34.50 31.43 1llf s PRO 294 CO 0.09 -0.54 0.74 0.20 -0.33 0.00 0.00 177.00 177.17 1llf s GLY 295 N 0.13 1.80 0.20 0.52 0.00 -0.11 -4.26 107.32 105.59 1llf s GLY 295 Ca 0.57 -1.31 0.21 0.00 0.00 0.00 0.00 44.72 44.19 1llf s GLY 295 CO 0.55 -1.05 1.65 1.97 0.00 0.00 0.00 173.10 176.21 1llf n PHE 296 N -2.27 0.62 1.05 1.90 1.16 -1.11 -1.40 117.46 117.42 1llf n PHE 296 Ca 0.07 0.24 0.11 0.00 -1.87 0.00 0.00 57.45 56.01 1llf n PHE 296 Cb 0.59 -0.89 0.08 0.00 -1.61 0.00 0.00 39.48 37.64 1llf n PHE 296 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 1llf n LEU 297 N -2.06 1.45 -4.60 5.98 4.77 0.01 -4.23 117.00 118.31 1llf n LEU 297 Ca 0.02 -0.53 -0.29 0.00 -0.03 0.00 0.00 56.01 55.18 1llf n LEU 297 Cb 0.21 -0.05 0.22 0.00 -2.33 0.00 0.00 43.42 41.47 1llf n LEU 297 CO 0.18 0.29 0.61 0.00 -1.33 0.00 0.00 177.39 177.14 1llf s ALA 298 N -2.65 0.57 0.29 -1.18 0.00 -0.49 -4.71 121.76 113.59 1llf s ALA 298 Ca 0.17 -0.69 0.03 0.00 0.00 0.00 0.00 51.96 51.46 1llf s ALA 298 Cb 0.18 -2.99 0.64 0.00 0.00 0.00 0.00 23.12 20.95 1llf s ALA 298 CO 0.64 -3.40 1.78 -0.92 0.00 0.00 0.00 175.76 173.86 1llf h TYR 299 N -2.39 0.99 -0.13 0.00 3.20 -1.86 0.45 116.97 117.23 1llf h TYR 299 Ca -0.50 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.44 1llf h TYR 299 Cb 1.31 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.28 1llf h TYR 299 CO -1.16 0.26 0.14 0.77 -1.64 0.00 0.00 178.16 176.52 1llf h SER 300 N 0.76 0.00 0.00 -2.11 0.02 -1.88 -3.45 113.55 106.89 1llf h SER 300 Ca 0.53 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.48 1llf h SER 300 Cb 0.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1llf h SER 300 CO -0.36 0.00 0.00 -0.24 -1.14 0.00 0.00 176.83 175.09 1llf n SER 301 N -3.88 0.00 0.00 3.07 2.88 0.15 -1.62 113.62 114.22 1llf n SER 301 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 1llf n SER 301 Cb 0.25 0.00 0.49 0.00 -0.75 0.00 0.00 64.21 64.19 1llf n SER 301 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1llf n LEU 302 N 0.00 0.00 -4.42 2.46 4.77 -1.26 -3.93 117.00 114.62 1llf n LEU 302 Ca 0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.59 1llf n LEU 302 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1llf n LEU 302 CO 0.00 0.00 1.95 -1.14 -1.33 0.00 0.00 177.39 176.87 1llf n ARG 303 N -0.89 2.65 -2.29 3.23 0.63 -0.64 -4.95 116.66 114.40 1llf n ARG 303 Ca 0.12 -2.91 -0.37 0.00 -0.92 0.00 0.00 57.85 53.77 1llf n ARG 303 Cb 0.06 -3.50 -0.01 0.00 0.45 0.00 0.00 32.46 29.45 1llf n ARG 303 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1llf s LEU 304 N 5.54 4.07 0.32 6.15 1.43 -1.25 -4.92 118.68 130.02 1llf s LEU 304 Ca 0.57 2.29 0.14 0.00 -1.03 0.00 0.00 54.13 56.10 1llf s LEU 304 Cb 0.05 -4.18 0.50 0.00 0.03 0.00 0.00 46.19 42.58 1llf s LEU 304 CO 0.08 -0.82 1.67 0.28 0.23 0.00 0.00 176.35 177.78 1llf h SER 305 N 2.23 0.00 -3.25 2.29 0.02 -1.89 -3.43 113.55 109.51 1llf h SER 305 Ca -0.49 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.03 1llf h SER 305 Cb 1.24 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 63.39 1llf h SER 305 CO 0.61 0.50 -0.76 -0.31 -1.14 0.00 0.00 176.83 175.74 1llf s TYR 306 N -3.61 0.45 0.02 3.45 2.02 -1.26 -4.94 117.35 113.49 1llf s TYR 306 Ca -0.01 -0.11 -0.28 0.00 -0.37 0.00 0.00 57.07 56.30 1llf s TYR 306 Cb 0.12 -0.71 0.10 0.00 -0.40 0.00 0.00 41.96 41.07 1llf s TYR 306 CO 0.73 -0.33 0.90 -0.48 -1.57 0.00 0.00 175.55 174.80 1llf s LEU 307 N 2.04 -0.34 0.44 -1.29 2.34 -1.26 -4.64 118.68 115.98 1llf s LEU 307 Ca 0.04 -0.06 -0.25 0.00 0.06 0.00 0.00 54.13 53.92 1llf s LEU 307 Cb -0.13 2.04 -0.08 0.00 -0.56 0.00 0.00 46.19 47.46 1llf s LEU 307 CO -0.05 -0.66 1.34 -2.84 -1.06 0.00 0.00 176.35 173.08 1llf s PRO 308 N -3.14 3.76 -0.00 1.48 0.02 -1.26 -4.97 135.00 130.88 1llf s PRO 308 Ca 0.06 2.23 -0.01 0.00 0.02 0.00 0.00 61.00 63.31 1llf s PRO 308 Cb -0.01 -2.64 -0.00 0.00 0.02 0.00 0.00 34.50 31.87 1llf s PRO 308 CO -0.07 -0.69 0.02 1.03 -0.33 0.00 0.00 177.00 176.95 1llf s ARG 309 N -2.42 0.08 0.24 5.54 0.52 -1.26 -4.76 118.95 116.89 1llf s ARG 309 Ca 0.60 -0.08 -0.31 0.00 -0.52 0.00 0.00 55.73 55.42 1llf s ARG 309 Cb -0.40 0.03 -0.14 0.00 0.52 0.00 0.00 34.95 34.97 1llf s ARG 309 CO 0.50 -0.01 1.29 -2.30 0.02 0.00 0.00 175.30 174.80 1llf n PRO 310 N 2.79 1.77 0.00 3.54 -0.02 -1.26 -4.52 135.00 137.31 1llf n PRO 310 Ca -0.14 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1llf n PRO 310 Cb 0.59 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1llf n PRO 310 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1llf n ASP 311 N 1.83 0.95 0.00 2.55 5.68 0.29 -0.75 116.55 127.10 1llf n ASP 311 Ca 0.11 -1.07 0.00 0.00 -0.50 0.00 0.00 54.79 53.33 1llf n ASP 311 Cb 0.31 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 1llf n ASP 311 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1llf n GLY 312 N -0.03 1.08 1.14 6.12 0.00 -0.63 -4.78 105.19 108.09 1llf n GLY 312 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1llf n GLY 312 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1llf n LYS 313 N -2.00 0.00 -0.08 1.61 4.81 -1.26 -4.82 118.16 116.42 1llf n LYS 313 Ca 0.00 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.38 1llf n LYS 313 Cb 0.00 -0.07 -0.15 0.00 0.02 0.00 0.00 35.03 34.83 1llf n LYS 313 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1llf n ASN 314 N -2.66 0.36 -4.04 3.14 4.13 -1.26 -4.68 115.26 110.25 1llf n ASN 314 Ca 0.00 0.00 -0.32 0.00 1.68 0.00 0.00 54.58 55.94 1llf n ASN 314 Cb 0.00 1.12 -0.14 0.00 -1.54 0.00 0.00 39.78 39.22 1llf n ASN 314 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1llf s ILE 315 N -2.61 2.59 -1.12 2.41 1.01 -1.26 -0.36 121.20 121.86 1llf s ILE 315 Ca -0.09 -2.37 0.28 0.00 0.00 0.00 0.00 60.65 58.48 1llf s ILE 315 Cb 0.07 -2.86 0.23 0.00 0.01 0.00 0.00 42.46 39.91 1llf s ILE 315 CO 0.78 -0.65 1.80 0.35 0.00 0.00 0.00 174.94 177.22 1llf n THR 316 N 4.23 0.00 -3.78 2.92 -2.24 -1.26 -0.55 114.28 113.60 1llf n THR 316 Ca 0.03 -0.01 -0.03 0.00 -2.27 0.00 0.00 64.05 61.77 1llf n THR 316 Cb 0.41 -0.25 -0.00 0.00 -2.10 0.00 0.00 70.33 68.38 1llf n THR 316 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1llf s ASP 317 N -2.90 -0.12 -0.21 3.42 -1.08 -1.26 -4.26 116.67 110.27 1llf s ASP 317 Ca 0.16 -0.48 -0.19 0.00 -0.52 0.00 0.00 52.55 51.52 1llf s ASP 317 Cb 0.19 0.48 -0.08 0.00 -1.46 0.00 0.00 42.92 42.05 1llf s ASP 317 CO 0.56 -0.91 0.69 -0.67 0.52 0.00 0.00 175.17 175.36 1llf n ASP 318 N -0.68 0.48 0.20 -0.34 -0.08 -1.26 -4.71 116.55 110.16 1llf n ASP 318 Ca -0.05 0.47 0.06 0.00 -1.51 0.00 0.00 54.79 53.76 1llf n ASP 318 Cb 0.60 -0.37 0.38 0.00 2.34 0.00 0.00 41.12 44.08 1llf n ASP 318 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 1llf h MET 319 N 2.26 0.00 -0.55 -0.67 2.86 -1.86 -0.49 114.93 116.47 1llf h MET 319 Ca -0.17 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.45 1llf h MET 319 Cb 0.57 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.21 1llf h MET 319 CO 0.41 0.35 0.25 1.88 1.06 0.00 0.00 176.91 180.86 1llf h TYR 320 N 0.00 0.81 -0.35 -0.22 -1.99 -1.88 -2.36 116.97 110.98 1llf h TYR 320 Ca -0.00 -0.05 -0.13 0.00 2.00 0.00 0.00 58.73 60.55 1llf h TYR 320 Cb 0.81 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 39.28 1llf h TYR 320 CO 0.00 0.64 -0.30 -0.22 -0.00 0.00 0.00 178.16 178.27 1llf h LYS 321 N 0.75 0.76 -0.67 4.88 3.64 -1.68 -0.28 116.57 123.97 1llf h LYS 321 Ca 0.19 -0.35 0.07 0.00 -1.27 0.00 0.00 60.65 59.29 1llf h LYS 321 Cb 0.14 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.89 1llf h LYS 321 CO -0.02 0.96 0.36 -0.07 -2.27 0.00 0.00 179.45 178.41 1llf h LEU 322 N 0.64 0.51 -0.17 5.20 3.38 -0.97 0.08 115.31 123.98 1llf h LEU 322 Ca 0.07 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 1llf h LEU 322 Cb 0.83 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1llf h LEU 322 CO 0.07 0.32 -0.35 0.58 0.09 0.00 0.00 178.44 179.15 1llf h VAL 323 N 0.64 1.35 -0.96 1.22 2.07 -1.17 -0.68 116.25 118.72 1llf h VAL 323 Ca 0.31 -1.60 0.13 0.00 0.82 0.00 0.00 66.70 66.37 1llf h VAL 323 Cb 0.25 1.95 -0.09 0.00 -1.52 0.00 0.00 31.29 31.88 1llf h VAL 323 CO -0.21 0.49 0.58 -0.09 0.02 0.00 0.00 177.57 178.36 1llf h ARG 324 N 0.17 0.85 -0.13 1.57 2.43 -0.77 -2.78 114.38 115.73 1llf h ARG 324 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1llf h