#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f0l s HIS 8 N 0.00 0.50 0.08 -1.77 -3.43 -1.26 -5.13 115.29 104.28 2f0l s HIS 8 Ca 0.00 -0.57 -0.13 0.00 -0.80 0.00 0.00 55.06 53.56 2f0l s HIS 8 Cb 0.00 -0.32 -0.06 0.00 -1.43 0.00 0.00 32.58 30.77 2f0l s HIS 8 CO 0.00 -0.15 0.46 0.15 -2.00 0.00 0.00 174.74 173.19 2f0l s LYS 9 N -1.80 3.88 0.04 -0.38 1.02 -1.26 -4.37 119.74 116.87 2f0l s LYS 9 Ca -0.10 0.35 0.04 0.00 0.02 0.00 0.00 55.97 56.28 2f0l s LYS 9 Cb -0.08 -3.04 -0.02 0.00 -0.52 0.00 0.00 37.83 34.17 2f0l s LYS 9 CO -0.01 0.57 -0.13 -1.21 -0.92 0.00 0.00 175.35 173.65 2f0l s GLU 10 N -1.70 0.85 0.59 1.68 2.02 -0.68 -4.96 118.70 116.50 2f0l s GLU 10 Ca 0.32 -0.75 -0.15 0.00 0.02 0.00 0.00 54.97 54.41 2f0l s GLU 10 Cb -0.15 -0.83 -0.04 0.00 0.10 0.00 0.00 34.13 33.20 2f0l s GLU 10 CO 0.17 0.20 1.04 -1.25 0.02 0.00 0.00 175.26 175.44 2f0l s PRO 11 N -1.20 3.45 0.17 0.39 0.04 -1.26 -0.12 135.00 136.47 2f0l s PRO 11 Ca -0.00 1.09 -0.11 0.00 0.04 0.00 0.00 61.00 62.02 2f0l s PRO 11 Cb -0.08 -2.06 -0.00 0.00 0.04 0.00 0.00 34.50 32.40 2f0l s PRO 11 CO 0.01 -0.69 0.35 0.00 0.04 0.00 0.00 177.00 176.70 2f0l s ALA 12 N -2.59 -0.22 -0.03 8.56 0.00 -0.98 -4.62 121.76 121.87 2f0l s ALA 12 Ca 0.61 -0.74 0.05 0.00 0.00 0.00 0.00 51.96 51.89 2f0l s ALA 12 Cb -0.14 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.84 2f0l s ALA 12 CO 0.38 -0.69 -0.18 0.99 0.00 0.00 0.00 175.76 176.26 2f0l s THR 13 N -3.95 1.48 0.26 0.00 2.01 -0.71 -4.26 115.64 110.47 2f0l s THR 13 Ca 0.16 -0.76 -0.30 0.00 0.31 0.00 0.00 61.69 61.09 2f0l s THR 13 Cb 0.02 -1.26 -0.10 0.00 0.01 0.00 0.00 72.50 71.18 2f0l s THR 13 CO -0.00 0.42 1.36 -0.22 -0.69 0.00 0.00 174.62 175.49 2f0l s LEU 14 N -0.14 4.41 -0.15 4.42 2.96 -1.26 -0.59 118.68 128.32 2f0l s LEU 14 Ca 0.00 2.59 -0.09 0.00 -0.22 0.00 0.00 54.13 56.42 2f0l s LEU 14 Cb -0.10 -3.63 -0.07 0.00 0.50 0.00 0.00 46.19 42.90 2f0l s LEU 14 CO 0.01 -0.60 -0.22 -0.38 -1.32 0.00 0.00 176.35 173.84 2f0l n ILE 15 N 1.98 1.00 -3.66 6.68 5.41 0.00 -4.81 119.36 125.95 2f0l n ILE 15 Ca 0.05 -0.16 -0.08 0.00 1.00 0.00 0.00 62.75 63.55 2f0l n ILE 15 Cb 0.41 -1.78 -0.08 0.00 -0.71 0.00 0.00 39.64 37.48 2f0l n ILE 15 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2f0l s LYS 16 N -2.35 0.55 0.01 0.38 2.20 -0.63 -5.02 119.74 114.88 2f0l s LYS 16 Ca -0.23 1.06 -0.29 0.00 -0.36 0.00 0.00 55.97 56.15 2f0l s LYS 16 Cb 0.08 0.13 -0.04 0.00 -1.51 0.00 0.00 37.83 36.50 2f0l s LYS 16 CO 0.29 -0.16 0.92 0.00 -0.36 0.00 0.00 175.35 176.04 2f0l s ALA 17 N 1.68 3.21 -0.22 3.13 0.00 -1.26 -0.61 121.76 127.69 2f0l s ALA 17 Ca -0.09 0.47 0.02 0.00 0.00 0.00 0.00 51.96 52.36 2f0l s ALA 17 Cb -0.07 -3.26 -0.14 0.00 0.00 0.00 0.00 23.12 19.65 2f0l s ALA 17 CO -0.17 -0.17 -0.19 -0.89 0.00 0.00 0.00 175.76 174.34 2f0l n ILE 18 N 3.68 1.26 -3.62 0.00 5.41 -0.11 -4.95 119.36 121.03 2f0l n ILE 18 Ca 0.04 -0.48 -0.07 0.00 1.00 0.00 0.00 62.75 63.24 2f0l n ILE 18 Cb 0.51 -1.28 0.01 0.00 -0.71 0.00 0.00 39.64 38.17 2f0l n ILE 18 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2f0l n ASP 19 N -3.14 -1.25 0.13 4.38 -0.08 -0.96 -4.97 116.55 110.67 2f0l n ASP 19 Ca -0.39 -2.06 0.13 0.00 -1.51 0.00 0.00 54.79 50.96 2f0l n ASP 19 Cb 0.92 2.13 0.65 0.00 2.34 0.00 0.00 41.12 47.16 2f0l n ASP 19 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2f0l h GLY 20 N 1.24 0.05 -0.25 0.27 0.00 -1.84 -3.20 103.07 99.34 2f0l h GLY 20 Ca -0.20 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2f0l h GLY 20 CO 0.25 0.01 -0.13 2.09 0.00 0.00 0.00 176.54 178.77 2f0l n ASP 21 N -4.47 1.23 -3.82 0.19 3.85 -1.26 -4.77 116.55 107.50 2f0l n ASP 21 Ca 0.03 -2.16 -0.18 0.00 -0.71 0.00 0.00 54.79 51.77 2f0l n ASP 21 Cb 0.32 -0.19 -0.16 0.00 -1.35 0.00 0.00 41.12 39.74 2f0l n ASP 21 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 2f0l s THR 22 N -1.16 0.24 0.05 2.12 2.01 -1.21 -1.10 115.64 116.59 2f0l s THR 22 Ca 0.10 0.06 0.05 0.00 0.31 0.00 0.00 61.69 62.21 2f0l s THR 22 Cb 0.09 -0.33 -0.02 0.00 0.01 0.00 0.00 72.50 72.25 2f0l s THR 22 CO 0.01 0.16 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.20 2f0l s LEU 23 N 1.07 2.22 -0.28 4.42 1.43 -0.47 -0.94 118.68 126.13 2f0l s LEU 23 Ca -0.09 -0.53 -0.10 0.00 -1.03 0.00 0.00 54.13 52.39 2f0l s LEU 23 Cb -0.14 -0.57 -0.03 0.00 0.03 0.00 0.00 46.19 45.49 2f0l s LEU 23 CO -0.02 -0.01 0.15 -0.75 0.23 0.00 0.00 176.35 175.95 2f0l s LYS 24 N -1.40 3.67 0.18 1.70 2.20 0.22 0.91 119.74 127.21 2f0l s LYS 24 Ca 0.00 -0.50 0.10 0.00 -0.36 0.00 0.00 55.97 55.21 2f0l s LYS 24 Cb -0.09 