#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fl8 s ILE 2 N 0.00 4.97 -0.38 3.17 1.01 -0.62 -4.96 121.20 124.38 3fl8 s ILE 2 Ca 0.00 1.19 -0.15 0.00 0.00 0.00 0.00 60.65 61.68 3fl8 s ILE 2 Cb 0.00 -3.96 0.01 0.00 0.01 0.00 0.00 42.46 38.52 3fl8 s ILE 2 CO 0.00 0.02 0.34 -0.69 0.00 0.00 0.00 174.94 174.61 3fl8 s VAL 3 N 2.53 5.20 -0.09 2.92 1.01 -1.26 -0.84 120.40 129.86 3fl8 s VAL 3 Ca 0.27 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.94 3fl8 s VAL 3 Cb -0.15 -3.89 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 3fl8 s VAL 3 CO 0.08 -0.23 -0.15 -0.44 0.00 0.00 0.00 175.10 174.36 3fl8 s SER 4 N 1.73 3.90 -0.03 3.32 0.01 0.20 -0.12 113.70 122.72 3fl8 s SER 4 Ca 0.09 -0.30 -0.25 0.00 1.31 0.00 0.00 55.95 56.80 3fl8 s SER 4 Cb -0.18 -1.21 -0.04 0.00 0.21 0.00 0.00 66.02 64.80 3fl8 s SER 4 CO 0.11 0.25 0.78 -0.36 0.41 0.00 0.00 173.24 174.43 3fl8 s PHE 5 N -0.15 3.63 -0.24 2.43 0.40 -0.09 0.30 117.98 124.27 3fl8 s PHE 5 Ca -0.01 1.41 -0.01 0.00 -0.60 0.00 0.00 56.93 57.71 3fl8 s PHE 5 Cb -0.14 -2.88 0.02 0.00 0.51 0.00 0.00 43.02 40.53 3fl8 s PHE 5 CO 0.03 0.11 -0.08 1.41 0.70 0.00 0.00 175.22 177.39 3fl8 s MET 6 N 0.66 2.91 -0.02 0.44 -2.45 -0.60 -0.31 119.30 119.92 3fl8 s MET 6 Ca 0.41 -0.92 -0.09 0.00 -1.25 0.00 0.00 55.69 53.84 3fl8 s MET 6 Cb -0.19 -2.93 0.01 0.00 1.25 0.00 0.00 34.83 32.97 3fl8 s MET 6 CO 0.22 -0.35 0.19 0.54 1.05 0.00 0.00 175.02 176.66 3fl8 s VAL 7 N 1.33 0.06 -0.11 10.11 0.11 0.14 -4.56 120.40 127.48 3fl8 s VAL 7 Ca 0.01 -0.47 0.03 0.00 -2.93 0.00 0.00 61.98 58.62 3fl8 s VAL 7 Cb -0.16 -0.43 0.01 0.00 -1.53 0.00 0.00 36.38 34.27 3fl8 s VAL 7 CO -0.05 -0.26 -0.21 0.00 -3.33 0.00 0.00 175.10 171.25 3fl8 s ALA 8 N -0.98 2.03 0.08 1.54 0.00 -1.26 -0.42 121.76 122.75 3fl8 s ALA 8 Ca -0.11 -0.92 -0.08 0.00 0.00 0.00 0.00 51.96 50.85 3fl8 s ALA 8 Cb -0.06 -0.84 -0.00 0.00 0.00 0.00 0.00 23.12 22.22 3fl8 s ALA 8 CO 0.02 0.13 0.18 0.00 0.00 0.00 0.00 175.76 176.08 3fl8 s MET 9 N 0.61 0.80 0.00 0.00 0.00 -0.10 -4.56 119.30 116.05 3fl8 s MET 9 Ca -0.13 -0.90 0.00 0.00 0.00 0.00 0.00 55.69 54.66 3fl8 s MET 9 Cb -0.17 0.32 0.00 0.00 0.00 0.00 0.00 34.83 34.99 3fl8 s MET 9 CO 0.04 -0.24 0.00 -0.40 0.00 0.00 0.00 175.02 174.41 3fl8 n ASP 10 N 0.11 0.00 0.30 -1.18 5.75 -0.82 -0.45 116.55 120.26 3fl8 n ASP 10 Ca -0.16 -0.63 0.18 0.00 -0.01 0.00 0.00 54.79 54.17 3fl8 n ASP 10 Cb 0.62 0.00 0.91 0.00 -1.03 0.00 0.00 41.12 41.62 3fl8 n ASP 10 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3fl8 h GLU 11 N 0.00 0.00 -0.20 0.11 5.08 -1.27 -2.04 114.58 116.26 3fl8 h GLU 11 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3fl8 h GLU 11 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3fl8 h GLU 11 