ARG 324 Cb 0.95 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1llf h ARG 324 CO 0.08 0.56 0.00 -0.25 -1.51 0.00 0.00 179.97 178.85 1llf n ASP 325 N -4.70 1.70 0.00 -3.80 10.43 -0.01 -4.94 116.55 115.24 1llf n ASP 325 Ca 0.19 -1.66 0.00 0.00 2.57 0.00 0.00 54.79 55.89 1llf n ASP 325 Cb 0.40 -0.08 0.00 0.00 1.84 0.00 0.00 41.12 43.28 1llf n ASP 325 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1llf n GLY 326 N 1.16 0.56 2.62 0.44 0.00 -0.83 -4.96 105.19 104.18 1llf n GLY 326 Ca 0.17 -0.53 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 1llf n GLY 326 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1llf n LYS 327 N -2.76 4.30 -4.00 1.61 5.02 -0.32 -4.88 118.16 117.13 1llf n LYS 327 Ca 0.00 -3.54 -0.08 0.00 -2.02 0.00 0.00 58.31 52.67 1llf n LYS 327 Cb 0.00 -2.72 -0.09 0.00 -0.02 0.00 0.00 35.03 32.21 1llf n LYS 327 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 1llf s TYR 328 N -0.78 0.44 0.36 2.13 -0.85 -1.24 -3.46 117.35 113.94 1llf s TYR 328 Ca 0.48 -0.89 -0.27 0.00 -0.52 0.00 0.00 57.07 55.87 1llf s TYR 328 Cb 0.15 -0.25 -0.09 0.00 0.38 0.00 0.00 41.96 42.15 1llf s TYR 328 CO -0.06 -0.51 1.21 0.00 -1.52 0.00 0.00 175.55 174.68 1llf s ALA 329 N -3.93 3.31 -0.96 9.51 0.00 -0.27 -4.66 121.76 124.76 1llf s ALA 329 Ca 0.11 1.07 -0.17 0.00 0.00 0.00 0.00 51.96 52.97 1llf s ALA 329 Cb 0.06 -3.41 0.15 0.00 0.00 0.00 0.00 23.12 19.92 1llf s ALA 329 CO -0.07 -0.53 1.13 -1.12 0.00 0.00 0.00 175.76 175.17 1llf s SER 330 N -0.85 6.72 0.07 0.00 0.01 -1.26 -4.74 113.70 113.65 1llf s SER 330 Ca 0.52 -2.28 0.02 0.00 1.31 0.00 0.00 55.95 55.52 1llf s SER 330 Cb -0.34 -2.37 -0.03 0.00 0.21 0.00 0.00 66.02 63.48 1llf s SER 330 CO 0.44 -0.95 -0.08 0.68 0.41 0.00 0.00 173.24 173.75 1llf s VAL 331 N 2.17 0.64 0.59 3.43 -7.23 -1.05 -4.86 120.40 114.10 1llf s VAL 331 Ca 0.32 -1.43 -0.16 0.00 -1.81 0.00 0.00 61.98 58.90 1llf s VAL 331 Cb -0.05 -1.06 -0.03 0.00 0.56 0.00 0.00 36.38 35.79 1llf s VAL 331 CO -0.08 -0.56 1.07 -2.16 -0.31 0.00 0.00 175.10 173.05 1llf s PRO 332 N -2.47 3.27 0.02 4.82 0.04 -1.26 -3.43 135.00 135.99 1llf s PRO 332 Ca -0.01 1.25 -0.01 0.00 0.04 0.00 0.00 61.00 62.27 1llf s PRO 332 Cb -0.04 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.46 1llf s PRO 332 CO -0.01 -0.85 -0.00 0.14 0.04 0.00 0.00 177.00 176.31 1llf s VAL 333 N -2.39 0.12 -0.10 -0.36 -7.23 -0.39 -2.40 120.40 107.65 1llf s VAL 333 Ca 0.65 -1.01 -0.00 0.00 -1.81 0.00 0.00 61.98 59.80 1llf s VAL 333 Cb -0.17 -0.49 -0.02 0.00 0.56 0.00 0.00 36.38 36.26 1llf s VAL 333 CO 0.36 -0.56 -0.09 -0.63 -0.31 0.00 0.00 175.10 173.87 1llf s ILE 334 N -1.85 3.42 -0.03 -0.62 1.01 -0.64 -1.22 121.20 121.28 1llf s ILE 334 Ca -0.12 -0.55 -0.02 0.00 0.00 0.00 0.00 60.65 59.95 1llf s ILE 334 Cb -0.07 -2.42 0.01 0.00 0.01 0.00 0.00 42.46 39.98 1llf s ILE 334 CO -0.02 0.55 0.07 -0.51 0.00 0.00 0.00 174.94 175.03 1llf s ILE 335 N -0.16 -0.00 0.22 2.92 2.07 -0.17 -0.70 121.20 125.38 1llf s ILE 335 Ca 0.01 0.01 -0.05 0.00 -1.41 0.00 0.00 60.65 59.21 1llf s ILE 335 Cb -0.13 -0.10 0.02 0.00 0.13 0.00 0.00 42.46 42.37 1llf s ILE 335 CO 0.03 0.00 0.38 0.61 -1.91 0.00 0.00 174.94 174.05 1llf n GLY 336 N 3.09 1.95 3.17 1.50 0.00 -0.37 -2.72 105.19 111.82 1llf n GLY 336 Ca -0.13 -1.34 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 1llf n GLY 336 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1llf s ASP 337 N -2.26 0.29 0.03 1.61 1.01 -0.70 -0.77 116.67 115.88 1llf s ASP 337 Ca 0.13 -1.02 -0.17 0.00 0.71 0.00 0.00 52.55 52.21 1llf s ASP 337 Cb -0.02 0.30 -0.06 0.00 1.01 0.00 0.00 42.92 44.15 1llf s ASP 337 CO 0.10 -0.72 0.47 -1.10 0.21 0.00 0.00 175.17 174.13 1llf s GLN 338 N -3.97 4.03 0.34 8.23 -1.52 -1.26 -0.61 119.66 124.89 1llf s GLN 338 Ca 0.16 0.54 0.04 0.00 -1.95 0.00 0.00 55.36 54.14 1llf s GLN 338 Cb 0.07 -3.23 0.65 0.00 -0.22 0.00 0.00 33.01 30.28 1llf s GLN 338 CO -0.03 0.67 1.94 -0.97 -0.25 0.00 0.00 175.29 176.64 1llf h ASN 339 N 4.66 0.77 -1.64 5.90 -1.24 -1.11 -3.08 115.58 119.84 1llf h ASN 339 Ca -0.51 0.00 -0.62 0.00 0.71 0.00 0.00 56.30 55.88 1llf h ASN 339 Cb 1.22 -0.16 -0.39 0.00 0.73 0.00 0.00 38.32 39.72 1llf h ASN 339 CO 0.62 0.49 -0.38 0.47 -1.29 0.00 0.00 177.43 177.34 1llf n ASP 340 N -4.48 5.24 -0.32 1.15 8.00 -0.16 -4.85 116.55 121.13 1llf n ASP 340 Ca 0.12 -3.74 0.18 0.00 0.71 0.00 0.00 54.79 52.06 1llf n ASP 340 Cb 0.22 -0.58 0.43 0.00 -0.02 0.00 0.00 41.12 41.16 1llf n ASP 340 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1llf h GLU 341 N 2.68 0.53 0.00 -1.24 4.39 -1.67 -2.86 114.58 116.41 1llf h GLU 341 Ca 0.35 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.01 1llf h GLU 341 Cb 0.74 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1llf h GLU 341 CO 0.96 0.35 -0.05 0.41 -1.16 0.00 0.00 179.01 179.53 1llf n GLY 342 N -1.41 -1.57 0.31 -3.84 0.00 -1.26 -4.11 105.19 93.32 1llf n GLY 342 Ca 0.24 -0.09 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 1llf n GLY 342 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1llf h THR 343 N 0.00 1.26 -0.70 2.61 1.35 -1.74 -0.94 112.91 114.76 1llf h THR 343 Ca 0.00 -1.07 -0.02 0.00 -0.55 0.00 0.00 66.41 64.77 1llf h THR 343 Cb 0.60 0.71 -0.03 0.00 -1.73 0.00 0.00 68.15 67.70 1llf h THR 343 CO 0.00 0.39 0.34 0.40 -0.25 0.00 0.00 175.52 176.40 1llf h ILE 344 N 0.98 1.22 -0.02 6.82 2.04 -1.83 -2.73 117.51 123.99 1llf h ILE 344 Ca 0.19 -0.63 -0.16 0.00 1.00 0.00 0.00 64.86 65.26 1llf h ILE 344 Cb 0.47 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 1llf h ILE 344 CO 0.02 0.26 -0.72 -0.26 0.00 0.00 0.00 178.15 177.46 1llf h PHE 345 N 0.99 0.16 0.00 1.37 0.04 -1.63 -2.57 116.94 115.30 1llf h PHE 345 Ca 0.24 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.94 1llf h PHE 345 Cb 0.10 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.23 1llf h PHE 345 CO 0.01 0.79 0.00 0.78 -0.60 0.00 0.00 178.31 179.29 1llf h GLY 346 N 1.85 0.00 2.00 -1.45 0.00 -0.89 -1.89 103.07 102.69 1llf h GLY 346 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1llf h GLY 346 CO 0.10 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.68 1llf n LEU 347 N -2.76 0.03 -0.12 3.11 4.77 -0.97 -2.85 117.00 118.21 1llf n LEU 347 Ca -0.01 0.51 0.13 0.00 -0.03 0.00 0.00 56.01 56.61 1llf n LEU 347 Cb 0.13 -0.50 0.46 0.00 -2.33 0.00 0.00 43.42 41.18 1llf n LEU 347 CO 0.19 -0.24 0.72 -1.20 -1.33 0.00 0.00 177.39 175.53 1llf n SER 348 N -1.53 0.61 -2.35 -1.43 7.64 -0.71 -4.12 113.62 111.73 1llf n SER 348 Ca 0.04 -0.50 -0.12 0.00 1.01 0.00 0.00 58.87 59.30 1llf n SER 348 Cb 0.19 0.03 0.04 0.00 -1.01 0.00 0.00 64.21 63.45 1llf n SER 348 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1llf n SER 349 N -1.03 3.25 0.00 6.43 3.41 -1.13 -4.17 113.62 120.37 1llf n SER 349 Ca 0.11 -2.93 0.11 0.00 -0.26 0.00 0.00 58.87 55.90 1llf n SER 349 Cb 0.32 -0.41 0.62 0.00 -0.26 0.00 0.00 64.21 64.49 1llf n SER 349 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1llf n LEU 350 N -0.64 0.00 -0.19 1.04 4.77 -1.26 -0.86 117.00 119.86 1llf n LEU 350 Ca 0.26 0.16 0.15 0.00 -0.03 0.00 0.00 56.01 56.54 1llf n LEU 350 Cb 0.89 -0.16 0.72 0.00 -2.33 0.00 0.00 43.42 42.54 1llf n LEU 350 CO 0.23 -0.04 0.97 -0.46 -1.33 0.00 0.00 177.39 176.76 1llf n ASN 351 N -1.16 0.62 -4.47 -1.43 6.94 -1.26 -4.72 115.26 109.78 1llf n ASN 351 Ca 0.14 -1.04 -0.43 0.00 -0.02 0.00 0.00 54.58 53.22 1llf n ASN 351 Cb 0.13 -0.02 -0.05 0.00 -2.36 0.00 0.00 39.78 37.48 1llf n ASN 351 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1llf s VAL 352 N -2.13 4.66 0.00 3.53 1.01 -0.04 -4.87 120.40 122.56 1llf s VAL 352 Ca 0.39 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1llf s VAL 352 Cb 0.21 -4.41 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1llf s VAL 352 CO 0.39 -0.96 0.00 0.35 0.00 0.00 0.00 175.10 174.88 1llf n THR 353 N 5.86 0.00 -4.06 3.92 -2.24 -1.26 -4.45 114.28 112.04 1llf n THR 353 Ca -0.03 -0.04 -0.23 0.00 -2.27 0.00 0.00 64.05 61.48 1llf n THR 353 Cb 0.46 0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 69.07 1llf n THR 353 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1llf s THR 354 N -1.42 2.91 0.26 4.28 -4.23 -1.26 -4.40 115.64 111.78 1llf s THR 354 Ca 0.00 -1.66 -0.04 0.00 -1.18 0.00 0.00 61.69 58.81 1llf s THR 354 Cb 0.00 -2.99 0.16 0.00 1.34 0.00 0.00 72.50 71.01 1llf s THR 354 CO 0.00 -0.14 