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 2f0l s LYS 24 CO 0.02 -0.26 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.03 2f0l s LEU 25 N 1.68 2.44 -0.30 5.43 1.43 0.47 -0.82 118.68 129.01 2f0l s LEU 25 Ca 0.06 -0.86 -0.19 0.00 -1.03 0.00 0.00 54.13 52.11 2f0l s LEU 25 Cb -0.16 -0.95 -0.01 0.00 0.03 0.00 0.00 46.19 45.10 2f0l s LEU 25 CO 0.07 0.02 0.56 -0.32 0.23 0.00 0.00 176.35 176.92 2f0l s MET 26 N -2.75 3.91 -0.07 1.70 -2.45 0.24 -0.02 119.30 119.87 2f0l s MET 26 Ca 0.17 0.22 0.01 0.00 -1.25 0.00 0.00 55.69 54.84 2f0l s MET 26 Cb -0.07 -3.71 0.02 0.00 1.25 0.00 0.00 34.83 32.32 2f0l s MET 26 CO 0.08 -0.50 -0.07 -0.47 1.05 0.00 0.00 175.02 175.11 2f0l s TYR 27 N 2.46 1.09 -1.56 4.11 5.04 0.88 -1.74 117.35 127.64 2f0l s TYR 27 Ca 0.22 -0.40 -0.13 0.00 -2.44 0.00 0.00 57.07 54.32 2f0l s TYR 27 Cb -0.15 -0.91 0.09 0.00 0.35 0.00 0.00 41.96 41.34 2f0l s TYR 27 CO 0.11 -0.29 0.86 1.63 -1.34 0.00 0.00 175.55 176.52 2f0l n LYS 28 N 4.25 -4.65 -0.83 4.97 4.01 -1.26 -1.19 118.16 123.46 2f0l n LYS 28 Ca -0.20 0.52 0.00 0.00 -0.51 0.00 0.00 58.31 58.12 2f0l n LYS 28 Cb 0.51 -5.28 0.00 0.00 -0.51 0.00 0.00 35.03 29.75 2f0l n LYS 28 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2f0l n GLY 29 N -1.62 0.56 3.48 0.72 0.00 -1.26 -4.99 105.19 102.07 2f0l n GLY 29 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2f0l n GLY 29 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2f0l s GLN 30 N -0.45 2.34 0.11 1.61 1.11 -0.34 -5.09 119.66 118.95 2f0l s GLN 30 Ca 0.00 -0.81 -0.30 0.00 0.01 0.00 0.00 55.36 54.25 2f0l s GLN 30 Cb 0.00 -2.31 -0.07 0.00 -1.01 0.00 0.00 33.01 29.62 2f0l s GLN 30 CO 0.00 0.59 1.21 -1.25 0.01 0.00 0.00 175.29 175.85 2f0l s PRO 31 N -1.07 4.45 -0.07 2.91 0.04 -1.26 -0.08 135.00 139.92 2f0l s PRO 31 Ca 0.13 1.83 -0.07 0.00 0.04 0.00 0.00 61.00 62.93 2f0l s PRO 31 Cb -0.11 -3.30 0.02 0.00 0.04 0.00 0.00 34.50 31.15 2f0l s PRO 31 CO 0.03 -0.21 0.19 1.41 0.04 0.00 0.00 177.00 178.47 2f0l s MET 32 N 0.61 0.26 -0.04 4.56 1.75 0.97 -4.94 119.30 122.47 2f0l s MET 32 Ca 0.57 0.20 -0.23 0.00 -1.25 0.00 0.00 55.69 54.99 2f0l s MET 32 Cb -0.31 0.12 -0.04 0.00 2.84 0.00 0.00 34.83 37.44 2f0l s MET 32 CO 0.32 -0.04 0.68 0.99 -0.65 0.00 0.00 175.02 176.32 2f0l s THR 33 N -0.05 4.98 -0.01 10.11 2.01 -1.26 -0.40 115.64 131.02 2f0l s THR 33 Ca -0.02 1.41 0.06 0.00 0.31 0.00 0.00 61.69 63.45 2f0l s THR 33 Cb -0.02 -4.02 -0.03 0.00 0.01 0.00 0.00 72.50 68.45 2f0l s THR 33 CO 0.00 0.31 -0.17 -0.36 -0.69 0.00 0.00 174.62 173.71 2f0l s PHE 34 N 0.45 2.59 -0.18 4.92 0.40 0.26 -1.11 117.98 125.32 2f0l s PHE 34 Ca 0.36 -0.24 -0.05 0.00 -0.60 0.00 0.00 56.93 56.40 2f0l s PHE 34 Cb -0.18 -1.55 -0.03 0.00 0.51 0.00 0.00 43.02 41.77 2f0l s PHE 34 CO 0.18 0.18 0.01 0.50 0.70 0.00 0.00 175.22 176.78 2f0l s ARG 35 N -0.97 3.76 -0.02 0.44 6.06 0.17 -1.37 118.95 127.02 2f0l s ARG 35 Ca 0.12 -0.46 -0.30 0.00 -2.50 0.00 0.00 55.73 52.60 2f0l s ARG 35 Cb -0.10 -3.06 -0.06 0.00 0.06 0.00 0.00 34.95 31.79 2f0l s ARG 35 CO 0.02 0.20 1.64 -0.51 -2.50 0.00 0.00 175.30 174.15 2f0l s LEU 36 N 0.52 4.33 0.37 -0.88 1.43 -0.26 -2.85 118.68 121.35 2f0l s LEU 36 Ca -0.00 2.29 -0.28 0.00 -1.03 0.00 0.00 54.13 55.10 2f0l s LEU 36 Cb -0.14 -3.54 -0.11 0.00 0.03 0.00 0.00 46.19 42.43 2f0l s LEU 36 CO 0.02 -0.90 1.46 0.18 0.23 0.00 0.00 176.35 177.34 2f0l n LEU 37 N 6.67 4.57 0.00 1.79 4.77 -0.64 -3.74 117.00 130.41 2f0l n LEU 37 Ca 0.17 1.22 0.00 0.00 -0.03 0.00 0.00 56.01 57.37 2f0l n LEU 37 Cb 0.42 -1.60 0.00 0.00 -2.33 0.00 0.00 43.42 39.92 2f0l n LEU 37 CO 0.62 0.06 0.00 0.18 -1.33 0.00 0.00 177.39 176.92 2f0l n LEU 38 N 0.57 0.28 -4.09 2.23 4.77 -1.26 -4.90 117.00 114.59 2f0l n LEU 38 Ca 0.02 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.83 2f0l n LEU 38 Cb 0.38 -0.87 -0.13 0.00 -2.33 0.00 0.00 43.42 40.48 2f0l n LEU 38 CO 0.64 -0.24 -0.44 0.68 -1.33 0.00 0.00 177.39 176.70 2f0l s VAL 39 N -2.15 0.85 -0.24 4.08 -7.23 -1.25 -0.50 120.40 113.97 2f0l s VAL 39 Ca 0.00 -0.92 -0.03 0.00 -1.81 0.00 0.00 61.98 59.21 2f0l s VAL 39 Cb 0.00 -0.80 0.00 0.00 0.56 0.00 0.00 36.38 36.14 2f0l s VAL 39 CO 0.00 -0.10 -0.04 -1.81 -0.31 0.00 0.00 175.10 172.84 2f0l s ASP 40 N -1.14 4.36 0.22 4.85 1.01 -0.20 -4.77 116.67 120.98 2f0l s ASP 40 Ca -0.02 -0.57 0.06 0.00 0.71 0.00 0.00 52.55 52.73 2f0l s ASP 40 Cb -0.08 -1.73 -0.03 0.00 1.01 0.00 0.00 42.92 42.09 2f0l s ASP 40 CO 0.01 -0.07 0.23 0.42 0.21 0.00 0.00 175.17 175.97 2f0l s THR 41 N 1.43 4.74 0.54 -1.27 -4.23 -1.26 -1.20 115.64 114.39 2f0l s THR 41 Ca 0.04 -1.15 -0.21 0.00 -1.18 0.00 0.00 