CO 0.00 0.03 0.00 0.09 -1.00 0.00 0.00 179.01 178.13 3fl8 n ASN 12 N -3.25 3.53 -0.16 1.42 5.03 -1.26 -4.96 115.26 115.60 3fl8 n ASN 12 Ca -0.02 -3.03 -0.02 0.00 0.87 0.00 0.00 54.58 52.39 3fl8 n ASN 12 Cb 0.19 -0.52 -0.01 0.00 -1.02 0.00 0.00 39.78 38.43 3fl8 n ASN 12 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3fl8 n ARG 13 N -0.72 -0.54 -1.74 3.52 1.74 -0.77 -4.88 116.66 113.27 3fl8 n ARG 13 Ca 0.20 0.34 -0.42 0.00 -0.77 0.00 0.00 57.85 57.20 3fl8 n ARG 13 Cb 0.83 -3.89 -0.03 0.00 -1.02 0.00 0.00 32.46 28.35 3fl8 n ARG 13 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3fl8 s VAL 14 N -1.88 2.06 0.00 1.55 1.01 -1.26 -0.43 120.40 121.44 3fl8 s VAL 14 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.02 3fl8 s VAL 14 Cb 0.00 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.35 3fl8 s VAL 14 CO 0.00 0.00 0.38 2.30 0.00 0.00 0.00 175.10 177.78 3fl8 n ILE 15 N 3.91 0.00 -3.56 2.22 -5.35 -0.33 -1.94 119.36 114.30 3fl8 n ILE 15 Ca 0.15 -0.42 -0.09 0.00 -0.27 0.00 0.00 62.75 62.12 3fl8 n ILE 15 Cb 0.35 1.14 -0.04 0.00 -1.74 0.00 0.00 39.64 39.35 3fl8 n ILE 15 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3fl8 s GLY 16 N -0.09 -0.30 -0.05 3.28 0.00 -1.21 -4.77 107.32 104.18 3fl8 s GLY 16 Ca 0.00 1.78 -0.02 0.00 0.00 0.00 0.00 44.72 46.48 3fl8 s GLY 16 CO 0.00 0.80 0.11 1.25 0.00 0.00 0.00 173.10 175.26 3fl8 s LYS 17 N -1.76 0.03 0.00 2.90 2.47 0.24 -1.23 119.74 122.40 3fl8 s LYS 17 Ca 0.02 0.35 0.00 0.00 -1.56 0.00 0.00 55.97 54.78 3fl8 s LYS 17 Cb -0.01 -0.24 0.00 0.00 -1.46 0.00 0.00 37.83 36.12 3fl8 s LYS 17 CO -0.02 -0.20 0.00 -0.25 0.16 0.00 0.00 175.35 175.04 3fl8 n ASP 18 N 4.44 0.00 0.00 1.43 9.92 -1.26 -0.96 116.55 130.12 3fl8 n ASP 18 Ca -0.22 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.04 3fl8 n ASP 18 Cb 0.51 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.99 3fl8 n ASP 18 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3fl8 n ASN 19 N 1.83 0.00 -4.43 -2.24 3.02 -1.26 -5.12 115.26 107.06 3fl8 n ASN 19 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.26 3fl8 n ASN 19 Cb 0.00 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.09 3fl8 n ASN 19 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3fl8 s ASN 20 N 0.00 3.40 -0.01 6.41 0.01 -0.13 -4.63 114.94 119.99 3fl8 s ASN 20 Ca 0.00 -1.64 -0.28 0.00 -0.71 0.00 0.00 52.86 50.23 3fl8 s ASN 20 Cb 0.00 0.44 -0.03 0.00 0.41 0.00 0.00 41.25 42.07 3fl8 s ASN 20 CO 0.00 -0.86 0.92 -0.76 -1.51 0.00 0.00 177.10 174.89 3fl8 s LEU 21 N -3.72 4.36 0.22 0.60 1.43 -1.26 -0.59 118.68 119.72 3fl8 s LEU 21 Ca 0.17 1.55 0.21 0.00 -1.03 0.00 0.00 54.13 55.03 3fl8 s LEU 21 Cb 0.03 -3.46 0.92 0.00 0.03 0.00 0.00 46.19 43.71 3fl8 s LEU 21 CO 