1.81 0.78 -0.54 0.00 0.00 174.62 176.52 1llf h ASN 355 N 1.49 0.90 -0.72 3.99 2.35 -1.97 0.47 115.58 122.09 1llf h ASN 355 Ca -0.43 -0.15 -0.04 0.00 -0.55 0.00 0.00 56.30 55.12 1llf h ASN 355 Cb 1.25 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 39.36 1llf h ASN 355 CO 0.64 0.84 0.31 0.00 -1.65 0.00 0.00 177.43 177.57 1llf h ALA 356 N 1.28 1.16 -0.28 -0.83 0.00 -1.99 -0.29 119.26 118.30 1llf h ALA 356 Ca 0.21 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1llf h ALA 356 Cb 0.27 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1llf h ALA 356 CO -0.01 0.61 -0.40 1.96 0.00 0.00 0.00 179.25 181.42 1llf h GLN 357 N 1.06 0.77 -0.74 0.00 4.20 -1.86 -1.43 115.11 117.11 1llf h GLN 357 Ca 0.25 -0.45 0.00 0.00 0.06 0.00 0.00 58.65 58.51 1llf h GLN 357 Cb 0.18 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.96 1llf h GLN 357 CO -0.02 1.08 0.48 0.00 -0.67 0.00 0.00 178.83 179.69 1llf h ALA 358 N 0.68 0.93 -0.42 3.87 0.00 -0.52 -0.76 119.26 123.05 1llf h ALA 358 Ca 0.03 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1llf h ALA 358 Cb 0.99 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1llf h ALA 358 CO 0.09 0.37 0.27 -0.09 0.00 0.00 0.00 179.25 179.89 1llf h ARG 359 N 1.00 0.54 -0.70 0.00 2.43 -0.81 0.63 114.38 117.46 1llf h ARG 359 Ca 0.27 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.35 1llf h ARG 359 Cb -0.09 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.31 1llf h ARG 359 CO -0.06 0.35 0.22 0.00 -1.51 0.00 0.00 179.97 178.98 1llf h ALA 360 N 1.16 1.06 -0.36 2.80 0.00 -0.90 0.50 119.26 123.52 1llf h ALA 360 Ca 0.16 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1llf h ALA 360 Cb -0.05 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1llf h ALA 360 CO -0.04 0.64 0.14 -0.92 0.00 0.00 0.00 179.25 179.07 1llf h TYR 361 N 1.04 0.54 -0.56 0.00 3.20 -0.65 0.04 116.97 120.59 1llf h TYR 361 Ca 0.23 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 1llf h TYR 361 Cb 0.29 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.38 1llf h TYR 361 CO 0.02 0.49 0.33 0.74 -1.64 0.00 0.00 178.16 178.10 1llf h PHE 362 N 0.43 0.74 -0.31 -3.82 0.04 -0.55 -1.28 116.94 112.18 1llf h PHE 362 Ca 0.12 -0.01 -0.09 0.00 2.80 0.00 0.00 57.97 60.79 1llf h PHE 362 Cb 0.18 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.07 1llf h PHE 362 CO -0.00 0.52 -0.19 0.87 -0.60 0.00 0.00 178.31 178.90 1llf h LYS 363 N 0.75 0.57 -0.40 1.51 1.57 -0.64 0.06 116.57 119.98 1llf h LYS 363 Ca 0.20 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1llf h LYS 363 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1llf h LYS 363 CO -0.04 0.73 -0.07 0.37 -0.57 0.00 0.00 179.45 179.88 1llf h GLN 364 N 0.51 0.67 0.02 3.15 4.15 -0.78 -3.17 115.11 119.67 1llf h GLN 364 Ca 0.08 -0.19 -0.22 0.00 0.77 0.00 0.00 58.65 59.09 1llf h GLN 364 Cb 0.62 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 1llf h GLN 364 CO 0.04 0.74 -0.96 0.77 -1.93 0.00 0.00 178.83 177.49 1llf h SER 365 N 0.62 0.34 -3.10 -0.69 0.02 -0.84 -3.39 113.55 106.52 1llf h SER 365 Ca 0.12 -0.29 -0.65 0.00 -0.84 0.00 0.00 61.79 60.12 1llf h SER 365 Cb 0.49 -0.10 -0.39 0.00 0.14 0.00 0.00 62.40 62.54 1llf h SER 365 CO 0.03 1.12 -0.37 0.49 -1.14 0.00 0.00 176.83 176.95 1llf n PHE 366 N -3.64 3.63 0.31 3.45 3.72 -0.03 -4.74 117.46 120.17 1llf n PHE 366 Ca -0.05 -4.21 0.12 0.00 -0.05 0.00 0.00 57.45 53.25 1llf n PHE 366 Cb 0.86 -0.82 0.52 0.00 -0.94 0.00 0.00 39.48 39.10 1llf n PHE 366 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 1llf n ILE 367 N 1.98 0.91 1.02 4.37 -5.35 -1.25 -1.99 119.36 119.04 1llf n ILE 367 Ca 0.21 0.40 0.11 0.00 -0.27 0.00 0.00 62.75 63.20 1llf n ILE 367 Cb 0.36 -1.36 0.01 0.00 -1.74 0.00 0.00 39.64 36.91 1llf n ILE 367 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1llf n HIS 368 N -2.24 0.00 -2.77 4.28 8.25 -1.26 -4.95 115.22 116.53 1llf n HIS 368 Ca 0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.06 1llf n HIS 368 Cb 0.16 -0.06 -0.04 0.00 1.12 0.00 0.00 29.99 31.17 1llf n HIS 368 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1llf s ALA 369 N -2.89 3.25 0.84 -1.41 0.00 -0.84 -4.82 121.76 115.89 1llf s ALA 369 Ca 0.11 0.52 -0.12 0.00 0.00 0.00 0.00 51.96 52.47 1llf s ALA 369 Cb 0.17 -3.24 0.10 0.00 0.00 0.00 0.00 23.12 20.14 1llf s ALA 369 CO 0.77 -0.05 1.12 -1.54 0.00 0.00 0.00 175.76 176.06 1llf s SER 370 N 0.19 4.15 0.34 0.00 1.04 -1.26 -4.81 113.70 113.34 1llf s SER 370 Ca 0.46 1.09 0.02 0.00 0.48 0.00 0.00 55.95 58.01 1llf s SER 370 Cb -0.22 -1.74 0.61 0.00 0.10 0.00 0.00 66.02 64.76 1llf s SER 370 CO 0.28 -2.16 1.98 0.44 0.98 0.00 0.00 173.24 174.77 1llf h ASP 371 N -1.22 0.78 -0.59 7.02 3.32 -1.99 -0.55 116.42 123.20 1llf h ASP 371 Ca -0.48 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.49 1llf h ASP 371 Cb 1.30 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.64 1llf h ASP 371 CO 0.61 0.55 0.12 0.00 -1.72 0.00 0.00 179.24 178.80 1llf h ALA 372 N 1.57 1.05 -0.16 3.45 0.00 -1.99 0.95 119.26 124.12 1llf h ALA 372 Ca 0.28 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 1llf h ALA 372 Cb -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1llf h ALA 372 CO -0.07 0.62 -0.43 0.93 0.00 0.00 0.00 179.25 180.29 1llf h GLU 373 N 0.94 0.39 -0.48 0.00 5.08 -1.66 -0.44 114.58 118.41 1llf h GLU 373 Ca 0.19 -0.20 -0.13 0.00 -1.00 0.00 0.00 59.36 58.22 1llf h GLU 373 Cb 0.37 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1llf h GLU 373 CO 0.01 0.75 -0.22 0.82 -1.00 0.00 0.00 179.01 179.38 1llf h ILE 374 N 0.32 1.27 -0.43 3.13 1.08 -0.91 -0.95 117.51 121.02 1llf h ILE 374 Ca 0.02 -1.38 0.04 0.00 -0.39 0.00 0.00 64.86 63.16 1llf h ILE 374 Cb 0.90 1.12 -0.04 0.00 -3.07 0.00 0.00 36.82 35.73 1llf h ILE 374 CO 0.07 0.48 0.20 0.44 -0.69 0.00 0.00 178.15 178.65 1llf h ASP 375 N 0.85 0.28 -0.71 1.72 3.32 -0.36 0.17 116.42 121.68 1llf h ASP 375 Ca 0.11 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1llf h ASP 375 Cb 0.79 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.29 1llf h ASP 375 CO 0.07 0.20 0.37 0.74 -1.72 0.00 0.00 179.24 178.90 1llf h THR 376 N 0.41 1.23 -0.21 0.35 2.02 -0.94 -0.61 112.91 115.15 1llf h THR 376 Ca 0.19 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 66.77 1llf h THR 376 Cb 0.12 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 1llf h THR 376 CO -0.15 0.26 0.12 0.25 0.37 0.00 0.00 175.52 176.37 1llf h LEU 377 N 0.99 0.26 -0.76 2.58 5.85 -0.77 -1.76 115.31 121.70 1llf h LEU 377 Ca 0.25 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1llf h LEU 377 Cb 0.07 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1llf h LEU 377 CO -0.04 0.25 0.00 0.24 -0.34 0.00 0.00 178.44 178.55 1llf h MET 378 N 0.25 0.00 -0.18 1.25 2.86 -0.62 -0.09 114.93 118.40 1llf h MET 378 Ca 0.07 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.51 1llf h MET 378 Cb 0.04 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.71 1llf h MET 378 CO -0.01 0.00 -0.69 0.00 1.06 0.00 0.00 176.91 177.26 1llf h ALA 379 N 2.04 0.33 -0.06 6.32 0.00 -0.97 -3.26 119.26 123.66 1llf h ALA 379 Ca 0.00 -0.57 -0.16 0.00 0.00 0.00 0.00 54.91 54.18 1llf h ALA 379 Cb 0.72 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1llf h ALA 379 CO 0.00 0.65 -0.67 0.00 0.00 0.00 0.00 179.25 179.23 1llf h ALA 380 N 0.58 0.75 -3.08 0.00 0.00 -0.85 -3.34 119.26 113.31 1llf h ALA 380 Ca -0.03 -0.59 -0.65 0.00 0.00 0.00 0.00 54.91 53.64 1llf h ALA 380 Cb 1.32 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 18.63 1llf h ALA 380 CO 0.15 0.77 -0.44 0.71 0.00 0.00 0.00 179.25 180.43 1llf s TYR 381 N -3.63 3.58 0.80 0.00 2.02 -0.09 -4.53 117.35 115.50 1llf s TYR 381 Ca -0.04 -3.18 -0.12 0.00 -0.37 0.00 0.00 57.07 53.36 1llf s TYR 381 Cb 0.11 -2.91 0.07 0.00 -0.40 0.00 0.00 41.96 38.84 1llf s TYR 381 CO 0.81 -0.65 1.13 -1.25 -1.57 0.00 0.00 175.55 174.01 1llf s PRO 382 N -1.12 2.04 0.25 -1.71 0.04 -1.23 -4.56 135.00 128.71 1llf s PRO 382 Ca 0.23 0.39 -0.05 0.00 0.04 0.00 0.00 61.00 61.62 1llf s PRO 382 Cb -0.10 -1.93 0.28 0.00 0.04 0.00 0.00 34.50 32.78 1llf s PRO 382 CO -0.12 -1.59 1.80 0.37 0.04 0.00 0.00 177.00 177.50 1llf h GLN 383 N -1.06 1.02 -2.43 4.56 -0.00 -1.91 -3.45 115.11 111.84 1llf h GLN 383 Ca -0.47 -0.20 -0.29 0.00 -0.00 0.00 0.00 58.65 57.69 1llf h GLN 383 Cb 1.29 -0.16 -0.02 0.00 0.00 0.00 0.00 27.48 