61.69 59.19 2f0l s THR 41 Cb -0.15 -3.52 -0.05 0.00 1.34 0.00 0.00 72.50 70.12 2f0l s THR 41 CO -0.03 -0.26 1.26 -2.84 -0.54 0.00 0.00 174.62 172.21 2f0l s PRO 42 N -3.63 3.23 0.08 3.99 0.02 -1.26 -4.95 135.00 132.47 2f0l s PRO 42 Ca 0.33 1.99 -0.06 0.00 0.02 0.00 0.00 61.00 63.28 2f0l s PRO 42 Cb -0.09 -2.18 -0.05 0.00 0.02 0.00 0.00 34.50 32.20 2f0l s PRO 42 CO 0.26 -1.04 0.32 -1.21 -0.33 0.00 0.00 177.00 175.00 2f0l s GLU 43 N -3.00 3.61 -0.15 5.54 2.02 -1.26 -4.28 118.70 121.18 2f0l s GLU 43 Ca 0.72 -0.08 0.18 0.00 0.02 0.00 0.00 54.97 55.81 2f0l s GLU 43 Cb -0.34 -2.97 -0.26 0.00 0.10 0.00 0.00 34.13 30.66 2f0l s GLU 43 CO 0.40 0.56 0.20 0.25 0.02 0.00 0.00 175.26 176.69 2f0l n THR 44 N 0.61 1.20 -0.86 3.63 -2.24 -1.26 0.40 114.28 115.76 2f0l n THR 44 Ca -0.07 -0.80 -0.07 0.00 -2.27 0.00 0.00 64.05 60.84 2f0l n THR 44 Cb 0.52 -0.45 0.06 0.00 -2.10 0.00 0.00 70.33 68.36 2f0l n THR 44 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2f0l n LYS 45 N -2.71 -1.08 -0.31 -0.78 4.01 -1.26 -4.06 118.16 111.98 2f0l n LYS 45 Ca -0.27 -0.46 0.00 0.00 -0.51 0.00 0.00 58.31 57.07 2f0l n LYS 45 Cb 1.06 -0.38 0.00 0.00 -0.51 0.00 0.00 35.03 35.20 2f0l n LYS 45 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 2f0l n HIS 46 N -2.84 -0.79 0.10 2.13 8.25 -1.26 -4.09 115.22 116.71 2f0l n HIS 46 Ca 0.04 0.41 0.04 0.00 -0.26 0.00 0.00 57.72 57.95 2f0l n HIS 46 Cb 0.14 -1.86 -0.01 0.00 1.12 0.00 0.00 29.99 29.38 2f0l n HIS 46 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2f0l h PRO 47 N 0.50 0.00 -3.90 -0.41 0.13 -1.94 -2.72 132.00 123.66 2f0l h PRO 47 Ca 0.00 0.00 -0.76 0.00 -0.87 0.00 0.00 66.00 64.37 2f0l h PRO 47 Cb 0.00 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 30.95 2f0l h PRO 47 CO 0.00 0.30 1.55 1.17 -0.23 0.00 0.00 178.00 180.79 2f0l n LYS 48 N -3.00 3.61 0.00 0.86 0.00 -1.26 -4.22 118.16 114.16 2f0l n LYS 48 Ca -0.03 -3.81 0.00 0.00 0.00 0.00 0.00 58.31 54.47 2f0l n LYS 48 Cb 0.73 -2.90 0.00 0.00 0.00 0.00 0.00 35.03 32.86 2f0l n LYS 48 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2f0l n LYS 49 N 4.16 0.00 0.00 1.64 5.02 -1.26 -5.13 118.16 122.59 2f0l n LYS 49 Ca 0.36 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 2f0l n LYS 49 Cb 0.38 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.39 2f0l n LYS 49 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f0l n GLY 50 N 0.00 0.39 3.44 0.72 0.00 -1.02 -4.78 105.19 103.95 2f0l n GLY 50 Ca 0.00 -1.80 -0.44 0.00 0.00 0.00 0.00 46.02 43.78 2f0l n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f0l s VAL 51 N 0.00 4.54 0.97 1.61 1.01 -1.26 -4.13 120.40 123.15 2f0l s VAL 51 Ca 0.00 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 60.93 2f0l s VAL 51 Cb 0.00 -4.70 0.17 0.00 0.00 0.00 0.00 36.38 31.85 2f0l s VAL 51 CO 0.00 -1.44 1.09 -1.61 0.00 0.00 0.00 175.10 173.14 2f0l s GLU 52 N 3.35 0.62 0.10 2.72 2.02 0.16 -4.89 118.70 122.78 2f0l s GLU 52 Ca 0.25 0.65 -0.31 0.00 0.02 0.00 0.00 54.97 55.58 2f0l s GLU 52 Cb -0.13 -1.75 -0.08 0.00 0.10 0.00 0.00 34.13 32.28 2f0l s GLU 52 CO 0.02 -2.63 1.45 0.21 0.02 0.00 0.00 175.26 174.32 2f0l s LYS 53 N -4.92 4.28 0.00 1.61 2.47 -1.26 -1.76 119.74 120.16 2f0l s LYS 53 Ca 0.65 2.13 0.00 0.00 -1.56 0.00 0.00 55.97 57.19 2f0l s LYS 53 Cb -0.19 -3.33 0.00 0.00 -1.46 0.00 0.00 37.83 32.85 2f0l s LYS 53 CO 0.58 -0.52 0.00 0.66 0.16 0.00 0.00 175.35 176.23 2f0l n TYR 54 N 4.38 0.00 0.06 4.03 4.01 -1.26 -4.77 117.16 123.61 2f0l n TYR 54 Ca 0.13 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.71 2f0l n TYR 54 Cb 0.42 -0.01 -0.09 0.00 -0.31 0.00 0.00 39.34 39.34 2f0l n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2f0l h GLY 55 N 0.00 -1.07 0.84 2.72 0.00 -1.53 0.39 103.07 104.42 2f0l h GLY 55 Ca 0.00 0.64 0.11 0.00 0.00 0.00 0.00 47.33 48.08 2f0l h GLY 55 CO 0.00 -0.24 0.48 -2.55 0.00 0.00 0.00 176.54 174.23 2f0l h PRO 56 N -0.67 0.52 -0.32 4.80 0.11 -1.86 -1.75 132.00 132.83 2f0l h PRO 56 Ca 0.02 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 65.92 2f0l h PRO 56 Cb 0.72 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.71 2f0l h PRO 56 CO -0.35 0.35 -0.48 0.93 -0.21 0.00 0.00 178.00 178.24 2f0l h GLU 57 N 0.54 0.86 -0.50 1.05 3.07 -1.64 -1.36 114.58 116.61 2f0l h GLU 57 Ca 0.34 -0.51 -0.11 0.00 -0.50 0.00 0.00 59.36 58.59 2f0l h GLU 57 Cb 0.60 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.54 2f0l h GLU 57 CO -0.12 1.15 -0.12 0.00 -1.40 0.00 0.00 179.01 178.51 2f0l h ALA 58 N 0.76 0.83 -0.40 3.43 0.00 -0.64 -1.00 119.26 122.24 2f0l h ALA 58 Ca 0.03 