#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hlw n ASN 7 N 0.00 0.00 -1.22 6.55 5.03 -1.26 -3.70 115.26 120.66 1hlw n ASN 7 Ca 0.00 -0.62 0.09 0.00 0.87 0.00 0.00 54.58 54.92 1hlw n ASN 7 Cb 0.00 -0.06 0.29 0.00 -1.02 0.00 0.00 39.78 38.99 1hlw n ASN 7 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1hlw n LYS 8 N -1.06 3.14 -1.79 3.52 5.02 -1.26 -3.57 118.16 122.15 1hlw n LYS 8 Ca 0.17 -2.61 -0.37 0.00 -2.02 0.00 0.00 58.31 53.48 1hlw n LYS 8 Cb 0.10 -1.63 0.05 0.00 -0.02 0.00 0.00 35.03 33.54 1hlw n LYS 8 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1hlw s GLU 9 N -1.44 2.81 0.05 1.97 2.12 -1.24 -4.71 118.70 118.25 1hlw s GLU 9 Ca 0.43 2.09 0.03 0.00 0.36 0.00 0.00 54.97 57.88 1hlw s GLU 9 Cb 0.25 -1.99 -0.02 0.00 0.26 0.00 0.00 34.13 32.63 1hlw s GLU 9 CO 0.24 -1.41 -0.10 1.03 -0.54 0.00 0.00 175.26 174.48 1hlw s ARG 10 N -3.21 0.63 0.13 4.30 0.52 -1.26 -0.96 118.95 119.10 1hlw s ARG 10 Ca 0.78 -0.77 0.04 0.00 -0.52 0.00 0.00 55.73 55.27 1hlw s ARG 10 Cb -0.38 -0.50 -0.04 0.00 0.52 0.00 0.00 34.95 34.55 1hlw s ARG 10 CO 0.41 0.11 -0.10 -0.08 0.02 0.00 0.00 175.30 175.66 1hlw s THR 11 N -1.21 1.08 -0.14 0.02 -1.32 -0.50 -4.75 115.64 108.82 1hlw s THR 11 Ca -0.06 -1.97 -0.04 0.00 -1.21 0.00 0.00 61.69 58.41 1hlw s THR 11 Cb -0.09 -1.74 -0.03 0.00 -1.51 0.00 0.00 72.50 69.13 1hlw s THR 11 CO 0.01 -0.72 -0.01 0.12 -2.21 0.00 0.00 174.62 171.81 1hlw s PHE 12 N -3.19 3.10 0.01 9.09 5.36 -1.26 -2.16 117.98 128.93 1hlw s PHE 12 Ca 0.14 -0.10 0.05 0.00 -0.96 0.00 0.00 56.93 56.06 1hlw s PHE 12 Cb 0.02 -1.94 -0.01 0.00 -0.34 0.00 0.00 43.02 40.74 1hlw s PHE 12 CO -0.00 0.12 -0.14 -0.51 -1.46 0.00 0.00 175.22 173.23 1hlw s LEU 13 N 0.07 2.08 -0.08 6.12 1.43 -0.29 -1.55 118.68 126.47 1hlw s LEU 13 Ca 0.01 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1hlw s LEU 13 Cb -0.13 -0.69 0.02 0.00 0.03 0.00 0.00 46.19 45.42 1hlw s LEU 13 CO 0.02 0.12 -0.07 0.00 0.23 0.00 0.00 176.35 176.65 1hlw s ALA 14 N -0.52 1.06 -0.33 4.21 0.00 -0.41 -0.37 121.76 125.41 1hlw s ALA 14 Ca 0.04 -0.33 -0.23 0.00 0.00 0.00 0.00 51.96 51.44 1hlw s ALA 14 Cb -0.06 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.38 1hlw s ALA 14 CO 0.00 -0.18 0.75 0.08 0.00 0.00 0.00 175.76 176.41 1hlw s VAL 15 N 1.27 4.80 0.98 0.00 1.01 0.52 -1.78 120.40 127.21 1hlw s VAL 15 Ca -0.04 0.97 -0.12 0.00 0.00 0.00 0.00 61.98 62.78 1hlw s VAL 15 Cb -0.14 -4.14 0.18 0.00 0.00 0.00 0.00 36.38 32.28 1hlw s VAL 15 CO -0.02 -0.31 1.11 -0.54 0.00 0.00 0.00 175.10 175.33 1hlw s LYS 16 N 2.93 0.55 0.46 2.72 1.02 -0.12 -1.98 119.74 125.31 1hlw s LYS 16 Ca 0.30 0.43 0.21 0.00 0.02 0.00 0.00 55.97 56.94 1hlw s LYS 16 Cb -0.14 -1.76 1.19 0.00 -0.52 0.00 0.00 37.83 36.61 1hlw s LYS 16 CO 0.14 -2.63 1.88 -1.35 -0.92 0.00 0.00 175.35 172.47 1hlw h PRO 17 N -1.82 0.27 -0.34 -1.68 0.11 -1.86 -0.89 132.00 125.79 1hlw h PRO 17 Ca -0.54 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.41 1hlw h PRO 17 Cb 1.33 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1hlw h PRO 17 CO 0.59 0.18 -0.38 0.38 -0.21 0.00 0.00 178.00 178.56 1hlw h ASP 18 N 0.28 0.87 -0.53 -2.05 2.03 -1.88 -0.71 116.42 114.43 1hlw h ASP 18 Ca 0.43 -0.39 -0.12 0.00 -0.73 0.00 0.00 57.03 56.22 1hlw h ASP 18 Cb 1.24 -0.25 -0.02 0.00 -0.83 0.00 0.00 39.33 39.48 1hlw h ASP 18 CO -0.12 1.15 -0.12 1.23 -1.03 0.00 0.00 179.24 180.36 1hlw h GLY 19 N 0.88 1.10 0.85 7.15 0.00 -1.33 -1.57 103.07 110.15 1hlw h GLY 19 Ca 0.06 -0.90 -0.05 0.00 0.00 0.00 0.00 47.33 46.43 1hlw h GLY 19 CO 0.09 0.83 -0.03 -2.08 0.00 0.00 0.00 176.54 175.34 1hlw h VAL 20 N 0.89 1.27 -0.04 4.60 2.07 -1.24 -2.16 116.25 121.64 1hlw h VAL 20 Ca 0.14 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.64 1hlw h VAL 20 Cb 0.69 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1hlw h VAL 20 CO 0.05 0.31 -0.08 0.00 0.02 0.00 0.00 177.57 177.88 1hlw h ALA 21 N 0.79 1.79 -0.19 1.67 0.00 -1.04 -2.02 119.26 120.25 1hlw h ALA 21 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1hlw h ALA 21 Cb 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1hlw h ALA 21 CO 0.02 0.16 0.00 0.54 0.00 0.00 0.00 179.25 179.97 1hlw n ARG 22 N -4.41 1.67 -2.87 0.00 1.74 -0.60 -4.93 116.66 107.25 1hlw n ARG 22 Ca -0.02 -1.01 -0.13 0.00 -0.77 0.00 0.00 57.85 55.92 1hlw n ARG 22 Cb 0.18 -1.34 0.03 0.00 -1.02 0.00 0.00 32.46 30.31 1hlw n ARG 22 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hlw n GLY 23 N 1.06 0.07 0.84 -0.13 0.00 -0.76 -4.95 105.19 101.32 1hlw n GLY 23 Ca 0.14 -0.23 0.09 0.00 0.00 0.00 0.00 46.02 46.02 1hlw n GLY 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hlw n LEU 24 N -2.64 2.93 0.04 0.99 4.77 -0.82 -4.68 117.00 117.58 1hlw n LEU 24 Ca -0.03 -1.49 -0.12 0.00 -0.03 0.00 0.00 56.01 54.34 1hlw n LEU 24 Cb 0.55 -0.18 -0.06 0.00 -2.33 0.00 0.00 43.42 41.40 1hlw n LEU 24 CO 0.31 0.64 0.86 0.58 -1.33 0.00 0.00 177.39 178.44 1hlw h VAL 25 N 3.27 0.95 -0.59 4.08 2.07 -1.88 -1.92 116.25 122.23 1hlw h VAL 25 Ca 0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 1hlw h VAL 25 Cb 0.79 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 