28.59 1llf h GLN 383 CO 0.63 0.86 0.62 -3.47 0.00 0.00 0.00 178.83 177.47 1llf n ASP 384 N -4.27 0.26 0.32 -0.69 -0.08 -1.26 -4.77 116.55 106.05 1llf n ASP 384 Ca 0.06 0.23 0.19 0.00 -1.51 0.00 0.00 54.79 53.76 1llf n ASP 384 Cb 0.21 -0.39 1.05 0.00 2.34 0.00 0.00 41.12 44.33 1llf n ASP 384 CO 0.00 0.00 0.00 0.16 0.12 0.00 0.00 177.20 177.48 1llf h ILE 385 N 3.11 0.19 0.00 5.18 3.07 -1.87 -1.18 117.51 126.01 1llf h ILE 385 Ca -0.04 -0.11 -0.01 0.00 1.55 0.00 0.00 64.86 66.26 1llf h ILE 385 Cb 0.59 1.09 -0.00 0.00 -0.27 0.00 0.00 36.82 38.23 1llf h ILE 385 CO 0.50 0.01 -0.03 0.71 -1.05 0.00 0.00 178.15 178.30 1llf h THR 386 N 0.00 0.06 -0.00 0.16 1.35 -1.86 -3.21 112.91 109.41 1llf h THR 386 Ca -0.00 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 65.17 1llf h THR 386 Cb 0.08 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.15 1llf h THR 386 CO 0.00 0.02 -0.53 0.00 -0.25 0.00 0.00 175.52 174.77 1llf n GLN 387 N -3.12 0.45 -0.66 4.72 6.02 -0.44 -4.32 117.38 120.03 1llf n GLN 387 Ca 0.01 -0.32 0.00 0.00 -0.01 0.00 0.00 57.00 56.69 1llf n GLN 387 Cb 0.37 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.13 1llf n GLN 387 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1llf n GLY 388 N 1.44 0.91 3.74 1.08 0.00 -1.21 -4.93 105.19 106.21 1llf n GLY 388 Ca 0.08 -1.98 -0.35 0.00 0.00 0.00 0.00 46.02 43.77 1llf n GLY 388 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1llf s SER 389 N -1.00 6.07 0.05 1.61 0.15 -0.35 -3.20 113.70 117.03 1llf s SER 389 Ca 0.00 0.24 -0.30 0.00 0.70 0.00 0.00 55.95 56.59 1llf s SER 389 Cb 0.00 -2.03 -0.09 0.00 -1.71 0.00 0.00 66.02 62.19 1llf s SER 389 CO 0.00 0.23 1.86 -2.84 1.20 0.00 0.00 173.24 173.69 1llf s PRO 390 N 0.02 4.15 0.59 5.44 0.02 -1.26 -4.27 135.00 139.68 1llf s PRO 390 Ca 0.08 2.53 -0.19 0.00 0.02 0.00 0.00 61.00 63.44 1llf s PRO 390 Cb -0.12 -3.93 -0.04 0.00 0.02 0.00 0.00 34.50 30.43 1llf s PRO 390 CO -0.00 -0.89 1.20 -0.06 -0.33 0.00 0.00 177.00 176.92 1llf s PHE 391 N 3.77 2.42 -1.24 6.54 0.08 -1.20 -3.40 117.98 124.96 1llf s PHE 391 Ca 0.83 1.52 -0.02 0.00 0.12 0.00 0.00 56.93 59.38 1llf s PHE 391 Cb -0.42 -3.47 0.00 0.00 -0.57 0.00 0.00 43.02 38.56 1llf s PHE 391 CO 0.38 -2.16 0.20 -0.25 -0.10 0.00 0.00 175.22 173.29 1llf n ASP 392 N -1.54 -4.75 -0.40 1.36 8.00 -1.26 -4.91 116.55 113.04 1llf n ASP 392 Ca 0.13 -0.10 0.06 0.00 0.71 0.00 0.00 54.79 55.59 1llf n ASP 392 Cb 0.50 -3.76 0.13 0.00 -0.02 0.00 0.00 41.12 37.97 1llf n ASP 392 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1llf n THR 393 N -4.09 1.51 -1.01 -3.53 -2.24 -1.22 -5.06 114.28 98.65 1llf n THR 393 Ca -0.14 -1.50 0.00 0.00 -2.27 0.00 0.00 64.05 60.14 1llf n THR 393 Cb 0.62 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 1llf n THR 393 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1llf n GLY 394 N -0.45 3.49 0.37 3.38 0.00 -1.26 -1.29 105.19 109.43 1llf n GLY 394 Ca 0.12 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.11 1llf n GLY 394 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1llf n ILE 395 N 0.00 0.07 -1.48 -0.61 -5.35 -1.26 -3.52 119.36 107.21 1llf n ILE 395 Ca 0.00 -0.21 -0.31 0.00 -0.27 0.00 0.00 62.75 61.96 1llf n ILE 395 Cb 0.00 0.20 0.08 0.00 -1.74 0.00 0.00 39.64 38.17 1llf n ILE 395 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1llf s PHE 396 N -1.93 2.85 -0.76 4.28 0.08 -0.41 -4.13 117.98 117.97 1llf s PHE 396 Ca 0.36 1.34 0.00 0.00 0.12 0.00 0.00 56.93 58.75 1llf s PHE 396 Cb 0.19 -3.01 0.00 0.00 -0.57 0.00 0.00 43.02 39.62 1llf s PHE 396 CO 0.30 -1.62 0.00 0.09 -0.10 0.00 0.00 175.22 173.89 1llf n ASN 397 N -3.37 -4.17 -3.67 1.36 3.02 -1.26 -4.92 115.26 102.26 1llf n ASN 397 Ca 0.08 0.18 -0.41 0.00 -0.03 0.00 0.00 54.58 54.39 1llf n ASN 397 Cb 0.54 -2.30 -0.00 0.00 -0.61 0.00 0.00 39.78 37.41 1llf n ASN 397 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1llf n ALA 398 N 1.13 5.94 -0.28 5.41 0.00 -1.26 -4.71 120.51 126.75 1llf n ALA 398 Ca -0.07 -3.91 0.01 0.00 0.00 0.00 0.00 53.44 49.47 1llf n ALA 398 Cb 0.29 -3.37 0.14 0.00 0.00 0.00 0.00 19.45 16.50 1llf n ALA 398 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1llf h ILE 399 N 3.71 0.95 -4.32 0.00 2.04 -1.96 -3.43 117.51 114.50 1llf h ILE 399 Ca 0.60 -0.27 -0.25 0.00 1.00 0.00 0.00 64.86 65.94 1llf h ILE 399 Cb 0.56 0.09 -0.15 0.00 -0.74 0.00 0.00 36.82 36.58 1llf h ILE 399 CO 1.81 0.14 -0.63 0.42 0.00 0.00 0.00 178.15 179.89 1llf s THR 400 N -6.06 0.20 -0.71 -0.27 -4.23 -1.26 -5.04 115.64 98.27 1llf s THR 400 Ca -0.13 -1.97 0.16 0.00 -1.18 0.00 0.00 61.69 58.57 1llf s THR 400 Cb 0.18 -2.35 0.15 0.00 1.34 0.00 0.00 72.50 71.82 1llf s THR 400 CO 0.78 -0.19 1.48 -2.65 -0.54 0.00 0.00 174.62 173.50 1llf n PRO 401 N -0.25 0.08 -0.00 3.99 -0.02 -1.26 -3.36 135.00 134.19 1llf n PRO 401 Ca -0.01 0.41 0.04 0.00 -2.02 0.00 0.00 63.50 61.92 1llf n PRO 401 Cb 0.65 -1.69 -0.05 0.00 -0.02 0.00 0.00 33.50 32.39 1llf n PRO 401 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1llf n GLN 402 N -1.84 3.95 0.00 -0.52 1.13 -1.26 -4.79 117.38 114.05 1llf n GLN 402 Ca 0.02 -0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 54.96 1llf n GLN 402 Cb 0.13 -0.92 -0.05 0.00 0.11 0.00 0.00 30.24 29.51 1llf n GLN 402 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 1llf h PHE 403 N 0.00 0.10 -0.16 1.08 3.57 -1.83 0.37 116.94 120.07 1llf h PHE 403 Ca 0.00 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.39 1llf h PHE 403 Cb 0.21 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1llf h PHE 403 CO 0.00 0.06 -0.40 0.87 -2.23 0.00 0.00 178.31 176.61 1llf h LYS 404 N 0.11 0.36 -0.16 1.11 1.57 -1.81 -0.55 116.57 117.21 1llf h LYS 404 Ca 0.03 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1llf h LYS 404 Cb -0.01 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1llf h LYS 404 CO -0.02 0.71 0.03 -0.09 -0.57 0.00 0.00 179.45 179.51 1llf h ARG 405 N 0.30 0.26 -0.42 3.15 2.43 -1.71 -0.62 114.38 117.78 1llf h ARG 405 Ca 0.03 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 1llf h ARG 405 Cb 0.84 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 1llf h ARG 405 CO 0.07 0.44 0.03 0.82 -1.51 0.00 0.00 179.97 179.82 1llf h ILE 406 N 0.04 1.25 -0.73 1.20 2.04 -0.84 -1.61 117.51 118.87 1llf h ILE 406 Ca 0.05 -0.96 0.03 0.00 1.00 0.00 0.00 64.86 64.98 1llf h ILE 406 Cb 0.30 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 1llf h ILE 406 CO 0.00 0.33 0.46 0.28 0.00 0.00 0.00 178.15 179.22 1llf h SER 407 N 0.56 0.75 -0.49 1.72 0.02 -1.10 -0.57 113.55 114.45 1llf h SER 407 Ca 0.12 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1llf h SER 407 Cb 0.43 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1llf h SER 407 CO 0.02 0.52 0.26 0.00 -1.14 0.00 0.00 176.83 176.49 1llf h ALA 408 N 1.31 0.62 -0.13 3.77 0.00 -0.74 -0.80 119.26 123.29 1llf h ALA 408 Ca 0.29 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1llf h ALA 408 Cb 0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1llf h ALA 408 CO -0.11 0.16 0.05 0.28 0.00 0.00 0.00 179.25 179.63 1llf h VAL 409 N 0.64 1.14 -0.52 0.00 2.07 -0.94 -1.31 116.25 117.34 1llf h VAL 409 Ca 0.17 -0.42 0.03 0.00 0.82 0.00 0.00 66.70 67.30 1llf h VAL 409 Cb 0.06 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 1llf h VAL 409 CO -0.03 0.13 0.29 -0.07 0.02 0.00 0.00 177.57 177.92 1llf h LEU 410 N 0.06 0.46 -0.70 2.57 3.38 -0.95 -1.37 115.31 118.75 1llf h LEU 410 Ca 0.04 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 1llf h LEU 410 Cb 0.16 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1llf h LEU 410 CO -0.00 0.32 0.22 1.23 0.09 0.00 0.00 178.44 180.29 1llf h GLY 411 N 0.58 1.17 0.95 0.83 0.00 -1.02 -1.88 103.07 103.70 1llf h GLY 411 Ca 0.22 -0.70 -0.18 0.00 0.00 0.00 0.00 47.33 46.67 1llf h GLY 411 CO -0.12 0.65 -0.69 -0.55 0.00 0.00 0.00 176.54 175.83 1llf h ASP 412 N 1.03 0.69 -0.09 0.19 5.19 -0.91 -0.84 116.42 121.68 1llf h ASP 412 Ca 0.23 -0.71 -0.06 0.00 -0.62 0.00 0.00 57.03 55.87 1llf h ASP 412 Cb 0.30 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.61 1llf h ASP 412 CO -0.01 1.30 -0.16 0.25 -3.12 0.00 0.00 179.24 177.50 1llf h LEU 413 N 0.15 0.30 -0.59 1.55 5.85 -1.27 0.55 115.31 121.85 1llf h LEU 413 Ca -0.07 -0.55 -0.15 0.00 0.84 0.00 0.00 57.88 57.94 1llf h LEU 413 Cb 1.36 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 1llf h LEU 413 CO 0.14 0.79 -0.69 0.00 -0.34 0.00 0.00 178.44 178.34 1llf h ALA 414 N 0.51 0.82 0.00 1.25 0.00 -1.46 -3.38 119.26 117.00 1llf h ALA 414 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1llf h ALA 414 Cb 0.74 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1llf h ALA 414 CO 0.04 0.84 -0.03 1.19 0.00 0.00 0.00 179.25 181.28 1llf n PHE 415 N -3.74 -1.78 -0.01 0.00 3.72 -0.73 -4.53 117.46 110.39 1llf n PHE 415 Ca -0.02 0.31 -0.16 0.00 -0.05 0.00 0.00 57.45 57.54 1llf n PHE 415 Cb 0.68 0.46 -0.12 0.00 -0.94 0.00 0.00 39.48 39.56 1llf n PHE 415 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1llf h ILE 416 N 0.00 1.53 0.00 4.37 2.04 -1.13 -0.94 117.51 123.38 1llf h ILE 416 Ca 0.00 -2.07 -0.11 0.00 1.00 0.00 0.00 64.86 63.67 1llf h ILE 416 Cb 0.03 2.