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.45 2f0l h ALA 58 Cb 1.07 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2f0l h ALA 58 CO 0.11 0.65 -0.32 0.77 0.00 0.00 0.00 179.25 180.47 2f0l h SER 59 N 0.84 0.93 0.14 0.00 0.02 -1.21 -1.13 113.55 113.14 2f0l h SER 59 Ca 0.13 -0.39 -0.15 0.00 -0.84 0.00 0.00 61.79 60.54 2f0l h SER 59 Cb 0.67 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 2f0l h SER 59 CO 0.05 1.17 -0.52 0.00 -1.14 0.00 0.00 176.83 176.38 2f0l h ALA 60 N 0.89 0.81 -0.04 3.77 0.00 -1.09 -1.75 119.26 121.86 2f0l h ALA 60 Ca 0.08 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 2f0l h ALA 60 Cb 0.89 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2f0l h ALA 60 CO 0.08 0.68 0.01 0.35 0.00 0.00 0.00 179.25 180.37 2f0l h PHE 61 N 0.33 0.05 -0.55 0.00 3.57 -0.97 -0.52 116.94 118.87 2f0l h PHE 61 Ca 0.01 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.51 2f0l h PHE 61 Cb 1.03 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.73 2f0l h PHE 61 CO 0.03 0.21 0.36 1.15 -2.23 0.00 0.00 178.31 177.83 2f0l h THR 62 N -0.12 1.14 0.04 4.41 2.02 -1.18 -1.58 112.91 117.64 2f0l h THR 62 Ca 0.01 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2f0l h THR 62 Cb 0.18 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 66.92 2f0l h THR 62 CO -0.00 0.14 -0.04 0.50 0.37 0.00 0.00 175.52 176.49 2f0l h LYS 63 N 0.74 -0.08 -0.59 6.66 3.64 -1.18 -0.75 116.57 125.00 2f0l h LYS 63 Ca 0.20 0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.49 2f0l h LYS 63 Cb -0.08 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 2f0l h LYS 63 CO -0.04 -0.06 -0.02 0.87 -2.27 0.00 0.00 179.45 177.93 2f0l h LYS 64 N -0.09 1.06 -0.68 1.90 1.79 -1.00 0.02 116.57 119.57 2f0l h LYS 64 Ca 0.00 -0.34 -0.04 0.00 -2.18 0.00 0.00 60.65 58.09 2f0l h LYS 64 Cb 0.09 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.61 2f0l h LYS 64 CO -0.01 1.04 0.25 1.98 -1.08 0.00 0.00 179.45 181.63 2f0l h MET 65 N 0.96 1.02 0.03 3.15 4.05 -1.00 -1.64 114.93 121.49 2f0l h MET 65 Ca 0.17 -0.18 -0.25 0.00 -0.28 0.00 0.00 59.70 59.15 2f0l h MET 65 Cb 0.58 -0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 31.18 2f0l h MET 65 CO 0.03 0.84 -1.30 -0.39 0.23 0.00 0.00 176.91 176.32 2f0l h VAL 66 N 0.99 1.37 0.00 -5.77 -1.51 -0.98 -3.29 116.25 107.06 2f0l h VAL 66 Ca 0.23 -3.10 -0.10 0.00 -1.23 0.00 0.00 66.70 62.50 2f0l h VAL 66 Cb 0.22 2.72 -0.01 0.00 -2.13 0.00 0.00 31.29 32.08 2f0l h VAL 66 CO -0.02 0.81 -0.45 -0.33 -1.23 0.00 0.00 177.57 176.35 2f0l h GLU 67 N 0.02 0.00 -0.26 5.19 5.08 -0.88 -3.11 114.58 120.61 2f0l h GLU 67 Ca -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 2f0l h GLU 67 Cb 1.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.14 2f0l h GLU 67 CO 0.12 0.45 0.00 0.09 -1.00 0.00 0.00 179.01 178.68 2f0l n ASN 68 N -3.84 2.33 -4.79 1.42 5.03 -0.63 -4.95 115.26 109.84 2f0l n ASN 68 Ca -0.01 -1.83 -0.37 0.00 0.87 0.00 0.00 54.58 53.23 2f0l n ASN 68 Cb 0.50 -0.17 -0.06 0.00 -1.02 0.00 0.00 39.78 39.03 2f0l n ASN 68 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2f0l s ALA 69 N -1.66 3.30 0.13 5.41 0.00 -1.18 -4.97 121.76 122.78 2f0l s ALA 69 Ca 0.34 0.42 -0.12 0.00 0.00 0.00 0.00 51.96 52.60 2f0l s ALA 69 Cb 0.19 -3.06 -0.09 0.00 0.00 0.00 0.00 23.12 20.15 2f0l s ALA 69 CO 0.27 0.23 1.40 0.87 0.00 0.00 0.00 175.76 178.54 2f0l h LYS 70 N 3.42 0.89 -4.70 0.00 1.57 -1.92 -3.46 116.57 112.37 2f0l h LYS 70 Ca -0.47 -0.57 -0.42 0.00 -1.87 0.00 0.00 60.65 57.32 2f0l h LYS 70 Cb 1.19 0.07 -0.30 0.00 0.08 0.00 0.00 32.23 33.27 2f0l h LYS 70 CO 0.65 1.20 -0.79 0.15 -0.57 0.00 0.00 179.45 180.10 2f0l s LYS 71 N -4.13 0.91 -0.01 3.15 1.02 -1.26 -5.03 119.74 114.39 2f0l s LYS 71 Ca -0.11 -0.33 0.08 0.00 0.02 0.00 0.00 55.97 55.64 2f0l s LYS 71 Cb 0.10 -0.86 -0.02 0.00 -0.52 0.00 0.00 37.83 36.53 2f0l s LYS 71 CO 0.89 0.15 -0.26 -0.51 -0.92 0.00 0.00 175.35 174.71 2f0l s LEU 72 N 0.02 2.08 0.04 3.17 1.43 -1.26 -1.37 118.68 122.79 2f0l s LEU 72 Ca -0.00 -0.49 0.03 0.00 -1.03 0.00 0.00 54.13 52.64 2f0l s LEU 72 Cb -0.07 -1.33 -0.02 0.00 0.03 0.00 0.00 46.19 44.80 2f0l s LEU 72 CO 0.00 0.31 -0.10 -1.61 0.23 0.00 0.00 176.35 175.18 2f0l s GLU 73 N -0.72 0.64 -0.00 1.70 2.02 -0.49 -2.33 118.70 119.52 2f0l s GLU 73 Ca 0.10 -0.72 0.07 0.00 0.02 0.00 0.00 54.97 54.45 2f0l s GLU 73 Cb -0.10 -0.53 -0.03 0.00 0.10 0.00 0.00 34.13 33.58 2f0l s GLU 73 CO -0.00 0.12 -0.22 0.14 0.02 0.00 0.00 175.26 175.31 2f0l s VAL 74 N -1.10 2.43 -0.24 2.63 -7.23 0.82 -0.44 120.40 117.27 2f0l s VAL 74 Ca -0.05 -1.09 -0.01 0.00 -1.81 0.00 