1hlw h VAL 25 CO 0.00 0.00 0.10 1.23 0.02 0.00 0.00 177.57 178.92 1hlw h GLY 26 N -0.02 1.04 0.89 2.17 0.00 -1.97 -0.85 103.07 104.32 1hlw h GLY 26 Ca 0.01 -0.69 0.02 0.00 0.00 0.00 0.00 47.33 46.68 1hlw h GLY 26 CO -0.03 0.64 0.37 -2.09 0.00 0.00 0.00 176.54 175.43 1hlw h GLU 27 N 0.87 0.72 -0.12 4.80 4.57 -1.83 -0.98 114.58 122.61 1hlw h GLU 27 Ca 0.18 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.29 1hlw h GLU 27 Cb 0.41 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 28.84 1hlw h GLU 27 CO 0.01 0.48 -0.04 0.82 -1.18 0.00 0.00 179.01 179.10 1hlw h ILE 28 N 0.74 1.30 -0.97 2.32 2.04 -1.05 -2.67 117.51 119.22 1hlw h ILE 28 Ca 0.24 -1.00 0.01 0.00 1.00 0.00 0.00 64.86 65.11 1hlw h ILE 28 Cb 0.01 1.71 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 1hlw h ILE 28 CO -0.09 0.29 0.64 0.40 0.00 0.00 0.00 178.15 179.39 1hlw h ILE 29 N -0.08 1.24 -0.40 -0.67 2.04 -1.01 -2.13 117.51 116.50 1hlw h ILE 29 Ca 0.03 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 1hlw h ILE 29 Cb 0.47 -0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.35 1hlw h ILE 29 CO 0.01 0.24 0.18 0.00 0.00 0.00 0.00 178.15 178.58 1hlw h ALA 30 N 1.36 1.56 -0.81 1.87 0.00 -1.10 -0.92 119.26 121.23 1hlw h ALA 30 Ca 0.36 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1hlw h ALA 30 Cb -0.13 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 1hlw h ALA 30 CO -0.08 0.35 0.39 0.00 0.00 0.00 0.00 179.25 179.90 1hlw h ARG 31 N 0.56 1.16 -0.01 0.00 3.08 -1.03 0.03 114.38 118.18 1hlw h ARG 31 Ca 0.14 -0.17 -0.20 0.00 0.07 0.00 0.00 59.98 59.82 1hlw h ARG 31 Cb 0.08 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1hlw h ARG 31 CO -0.02 0.90 -0.87 1.88 -1.07 0.00 0.00 179.97 180.79 1hlw h TYR 32 N 1.15 0.43 -0.46 3.04 0.05 -1.32 -2.83 116.97 117.03 1hlw h TYR 32 Ca 0.28 -0.23 -0.10 0.00 0.05 0.00 0.00 58.73 58.73 1hlw h TYR 32 Cb 0.12 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 1hlw h TYR 32 CO 0.01 1.03 -0.11 0.93 -1.05 0.00 0.00 178.16 178.97 1hlw h GLU 33 N 0.17 0.89 -0.22 4.88 5.08 -0.93 -2.51 114.58 121.95 1hlw h GLU 33 Ca -0.05 -0.34 -0.06 0.00 -1.00 0.00 0.00 59.36 57.91 1hlw h GLU 33 Cb 1.48 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.67 1hlw h GLU 33 CO 0.14 0.99 -0.12 0.87 -1.00 0.00 0.00 179.01 179.89 1hlw h LYS 34 N 0.73 0.35 0.00 2.33 1.57 -1.01 -2.02 116.57 118.53 1hlw h LYS 34 Ca 0.12 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1hlw h LYS 34 Cb 0.66 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1hlw h LYS 34 CO 0.05 0.48 -0.22 -0.22 -0.57 0.00 0.00 179.45 178.97 1hlw h LYS 35 N 0.33 0.00 0.00 3.15 1.63 -1.35 -3.47 116.57 116.87 1hlw h LYS 35 Ca 0.07 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 1hlw h LYS 35 Cb 0.41 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.04 1hlw h LYS 35 CO 0.02 0.22 0.00 0.41 -3.45 0.00 0.00 179.45 176.65 1hlw n GLY 36 N -0.58 0.93 3.82 5.01 0.00 -0.76 -5.10 105.19 108.51 1hlw n GLY 36 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1hlw n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hlw s PHE 37 N -2.00 3.24 -0.16 1.61 0.08 -0.96 -4.84 117.98 114.94 1hlw s PHE 37 Ca 0.00 1.59 -0.06 0.00 0.12 0.00 0.00 56.93 58.58 1hlw s PHE 37 Cb 0.00 -2.90 -0.04 0.00 -0.57 0.00 0.00 43.02 39.51 1hlw s PHE 37 CO 0.00 -0.31 0.05 0.08 -0.10 0.00 0.00 175.22 174.94 1hlw s VAL 38 N -2.17 4.69 -0.09 -0.44 1.01 -0.55 -4.45 120.40 118.40 1hlw s VAL 38 Ca 0.63 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 62.24 1hlw s VAL 38 Cb -0.11 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1hlw s VAL 38 CO 0.16 0.50 1.25 -0.22 0.00 0.00 0.00 175.10 176.79 1hlw s LEU 39 N 0.06 4.24 -0.00 3.92 2.96 -1.26 -0.80 118.68 127.80 1hlw s LEU 39 Ca 0.05 1.80 0.03 0.00 -0.22 0.00 0.00 54.13 55.79 1hlw s LEU 39 Cb -0.12 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.97 1hlw s LEU 39 CO 0.01 -0.67 0.10 0.52 -1.32 0.00 0.00 176.35 174.99 1hlw n VAL 40 N 4.93 0.00 -3.63 1.68 0.31 -0.05 -4.94 118.33 116.63 1hlw n VAL 40 Ca 0.12 -0.23 -0.15 0.00 -0.01 0.00 0.00 64.34 64.08 1hlw n VAL 40 Cb 0.45 0.67 -0.07 0.00 -0.91 0.00 0.00 33.84 33.98 1hlw n VAL 40 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1hlw s GLY 41 N -1.93 -0.49 -0.28 2.92 0.00 -1.15 -0.75 107.32 105.63 1hlw s GLY 41 Ca -0.00 1.64 -0.17 0.00 0.00 0.00 0.00 44.72 46.19 1hlw s GLY 41 CO 0.14 1.37 0.79 -2.27 0.00 0.00 0.00 173.10 173.13 1hlw s LEU 42 N -0.08 -0.79 -0.11 0.66 2.96 -1.26 -1.43 118.68 118.63 1hlw s LEU 42 Ca -0.03 1.28 -0.30 0.00 -0.22 0.00 0.00 54.13 54.86 1hlw s LEU 42 Cb -0.04 2.18 0.12 0.00 0.50 0.00 0.00 46.19 48.95 1hlw s LEU 42 CO 0.03 -0.20 0.95 -1.59 -1.32 0.00 0.00 176.35 174.22 1hlw s LYS 43 N 1.43 0.67 -0.09 1.98 -2.85 -0.85 -5.02 119.74 115.01 1hlw s LYS 43 Ca -0.09 0.02 -0.02 0.00 -1.00 0.00 0.00 55.97 54.88 1hlw s LYS 43 Cb -0.05 0.32 -0.03 0.00 -2.06 0.00 0.00 37.83 36.01 1hlw s LYS 43 CO -0.17 -0.24 0.02 -1.14 0.10 0.00 0.00 175.35 173.93 1hlw s GLN 44 N -1.70 3.04 0.20 1.78 0.74 -1.26 -1.00 119.66 121.46 1hlw s GLN 44 Ca -0.00 -0.37 -0.20 0.00 0.05 0.00 0.00 55.36 54.84 1hlw s GLN 44 Cb -0.01 -2.85 0.04 0.00 1.10 0.00 0.00 33.01 31.30 1hlw s GLN 44 CO -0.01 0.71 0.57 -0.48 -0.55 0.00 0.00 175.29 175.54 1hlw s LEU 45 N -0.92 -0.15 -0.36 3.68 2.34 -0.50 -4.97 118.68 117.79 1hlw s LEU 45 Ca 0.14 -0.35 -0.09 0.00 0.06 0.00 0.00 54.13 53.88 1hlw s LEU 45 Cb -0.11 2.36 0.03 0.00 -0.56 0.00 0.00 46.19 47.91 1hlw s LEU 45 CO 0.03 -1.07 0.16 -0.69 -1.06 0.00 0.00 176.35 173.72 1hlw s VAL 46 N -3.84 4.24 0.41 1.48 1.01 -1.26 -0.23 120.40 122.21 1hlw s VAL 46 Ca 0.07 -0.95 -0.26 0.00 0.00 0.00 0.00 61.98 60.84 1hlw s VAL 46 Cb -0.02 -3.37 -0.10 0.00 0.00 0.00 0.00 36.38 32.89 1hlw s VAL 46 CO -0.05 -0.20 1.26 -2.65 0.00 0.00 0.00 175.10 173.47 1hlw n PRO 47 N 4.92 1.92 -2.74 2.72 -0.02 -1.26 -5.01 135.00 135.53 1hlw n PRO 47 Ca -0.12 0.68 -0.26 0.00 -2.02 0.00 0.00 63.50 61.78 1hlw n PRO 47 Cb 0.46 -2.36 0.01 0.00 -0.02 0.00 0.00 33.50 31.59 1hlw n PRO 47 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1hlw s THR 48 N -1.19 4.38 0.27 3.45 -4.23 -1.26 -4.63 115.64 112.43 1hlw s THR 48 Ca 0.60 -0.09 -0.02 0.00 -1.18 0.00 0.00 61.69 61.00 1hlw s THR 48 Cb -0.52 -3.66 0.27 0.00 1.34 0.00 0.00 72.50 69.93 1hlw s THR 48 CO 0.58 -0.59 1.89 0.50 -0.54 0.00 0.00 174.62 176.46 1hlw h LYS 49 N 0.22 1.13 -0.27 3.99 3.64 -1.95 -1.33 116.57 122.01 1hlw h LYS 49 Ca -0.47 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 58.84 1hlw h LYS 49 Cb 1.23 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1hlw h LYS 49 CO 0.60 0.75 0.13 -0.44 -2.27 0.00 0.00 179.45 178.22 1hlw h ASP 50 N 1.17 0.35 -0.48 4.20 3.32 -1.99 -0.23 116.42 122.75 1hlw h ASP 50 Ca 0.43 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.34 1hlw h ASP 50 Cb 0.17 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1hlw h ASP 50 CO -0.17 0.37 0.23 0.25 -1.72 0.00 0.00 179.24 178.21 1hlw h LEU 51 N 0.30 0.63 -0.48 1.55 5.85 -1.86 -2.08 115.31 119.22 1hlw h LEU 51 Ca 0.09 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1hlw h LEU 51 Cb 0.12 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1hlw h LEU 51 CO -0.01 0.58 0.32 0.00 -0.34 0.00 0.00 178.44 178.98 1hlw h ALA 52 N 1.07 0.61 -0.39 1.25 0.00 -0.88 -0.17 119.26 120.76 1hlw h ALA 52 Ca 0.17 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1hlw h ALA 52 Cb 0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1hlw h ALA 52 CO -0.02 0.06 -0.03 0.93 0.00 0.00 0.00 179.25 180.19 1hlw h GLU 53 N 0.65 0.63 -0.28 0.00 5.08 -0.96 -0.86 114.58 118.85 1hlw h GLU 53 Ca 0.18 -0.16 -0.10 0.00 -1.00 0.00 0.00 59.36 58.28 1hlw h GLU 53 Cb -0.07 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 1hlw h GLU 53 CO -0.04 0.68 -0.19 1.03 -1.00 0.00 0.00 179.01 179.48 1hlw h SER 54 N 0.60 0.66 -0.78 1.42 0.87 -1.02 -1.73 113.55 113.57 1hlw h SER 54 Ca 0.12 -0.44 0.03 0.00 -1.23 0.00 0.00 61.79 60.27 1hlw h SER 54 Cb 0.42 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 62.15 1hlw h SER 54 CO 0.02 0.96 0.50 -0.74 -0.53 0.00 0.00 176.83 177.04 1hlw h HIS 55 N 0.37 0.95 -0.60 2.24 -0.00 -0.59 -2.52 115.15 114.99 1hlw h HIS 55 Ca 0.06 0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.39 1hlw h HIS 55 Cb 0.74 -0.31 -0.04 0.00 -0.00 0.00 0.00 27.41 27.79 1hlw h HIS 55 CO 0.07 0.55 0.08 0.66 -0.00 0.00 0.00 177.93 179.29 1hlw n TYR 56 N -4.59 2.11 -0.10 5.26 4.01 -0.37 -4.64 117.16 118.84 1hlw n TYR 56 Ca 0.09 -0.83 0.24 0.00 -0.16 0.00 0.00 57.90 57.24 1hlw n TYR 56 Cb 0.07 -0.55 0.70 0.00 -0.31 0.00 0.00 39.34 39.25 1hlw n TYR 56 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1hlw h ALA 57 N 3.53 2.67 0.00 -0.72 0.00 -0.85 -0.13 119.26 123.77 1hlw h ALA 57 Ca 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1hlw h ALA 57 Cb 2.02 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.86 1hlw h ALA 57 CO 0.55 -0.88 -0.03 1.05 0.00 0.00 0.00 179.25 179.94 1hlw h GLU 58 N 0.02 0.00 -0.42 0.00 4.11 -1.85 -2.47 114.58 113.97 1hlw h GLU 58 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.78 1hlw h GLU 58 Cb 1.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.63 1hlw h GLU 58 CO -0.01 0.03 0.00 0.72 0.07 0.00 0.00 179.01 179.82 1hlw n HIS 59 N -3.24 0.55 0.32 2.06 8.25 -0.06 -4.64 115.22 118.46 1hlw n HIS 59 Ca -0.02 -0.33 0.19 0.00 -0.26 0.00 0.00 57.72 57.31 1hlw n HIS 59 Cb 0.17 -0.01 1.04 0.00 1.12 0.00 0.00 29.99 32.32 1hlw n HIS 59 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 1hlw h LYS 60 N 3.77 0.00 -0.00 -0.41 2.10 -1.48 0.19 116.57 120.74 1hlw h LYS 60 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1hlw h LYS 60 Cb 0.89 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.22 1hlw h LYS 60 CO 0.00 0.00 -0.53 0.39 -2.00 0.00 0.00 179.45 177.31 1hlw n GLU 61 N -3.10 0.08 -2.82 0.07 4.71 -1.26 -4.91 120.64 113.40 1hlw n GLU 61 Ca -0.02 -0.05 -0.31 0.00 -0.01 0.00 0.00 57.16 56.77 1hlw n GLU 61 Cb 0.21 -1.50 -0.04 0.00 -1.01 0.00 0.00 31.44 29.10 1hlw n GLU 61 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 1hlw s ARG 62 N -2.95 3.85 0.27 3.49 1.81 0.68 -5.00 118.95 121.09 1hlw s ARG 62 Ca 0.12 0.59 -0.03 0.00 -1.72 0.00 0.00 55.73 54.69 1hlw s ARG 62 Cb 0.17 -2.35 0.36 0.00 -0.45 0.00 0.00 34.95 32.68 1hlw s ARG 62 CO 0.70 -0.04 1.86 -1.00 -0.68 0.00 0.00 175.30 176.14 1hlw h PRO 63 N 1.37 1.01 0.00 3.54 0.13 -1.91 -2.97 132.00 133.17 1hlw h PRO 63 Ca -0.47 -0.15 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 1hlw h PRO 63 Cb 1.18 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1hlw h PRO 63 CO 0.64 0.79 0.00 1.97 -0.23 0.00 0.00 178.00 181.17 1hlw n PHE 64 N -4.32 0.00 -0.06 1.56 -1.74 -1.26 -3.80 117.46 107.84 1hlw n PHE 64 Ca 0.07 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.88 1hlw n PHE 64 Cb 0.15 -0.26 -0.02 0.00 1.52 0.00 0.00 39.48 40.87 1hlw n PHE 64 CO 0.00 0.00 0.00 0.35 -0.56 0.00 0.00 176.76 176.55 1hlw h PHE 65 N 0.00 -0.66 -0.61 2.97 3.57 -1.73 -2.27 116.94 118.20 1hlw h PHE 65 Ca 0.00 0.04 0.12 0.00 3.53 0.00 0.00 57.97 61.66 1hlw h PHE 65 Cb 0.18 0.33 -0.09 0.00 2.79 0.00 0.00 35.95 39.16 1hlw h PHE 65 CO 0.00 -0.32 0.10 0.78 -2.23 0.00 0.00 178.31 176.63 1hlw h GLY 66 N -0.25 0.75 1.04 2.40 0.00 -1.82 -1.19 103.07 104.01 1hlw h GLY 66 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.43 1hlw h GLY 66 CO -0.40 -0.14 0.35 -1.33 0.00 0.00 0.00 176.54 175.02 1hlw h GLY 67 N 0.22 1.28 1.05 4.60 0.00 -1.73 0.50 103.07 108.99 1hlw h GLY 67 Ca 0.32 -0.67 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1hlw h GLY 67 CO -0.44 0.63 0.22 1.41 0.00 0.00 0.00 176.54 178.36 1hlw h LEU 68 N 1.17 1.06 -0.40 3.11 3.38 -0.69 -1.21 115.31 121.73 1hlw h LEU 68 Ca 0.27 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 1hlw h LEU 68 Cb 0.17 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1hlw h LEU 68 CO -0.03 0.99 -0.20 0.58 0.09 0.00 0.00 178.44 179.87 1hlw h VAL 69 N 1.08 1.28 -0.24 1.22 2.07 -1.01 -2.26 116.25 118.39 1hlw h VAL 69 Ca 0.23 -1.34 -0.02 0.00 0.82 0.00 0.00 66.70 66.39 1hlw h VAL 69 Cb 0.32 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1hlw h VAL 69 CO -0.01 0.45 0.08 0.28 0.02 0.00 0.00 177.57 178.40 1hlw h SER 70 N 0.65 0.35 -0.23 0.57 0.02 -0.72 -2.76 113.55 111.43 1hlw h SER 70 Ca 0.09 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 1hlw h SER 70 Cb 0.76 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1hlw h SER 70 CO 0.06 0.45 0.06 0.15 -1.14 0.00 0.00 176.83 176.40 1hlw h PHE 71 N 0.23 0.38 0.00 3.45 3.57 -1.21 -2.80 116.94 120.56 1hlw h PHE 71 Ca 0.08 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1hlw h PHE 71 Cb 0.22 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.85 1hlw h PHE 71 CO -0.00 0.46 0.00 0.97 -2.23 0.00 0.00 178.31 177.51 1hlw h ILE 72 N 0.19 0.00 -0.50 1.41 2.10 -1.39 -1.30 117.51 118.02 1hlw h ILE 72 Ca 0.07 -0.31 0.00 0.00 1.08 0.00 0.00 64.86 65.70 1hlw h ILE 72 Cb 0.28 1.29 0.00 0.00 -1.09 0.00 0.00 36.82 37.30 1hlw h ILE 72 CO 0.00 0.00 0.00 0.35 -1.08 0.00 0.00 178.15 177.42 1hlw n THR 73 N -3.05 0.66 1.37 2.19 -2.24 -1.05 -4.36 114.28 107.80 1hlw n THR 73 Ca -0.01 -0.78 0.15 0.00 -2.27 0.00 0.00 64.05 61.14 1hlw n THR 73 Cb 0.21 0.68 0.72 0.00 -2.10 0.00 0.00 70.33 69.84 1hlw n THR 73 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1hlw n SER 74 N 1.38 0.07 -3.28 3.42 3.41 -0.49 -4.82 113.62 113.31 1hlw n SER 74 Ca 0.21 -0.13 0.02 0.00 -0.26 0.00 0.00 58.87 58.71 1hlw n SER 74 Cb 0.56 -0.27 0.01 0.00 -0.26 0.00 0.00 64.21 64.25 1hlw n SER 74 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hlw n GLY 75 N 1.31 0.32 3.74 5.00 0.00 -1.26 -5.12 105.19 109.18 1hlw n GLY 75 Ca 0.13 -1.01 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 1hlw n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1hlw s PRO 76 N -2.01 2.74 0.02 1.61 0.04 -1.26 -4.51 135.00 131.63 1hlw s PRO 76 Ca 0.24 2.07 0.04 0.00 0.04 0.00 0.00 61.00 63.39 1hlw s PRO 76 Cb -0.01 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.57 1hlw s PRO 76 CO -0.00 -1.45 -0.13 0.08 0.04 0.00 0.00 177.00 175.53 1hlw s VAL 77 N -1.40 1.05 -0.33 -0.36 1.01 0.68 -3.73 120.40 117.32 1hlw s VAL 77 Ca 0.80 -0.80 -0.07 0.00 0.00 0.00 0.00 61.98 61.90 1hlw s VAL 77 Cb -0.37 -0.93 0.03 0.00 0.00 0.00 0.00 36.38 35.11 1hlw s VAL 77 CO 0.40 0.12 0.11 -0.69 0.00 0.00 0.00 175.10 175.04 1hlw s VAL 78 N -0.62 3.91 -0.10 2.92 1.01 -0.84 -1.41 120.40 125.27 1hlw s VAL 78 Ca 0.03 -1.00 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 1hlw s VAL 78 Cb -0.07 -3.17 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 1hlw s VAL 78 CO 0.00 -0.13 0.28 0.00 0.00 0.00 0.00 175.10 175.26 1hlw s ALA 79 N 1.44 3.72 0.10 5.51 0.00 -0.17 -0.35 121.76 132.00 1hlw s ALA 79 Ca -0.00 -0.44 -0.12 0.00 0.00 0.00 0.00 51.96 51.40 1hlw s ALA 79 Cb -0.19 -2.25 0.01 0.00 0.00 0.00 0.00 23.12 20.69 1hlw s ALA 79 CO 0.03 0.38 0.28 0.00 0.00 0.00 0.00 175.76 176.45 1hlw s MET 80 N -0.51 0.92 -0.08 0.00 0.23 0.50 -2.01 119.30 118.36 1hlw s MET 80 Ca 0.18 -0.82 0.02 0.00 -1.03 0.00 0.00 55.69 54.05 1hlw s MET 80 Cb -0.14 0.39 0.01 0.00 -1.53 0.00 0.00 34.83 33.56 1hlw s MET 80 CO 0.07 -0.32 -0.14 0.08 -2.03 0.00 0.00 175.02 172.68 1hlw s VAL 81 N -3.69 1.29 0.04 5.16 