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.92 1llf h ILE 416 CO 0.00 0.58 -0.59 0.45 0.00 0.00 0.00 178.15 178.59 1llf h HIS 417 N -0.43 0.00 -0.51 1.37 3.86 -1.12 -2.67 115.15 115.65 1llf h HIS 417 Ca -0.05 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.19 1llf h HIS 417 Cb 1.15 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.58 1llf h HIS 417 CO 0.18 0.52 0.28 0.00 0.86 0.00 0.00 177.93 179.77 1llf h ALA 418 N 1.48 0.65 -0.52 2.45 0.00 -1.51 -0.05 119.26 121.76 1llf h ALA 418 Ca -0.02 0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1llf h ALA 418 Cb 1.41 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.05 1llf h ALA 418 CO 0.07 -0.04 0.28 -0.09 0.00 0.00 0.00 179.25 179.46 1llf h ARG 419 N 0.55 0.53 -0.80 0.00 2.43 -1.10 -0.67 114.38 115.33 1llf h ARG 419 Ca 0.21 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 1llf h ARG 419 Cb 0.08 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.47 1llf h ARG 419 CO -0.12 0.35 0.33 -0.09 -1.51 0.00 0.00 179.97 178.92 1llf h ARG 420 N 0.54 1.18 -0.07 0.20 2.43 -1.06 -0.34 114.38 117.26 1llf h ARG 420 Ca 0.22 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1llf h ARG 420 Cb 0.10 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1llf h ARG 420 CO -0.14 0.95 0.04 -0.92 -1.51 0.00 0.00 179.97 178.39 1llf h TYR 421 N 1.15 0.07 -0.23 2.20 5.03 -0.67 -0.68 116.97 123.85 1llf h TYR 421 Ca 0.27 0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.63 1llf h TYR 421 Cb 0.20 -0.02 -0.06 0.00 1.55 0.00 0.00 36.73 38.40 1llf h TYR 421 CO 0.02 0.04 -0.13 0.35 -1.32 0.00 0.00 178.16 177.12 1llf h PHE 422 N 0.08 -0.32 -0.52 -3.82 3.57 -0.64 -2.10 116.94 113.19 1llf h PHE 422 Ca 0.03 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 1llf h PHE 422 Cb -0.00 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 1llf h PHE 422 CO -0.08 -0.20 0.16 -0.07 -2.23 0.00 0.00 178.31 175.90 1llf h LEU 423 N -0.11 0.71 -0.89 0.59 3.38 -0.79 0.23 115.31 118.42 1llf h LEU 423 Ca 0.13 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1llf h LEU 423 Cb 0.30 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1llf h LEU 423 CO -0.30 0.67 -0.37 0.78 0.09 0.00 0.00 178.44 179.32 1llf h ASN 424 N 0.75 0.00 0.00 -0.43 2.35 -0.65 -3.33 115.58 114.27 1llf h ASN 424 Ca 0.17 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.68 1llf h ASN 424 Cb 0.22 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.55 1llf h ASN 424 CO -0.01 0.37 -2.02 1.41 -1.65 0.00 0.00 177.43 175.53 1llf n HIS 425 N -3.49 0.00 -2.27 1.19 8.25 -0.83 -4.96 115.22 113.10 1llf n HIS 425 Ca -0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 1llf n HIS 425 Cb 0.52 -0.71 -0.03 0.00 1.12 0.00 0.00 29.99 30.89 1llf n HIS 425 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1llf s PHE 426 N -2.49 2.65 -0.14 4.41 5.36 0.75 -4.87 117.98 123.64 1llf s PHE 426 Ca -0.07 0.77 0.18 0.00 -0.96 0.00 0.00 56.93 56.84 1llf s PHE 426 Cb 0.05 -3.64 0.32 0.00 -0.34 0.00 0.00 43.02 39.41 1llf s PHE 426 CO 0.65 -2.41 1.17 1.04 -1.46 0.00 0.00 175.22 174.21 1llf n GLN 427 N 6.32 1.39 0.17 10.12 1.13 -1.26 -4.77 117.38 130.48 1llf n GLN 427 Ca 0.14 -2.70 0.13 0.00 -1.94 0.00 0.00 57.00 52.64 1llf n GLN 427 Cb 0.44 -1.53 0.38 0.00 0.11 0.00 0.00 30.24 29.64 1llf n GLN 427 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1llf h GLY 428 N 0.22 0.00 -2.31 1.08 0.00 -1.85 -3.48 103.07 96.73 1llf h GLY 428 Ca 0.00 0.00 0.40 0.00 0.00 0.00 0.00 47.33 47.73 1llf h GLY 428 CO 0.01 0.00 0.99 -0.32 0.00 0.00 0.00 176.54 177.22 1llf s GLY 429 N -3.87 -0.30 0.33 4.60 0.00 -1.22 -2.53 107.32 104.34 1llf s GLY 429 Ca 0.07 0.40 -0.29 0.00 0.00 0.00 0.00 44.72 44.91 1llf s GLY 429 CO 0.58 4.55 1.40 2.41 0.00 0.00 0.00 173.10 182.04 1llf n THR 430 N -0.81 1.76 -5.04 0.90 -1.04 -1.26 -4.75 114.28 104.02 1llf n THR 430 Ca 0.01 -0.44 -0.32 0.00 -2.04 0.00 0.00 64.05 61.26 1llf n THR 430 Cb 0.60 -1.73 -0.14 0.00 -1.82 0.00 0.00 70.33 67.24 1llf n THR 430 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1llf s LYS 431 N -1.61 2.36 -0.01 -2.82 1.02 -1.26 -1.26 119.74 116.16 1llf s LYS 431 Ca 0.57 -0.78 0.05 0.00 0.02 0.00 0.00 55.97 55.83 1llf s LYS 431 Cb -0.54 -2.25 -0.01 0.00 -0.52 0.00 0.00 37.83 34.50 1llf s LYS 431 CO 0.60 0.60 -0.15 0.71 -0.92 0.00 0.00 175.35 176.18 1llf s TYR 432 N -0.69 1.38 0.03 3.18 2.02 -0.36 -0.89 117.35 122.03 1llf s TYR 432 Ca 0.11 -0.26 0.03 0.00 -0.37 0.00 0.00 57.07 56.58 1llf s TYR 432 Cb -0.10 -0.89 -0.02 0.00 -0.40 0.00 0.00 41.96 40.55 1llf s TYR 432 CO -0.00 -0.02 -0.10 0.45 -1.57 0.00 0.00 175.55 174.31 1llf s SER 433 N -0.40 1.18 0.15 2.29 0.15 -1.26 -1.00 113.70 114.81 1llf s SER 433 Ca 0.06 -0.41 0.06 0.00 0.70 0.00 0.00 55.95 56.36 1llf s SER 433 Cb -0.06 -0.05 -0.04 0.00 -1.71 0.00 0.00 66.02 64.16 1llf s SER 433 CO -0.01 -0.04 -0.14 0.72 1.20 0.00 0.00 173.24 174.98 1llf s PHE 434 N -0.87 1.48 -0.06 3.44 -0.12 -1.10 -1.39 117.98 119.36 1llf s PHE 434 Ca -0.02 -0.58 -0.02 0.00 -0.05 0.00 0.00 56.93 56.26 1llf s PHE 434 Cb -0.07 -0.75 0.03 0.00 -0.63 0.00 0.00 43.02 41.60 1llf s PHE 434 CO 0.01 0.20 0.03 -1.17 -0.05 0.00 0.00 175.22 174.23 1llf s LEU 435 N -2.76 0.43 -0.08 -1.99 2.96 -0.18 -1.72 118.68 115.35 1llf s LEU 435 Ca 0.14 -0.01 -0.14 0.00 -0.22 0.00 0.00 54.13 53.89 1llf s LEU 435 Cb -0.03 -0.31 -0.05 0.00 0.50 0.00 0.00 46.19 46.30 1llf s LEU 435 CO 0.04 -0.21 0.37 -0.55 -1.32 0.00 0.00 176.35 174.67 1llf s SER 436 N 2.01 6.65 -0.18 3.68 0.15 0.22 -2.50 113.70 123.72 1llf s SER 436 Ca 0.04 0.77 0.13 0.00 0.70 0.00 0.00 55.95 57.59 1llf s SER 436 Cb -0.12 -2.22 0.43 0.00 -1.71 0.00 0.00 66.02 62.39 1llf s SER 436 CO -0.04 0.21 1.21 0.29 1.20 0.00 0.00 173.24 176.11 1llf n LYS 437 N 2.66 1.50 0.14 5.44 5.02 0.13 -1.02 118.16 132.03 1llf n LYS 437 Ca -0.13 -3.18 0.06 0.00 -2.02 0.00 0.00 58.31 53.05 1llf n LYS 437 Cb 0.52 -1.42 0.54 0.00 -0.02 0.00 0.00 35.03 34.65 1llf n LYS 437 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1llf h GLN 438 N 1.11 0.26 -0.43 1.97 4.15 -1.79 -2.61 115.11 117.78 1llf h GLN 438 Ca -0.01 -0.02 -0.16 0.00 0.77 0.00 0.00 58.65 59.24 1llf h GLN 438 Cb 1.18 -0.06 -0.09 0.00 0.21 0.00 0.00 27.48 28.72 1llf h GLN 438 CO 0.08 0.17 0.06 1.28 -1.93 0.00 0.00 178.83 178.49 1llf n LEU 439 N -4.51 4.54 -4.62 -2.39 4.77 -1.26 -3.51 117.00 110.02 1llf n LEU 439 Ca -0.00 -3.44 -0.48 0.00 -0.03 0.00 0.00 56.01 52.06 1llf n LEU 439 Cb 0.08 -0.64 -0.04 0.00 -2.33 0.00 0.00 43.42 40.49 1llf n LEU 439 CO 0.35 0.99 0.91 -1.20 -1.33 0.00 0.00 177.39 177.11 1llf n SER 440 N -0.80 2.07 0.00 -1.43 7.64 -0.98 -1.36 113.62 118.75 1llf n SER 440 Ca 0.33 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.33 1llf n SER 440 Cb 1.09 -1.