0.00 61.98 59.02 2f0l s VAL 74 Cb -0.09 -1.92 0.07 0.00 0.56 0.00 0.00 36.38 35.01 2f0l s VAL 74 CO 0.01 0.50 0.03 -0.70 -0.31 0.00 0.00 175.10 174.63 2f0l s GLU 75 N -0.90 0.94 0.58 4.82 2.12 -0.04 -1.68 118.70 124.53 2f0l s GLU 75 Ca 0.11 -0.79 -0.18 0.00 0.36 0.00 0.00 54.97 54.48 2f0l s GLU 75 Cb -0.10 -2.23 -0.04 0.00 0.26 0.00 0.00 34.13 32.02 2f0l s GLU 75 CO 0.01 -0.74 1.09 -0.06 -0.54 0.00 0.00 175.26 175.03 2f0l s PHE 76 N 1.65 2.78 0.00 5.30 0.40 -1.26 -0.47 117.98 126.38 2f0l s PHE 76 Ca 0.01 1.54 0.00 0.00 -0.60 0.00 0.00 56.93 57.88 2f0l s PHE 76 Cb -0.18 -3.16 0.00 0.00 0.51 0.00 0.00 43.02 40.20 2f0l s PHE 76 CO -0.12 -1.38 0.00 -3.47 0.70 0.00 0.00 175.22 170.94 2f0l n ASP 77 N -1.72 0.00 0.00 1.36 -0.08 -1.26 -4.71 116.55 110.15 2f0l n ASP 77 Ca 0.10 -0.26 0.12 0.00 -1.51 0.00 0.00 54.79 53.24 2f0l n ASP 77 Cb 0.52 0.00 0.22 0.00 2.34 0.00 0.00 41.12 44.20 2f0l n ASP 77 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2f0l n LYS 78 N -0.26 0.00 0.00 -0.67 5.02 -1.26 -4.92 118.16 116.07 2f0l n LYS 78 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2f0l n LYS 78 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 2f0l n LYS 78 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f0l n GLY 79 N 1.50 1.73 3.78 0.72 0.00 -1.26 -4.99 105.19 106.66 2f0l n GLY 79 Ca 0.05 -1.74 -0.36 0.00 0.00 0.00 0.00 46.02 43.97 2f0l n GLY 79 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2f0l s GLN 80 N 3.75 3.71 0.00 1.61 0.00 -1.26 -4.94 119.66 122.53 2f0l s GLN 80 Ca 0.00 1.66 0.17 0.00 -0.00 0.00 0.00 55.36 57.19 2f0l s GLN 80 Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 33.01 30.72 2f0l s GLN 80 CO 0.00 -0.56 0.88 0.54 0.00 0.00 0.00 175.29 176.14 2f0l n ARG 81 N -0.69 1.64 -4.17 9.60 1.74 -1.26 -4.80 116.66 118.73 2f0l n ARG 81 Ca 0.08 -0.86 -0.17 0.00 -0.77 0.00 0.00 57.85 56.14 2f0l n ARG 81 Cb 0.49 -1.29 -0.11 0.00 -1.02 0.00 0.00 32.46 30.53 2f0l n ARG 81 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2f0l s THR 82 N -1.90 1.02 0.51 0.55 -4.23 -1.26 -0.46 115.64 109.87 2f0l s THR 82 Ca 0.14 -1.40 0.01 0.00 -1.18 0.00 0.00 61.69 59.26 2f0l s THR 82 Cb 0.13 -1.13 0.10 0.00 1.34 0.00 0.00 72.50 72.94 2f0l s THR 82 CO 0.40 -0.35 0.69 -0.90 -0.54 0.00 0.00 174.62 173.93 2f0l n ASP 83 N 1.04 1.08 0.00 3.99 5.68 -0.26 -4.91 116.55 123.18 2f0l n ASP 83 Ca -0.19 -1.88 0.03 0.00 -0.50 0.00 0.00 54.79 52.25 2f0l n ASP 83 Cb 0.55 -0.44 0.15 0.00 -1.14 0.00 0.00 41.12 40.24 2f0l n ASP 83 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2f0l n LYS 84 N -2.25 0.00 -0.20 0.11 2.85 -1.26 -1.49 118.16 115.92 2f0l n LYS 84 Ca 0.12 0.38 0.12 0.00 -1.05 0.00 0.00 58.31 57.87 2f0l n LYS 84 Cb 0.43 -1.50 0.23 0.00 -0.65 0.00 0.00 35.03 33.54 2f0l n LYS 84 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2f0l n TYR 85 N -1.49 0.52 -0.70 5.58 4.02 -1.26 -4.91 117.16 118.92 2f0l n TYR 85 Ca 0.02 -0.26 0.00 0.00 -0.01 0.00 0.00 57.90 57.64 2f0l n TYR 85 Cb 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.40 2f0l n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2f0l n GLY 86 N 1.50 0.66 3.74 2.72 0.00 -0.55 -5.04 105.19 108.22 2f0l n GLY 86 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 2f0l n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2f0l s ARG 87 N -0.30 4.50 0.44 1.61 0.52 -1.26 -4.73 118.95 119.73 2f0l s ARG 87 Ca 0.00 1.07 -0.25 0.00 -0.52 0.00 0.00 55.73 56.02 2f0l s ARG 87 Cb 0.00 -3.37 -0.09 0.00 0.52 0.00 0.00 34.95 32.02 2f0l s ARG 87 CO 0.00 0.27 1.41 0.41 0.02 0.00 0.00 175.30 177.42 2f0l n GLY 88 N 2.41 0.95 3.17 -3.53 0.00 -0.27 -1.10 105.19 106.82 2f0l n GLY 88 Ca -0.02 0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2f0l n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2f0l s LEU 89 N -2.47 4.30 0.19 0.99 1.43 0.40 -0.66 118.68 122.85 2f0l s LEU 89 Ca 0.61 -1.47 -0.13 0.00 -1.03 0.00 0.00 54.13 52.10 2f0l s LEU 89 Cb -0.46 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.01 2f0l s LEU 89 CO 0.58 -0.34 0.41 0.00 0.23 0.00 0.00 176.35 177.23 2f0l s ALA 90 N 1.23 -0.46 -0.05 4.21 0.00 -1.13 -4.32 121.76 121.24 2f0l s ALA 90 Ca -0.01 -0.58 -0.19 0.00 0.00 0.00 0.00 51.96 51.18 2f0l s ALA 90 Cb -0.20 0.87 -0.05 0.00 0.00 0.00 0.00 23.12 23.74 2f0l s ALA 90 CO -0.02 -0.74 0.55 0.71 0.00 0.00 0.00 175.76 176.26 2f0l s TYR 91 N -3.93 3.62 -0.09 0.00 2.02 0.38 -1.62 117.35 117.75 2f0l s TYR 91 Ca 0.14 1.08 0.01 0.00 -0.37 0.00 0.00 57.07 57.93 2f0l s TYR 91 Cb 0.01 -2.58 -0.02 0.00 -0.40 0.00 0.00 41.96 38.97 2f0l s TYR 91 CO -0.01 0.30 -0.10 