1.01 -0.51 -1.13 120.40 122.57 1hlw s VAL 81 Ca 0.03 -0.55 0.07 0.00 0.00 0.00 0.00 61.98 61.54 1hlw s VAL 81 Cb 0.03 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.20 1hlw s VAL 81 CO -0.11 0.39 -0.19 -0.36 0.00 0.00 0.00 175.10 174.84 1hlw s PHE 82 N 0.78 2.53 -0.02 5.22 0.08 -0.92 -0.87 117.98 124.78 1hlw s PHE 82 Ca -0.12 -0.27 0.08 0.00 0.12 0.00 0.00 56.93 56.73 1hlw s PHE 82 Cb -0.16 -1.45 -0.02 0.00 -0.57 0.00 0.00 43.02 40.82 1hlw s PHE 82 CO 0.02 0.24 -0.25 -2.00 -0.10 0.00 0.00 175.22 173.13 1hlw s GLU 83 N -1.44 2.07 0.00 0.44 2.12 0.02 -1.41 118.70 120.51 1hlw s GLU 83 Ca 0.14 -0.91 0.00 0.00 0.36 0.00 0.00 54.97 54.57 1hlw s GLU 83 Cb -0.10 -1.99 0.00 0.00 0.26 0.00 0.00 34.13 32.29 1hlw s GLU 83 CO 0.05 0.54 0.00 0.41 -0.54 0.00 0.00 175.26 175.72 1hlw n GLY 84 N 2.47 1.85 3.73 -1.50 0.00 -0.13 -1.49 105.19 110.12 1hlw n GLY 84 Ca -0.16 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.40 1hlw n GLY 84 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hlw s LYS 85 N -2.00 4.23 -1.50 1.61 2.20 -1.24 -2.74 119.74 120.30 1hlw s LYS 85 Ca 0.00 2.34 0.00 0.00 -0.36 0.00 0.00 55.97 57.95 1hlw s LYS 85 Cb 0.00 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 1hlw s LYS 85 CO 0.00 -0.54 0.00 0.41 -0.36 0.00 0.00 175.35 174.86 1hlw n GLY 86 N 3.14 0.59 0.29 5.54 0.00 -1.26 -4.86 105.19 108.62 1hlw n GLY 86 Ca 0.11 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.17 1hlw n GLY 86 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1hlw h VAL 87 N 0.00 1.10 0.26 1.61 3.04 -1.82 -0.99 116.25 119.46 1hlw h VAL 87 Ca -0.34 -0.26 -0.01 0.00 -1.01 0.00 0.00 66.70 65.08 1hlw h VAL 87 Cb 1.13 0.70 0.00 0.00 -2.01 0.00 0.00 31.29 31.11 1hlw h VAL 87 CO 0.45 0.11 -0.13 0.58 -1.01 0.00 0.00 177.57 177.57 1hlw h VAL 88 N 0.42 0.76 -0.09 1.51 2.07 -1.87 0.14 116.25 119.19 1hlw h VAL 88 Ca 0.11 -0.11 -0.20 0.00 0.82 0.00 0.00 66.70 67.31 1hlw h VAL 88 Cb 0.02 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1hlw h VAL 88 CO -0.02 0.03 -0.78 0.00 0.02 0.00 0.00 177.57 176.82 1hlw h ALA 89 N 0.32 0.47 -0.55 1.67 0.00 -1.87 -3.10 119.26 116.19 1hlw h ALA 89 Ca -0.04 -0.62 -0.02 0.00 0.00 0.00 0.00 54.91 54.23 1hlw h ALA 89 Cb 0.31 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1hlw h ALA 89 CO 0.06 0.74 0.27 1.03 0.00 0.00 0.00 179.25 181.36 1hlw h SER 90 N 0.35 0.72 -0.14 0.00 0.87 -1.12 -2.00 113.55 112.23 1hlw h SER 90 Ca -0.05 -0.12 -0.04 0.00 -1.23 0.00 0.00 61.79 60.35 1hlw h SER 90 Cb 1.38 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 63.14 1hlw h SER 90 CO 0.14 0.64 -0.02 0.00 -0.53 0.00 0.00 176.83 177.06 1hlw h ALA 91 N 1.11 1.48 -0.43 6.23 0.00 -0.74 -1.35 119.26 125.57 1hlw h ALA 91 Ca 0.19 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1hlw h ALA 91 Cb 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1hlw h ALA 91 CO -0.03 0.37 -0.18 0.00 0.00 0.00 0.00 179.25 179.41 1hlw h ARG 92 N 0.38 0.82 -0.47 0.00 3.08 -1.39 -1.62 114.38 115.19 1hlw h ARG 92 Ca 0.08 -0.32 -0.09 0.00 0.07 0.00 0.00 59.98 59.73 1hlw h ARG 92 Cb 0.29 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1hlw h ARG 92 CO 0.01 0.94 -0.07 1.25 -1.07 0.00 0.00 179.97 181.03 1hlw h LEU 93 N 0.73 0.82 -1.20 3.04 5.85 -0.76 -1.59 115.31 122.19 1hlw h LEU 93 Ca 0.11 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.53 1hlw h LEU 93 Cb 0.70 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1hlw h LEU 93 CO 0.05 0.92 -0.30 0.24 -0.34 0.00 0.00 178.44 179.02 1hlw h MET 94 N 0.76 0.00 0.04 1.25 2.86 -0.95 -3.16 114.93 115.74 1hlw h MET 94 Ca 0.13 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.67 1hlw h MET 94 Cb 0.55 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.23 1hlw h MET 94 CO 0.03 0.30 -0.42 0.82 1.06 0.00 0.00 176.91 178.70 1hlw h ILE 95 N 0.00 1.57 0.00 -1.22 2.04 -0.93 -0.41 117.51 118.56 1hlw h ILE 95 Ca -0.00 -2.23 0.00 0.00 1.00 0.00 0.00 64.86 63.62 1hlw h ILE 95 Cb 0.73 3.01 0.00 0.00 -0.74 0.00 0.00 36.82 39.82 1hlw h ILE 95 CO 0.04 0.62 0.00 0.61 0.00 0.00 0.00 178.15 179.42 1hlw n GLY 96 N 1.36 -0.08 3.97 5.37 0.00 -0.63 -1.15 105.19 114.03 1hlw n GLY 96 Ca -0.11 -2.23 -0.20 0.00 0.00 0.00 0.00 46.02 43.48 1hlw n GLY 96 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hlw s VAL 97 N 0.00 2.49 0.27 1.61 -7.23 -1.26 -4.78 120.40 111.50 1hlw s VAL 97 Ca 0.00 -1.14 0.00 0.00 -1.81 0.00 0.00 61.98 59.03 1hlw s VAL 97 Cb 0.00 -2.63 0.25 0.00 0.56 0.00 0.00 36.38 34.57 1hlw s VAL 97 CO 0.00 0.00 1.76 0.74 -0.31 0.00 0.00 175.10 177.29 1hlw h THR 98 N 0.60 0.71 -3.59 5.32 2.02 -1.99 -3.36 112.91 112.62 1hlw h THR 98 Ca -0.37 -0.21 -0.64 0.00 0.77 0.00 0.00 66.41 65.96 1hlw h THR 98 Cb 1.28 0.03 -0.14 0.00 -1.74 0.00 0.00 68.15 67.58 1hlw h THR 98 CO 0.48 0.11 0.18 0.21 0.37 0.00 0.00 175.52 176.87 1hlw s ASN 99 N -5.41 6.38 0.52 4.18 3.04 -1.26 -4.67 114.94 117.73 1hlw s ASN 99 Ca -0.12 -0.10 0.22 0.00 0.04 0.00 0.00 52.86 52.90 1hlw s ASN 99 Cb 0.22 -2.34 1.34 0.00 -1.54 0.00 0.00 41.25 38.94 1hlw s ASN 99 CO 0.78 -0.73 2.03 -0.65 -3.04 0.00 0.00 177.10 175.49 1hlw h