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1llf n SER 440 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1llf n GLY 441 N 2.39 1.90 3.64 0.23 0.00 -1.26 -5.04 105.19 107.05 1llf n GLY 441 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1llf n GLY 441 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1llf s LEU 442 N 0.00 4.01 0.41 0.99 2.96 -0.47 -4.89 118.68 121.69 1llf s LEU 442 Ca 0.00 2.15 -0.26 0.00 -0.22 0.00 0.00 54.13 55.80 1llf s LEU 442 Cb 0.00 -3.53 -0.10 0.00 0.50 0.00 0.00 46.19 43.06 1llf s LEU 442 CO 0.00 -1.36 1.32 -2.65 -1.32 0.00 0.00 176.35 172.35 1llf n PRO 443 N 7.89 2.09 0.00 0.98 -0.02 -1.26 -1.14 135.00 143.54 1llf n PRO 443 Ca 0.22 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 1llf n PRO 443 Cb 0.43 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1llf n PRO 443 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1llf n ILE 444 N -0.05 0.00 -0.02 4.25 5.41 -1.26 -4.32 119.36 123.37 1llf n ILE 444 Ca 0.05 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 63.72 1llf n ILE 444 Cb 0.39 0.00 -0.14 0.00 -0.71 0.00 0.00 39.64 39.18 1llf n ILE 444 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 176.55 176.78 1llf n MET 445 N 0.00 0.63 0.00 0.38 2.81 -1.23 -4.46 117.12 115.25 1llf n MET 445 Ca 0.00 0.30 0.00 0.00 -1.81 0.00 0.00 57.70 56.19 1llf n MET 445 Cb 0.00 -1.80 0.00 0.00 -0.71 0.00 0.00 33.22 30.71 1llf n MET 445 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1llf n GLY 446 N 1.55 1.75 3.49 3.03 0.00 -0.29 -3.67 105.19 111.05 1llf n GLY 446 Ca -0.17 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 44.92 1llf n GLY 446 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1llf s THR 447 N 0.00 4.51 0.55 2.61 2.01 -1.26 -4.70 115.64 119.37 1llf s THR 447 Ca 0.00 -1.55 -0.06 0.00 0.31 0.00 0.00 61.69 60.39 1llf s THR 447 Cb 0.00 -4.91 -0.01 0.00 0.01 0.00 0.00 72.50 67.59 1llf s THR 447 CO 0.00 -1.68 0.87 0.72 -0.69 0.00 0.00 174.62 173.83 1llf s PHE 448 N 3.25 3.39 0.13 4.92 -0.12 -1.24 -0.98 117.98 127.33 1llf s PHE 448 Ca 0.40 0.75 -0.34 0.00 -0.05 0.00 0.00 56.93 57.68 1llf s PHE 448 Cb -0.02 -2.58 -0.14 0.00 -0.63 0.00 0.00 43.02 39.65 1llf s PHE 448 CO -0.07 -0.62 1.57 1.58 -0.05 0.00 0.00 175.22 177.63 1llf n HIS 449 N -2.48 2.17 -0.96 3.49 -0.00 -1.25 -2.03 115.22 114.16 1llf n HIS 449 Ca 0.03 0.30 0.00 0.00 -0.00 0.00 0.00 57.72 58.06 1llf n HIS 449 Cb 0.56 -2.52 0.00 0.00 -0.00 0.00 0.00 29.99 28.03 1llf n HIS 449 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1llf n ALA 450 N 3.54 0.00 0.26 1.57 0.00 -1.26 -4.89 120.51 119.73 1llf n ALA 450 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.72 1llf n ALA 450 Cb 0.27 -0.25 0.69 0.00 0.00 0.00 0.00 19.45 20.16 1llf n ALA 450 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1llf h ASN 451 N 0.00 0.00 -0.20 0.00 7.08 -1.79 -1.54 115.58 119.13 1llf h ASN 451 Ca 0.00 0.00 0.06 0.00 -3.08 0.00 0.00 56.30 53.28 1llf h ASN 451 Cb 0.11 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.35 1llf h ASN 451 CO 0.00 0.11 0.17 -2.24 -2.08 0.00 0.00 177.43 173.39 1llf h ASP 452 N 0.00 0.00 -0.94 6.14 2.03 -1.90 -0.35 116.42 121.40 1llf h ASP 452 Ca -0.00 0.00 0.02 0.00 -0.73 0.00 0.00 57.03 56.32 1llf h ASP 452 Cb 0.25 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.70 1llf h ASP 452 CO 0.01 0.00 0.62 0.40 -1.03 0.00 0.00 179.24 179.24 1llf h ILE 453 N 0.00 1.20 -0.19 4.15 1.08 -1.69 -0.64 117.51 121.42 1llf h ILE 453 Ca 0.09 -0.42 0.03 0.00 -0.39 0.00 0.00 64.86 64.17 1llf h ILE 453 Cb 0.43 -0.14 -0.03 0.00 -3.07 0.00 0.00 36.82 34.02 1llf h ILE 453 CO -0.00 0.22 0.01 0.58 -0.69 0.00 0.00 178.15 178.27 1llf h VAL 454 N 1.23 0.88 0.00 1.67 2.07 -1.19 -0.65 116.25 120.26 1llf h VAL 454 Ca 0.36 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.85 1llf h VAL 454 Cb -0.08 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1llf h VAL 454 CO -0.10 0.01 0.00 0.79 0.02 0.00 0.00 177.57 178.30 1llf n TRP 455 N -5.12 0.14 -0.04 1.57 7.02 -0.97 -0.65 117.44 119.39 1llf n TRP 455 Ca -0.03 0.04 -0.16 0.00 -1.02 0.00 0.00 57.50 56.34 1llf n TRP 455 Cb 0.10 -0.57 -0.14 0.00 -2.42 0.00 0.00 31.31 28.28 1llf n TRP 455 CO 0.00 0.00 0.00 0.94 -2.02 0.00 0.00 177.69 176.61 1llf n GLN 456 N -1.62 0.70 0.00 -0.99 7.27 -0.28 -4.29 117.38 118.17 1llf n GLN 456 Ca 0.07 0.22 0.00 0.00 0.07 0.00 0.00 57.00 57.36 1llf n GLN 456 Cb 0.35 -1.68 0.00 0.00 2.41 0.00 0.00 30.24 31.32 1llf n GLN 456 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1llf n ASP 457 N -3.23 4.16 0.00 1.69 8.00 -0.28 -4.21 116.55 122.69 1llf n ASP 457 Ca -0.30 -0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.14 1llf n ASP 457 Cb 1.05 0.95 0.00 0.00 -0.02 0.00 0.00 41.12 43.11 1llf n ASP 457 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1llf n TYR 458 N -1.37 0.00 -4.07 1.24 4.01 0.18 -4.64 117.16 112.51 1llf n TYR 458 Ca 0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.65 1llf n TYR 458 Cb 0.00 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 38.93 1llf n TYR 458 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1llf s LEU 459 N -4.80 2.40 -0.14 7.72 1.43 -0.07 -5.04 118.68 120.19 1llf s LEU 459 Ca 0.00 -0.82 -0.21 0.00 -1.03 0.00 0.00 54.13 52.07 1llf s LEU 459 Cb 0.00 0.10 -0.03 0.00 0.03 0.00 0.00 46.19 46.29 1llf s LEU 459 CO 0.00 -0.46 0.61 -0.22 0.23 0.00 0.00 176.35 176.51 1llf s LEU 460 N -2.40 4.23 0.00 1.79 2.96 -1.26 -4.15 118.68 119.84 1llf s LEU 460 Ca -0.00 0.94 0.03 0.00 -0.22 0.00 0.00 54.13 54.87 1llf s LEU 460 Cb 0.01 -2.89 -0.01 0.00 0.50 0.00 0.00 46.19 43.80 1llf s LEU 460 CO -0.06 -0.15 0.39 0.61 -1.32 0.00 0.00 176.35 175.82 1llf n GLY 461 N 3.44 2.50 0.35 7.98 0.00 -1.26 -5.02 105.19 113.18 1llf n GLY 461 Ca -0.03 -1.75 0.07 0.00 0.00 0.00 0.00 46.02 44.31 1llf n GLY 461 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1llf h SER 462 N 1.99 0.64 0.95 1.61 4.64 -1.87 -1.16 113.55 120.35 1llf h SER 462 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1llf h SER 462 Cb 1.18 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1llf h SER 462 CO 0.35 0.41 0.00 0.61 -0.87 0.00 0.00 176.83 177.33 1llf n GLY 463 N -1.45 -1.40 0.29 -0.77 0.00 -1.26 -3.09 105.19 97.50 1llf n GLY 463 Ca 0.10 0.04 0.17 0.00 0.00 0.00 0.00 46.02 46.33 1llf n GLY 463 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1llf h SER 464 N 0.00 0.00 0.80 1.61 0.02 -1.39 0.10 113.55 114.69 1llf h SER 464 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1llf h SER 464 Cb 0.48 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.01 1llf h SER 464 CO 0.00 0.05 -0.09 -0.37 -1.14 0.00 0.00 176.83 175.28 1llf h VAL 465 N 0.00 0.25 0.00 2.27 -1.51 -1.72 0.75 116.25 116.29 1llf h VAL 465 Ca -0.00 -0.65 -0.10 0.00 -1.23 0.00 0.00 66.70 64.72 1llf h VAL 465 Cb 0.21 1.51 -0.02 0.00 -2.13 0.00 0.00 31.29 30.87 1llf h VAL 465 CO 0.01 0.08 -0.75 0.40 -1.23 0.00 0.00 177.57 176.08 1llf h ILE 466 N 0.00 0.56 0.00 7.19 1.08 -1.26 0.33 117.51 125.41 1llf h ILE 466 Ca -0.00 -1.64 -0.03 0.00 -0.39 0.00 0.00 64.86 62.80 1llf h ILE 466 Cb 0.51 1.28 -0.00 0.00 -3.07 0.00 0.00 36.82 35.53 1llf h ILE 466 CO 0.01 0.19 -0.13 1.88 -0.69 0.00 0.00 178.15 179.41 1llf h TYR 467 N -1.00 0.00 0.00 1.37 0.05 -1.17 -2.44 116.97 113.78 1llf h TYR 467 Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.62 1llf h TYR 467 Cb 0.86 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.60 1llf h TYR 467 CO -0.02 0.13 0.00 0.09 -1.05 0.00 0.00 178.16 177.32 1llf n ASN 468 N -3.34 0.00 0.06 3.88 3.02 0.24 -4.64 115.26 114.48 1llf n ASN 468 Ca -0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.44 1llf n ASN 468 Cb 0.35 -0.11 -0.05 0.00 -0.61 0.00 0.00 39.78 39.36 1llf n ASN 468 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1llf h ASN 469 N 0.00 -0.54 -0.56 6.41 4.21 -1.38 -0.20 115.58 123.52 1llf h ASN 469 Ca 0.00 0.08 -0.09 0.00 1.21 0.00 0.00 56.30 57.50 1llf h ASN 469 Cb 0.00 0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 37.40 1llf h ASN 469 CO 0.00 -0.25 0.02 0.00 -1.29 0.00 0.00 177.43 175.90 1llf h ALA 470 N 0.59 0.92 -0.45 -0.83 0.00 -0.78 -0.43 119.26 118.28 1llf h ALA 470 Ca 0.05 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 1llf h ALA 470 Cb 0.37 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1llf h ALA 470 CO -0.17 0.65 -0.08 0.74 0.00 0.00 0.00 179.25 180.39 1llf h PHE 471 N 0.93 0.86 -0.29 0.00 -1.00 -0.94 0.34 116.94 116.84 1llf h PHE 471 Ca 0.17 -0.15 -0.02 0.00 2.81 0.00 0.00 57.97 60.79 1llf h PHE 471 Cb 0.52 -0.22 -0.01 0.00 3.61 0.00 0.00 35.95 39.84 1llf h PHE 471 CO 0.03 0.83 0.10 0.82 -1.61 0.00 0.00 178.31 178.49 1llf h ILE 472 N 0.72 1.19 -0.67 -0.55 2.04 -0.64 0.32 117.51 119.92 1llf h ILE 472 Ca 0.13 -0.58 -0.05 0.00 1.00 0.00 0.00 64.86 65.36 1llf h ILE 472 Cb 0.55 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1llf h ILE 472 CO 0.03 0.20 0.23 0.00 0.00 0.00 0.00 178.15 178.61 1llf h ALA 473 N 0.94 1.14 -0.44 1.87 0.00 -0.85 -0.50 119.26 121.42 1llf h ALA 473 Ca 0.09 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1llf h ALA 473 Cb 