0.42 -1.57 0.00 0.00 175.55 174.59 2f0l s ILE 92 N 0.07 3.38 -0.13 2.71 -1.09 -1.26 -0.86 121.20 124.01 2f0l s ILE 92 Ca 0.29 -0.58 0.01 0.00 -2.23 0.00 0.00 60.65 58.14 2f0l s ILE 92 Cb -0.17 -2.38 -0.01 0.00 -1.58 0.00 0.00 42.46 38.32 2f0l s ILE 92 CO 0.15 0.57 -0.17 -0.31 -1.23 0.00 0.00 174.94 173.94 2f0l s TYR 93 N -0.40 2.72 -0.27 3.97 2.02 0.42 0.42 117.35 126.23 2f0l s TYR 93 Ca 0.05 -0.91 -0.04 0.00 -0.37 0.00 0.00 57.07 55.80 2f0l s TYR 93 Cb -0.12 -1.82 0.01 0.00 -0.40 0.00 0.00 41.96 39.64 2f0l s TYR 93 CO 0.02 -0.36 0.01 0.00 -1.57 0.00 0.00 175.55 173.65 2f0l s ALA 94 N 0.50 2.89 -1.50 3.71 0.00 0.74 -1.40 121.76 126.70 2f0l s ALA 94 Ca -0.11 -1.44 -0.07 0.00 0.00 0.00 0.00 51.96 50.33 2f0l s ALA 94 Cb -0.16 -1.92 0.06 0.00 0.00 0.00 0.00 23.12 21.09 2f0l s ALA 94 CO 0.05 -0.84 0.64 -0.25 0.00 0.00 0.00 175.76 175.35 2f0l n ASP 95 N 4.78 -1.93 0.00 0.00 10.43 -0.47 -1.09 116.55 128.26 2f0l n ASP 95 Ca -0.16 -0.96 0.00 0.00 2.57 0.00 0.00 54.79 56.25 2f0l n ASP 95 Cb 0.48 -3.19 0.00 0.00 1.84 0.00 0.00 41.12 40.24 2f0l n ASP 95 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2f0l n GLY 96 N -1.74 1.52 3.69 0.44 0.00 -1.26 -5.00 105.19 102.83 2f0l n GLY 96 Ca -0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 2f0l n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f0l s LYS 97 N -0.06 3.66 -0.16 1.61 1.02 -0.25 -5.04 119.74 120.53 2f0l s LYS 97 Ca 0.00 -0.32 -0.29 0.00 0.02 0.00 0.00 55.97 55.37 2f0l s LYS 97 Cb 0.00 -3.11 -0.02 0.00 -0.52 0.00 0.00 37.83 34.18 2f0l s LYS 97 CO 0.00 0.46 1.27 1.41 -0.92 0.00 0.00 175.35 177.57 2f0l s MET 98 N -0.15 4.23 0.24 1.68 -2.45 -1.26 -0.19 119.30 121.40 2f0l s MET 98 Ca 0.07 1.68 -0.06 0.00 -1.25 0.00 0.00 55.69 56.13 2f0l s MET 98 Cb -0.12 -3.77 0.25 0.00 1.25 0.00 0.00 34.83 32.44 2f0l s MET 98 CO 0.01 -0.71 1.84 0.28 1.05 0.00 0.00 175.02 177.50 2f0l h VAL 99 N 5.49 1.25 -0.95 10.11 2.07 -0.40 -1.78 116.25 132.04 2f0l h VAL 99 Ca -0.27 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.55 2f0l h VAL 99 Cb 1.11 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 2f0l h VAL 99 CO 0.97 0.30 0.61 0.78 0.02 0.00 0.00 177.57 180.25 2f0l h ASN 100 N 1.15 1.11 -0.28 0.57 4.21 -1.91 -2.30 115.58 118.14 2f0l h ASN 100 Ca 0.28 -0.04 -0.18 0.00 1.21 0.00 0.00 56.30 57.57 2f0l h ASN 100 Cb 0.11 -0.28 -0.00 0.00 -1.12 0.00 0.00 38.32 37.03 2f0l h ASN 100 CO -0.04 0.82 -0.50 -0.08 -1.29 0.00 0.00 177.43 176.35 2f0l h GLU 101 N 1.30 0.86 -0.43 0.81 4.22 -1.82 -3.02 114.58 116.50 2f0l h GLU 101 Ca 0.35 -0.52 0.04 0.00 0.08 0.00 0.00 59.36 59.31 2f0l h GLU 101 Cb -0.12 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.14 2f0l h GLU 101 CO -0.07 1.15 0.20 0.00 -2.18 0.00 0.00 179.01 178.11 2f0l h ALA 102 N 0.75 0.53 -0.71 2.92 0.00 -0.96 0.50 119.26 122.28 2f0l h ALA 102 Ca 0.03 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2f0l h ALA 102 Cb 1.10 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 2f0l h ALA 102 CO 0.11 -0.16 0.45 -0.07 0.00 0.00 0.00 179.25 179.58 2f0l h LEU 103 N 0.41 0.74 -0.21 0.00 3.38 -1.43 -1.80 115.31 116.40 2f0l h LEU 103 Ca 0.19 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.07 2f0l h LEU 103 Cb 0.11 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 2f0l h LEU 103 CO -0.14 0.51 -0.20 0.58 0.09 0.00 0.00 178.44 179.28 2f0l h VAL 104 N 0.88 1.32 -0.20 1.22 2.07 -1.22 -0.36 116.25 119.96 2f0l h VAL 104 Ca 0.29 -1.35 0.06 0.00 0.82 0.00 0.00 66.70 66.51 2f0l h VAL 104 Cb 0.02 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 2f0l h VAL 104 CO -0.11 0.41 0.15 -0.09 0.02 0.00 0.00 177.57 177.96 2f0l h ARG 105 N 0.20 0.00 -0.35 1.57 9.65 0.32 -1.29 114.38 124.48 2f0l h ARG 105 Ca 0.04 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.92 2f0l h ARG 105 Cb 0.74 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.32 2f0l h ARG 105 CO 0.05 0.00 0.00 1.04 2.80 0.00 0.00 179.97 183.86 2f0l n GLN 106 N -4.35 1.94 -1.77 0.20 1.13 -0.71 -4.37 117.38 109.45 2f0l n GLN 106 Ca 0.02 -1.45 -0.12 0.00 -1.94 0.00 0.00 57.00 53.50 2f0l n GLN 106 Cb 0.29 -1.36 -0.03 0.00 0.11 0.00 0.00 30.24 29.25 2f0l n GLN 106 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2f0l n GLY 107 N 1.18 0.65 0.99 1.08 0.00 -0.49 -4.40 105.19 104.22 2f0l n GLY 107 Ca 0.15 -0.41 0.08 0.00 0.00 0.00 0.00 46.02 45.84 2f0l n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2f0l n LEU 108 N -1.59 3.57 -3.51 0.99 4.77 -0.17 -1.54 117.00 119.53 2f0l n LEU 108 Ca -0.14 -2.17 -0.17 0.00 -0.03 0.00 0.00 56.01 53.51 2f0l n LEU 108 Cb 0.50 -0.38 -0.05 0.00 -2.33 0.00 0.00 43.42 41.16 2f0l n LEU 108 CO 0.18 0.81 0.45 0.00 -1.33 0.00 0.00 177.39 177.49 2f0l s ALA 109 N -1.31 -1.75 0.16 -1.18 0.00 -1.17 -4.37 121.76 112.14 2f0l s ALA 109 Ca 0.36 1.20 0.04 0.00 0.00 0.00 0.00 51.96 53.56 2f0l s ALA 109 Cb 0.21 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 2f0l s ALA 109 CO 0.21 -0.43 0.23 0.15 0.00 0.00 0.00 175.76 175.92 2f0l s LYS 110 N -1.58 3.22 0.04 0.00 3.01 -0.34 -4.53 119.74 119.56 2f0l s LYS 110 Ca -0.09 -0.72 -0.30 0.00 -1.01 0.00 0.00 55.97 53.85 2f0l s LYS 110 Cb -0.00 -2.83 -0.06 0.00 -1.01 0.00 0.00 37.83 33.93 2f0l s LYS 110 CO 0.06 0.50 1.28 0.08 0.51 0.00 0.00 175.35 177.78 2f0l s VAL 111 N -1.76 3.87 0.92 3.17 1.01 -1.26 -1.03 120.40 125.31 2f0l s VAL 111 Ca 0.33 1.30 -0.12 0.00 0.00 0.00 0.00 61.98 63.50 2f0l s VAL 111 Cb -0.11 -3.84 0.14 0.00 0.00 0.00 0.00 36.38 32.58 2f0l s VAL 111 CO 0.26 0.06 1.10 0.00 0.00 0.00 0.00 175.10 176.52 2f0l s ALA 112 N 1.56 1.48 0.29 5.51 0.00 0.34 -4.82 121.76 126.13 2f0l s ALA 112 Ca 0.60 -0.24 -0.29 0.00 0.00 0.00 0.00 51.96 52.03 2f0l s ALA 112 Cb -0.30 -3.14 -0.10 0.00 0.00 0.00 0.00 23.12 19.58 2f0l s ALA 112 CO 0.28 -2.42 1.42 0.71 0.00 0.00 0.00 175.76 175.75 2f0l s TYR 113 N -3.02 2.95 -0.09 0.00 4.12 -1.26 -4.93 117.35 115.12 2f0l s TYR 113 Ca 0.64 1.14 -0.03 0.00 0.02 0.00 0.00 57.07 58.85 2f0l s TYR 113 Cb -0.17 -3.82 -0.03 0.00 -1.52 0.00 0.00 41.96 36.41 2f0l s TYR 113 CO 0.56 -2.54 0.02 0.08 0.02 0.00 0.00 175.55 173.70 2f0l s VAL 114 N -0.50 4.50 -0.34 0.71 1.01 -1.26 -4.95 120.40 119.58 2f0l s VAL 114 Ca 0.56 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 62.37 2f0l s VAL 114 Cb -0.42 -2.91 0.09 0.00 0.00 0.00 0.00 36.38 33.14 2f0l s VAL 114 CO 0.49 0.60 0.06 -0.31 0.00 0.00 0.00 175.10 175.94 2f0l s TYR 115 N -0.92 3.62 0.39 5.22 1.51 -1.26 -5.06 117.35 120.85 2f0l s TYR 115 Ca 0.14 -2.69 -0.27 0.00 -1.01 0.00 0.00 57.07 53.24 2f0l s TYR 115 Cb -0.11 -2.79 -0.11 0.00 -0.11 0.00 0.00 41.96 38.84 2f0l s TYR 115 CO 0.03 -0.93 1.42 1.63 -1.11 0.00 0.00 175.55 176.59 2f0l n LYS 116 N 4.38 2.42 -0.42 -0.62 5.02 -1.26 0.15 118.16 127.84 2f0l n LYS 116 Ca -0.01 0.85 0.04 0.00 -2.02 0.00 0.00 58.31 57.17 2f0l n LYS 116 Cb 0.42 -2.58 0.21 0.00 -0.02 0.00 0.00 35.03 33.06 2f0l n LYS 116 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2f0l n PRO 117 N 0.28 2.81 -2.57 1.97 -0.04 -1.26 -5.00 135.00 131.20 2f0l n PRO 117 Ca 0.03 -1.62 -0.43 0.00 -0.04 0.00 0.00 63.50 61.44 2f0l n PRO 117 Cb 0.39 -1.77 0.01 0.00 -0.04 0.00 0.00 33.50 32.08 2f0l n PRO 117 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2f0l n ASN 118 N 0.41 5.45 -0.97 3.54 3.02 0.39 -4.30 115.26 122.80 2f0l n ASN 118 Ca 0.14 -3.18 -0.01 0.00 -0.03 0.00 0.00 54.58 51.51 2f0l n ASN 118 Cb 0.66 -1.43 -0.01 0.00 -0.61 0.00 0.00 39.78 38.39 2f0l n ASN 118 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2f0l n ASN 119 N 3.31 0.06 -0.16 6.41 6.94 -1.26 -4.32 115.26 126.24 2f0l n ASN 119 Ca 0.36 -1.82 -0.03 0.00 -0.02 0.00 0.00 54.58 53.06 2f0l n ASN 119 Cb 0.36 -0.06 0.06 0.00 -2.36 0.00 0.00 39.78 37.78 2f0l n ASN 119 CO 0.00 0.00 0.00 0.74 -1.03 0.00 0.00 177.26 176.97 2f0l h THR 120 N 6.10 0.85 -0.65 5.53 2.02 -1.97 -2.15 112.91 122.64 2f0l h THR 120 Ca -0.24 -0.13 -0.20 0.00 0.77 0.00 0.00 66.41 66.61 2f0l h THR 120 Cb 1.50 0.44 -0.12 0.00 -1.74 0.00 0.00 68.15 68.23 2f0l h THR 120 CO -0.05 0.07 0.26 1.41 0.37 0.00 0.00 175.52 177.58 2f0l n HIS 121 N -4.99 2.13 -0.27 3.16 8.25 -1.26 -4.55 115.22 117.69 2f0l n HIS 121 Ca 0.05 -1.08 -0.05 0.00 -0.26 0.00 0.00 57.72 56.38 2f0l n HIS 121 Cb 0.19 -0.63 0.06 0.00 1.12 0.00 0.00 29.99 30.73 2f0l n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2f0l h GLU 122 N 2.16 0.98 -0.03 -0.41 4.81 -1.77 -1.90 114.58 118.42 2f0l h GLU 122 Ca 0.25 -0.06 -0.24 0.00 -0.13 0.00 0.00 59.36 59.18 2f0l h GLU 122 Cb 2.13 -0.22 0.01 0.00 0.63 0.00 0.00 28.75 31.30 2f0l h GLU 122 CO 0.65 0.65 -0.94 1.96 -0.73 0.00 0.00 179.01 180.61 2f0l h GLN 123 N 1.01 0.61 -0.17 1.92 1.08 -1.83 -1.14 115.11 116.59 2f0l h GLN 123 Ca 0.27 -0.61 0.05 0.00 -1.45 0.00 0.00 58.65 56.91 2f0l h GLN 123 Cb -0.11 0.16 -0.06 0.00 -0.05 0.00 0.00 27.48 27.42 2f0l h GLN 123 CO -0.06 1.22 -0.26 1.25 -0.95 0.00 0.00 178.83 180.04 2f0l h HIS 124 N 0.37 -0.70 -0.73 2.96 -0.00 -1.87 -1.12 115.15 114.06 2f0l h HIS 124 Ca -0.09 0.03 -0.06 0.00 -0.00 0.00 0.00 60.37 60.25 2f0l h HIS 124 Cb 1.58 0.33 -0.03 0.00 -0.00 0.00 0.00 27.41 29.29 2f0l h HIS 124 CO 0.08 -0.34 0.20 -0.07 -0.00 0.00 0.00 177.93 177.80 2f0l h