PRO 100 N 8.73 0.03 0.00 0.43 0.11 -1.84 -1.64 132.00 137.82 1hlw h PRO 100 Ca -0.26 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.81 1hlw h PRO 100 Cb 1.10 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1hlw h PRO 100 CO 0.88 0.02 -0.22 -0.07 -0.21 0.00 0.00 178.00 178.40 1hlw h LEU 101 N 0.03 0.00 -1.84 2.35 3.38 -1.77 -2.74 115.31 114.72 1hlw h LEU 101 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1hlw h LEU 101 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1hlw h LEU 101 CO -0.01 0.22 -0.03 0.00 0.09 0.00 0.00 178.44 178.72 1hlw n ALA 102 N -2.30 2.53 -1.76 1.53 0.00 -0.63 -4.95 120.51 114.92 1hlw n ALA 102 Ca -0.01 -0.68 -0.39 0.00 0.00 0.00 0.00 53.44 52.36 1hlw n ALA 102 Cb 0.35 -0.82 -0.06 0.00 0.00 0.00 0.00 19.45 18.92 1hlw n ALA 102 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1hlw s SER 103 N -2.03 7.53 0.44 0.00 0.01 -1.03 -4.88 113.70 113.74 1hlw s SER 103 Ca 0.28 1.93 -0.23 0.00 1.31 0.00 0.00 55.95 59.23 1hlw s SER 103 Cb 0.20 -2.60 -0.08 0.00 0.21 0.00 0.00 66.02 63.75 1hlw s SER 103 CO 0.32 0.07 1.12 0.00 0.41 0.00 0.00 173.24 175.15 1hlw s ALA 104 N -1.32 3.00 0.44 1.44 0.00 -1.26 -4.35 121.76 119.70 1hlw s ALA 104 Ca 0.44 0.83 -0.25 0.00 0.00 0.00 0.00 51.96 52.99 1hlw s ALA 104 Cb -0.24 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.45 1hlw s ALA 104 CO 0.30 -0.49 1.28 -2.30 0.00 0.00 0.00 175.76 174.55 1hlw n PRO 105 N -0.41 1.91 0.00 0.00 -0.02 -1.26 -1.81 135.00 133.41 1hlw n PRO 105 Ca 0.07 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1hlw n PRO 105 Cb 0.49 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1hlw n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hlw n GLY 106 N 0.80 2.07 3.92 -1.23 0.00 -1.26 -4.96 105.19 104.53 1hlw n GLY 106 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 1hlw n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hlw s SER 107 N 0.20 6.17 0.06 1.61 1.04 -0.75 -4.92 113.70 117.11 1hlw s SER 107 Ca 0.00 0.77 -0.27 0.00 0.48 0.00 0.00 55.95 56.94 1hlw s SER 107 Cb 0.00 -2.10 -0.17 0.00 0.10 0.00 0.00 66.02 63.85 1hlw s SER 107 CO 0.00 -0.58 1.57 0.40 0.98 0.00 0.00 173.24 175.61 1hlw h ILE 108 N 0.29 0.76 -0.27 -1.02 2.04 -1.02 0.03 117.51 118.32 1hlw h ILE 108 Ca -0.47 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.11 1hlw h ILE 108 Cb 1.22 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 1hlw h ILE 108 CO 0.61 0.04 -0.15 0.03 0.00 0.00 0.00 178.15 178.69 1hlw h ARG 109 N -0.47 0.47 -0.50 2.37 3.08 -1.39 -1.38 114.38 116.56 1hlw h ARG 109 Ca -0.04 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 59.81 1hlw h ARG 109 Cb 0.35 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1hlw h ARG 109 CO 0.06 0.62 0.07 0.78 -1.07 0.00 0.00 179.97 180.43 1hlw h GLY 110 N 0.94 0.84 1.69 0.04 0.00 -1.67 -1.03 103.07 103.88 1hlw h GLY 110 Ca 0.08 -0.51 -0.20 0.00 0.00 0.00 0.00 47.33 46.70 1hlw h GLY 110 CO 0.03 0.48 -1.09 -0.55 0.00 0.00 0.00 176.54 175.41 1hlw h ASP 111 N 0.74 0.00 0.00 0.19 3.32 -0.69 -3.42 116.42 116.56 1hlw h ASP 111 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1hlw h ASP 111 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 1hlw h ASP 111 CO 0.01 0.86 -0.09 0.49 -1.72 0.00 0.00 179.24 178.79 1hlw n PHE 112 N -3.22 0.00 -4.40 4.55 3.72 -0.55 -5.07 117.46 112.49 1hlw n PHE 112 Ca -0.04 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.12 1hlw n PHE 112 Cb 0.91 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 39.36 1hlw n PHE 112 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1hlw s GLY 113 N -0.91 1.82 0.00 1.37 0.00 -0.39 -5.03 107.32 104.18 1hlw s GLY 113 Ca 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 44.72 42.91 1hlw s GLY 113 CO 0.00 -1.88 0.00 -0.62 0.00 0.00 0.00 173.10 170.60 1hlw n VAL 114 N -0.74 0.00 -4.97 1.40 0.31 -1.26 -4.36 118.33 108.71 1hlw n VAL 114 Ca -0.05 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.01 1hlw n VAL 114 Cb 0.60 0.09 -0.16 0.00 -0.91 0.00 0.00 33.84 33.47 1hlw n VAL 114 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1hlw s ASP 115 N -0.79 2.35 0.27 4.52 2.15 -1.26 -4.41 116.67 119.49 1hlw s ASP 115 Ca 0.00 -0.37 0.00 0.00 0.43 0.00 0.00 52.55 52.61 1hlw s ASP 115 Cb 0.00 -0.34 0.52 0.00 -0.30 0.00 0.00 42.92 42.79 1hlw s ASP 115 CO 0.00 0.23 1.83 0.58 -0.17 0.00 0.00 175.17 177.65 1hlw h VAL 116 N 4.76 0.93 0.00 1.11 2.07 -1.97 -1.59 116.25 121.57 1hlw h VAL 116 Ca -0.37 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 66.81 1hlw h VAL 116 Cb 1.15 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1hlw h VAL 116 CO 0.48 0.18 0.00 0.61 0.02 0.00 0.00 177.57 178.86 1hlw n GLY 117 N -1.34 -1.07 2.24 2.17 0.00 -1.26 -3.62 105.19 102.30 1hlw n GLY 117 Ca 0.18 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 1hlw n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hlw n ARG 118 N -1.14 1.02 -0.91 1.61 5.12 -0.60 -4.93 116.66 116.83 1hlw n ARG 118 Ca 0.18 -3.45 -0.07 0.00 -1.93 0.00 0.00 57.85 52.58 1hlw n ARG 118 Cb 0.16 -1.44 0.24 0.00 -1.16 0.00 0.00 32.46 30.26 1hlw n ARG 118 