0.21 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1llf h ALA 473 CO -0.01 0.60 0.03 0.35 0.00 0.00 0.00 179.25 180.23 1llf h PHE 474 N 0.98 0.82 0.00 0.00 3.57 -0.67 0.23 116.94 121.87 1llf h PHE 474 Ca 0.22 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 1llf h PHE 474 Cb 0.25 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 1llf h PHE 474 CO 0.02 0.79 -0.21 0.00 -2.23 0.00 0.00 178.31 176.68 1llf h ALA 475 N 0.92 1.42 0.03 2.41 0.00 -0.53 0.14 119.26 123.65 1llf h ALA 475 Ca 0.13 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1llf h ALA 475 Cb 0.45 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1llf h ALA 475 CO 0.02 0.26 -0.59 1.15 0.00 0.00 0.00 179.25 180.08 1llf h THR 476 N 0.00 1.44 0.00 0.00 2.02 -0.73 -3.43 112.91 112.21 1llf h THR 476 Ca -0.00 -2.33 0.00 0.00 0.77 0.00 0.00 66.41 64.85 1llf h THR 476 Cb 0.43 2.98 0.00 0.00 -1.74 0.00 0.00 68.15 69.82 1llf h THR 476 CO 0.03 0.55 0.00 0.47 0.37 0.00 0.00 175.52 176.94 1llf n ASP 477 N -4.43 0.93 -1.95 4.18 8.00 0.78 -5.00 116.55 119.06 1llf n ASP 477 Ca -0.18 -1.01 -0.19 0.00 0.71 0.00 0.00 54.79 54.12 1llf n ASP 477 Cb 0.62 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.69 1llf n ASP 477 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1llf n LEU 478 N -0.01 -1.72 -3.50 0.64 4.77 0.49 -4.97 117.00 112.70 1llf n LEU 478 Ca 0.00 0.12 -0.09 0.00 -0.03 0.00 0.00 56.01 56.02 1llf n LEU 478 Cb 0.02 -2.69 -0.09 0.00 -2.33 0.00 0.00 43.42 38.34 1llf n LEU 478 CO 0.00 -0.43 -0.01 -0.62 -1.33 0.00 0.00 177.39 175.00 1llf s ASP 479 N -2.34 -0.03 0.58 -1.43 3.68 -1.26 -4.97 116.67 110.90 1llf s ASP 479 Ca 0.00 0.61 0.35 0.00 2.13 0.00 0.00 52.55 55.65 1llf s ASP 479 Cb 0.00 1.24 1.74 0.00 -1.45 0.00 0.00 42.92 44.45 1llf s ASP 479 CO 0.00 -0.26 2.14 1.55 0.13 0.00 0.00 175.17 178.72 1llf h PRO 480 N 8.18 0.00 0.00 4.34 0.13 -1.82 -2.79 132.00 140.04 1llf h PRO 480 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 1llf h PRO 480 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1llf h PRO 480 CO 0.20 0.04 0.00 0.09 -0.23 0.00 0.00 178.00 178.10 1llf n ASN 481 N -3.26 0.02 0.00 1.44 3.02 -1.26 -1.88 115.26 113.33 1llf n ASN 481 Ca -0.01 0.50 0.12 0.00 -0.03 0.00 0.00 54.58 55.16 1llf n ASN 481 Cb 0.21 -0.51 0.62 0.00 -0.61 0.00 0.00 39.78 39.49 1llf n ASN 481 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1llf n THR 482 N -1.52 0.21 0.52 3.41 -2.24 -1.05 -2.42 114.28 111.18 1llf n THR 482 Ca 0.04 0.05 0.09 0.00 -2.27 0.00 0.00 64.05 61.96 1llf n THR 482 Cb 0.18 -0.67 0.39 0.00 -2.10 0.00 0.00 70.33 68.13 1llf n THR 482 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1llf n ALA 483 N -1.22 1.74 -3.20 6.98 0.00 -0.79 -4.91 120.51 119.11 1llf n ALA 483 Ca 0.13 -0.02 -0.14 0.00 0.00 0.00 0.00 53.44 53.41 1llf n ALA 483 Cb 0.16 -1.31 0.08 0.00 0.00 0.00 0.00 19.45 18.38 1llf n ALA 483 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llf n GLY 484 N 0.18 -0.36 3.72 0.00 0.00 -1.02 -5.00 105.19 102.72 1llf n GLY 484 Ca 0.03 0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1llf n GLY 484 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llf s LEU 485 N -5.67 3.29 0.04 0.99 1.43 -1.26 -4.93 118.68 112.57 1llf s LEU 485 Ca 0.07 2.31 0.24 0.00 -1.03 0.00 0.00 54.13 55.71 1llf s LEU 485 Cb -0.01 -4.58 0.98 0.00 0.03 0.00 0.00 46.19 42.61 1llf s LEU 485 CO 0.63 -2.26 1.75 0.18 0.23 0.00 0.00 176.35 176.89 1llf n LEU 486 N -2.80 0.13 -3.93 1.79 4.77 -1.26 -4.59 117.00 111.10 1llf n LEU 486 Ca 0.13 0.52 -0.23 0.00 -0.03 0.00 0.00 56.01 56.39 1llf n LEU 486 Cb 0.50 -0.49 -0.17 0.00 -2.33 0.00 0.00 43.42 40.94 1llf n LEU 486 CO 0.48 -0.13 -0.43 -0.69 -1.33 0.00 0.00 177.39 175.28 1llf s VAL 487 N -3.03 0.85 0.34 4.08 1.01 -1.26 -5.10 120.40 117.28 1llf s VAL 487 Ca 0.11 -0.27 -0.28 0.00 0.00 0.00 0.00 61.98 61.54 1llf s VAL 487 Cb 0.15 -0.84 -0.10 0.00 0.00 0.00 0.00 36.38 35.59 1llf s VAL 487 CO 0.44 0.31 1.26 0.21 0.00 0.00 0.00 175.10 177.33 1llf s ASN 488 N 1.09 6.76 -0.42 3.32 2.47 -1.26 -4.99 114.94 121.91 1llf s ASN 488 Ca -0.07 2.60 -0.18 0.00 0.42 0.00 0.00 52.86 55.62 1llf s ASN 488 Cb -0.14 -2.64 0.02 0.00 -1.45 0.00 0.00 41.25 37.04 1llf s ASN 488 CO -0.01 -0.53 0.47 0.86 -3.72 0.00 0.00 177.10 174.17 1llf s TRP 489 N -1.18 3.15 0.52 0.43 -0.11 -1.26 -4.98 118.94 115.50 1llf s TRP 489 Ca 0.50 -0.29 -0.20 0.00 1.22 0.00 0.00 56.10 57.34 1llf s TRP 489 Cb -0.38 -2.97 -0.07 0.00 -1.50 0.00 0.00 33.47 28.55 1llf s TRP 489 CO 0.49 -0.72 1.08 -1.25 -4.62 0.00 0.00 176.95 171.93 1llf s PRO 490 N 2.27 3.58 0.42 5.86 0.04 -1.26 -4.92 135.00 140.99 1llf s PRO 490 Ca 0.14 1.45 -0.24 0.00 0.04 0.00 0.00 61.00 62.39 1llf s PRO 490 Cb -0.16 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.24 1llf s PRO 490 CO 0.15 -0.63 1.16 0.15 0.04 0.00 0.00 177.00 177.86 1llf s LYS 491 N -3.31 3.97 -0.21 4.56 1.02 -1.26 -4.69 119.74 119.82 1llf s LYS 491 Ca 0.69 1.79 -0.12 0.00 0.02 0.00 0.00 55.97 58.35 1llf s LYS 491 Cb -0.19 -2.58 -0.05 0.00 -0.52 0.00 0.00 37.83 34.49 1llf s LYS 491 CO 0.24 -0.38 0.23 -0.47 -0.92 0.00 0.00 175.35 174.05 1llf s TYR 492 N -1.48 3.37 -0.11 3.18 6.14 -0.07 -4.86 117.35 123.53 1llf s TYR 492 Ca 0.59 0.40 -0.04 0.00 0.64 0.00 0.00 57.07 58.66 1llf s TYR 492 Cb -0.29 -2.32 -0.05 0.00 0.42 0.00 0.00 41.96 39.72 1llf s TYR 492 CO 0.36 0.12 -0.13 0.25 0.64 0.00 0.00 175.55 176.80 1llf n THR 493 N 4.03 0.60 -3.56 4.34 -2.24 -1.26 -4.26 114.28 111.92 1llf n THR 493 Ca -0.13 -0.18 -0.09 0.00 -2.27 0.00 0.00 64.05 61.39 1llf n THR 493 Cb 0.52 -1.41 -0.02 0.00 -2.10 0.00 0.00 70.33 67.32 1llf n THR 493 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1llf s SER 494 N -5.69 -0.39 0.00 3.42 1.04 -1.26 -4.73 113.70 106.10 1llf s SER 494 Ca -0.15 -0.15 0.16 0.00 0.48 0.00 0.00 55.95 56.30 1llf s SER 494 Cb 0.05 0.52 0.69 0.00 0.10 0.00 0.00 66.02 67.39 1llf s SER 494 CO 0.21 -0.88 1.52 -1.54 0.98 0.00 0.00 173.24 173.53 1llf n SER 495 N -0.36 0.01 -0.79 7.02 3.41 -1.26 -2.06 113.62 119.60 1llf n SER 495 Ca -0.11 0.50 0.12 0.00 -0.26 0.00 0.00 58.87 59.13 1llf n SER 495 Cb 0.62 -0.50 0.28 0.00 -0.26 0.00 0.00 64.21 64.35 1llf n SER 495 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1llf n SER 496 N -1.51 2.43 -4.69 4.04 3.41 -1.26 -4.62 113.62 111.41 1llf n SER 496 Ca 0.04 -1.80 -0.31 0.00 -0.26 0.00 0.00 58.87 56.53 1llf n SER 496 Cb 0.19 -0.04 0.15 0.00 -0.26 0.00 0.00 64.21 64.25 1llf n SER 496 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1llf s GLN 497 N -1.91 1.30 0.17 4.33 -2.07 -0.87 -4.93 119.66 115.67 1llf s GLN 497 Ca 0.33 1.51 0.03 0.00 -1.82 0.00 0.00 55.36 55.40 1llf s GLN 497 Cb 0.20 -1.76 0.02 0.00 -1.09 0.00 0.00 33.01 30.39 1llf s GLN 497 CO 0.31 -2.42 1.40 0.66 -1.32 0.00 0.00 175.29 173.92 1llf h SER 498 N -1.64 0.25 -0.63 12.60 4.64 -1.95 -3.47 113.55 123.35 1llf h SER 498 Ca -0.43 -0.20 -0.55 0.00 -0.47 0.00 0.00 61.79 60.14 1llf h SER 498 Cb 1.26 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 1llf h SER 498 CO 0.44 0.98 -0.21 -0.83 -0.87 0.00 0.00 176.83 176.33 1llf s GLY 499 N -4.49 2.11 0.29 -0.77 0.00 -1.26 -5.06 107.32 98.15 1llf s GLY 499 Ca -0.03 -1.61 -0.30 0.00 0.00 0.00 0.00 44.72 42.78 1llf s GLY 499 CO 0.82 -1.84 1.61 0.70 0.00 0.00 0.00 173.10 174.39 1llf n ASN 500 N -1.97 3.93 0.00 1.64 3.02 -1.26 -4.90 115.26 115.71 1llf n ASN 500 Ca 0.05 1.14 0.00 0.00 -0.03 0.00 0.00 54.58 55.75 1llf n ASN 500 Cb 0.63 -1.60 0.00 0.00 -0.61 0.00 0.00 39.78 38.20 1llf n ASN 500 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1llf n ASN 501 N 2.25 0.68 -4.29 6.41 0.23 -0.04 -4.81 115.26 115.68 1llf n ASN 501 Ca 0.09 -1.29 -0.32 0.00 -0.53 0.00 0.00 54.58 52.53 1llf n ASN 501 Cb 0.37 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 37.91 1llf n ASN 501 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1llf s LEU 502 N -0.29 2.33 -0.08 -4.53 1.43 -0.17 -4.43 118.68 112.94 1llf s LEU 502 Ca 0.00 -0.46 -0.30 0.00 -1.03 0.00 0.00 54.13 52.35 1llf s LEU 502 Cb 0.00 -1.48 -0.03 0.00 0.03 0.00 0.00 46.19 44.71 1llf s LEU 502 CO 0.00 0.19 1.24 -0.32 0.23 0.00 0.00 176.35 177.69 1llf s MET 503 N 0.20 4.31 0.02 1.70 -2.45 -0.49 -1.59 119.30 121.01 1llf s MET 503 Ca -0.12 1.71 0.02 0.00 -1.25 0.00 0.00 55.69 56.05 1llf s MET 503 Cb -0.16 -3.61 -0.04 0.00 1.25 0.00 0.00 34.83 32.27 