LEU 125 N -0.31 1.08 -1.53 0.26 3.38 -1.24 -2.26 115.31 114.69 2f0l h LEU 125 Ca 0.11 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 2f0l h LEU 125 Cb 0.48 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2f0l h LEU 125 CO -0.34 1.02 -0.23 0.03 0.09 0.00 0.00 178.44 179.00 2f0l h ARG 126 N 1.09 0.01 -0.40 1.13 3.08 -0.83 0.65 114.38 119.10 2f0l h ARG 126 Ca 0.23 -0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.18 2f0l h ARG 126 Cb 0.34 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2f0l h ARG 126 CO -0.00 0.24 -0.16 0.87 -1.07 0.00 0.00 179.97 179.85 2f0l h LYS 127 N 0.01 0.76 -0.13 0.04 1.57 -0.72 -0.45 116.57 117.64 2f0l h LYS 127 Ca -0.00 -0.27 -0.16 0.00 -1.87 0.00 0.00 60.65 58.35 2f0l h LYS 127 Cb 0.42 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 2f0l h LYS 127 CO 0.03 0.87 -0.58 0.77 -0.57 0.00 0.00 179.45 179.97 2f0l h SER 128 N 0.67 0.48 -0.50 0.86 0.02 -0.76 -2.68 113.55 111.64 2f0l h SER 128 Ca 0.11 -0.27 -0.07 0.00 -0.84 0.00 0.00 61.79 60.72 2f0l h SER 128 Cb 0.65 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.03 2f0l h SER 128 CO 0.05 0.95 0.04 -0.08 -1.14 0.00 0.00 176.83 176.65 2f0l h GLU 129 N 0.32 0.86 -0.72 3.45 4.81 -0.62 -0.61 114.58 122.07 2f0l h GLU 129 Ca 0.00 -0.25 -0.02 0.00 -0.13 0.00 0.00 59.36 58.95 2f0l h GLU 129 Cb 1.10 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.36 2f0l h GLU 129 CO 0.10 0.87 0.36 0.00 -0.73 0.00 0.00 179.01 179.61 2f0l h ALA 130 N 0.95 1.27 0.11 2.92 0.00 -0.97 -1.54 119.26 121.99 2f0l h ALA 130 Ca 0.15 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2f0l h ALA 130 Cb 0.46 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2f0l h ALA 130 CO 0.02 0.57 -0.05 0.37 0.00 0.00 0.00 179.25 180.16 2f0l h GLN 131 N 1.02 -0.14 -0.29 0.00 5.75 -1.31 0.54 115.11 120.69 2f0l h GLN 131 Ca 0.25 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.76 2f0l h GLN 131 Cb 0.09 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.65 2f0l h GLN 131 CO -0.03 0.03 0.18 0.00 -2.65 0.00 0.00 178.83 176.35 2f0l h ALA 132 N 0.60 1.78 0.11 3.38 0.00 -0.89 0.33 119.26 124.57 2f0l h ALA 132 Ca -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2f0l h ALA 132 Cb 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2f0l h ALA 132 CO 0.02 0.20 -0.05 0.87 0.00 0.00 0.00 179.25 180.29 2f0l h LYS 133 N 0.39 -0.14 -1.01 0.00 1.57 -1.05 -0.86 116.57 115.46 2f0l h LYS 133 Ca 0.10 0.01 0.24 0.00 -1.87 0.00 0.00 60.65 59.14 2f0l h LYS 133 Cb -0.03 0.03 -0.11 0.00 0.08 0.00 0.00 32.23 32.20 2f0l h LYS 133 CO -0.02 0.09 0.62 -0.22 -0.57 0.00 0.00 179.45 179.34 2f0l h LYS 134 N -0.36 0.55 -0.10 3.15 1.63 -0.28 -0.38 116.57 120.78 2f0l h LYS 134 Ca -0.02 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 2f0l h LYS 134 Cb 0.30 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.80 2f0l h LYS 134 CO 0.03 0.36 0.00 0.39 -3.45 0.00 0.00 179.45 176.78 2f0l n GLU 135 N -4.80 1.86 -3.85 1.90 1.02 0.05 -4.96 120.64 111.86 2f0l n GLU 135 Ca 0.26 -1.26 -0.27 0.00 -0.02 0.00 0.00 57.16 55.87 2f0l n GLU 135 Cb 0.75 -1.45 0.02 0.00 -0.02 0.00 0.00 31.44 30.74 2f0l n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2f0l n LYS 136 N 0.51 -4.99 -3.07 3.49 5.02 -0.15 -4.95 118.16 114.02 2f0l n LYS 136 Ca 0.17 0.58 -0.39 0.00 -2.02 0.00 0.00 58.31 56.65 2f0l n LYS 136 Cb 0.40 -5.26 -0.06 0.00 -0.02 0.00 0.00 35.03 30.10 2f0l n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2f0l s LEU 137 N -7.03 4.50 0.00 -0.35 1.43 -0.88 -3.34 118.68 113.02 2f0l s LEU 137 Ca 0.35 1.43 0.00 0.00 -1.03 0.00 0.00 54.13 54.88 2f0l s LEU 137 Cb -0.18 -3.14 0.00 0.00 0.03 0.00 0.00 46.19 42.90 2f0l s LEU 137 CO 0.83 0.13 0.00 0.59 0.23 0.00 0.00 176.35 178.13 2f0l n ASN 138 N 2.25 0.00 0.31 2.29 3.02 -1.26 -0.44 115.26 121.43 2f0l n ASN 138 Ca -0.05 0.00 0.20 0.00 -0.03 0.00 0.00 54.58 54.70 2f0l n ASN 138 Cb 0.50 0.00 1.00 0.00 -0.61 0.00 0.00 39.78 40.67 2f0l n ASN 138 CO 0.00 0.00 0.00 0.16 -2.62 0.00 0.00 177.26 174.80 2f0l h ILE 139 N 0.00 0.00 -0.16 2.41 3.07 -1.59 0.28 117.51 121.53 2f0l h ILE 139 Ca 0.00 -0.18 0.00 0.00 1.55 0.00 0.00 64.86 66.23 2f0l h ILE 139 Cb 0.00 1.16 0.00 0.00 -0.27 0.00 0.00 36.82 37.71 2f0l h ILE 139 CO 0.00 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 177.89 2f0l n TRP 140 N -3.03 0.20 0.31 0.16 7.02 0.42 -5.14 117.44 117.36 2f0l n TRP 140 Ca -0.02 -0.10 0.02 0.00 -1.02 0.00 0.00 57.50 56.39 2f0l n TRP 140 Cb 0.15 0.00 0.15 0.00 -2.42 0.00 0.00 31.31 29.19 2f0l n TRP 140 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54