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1hlw n ASN 119 N 1.09 3.69 0.00 0.55 6.94 -1.21 -4.27 115.26 122.06 1hlw n ASN 119 Ca 0.23 -3.45 0.00 0.00 -0.02 0.00 0.00 54.58 51.34 1hlw n ASN 119 Cb 0.54 -0.70 0.00 0.00 -2.36 0.00 0.00 39.78 37.26 1hlw n ASN 119 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 1hlw n ILE 120 N -0.75 0.00 -3.78 1.53 5.41 -1.26 -4.76 119.36 115.75 1hlw n ILE 120 Ca 0.40 0.00 -0.11 0.00 1.00 0.00 0.00 62.75 64.03 1hlw n ILE 120 Cb 1.26 0.00 -0.07 0.00 -0.71 0.00 0.00 39.64 40.12 1hlw n ILE 120 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1hlw s ILE 121 N 0.00 0.09 0.00 1.39 2.07 -1.26 -0.95 121.20 122.54 1hlw s ILE 121 Ca 0.00 -0.75 -0.01 0.00 -1.41 0.00 0.00 60.65 58.49 1hlw s ILE 121 Cb 0.00 -0.95 -0.00 0.00 0.13 0.00 0.00 42.46 41.63 1hlw s ILE 121 CO 0.00 -0.41 0.01 0.00 -1.91 0.00 0.00 174.94 172.62 1hlw s ALA 122 N -2.64 -0.00 0.23 1.50 0.00 -0.73 -4.94 121.76 115.18 1hlw s ALA 122 Ca -0.04 -0.14 0.07 0.00 0.00 0.00 0.00 51.96 51.85 1hlw s ALA 122 Cb -0.01 0.03 -0.05 0.00 0.00 0.00 0.00 23.12 23.09 1hlw s ALA 122 CO -0.04 -0.06 -0.10 0.20 0.00 0.00 0.00 175.76 175.76 1hlw s GLY 123 N -0.44 1.58 0.43 0.00 0.00 -1.26 -1.28 107.32 106.34 1hlw s GLY 123 Ca -0.05 -1.75 -0.26 0.00 0.00 0.00 0.00 44.72 42.66 1hlw s GLY 123 CO -0.00 -1.78 1.40 1.44 0.00 0.00 0.00 173.10 174.16 1hlw n SER 124 N -0.45 3.20 -0.01 1.64 7.64 -0.59 -4.93 113.62 120.10 1hlw n SER 124 Ca -0.07 1.14 0.12 0.00 1.01 0.00 0.00 58.87 61.07 1hlw n SER 124 Cb 0.62 -1.58 0.30 0.00 -1.01 0.00 0.00 64.21 62.53 1hlw n SER 124 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1hlw n ASP 125 N 0.04 0.47 -3.70 6.43 5.68 -1.26 -4.88 116.55 119.34 1hlw n ASP 125 Ca 0.05 -0.21 -0.09 0.00 -0.50 0.00 0.00 54.79 54.04 1hlw n ASP 125 Cb 0.40 0.17 -0.03 0.00 -1.14 0.00 0.00 41.12 40.53 1hlw n ASP 125 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1hlw s SER 126 N -2.97 -0.34 0.29 -1.12 1.04 -1.26 -4.96 113.70 104.37 1hlw s SER 126 Ca 0.12 -0.41 -0.02 0.00 0.48 0.00 0.00 55.95 56.12 1hlw s SER 126 Cb 0.18 0.64 0.42 0.00 0.10 0.00 0.00 66.02 67.36 1hlw s SER 126 CO 0.67 -1.15 1.95 0.58 0.98 0.00 0.00 173.24 176.27 1hlw h VAL 127 N 2.06 1.19 -0.34 5.02 2.07 -1.93 0.73 116.25 125.06 1hlw h VAL 127 Ca -0.26 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 66.80 1hlw h VAL 127 Cb 1.27 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1hlw h VAL 127 CO 0.32 0.21 -0.01 -0.33 0.02 0.00 0.00 177.57 177.78 1hlw h GLU 128 N 1.15 0.61 -0.43 1.57 3.07 -1.97 0.02 114.58 118.61 1hlw h GLU 128 Ca 0.34 -0.20 -0.13 0.00 -0.50 0.00 0.00 59.36 58.87 1hlw h GLU 128 Cb -0.05 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.79 1hlw h GLU 128 CO -0.09 0.73 -0.25 0.66 -1.40 0.00 0.00 179.01 178.66 1hlw h SER 129 N 0.41 0.91 -0.48 1.42 4.64 -1.88 -2.31 113.55 116.26 1hlw h SER 129 Ca 0.10 -0.35 0.06 0.00 -0.47 0.00 0.00 61.79 61.13 1hlw h SER 129 Cb 0.46 -0.25 -0.05 0.00 -0.31 0.00 0.00 62.40 62.25 1hlw h SER 129 CO 0.02 1.11 0.18 0.00 -0.87 0.00 0.00 176.83 177.27 1hlw h ALA 130 N 0.95 0.59 -0.72 5.18 0.00 -0.49 0.19 119.26 124.96 1hlw h ALA 130 Ca 0.09 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1hlw h ALA 130 Cb 0.80 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 1hlw h ALA 130 CO 0.07 -0.21 0.43 -0.91 0.00 0.00 0.00 179.25 178.63 1hlw h ASN 131 N 0.35 0.86 -0.15 0.00 2.35 -0.82 0.15 115.58 118.32 1hlw h ASN 131 Ca 0.23 -0.05 -0.06 0.00 -0.55 0.00 0.00 56.30 55.87 1hlw h ASN 131 Cb 0.23 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.39 1hlw h ASN 131 CO -0.23 0.66 -0.15 -0.09 -1.65 0.00 0.00 177.43 175.97 1hlw h ARG 132 N 0.99 0.36 -0.55 0.81 2.43 -0.73 -2.97 114.38 114.72 1hlw h ARG 132 Ca 0.26 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 59.19 1hlw h ARG 132 Cb -0.04 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1hlw h ARG 132 CO -0.05 0.75 0.15 0.93 -1.51 0.00 0.00 179.97 180.24 1hlw h GLU 133 N -0.01 0.87 -0.68 0.20 5.08 -0.32 -2.07 114.58 117.65 1hlw h GLU 133 Ca 0.02 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.21 1hlw h GLU 133 Cb 0.69 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 1hlw h GLU 133 CO 0.04 0.81 0.43 0.82 -1.00 0.00 0.00 179.01 180.10 1hlw h ILE 134 N 0.78 1.11 0.00 3.13 2.04 -0.78 -1.49 117.51 122.30 1hlw h ILE 134 Ca 0.18 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 1hlw h ILE 134 Cb 0.31 0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1hlw h ILE 134 CO -0.00 0.15 -0.11 0.00 0.00 0.00 0.00 178.15 178.19 1hlw h ALA 135 N 1.28 1.05 0.11 1.87 0.00 -1.32 -1.27 119.26 120.98 1hlw h ALA 135 Ca 0.27 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 1hlw h ALA 135 Cb -0.00 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.79 1hlw h ALA 135 CO -0.10 0.14 -0.71 1.25 0.00 0.00 0.00 179.25 179.83 1hlw h LEU 136 N 0.00 0.43 0.00 0.00 6.46 -0.63 -3.38 115.31 118.19 1hlw h LEU 136 Ca -0.00 -0.93 -0.17 0.00 -0.12 0.00 0.00 57.88 56.66 1hlw h LEU 136 Cb 0.56 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 40.33 1hlw h LEU 