1llf s MET 503 CO 0.07 -0.53 0.01 -1.64 1.05 0.00 0.00 175.02 173.98 1llf s MET 504 N 2.56 2.74 -0.10 4.11 1.00 0.52 -1.01 119.30 129.13 1llf s MET 504 Ca 0.57 -0.67 0.04 0.00 0.00 0.00 0.00 55.69 55.63 1llf s MET 504 Cb -0.25 -2.65 -0.00 0.00 0.00 0.00 0.00 34.83 31.93 1llf s MET 504 CO 0.21 0.60 -0.24 0.42 0.00 0.00 0.00 175.02 176.01 1llf s ILE 505 N -1.16 2.06 0.23 2.53 1.01 -1.04 -1.65 121.20 123.19 1llf s ILE 505 Ca 0.22 -1.02 0.01 0.00 0.00 0.00 0.00 60.65 59.86 1llf s ILE 505 Cb -0.12 -1.78 -0.01 0.00 0.01 0.00 0.00 42.46 40.57 1llf s ILE 505 CO 0.13 0.56 0.05 -0.46 0.00 0.00 0.00 174.94 175.22 1llf n ASN 506 N 3.45 1.66 0.26 3.58 0.23 0.15 0.17 115.26 124.76 1llf n ASN 506 Ca -0.19 -2.15 0.09 0.00 -0.53 0.00 0.00 54.58 51.80 1llf n ASN 506 Cb 0.53 0.42 0.68 0.00 -2.08 0.00 0.00 39.78 39.33 1llf n ASN 506 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1llf h ALA 507 N 1.28 1.84 -0.22 -2.53 0.00 -1.75 -2.24 119.26 115.64 1llf h ALA 507 Ca -0.19 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1llf h ALA 507 Cb 0.65 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1llf h ALA 507 CO 0.30 0.04 0.00 1.28 0.00 0.00 0.00 179.25 180.87 1llf n LEU 508 N -4.34 2.94 0.00 0.00 4.77 -1.26 -4.58 117.00 114.53 1llf n LEU 508 Ca -0.03 -1.15 0.00 0.00 -0.03 0.00 0.00 56.01 54.80 1llf n LEU 508 Cb 0.12 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1llf n LEU 508 CO 0.33 0.58 0.00 0.61 -1.33 0.00 0.00 177.39 177.58 1llf n GLY 509 N 1.39 0.55 3.83 -0.72 0.00 -0.84 -5.09 105.19 104.31 1llf n GLY 509 Ca 0.17 -1.64 -0.30 0.00 0.00 0.00 0.00 46.02 44.25 1llf n GLY 509 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llf s LEU 510 N 0.00 3.99 0.00 0.99 1.43 -1.26 -0.67 118.68 123.15 1llf s LEU 510 Ca 0.00 0.06 -0.10 0.00 -1.03 0.00 0.00 54.13 53.05 1llf s LEU 510 Cb 0.00 -2.63 0.04 0.00 0.03 0.00 0.00 46.19 43.63 1llf s LEU 510 CO 0.00 0.15 0.60 0.00 0.23 0.00 0.00 176.35 177.32 1llf n TYR 511 N 0.21 -1.98 -4.38 0.29 4.11 -0.66 -4.93 117.16 109.82 1llf n TYR 511 Ca -0.07 -1.54 -0.20 0.00 -0.00 0.00 0.00 57.90 56.09 1llf n TYR 511 Cb 0.52 0.70 -0.10 0.00 -0.00 0.00 0.00 39.34 40.46 1llf n TYR 511 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.86 177.81 1llf s THR 512 N -2.35 1.85 0.00 -3.48 -4.23 -1.26 -0.36 115.64 105.81 1llf s THR 512 Ca 0.14 -2.23 0.00 0.00 -1.18 0.00 0.00 61.69 58.42 1llf s THR 512 Cb -0.03 -2.16 0.00 0.00 1.34 0.00 0.00 72.50 71.65 1llf s THR 512 CO 0.10 -0.51 0.00 0.61 -0.54 0.00 0.00 174.62 174.28 1llf n GLY 513 N -0.46 2.65 3.33 3.99 0.00 -0.62 -4.87 105.19 109.22 1llf n GLY 513 Ca -0.07 -0.96 -0.28 0.00 0.00 0.00 0.00 46.02 44.70 1llf n GLY 513 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llf s LYS 514 N -0.66 1.56 -0.96 1.61 1.02 -1.26 -0.86 119.74 120.19 1llf s LYS 514 Ca 0.00 -1.14 -0.04 0.00 0.02 0.00 0.00 55.97 54.81 1llf s LYS 514 Cb 0.00 -1.81 0.13 0.00 -0.52 0.00 0.00 37.83 35.63 1llf s LYS 514 CO 0.00 0.45 2.46 -3.47 -0.92 0.00 0.00 175.35 173.87 1llf n ASP 515 N 1.53 7.39 -0.37 2.83 2.03 -1.26 -4.56 116.55 124.14 1llf n ASP 515 Ca -0.17 -3.25 0.07 0.00 0.52 0.00 0.00 54.79 51.96 1llf n ASP 515 Cb 0.53 -1.28 0.13 0.00 -0.72 0.00 0.00 41.12 39.77 1llf n ASP 515 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1llf n ASN 516 N 1.14 1.75 -4.94 1.67 6.94 -1.26 -4.77 115.26 115.79 1llf n ASN 516 Ca 0.56 -3.07 -0.26 0.00 -0.02 0.00 0.00 54.58 51.80 1llf n ASN 516 Cb 0.36 -0.41 -0.03 0.00 -2.36 0.00 0.00 39.78 37.34 1llf n ASN 516 CO 0.00 0.00 0.00 0.72 -1.03 0.00 0.00 177.26 176.95 1llf s PHE 517 N -2.35 3.48 -1.47 -2.53 -0.71 -1.26 -4.51 117.98 108.62 1llf s PHE 517 Ca 0.29 0.15 -0.02 0.00 -1.04 0.00 0.00 56.93 56.31 1llf s PHE 517 Cb 0.27 -1.69 0.02 0.00 -1.21 0.00 0.00 43.02 40.40 1llf s PHE 517 CO -0.01 0.47 0.36 0.54 -1.34 0.00 0.00 175.22 175.23 1llf n ARG 518 N -0.72 -2.74 0.06 1.99 1.74 -1.26 -4.88 116.66 110.85 1llf n ARG 518 Ca -0.07 0.33 -0.01 0.00 -0.77 0.00 0.00 57.85 57.33 1llf n ARG 518 Cb 0.54 -4.37 0.28 0.00 -1.02 0.00 0.00 32.46 27.89 1llf n ARG 518 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 1llf h THR 519 N -1.79 1.24 -0.75 0.55 1.35 -1.99 -1.21 112.91 110.32 1llf h THR 519 Ca -0.63 -1.08 -0.04 0.00 -0.55 0.00 0.00 66.41 64.10 1llf h THR 519 Cb 1.38 1.29 -0.03 0.00 -1.73 0.00 0.00 68.15 69.06 1llf h THR 519 CO 0.66 0.34 0.30 0.00 -0.25 0.00 0.00 175.52 176.57 1llf h ALA 520 N 1.46 1.11 -0.22 6.62 0.00 -1.92 -0.67 119.26 125.64 1llf h ALA 520 Ca 0.06 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 1llf h ALA 520 Cb 0.55 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1llf h ALA 520 CO 0.04 0.63 -0.49 0.78 0.00 0.00 0.00 179.25 180.21 1llf h GLY 521 N 1.12 0.66 0.69 0.00 0.00 -1.67 -0.73 103.07 103.14 1llf h GLY 521 Ca 0.25 -0.72 0.04 0.00 0.00 0.00 0.00 47.33 46.89 1llf h GLY 521 CO -0.02 0.65 0.03 -1.82 0.00 0.00 0.00 176.54 175.38 1llf h TYR 522 N 0.48 0.06 -0.68 5.60 5.03 -0.82 -1.67 116.97 124.96 1llf h TYR 522 Ca 0.02 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.31 1llf h TYR 522 Cb 1.03 0.01 -0.03 0.00 1.55 0.00 0.00 36.73 39.29 1llf h TYR 522 CO 0.05 0.00 0.29 -0.44 -1.32 0.00 0.00 178.16 176.74 1llf h ASP 523 N 0.12 0.90 -0.76 -2.11 3.32 -0.83 0.97 116.42 118.03 1llf h ASP 523 Ca 0.11 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 1llf h ASP 523 Cb 0.12 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 1llf h ASP 523 CO -0.16 0.79 0.31 0.00 -1.72 0.00 0.00 179.24 178.46 1llf h ALA 524 N 1.34 1.10 0.15 3.45 0.00 -0.74 -2.80 119.26 121.76 1llf h ALA 524 Ca 0.23 -0.19 -0.34 0.00 0.00 0.00 0.00 54.91 54.62 1llf h ALA 524 Cb 0.16 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1llf h ALA 524 CO -0.02 0.65 -1.71 -0.07 0.00 0.00 0.00 179.25 178.09 1llf h LEU 525 N 1.12 0.50 -1.49 0.00 3.38 -1.02 -3.41 115.31 114.38 1llf h LEU 525 Ca 0.26 -0.77 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1llf h LEU 525 Cb 0.20 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1llf h LEU 525 CO -0.02 1.66 -0.00 0.23 0.09 0.00 0.00 178.44 180.39 1llf n MET 526 N -3.51 0.79 -0.12 1.13 2.81 0.31 -3.62 117.12 114.90 1llf n MET 526 Ca -0.23 -1.26 -0.11 0.00 -1.81 0.00 0.00 57.70 54.29 1llf n MET 526 Cb 1.06 -1.25 -0.02 0.00 -0.71 0.00 0.00 33.22 32.30 1llf n MET 526 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1llf h THR 527 N 2.51 1.27 -2.78 2.03 2.02 -1.66 -3.35 112.91 112.96 1llf h THR 527 Ca 0.00 -1.08 -0.60 0.00 0.77 0.00 0.00 66.41 65.50 1llf h THR 527 Cb 0.53 1.24 -0.40 0.00 -1.74 0.00 0.00 68.15 67.78 1llf h THR 527 CO 0.00 0.36 -0.79 0.20 0.37 0.00 0.00 175.52 175.66 1llf s ASN 528 N -6.23 3.15 0.40 4.18 -0.87 -1.26 -5.01 114.94 109.30 1llf s ASN 528 Ca -0.13 -2.99 0.10 0.00 -1.57 0.00 0.00 52.86 48.27 1llf s ASN 528 Cb 0.09 -0.92 0.90 0.00 -0.02 0.00 0.00 41.25 41.31 1llf s ASN 528 CO 0.79 -0.20 1.98 -0.65 -2.57 0.00 0.00 177.10 176.45 1llf h PRO 529 N 6.13 0.54 0.00 -0.60 0.11 -1.70 -1.68 132.00 134.80 1llf h PRO 529 Ca 0.12 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1llf h PRO 529 Cb 0.89 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1llf h PRO 529 CO 0.48 0.36 0.00 0.66 -0.21 0.00 0.00 178.00 179.29 1llf h SER 530 N 0.56 0.00 0.37 -2.05 4.64 -1.95 -0.28 113.55 114.84 1llf h SER 530 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1llf h SER 530 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1llf h SER 530 CO -0.08 0.00 0.00 0.28 -0.87 0.00 0.00 176.83 176.16 1llf h SER 531 N 0.00 0.00 -0.19 4.97 0.02 -1.62 -2.86 113.55 113.87 1llf h SER 531 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1llf h SER 531 Cb 0.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.79 1llf h SER 531 CO 0.00 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.18 1llf n PHE 532 N -2.80 0.61 -1.94 3.45 3.72 -0.12 -2.23 117.46 118.14 1llf n PHE 532 Ca -0.01 -0.84 -0.31 0.00 -0.05 0.00 0.00 57.45 56.24 1llf n PHE 532 Cb 0.15 -0.23 0.01 0.00 -0.94 0.00 0.00 39.48 38.47 1llf n PHE 532 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1llf s PHE 533 N -2.52 3.45 -1.02 1.38 0.40 -1.08 -4.93 117.98 113.65 1llf s PHE 533 Ca 0.35 1.37 0.08 0.00 -0.60 0.00 0.00 56.93 58.13 1llf s PHE 533 Cb 0.28 -2.79 0.06 0.00 0.51 0.00 0.00 43.02 41.09 1llf s PHE 533 CO 0.08 -0.75 0.76 1.33 0.70 0.00 0.00 175.22 177.34