0.10 -0.22 1.63 -2.65 0.23 0.00 0.00 176.35 175.43 3fl8 n PRO 22 N 3.85 0.15 -4.44 1.29 -0.02 -1.26 -4.73 135.00 129.84 3fl8 n PRO 22 Ca 0.04 0.45 -0.22 0.00 -2.02 0.00 0.00 63.50 61.75 3fl8 n PRO 22 Cb 0.51 -1.82 -0.10 0.00 -0.02 0.00 0.00 33.50 32.07 3fl8 n PRO 22 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 3fl8 s TRP 23 N -3.31 2.05 -0.29 6.00 -2.14 -1.26 -5.03 118.94 114.95 3fl8 s TRP 23 Ca 0.03 -0.57 0.01 0.00 2.66 0.00 0.00 56.10 58.23 3fl8 s TRP 23 Cb 0.08 -1.08 0.09 0.00 -3.10 0.00 0.00 33.47 29.46 3fl8 s TRP 23 CO 0.31 0.43 0.04 0.50 -2.66 0.00 0.00 176.95 175.57 3fl8 s ARG 24 N -3.65 1.16 -0.59 3.25 3.52 -1.26 -5.04 118.95 116.34 3fl8 s ARG 24 Ca 0.29 -1.25 0.04 0.00 -0.13 0.00 0.00 55.73 54.68 3fl8 s ARG 24 Cb 0.01 -2.49 0.16 0.00 -1.56 0.00 0.00 34.95 31.07 3fl8 s ARG 24 CO 0.12 -0.86 0.42 -0.51 -0.81 0.00 0.00 175.30 173.66 3fl8 s LEU 25 N 1.37 3.65 0.32 -0.88 1.43 -1.26 -4.57 118.68 118.74 3fl8 s LEU 25 Ca 0.05 -3.48 0.09 0.00 -1.03 0.00 0.00 54.13 49.76 3fl8 s LEU 25 Cb -0.18 -1.25 0.88 0.00 0.03 0.00 0.00 46.19 45.67 3fl8 s LEU 25 CO -0.15 -0.13 1.71 -0.65 0.23 0.00 0.00 176.35 177.36 3fl8 h PRO 26 N 5.64 0.48 -0.73 1.29 0.11 -1.97 0.35 132.00 137.18 3fl8 h PRO 26 Ca 0.15 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.17 3fl8 h PRO 26 Cb 0.82 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.79 3fl8 h PRO 26 CO 0.60 0.32 0.21 1.03 -0.21 0.00 0.00 178.00 179.95 3fl8 h SER 27 N 0.50 1.07 -0.45 -2.05 0.87 -1.92 -1.60 113.55 109.97 3fl8 h SER 27 Ca 0.64 -0.21 0.03 0.00 -1.23 0.00 0.00 61.79 61.01 3fl8 h SER 27 Cb 1.25 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 62.90 3fl8 h SER 27 CO -0.51 1.00 0.25 -0.08 -0.53 0.00 0.00 176.83 176.96 3fl8 h GLU 28 N 1.09 0.49 -0.13 2.24 4.22 -1.31 -1.80 114.58 119.38 3fl8 h GLU 28 Ca 0.23 -0.03 -0.05 0.00 0.08 0.00 0.00 59.36 59.59 3fl8 h GLU 28 Cb 0.33 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3fl8 h GLU 28 CO -0.00 0.32 -0.16 -0.07 -2.18 0.00 0.00 179.01 176.92 3fl8 h LEU 29 N 0.51 0.20 -1.04 1.64 3.38 -1.03 -0.83 115.31 118.14 3fl8 h LEU 29 Ca 0.18 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 3fl8 h LEU 29 Cb 0.04 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3fl8 h LEU 29 CO -0.10 0.39 -0.36 -0.61 0.09 0.00 0.00 178.44 177.86 3fl8 h GLN 30 N 0.20 0.23 -0.22 1.13 5.75 -0.81 0.00 115.11 121.39 3fl8 h GLN 30 Ca 0.04 -0.10 -0.05 0.00 -0.15 0.00 0.00 58.65 58.39 3fl8 h GLN 30 Cb 0.42 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.95 3fl8 h GLN 30 CO 0.03 0.56 -0.06 -0.92 -2.65 0.00 0.00 178.83 175.79 3fl8 h TYR 31 N 0.20 0.48 -0.41 3.99 3.20 -0.36 -0.83 116.97 123.24 3fl8 h TYR 31 Ca 0.02 -0.10 0.07 0.00 3.14 0.00 0.00 