136 CO 0.01 1.33 -1.11 -0.50 -0.62 0.00 0.00 178.44 177.55 1hlw h TRP 137 N -0.39 0.00 -4.37 1.25 4.06 -1.27 -3.47 115.95 111.75 1hlw h TRP 137 Ca -0.12 0.00 -0.60 0.00 2.06 0.00 0.00 58.89 60.23 1hlw h TRP 137 Cb 1.54 0.00 -0.30 0.00 -1.00 0.00 0.00 29.16 29.40 1hlw h TRP 137 CO 0.20 0.66 -0.85 -0.06 -3.56 0.00 0.00 178.44 174.83 1hlw s PHE 138 N -2.87 1.82 0.43 0.49 0.40 -0.49 -5.11 117.98 112.67 1hlw s PHE 138 Ca -0.00 -0.36 -0.21 0.00 -0.60 0.00 0.00 56.93 55.76 1hlw s PHE 138 Cb 0.08 -1.18 -0.11 0.00 0.51 0.00 0.00 43.02 42.33 1hlw s PHE 138 CO 0.79 -0.04 0.95 0.15 0.70 0.00 0.00 175.22 177.77 1hlw s LYS 139 N -0.44 4.21 0.40 0.44 1.02 -1.26 -4.59 119.74 119.53 1hlw s LYS 139 Ca 0.07 1.13 0.16 0.00 0.02 0.00 0.00 55.97 57.35 1hlw s LYS 139 Cb -0.08 -2.18 1.04 0.00 -0.52 0.00 0.00 37.83 36.09 1hlw s LYS 139 CO -0.00 -0.05 1.84 -1.35 -0.92 0.00 0.00 175.35 174.86 1hlw h PRO 140 N 1.88 0.44 0.00 -1.68 0.11 -1.94 0.30 132.00 131.10 1hlw h PRO 140 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1hlw h PRO 140 Cb 1.18 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1hlw h PRO 140 CO 0.61 0.29 0.00 0.39 -0.21 0.00 0.00 178.00 179.08 1hlw n GLU 141 N -4.55 0.12 0.00 1.05 4.71 -1.26 -2.47 120.64 118.25 1hlw n GLU 141 Ca 0.20 0.11 0.13 0.00 -0.01 0.00 0.00 57.16 57.60 1hlw n GLU 141 Cb 0.70 -1.50 0.46 0.00 -1.01 0.00 0.00 31.44 30.09 1hlw n GLU 141 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1hlw n GLU 142 N -1.42 0.68 -4.62 3.49 1.02 0.09 -4.86 120.64 115.03 1hlw n GLU 142 Ca 0.07 -0.34 -0.34 0.00 -0.02 0.00 0.00 57.16 56.54 1hlw n GLU 142 Cb 0.22 -1.49 -0.11 0.00 -0.02 0.00 0.00 31.44 30.03 1hlw n GLU 142 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1hlw s LEU 143 N -2.55 3.18 0.44 -4.62 1.43 -1.03 -4.52 118.68 111.00 1hlw s LEU 143 Ca 0.24 -0.02 -0.25 0.00 -1.03 0.00 0.00 54.13 53.07 1hlw s LEU 143 Cb 0.19 -1.69 -0.08 0.00 0.03 0.00 0.00 46.19 44.64 1hlw s LEU 143 CO 0.52 0.36 1.36 -0.76 0.23 0.00 0.00 176.35 178.05 1hlw s LEU 144 N -0.78 4.14 -0.26 1.79 1.43 0.07 -4.93 118.68 120.14 1hlw s LEU 144 Ca 0.12 2.77 -0.07 0.00 -1.03 0.00 0.00 54.13 55.91 1hlw s LEU 144 Cb -0.11 -3.95 -0.15 0.00 0.03 0.00 0.00 46.19 42.00 1hlw s LEU 144 CO 0.01 -1.05 -0.24 0.41 0.23 0.00 0.00 176.35 175.72 1hlw n THR 145 N -0.12 1.53 -3.40 5.49 -1.04 -1.26 -4.87 114.28 110.61 1hlw n THR 145 Ca 0.05 -0.46 -0.39 0.00 -2.04 0.00 0.00 64.05 61.21 1hlw n THR 145 Cb 0.43 -1.68 -0.09 0.00 -1.82 0.00 0.00 70.33 67.17 1hlw n THR 145 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 1hlw s GLU 146 N -2.51 4.04 -0.07 -2.82 4.04 -1.26 -5.06 118.70 115.06 1hlw s GLU 146 Ca -0.36 0.05 0.05 0.00 0.04 0.00 0.00 54.97 54.74 1hlw s GLU 146 Cb 0.11 -3.64 -0.01 0.00 0.02 0.00 0.00 34.13 30.61 1hlw s GLU 146 CO 0.56 -0.24 -0.21 0.08 -1.84 0.00 0.00 175.26 173.61 1hlw s VAL 147 N 1.95 2.44 -0.29 1.83 1.01 -1.26 -5.09 120.40 120.99 1hlw s VAL 147 Ca 0.15 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.21 1hlw s VAL 147 Cb -0.16 -1.93 0.09 0.00 0.00 0.00 0.00 36.38 34.39 1hlw s VAL 147 CO 0.10 0.57 0.06 -0.54 0.00 0.00 0.00 175.10 175.28 1hlw s LYS 148 N -0.21 0.97 0.61 2.72 -0.14 -1.26 -5.13 119.74 117.30 1hlw s LYS 148 Ca -0.01 -1.13 -0.12 0.00 -1.36 0.00 0.00 55.97 53.35 1hlw s LYS 148 Cb -0.13 -2.29 -0.04 0.00 -1.68 0.00 0.00 37.83 33.68 1hlw s LYS 148 CO 0.03 -0.88 1.03 -1.25 -0.76 0.00 0.00 175.35 173.51 1hlw s PRO 149 N 1.49 3.60 0.40 -1.68 0.04 -1.26 -4.98 135.00 132.61 1hlw s PRO 149 Ca 0.06 0.81 -0.25 0.00 0.04 0.00 0.00 61.00 61.67 1hlw s PRO 149 Cb -0.18 -2.08 -0.11 0.00 0.04 0.00 0.00 34.50 32.17 1hlw s PRO 149 CO -0.18 -0.57 0.94 -1.71 0.04 0.00 0.00 177.00 175.52 1hlw n ASN 150 N -2.58 0.94 0.00 6.66 2.85 -1.26 -4.84 115.26 117.02 1hlw n ASN 150 Ca 0.06 1.04 0.12 0.00 -0.11 0.00 0.00 54.58 55.69 1hlw n ASN 150 Cb 0.54 -1.31 0.60 0.00 1.24 0.00 0.00 39.78 40.86 1hlw n ASN 150 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1hlw n PRO 151 N 0.29 0.34 -0.28 1.20 -0.04 -1.26 -3.14 135.00 132.11 1hlw n PRO 151 Ca 0.10 0.06 0.11 0.00 -0.04 0.00 0.00 63.50 63.73 1hlw n PRO 151 Cb 0.38 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.62 1hlw n PRO 151 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1hlw n ASN 152 N -1.28 3.49 -0.08 3.54 3.02 -1.26 -4.38 115.26 118.30 1hlw n ASN 152 Ca 0.11 -1.98 -0.12 0.00 -0.03 0.00 0.00 54.58 52.56 1hlw n ASN 152 Cb 0.19 -0.37 -0.15 0.00 -0.61 0.00 0.00 39.78 38.85 1hlw n ASN 152 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1hlw n LEU 153 N 1.44 0.80 -4.29 3.41 4.77 -1.19 -4.98 117.00 116.97 1hlw n LEU 153 Ca 0.21 0.09 -0.29 0.00 -0.03 0.00 0.00 56.01 55.99 1hlw n LEU 153 Cb 0.57 0.12 -0.15 0.00 -2.33 0.00 0.00 43.42 41.63 1hlw n LEU 153 CO 0.16 0.56 -0.55 -0.31 -1.33 0.00 0.00 177.39 175.91 1hlw s TYR 154 N -2.52 2.14 -2.27 -1.77 2.02 -1.26 -5.14 117.35 108.54 1hlw s TYR 154 Ca -0.13 -0.40 0.30 0.00 -0.37 0.00 0.00 57.07 56.46 1hlw s TYR 154 Cb 0.07 -1.34 1.44 0.00 -0.40 0.00 0.00 41.96 41.73 1hlw s TYR 154 CO 0.79 0.02 1.96 -1.91 -1.57 0.00 0.00 175.55 174.84