58.73 61.86 3fl8 h TYR 31 Cb 0.73 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.82 3fl8 h TYR 31 CO 0.01 0.67 0.02 0.28 -1.64 0.00 0.00 178.16 177.49 3fl8 h VAL 32 N 0.15 0.70 -0.35 1.81 2.07 -0.80 0.07 116.25 119.91 3fl8 h VAL 32 Ca 0.05 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.53 3fl8 h VAL 32 Cb 0.51 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 3fl8 h VAL 32 CO 0.02 0.02 0.23 0.50 0.02 0.00 0.00 177.57 178.37 3fl8 h LYS 33 N 0.13 0.47 -0.55 1.57 3.64 -0.85 -1.37 116.57 119.61 3fl8 h LYS 33 Ca 0.20 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 3fl8 h LYS 33 Cb 0.28 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 3fl8 h LYS 33 CO -0.32 0.31 0.28 -0.22 -2.27 0.00 0.00 179.45 177.22 3fl8 h LYS 34 N 0.48 0.78 -0.26 1.90 3.64 -0.75 -2.97 116.57 119.40 3fl8 h LYS 34 Ca 0.13 -0.11 -0.17 0.00 -1.27 0.00 0.00 60.65 59.24 3fl8 h LYS 34 Cb -0.06 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.62 3fl8 h LYS 34 CO -0.03 0.63 -0.51 1.15 -2.27 0.00 0.00 179.45 178.41 3fl8 h THR 35 N 0.74 1.29 -0.48 1.00 2.02 -0.72 -3.21 112.91 113.56 3fl8 h THR 35 Ca 0.19 -1.72 0.00 0.00 0.77 0.00 0.00 66.41 65.65 3fl8 h THR 35 Cb 0.09 1.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.15 3fl8 h THR 35 CO -0.03 0.55 0.00 0.35 0.37 0.00 0.00 175.52 176.76 3fl8 n THR 36 N -4.00 0.64 -1.85 3.16 -2.24 -0.54 -4.95 114.28 104.51 3fl8 n THR 36 Ca -0.03 -0.65 -0.42 0.00 -2.27 0.00 0.00 64.05 60.67 3fl8 n THR 36 Cb 0.60 0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 69.16 3fl8 n THR 36 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 3fl8 s MET 37 N -1.36 4.17 0.00 -0.78 0.00 -1.12 -2.19 119.30 118.01 3fl8 s MET 37 Ca 0.33 2.40 0.00 0.00 0.00 0.00 0.00 55.69 58.43 3fl8 s MET 37 Cb 0.18 -3.96 0.00 0.00 0.00 0.00 0.00 34.83 31.05 3fl8 s MET 37 CO 0.23 -0.87 0.00 0.41 0.00 0.00 0.00 175.02 174.79 3fl8 n GLY 38 N 4.27 0.54 3.10 2.11 0.00 -1.25 -5.05 105.19 108.92 3fl8 n GLY 38 Ca 0.18 -0.51 -0.17 0.00 0.00 0.00 0.00 46.02 45.53 3fl8 n GLY 38 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fl8 s HIS 39 N -2.00 0.96 0.42 1.61 3.76 -0.93 -5.01 115.29 114.09 3fl8 s HIS 39 Ca 0.00 -0.40 -0.27 0.00 -0.15 0.00 0.00 55.06 54.25 3fl8 s HIS 39 Cb 0.00 -0.56 -0.09 0.00 1.11 0.00 0.00 32.58 33.03 3fl8 s HIS 39 CO 0.00 -0.00 1.45 -2.14 -0.85 0.00 0.00 174.74 173.20 3fl8 s PRO 40 N -1.31 3.88 -0.23 8.40 0.02 -1.26 -4.33 135.00 140.17 3fl8 s PRO 40 Ca -0.03 2.48 -0.07 0.00 0.02 0.00 0.00 61.00 63.40 3fl8 s PRO 40 Cb -0.08 -2.80 -0.03 0.00 0.02 0.00 0.00 34.50 31.60 3fl8 s PRO 40 CO 0.01 -0.68 0.06 -0.51 -0.33 0.00 0.00 177.00 175.55 3fl8 s LEU 41 N -2.43 3.48 -0.25 -5.54 1.43 0.15 -1.66 118.68 113.88 3fl8 s LEU 41 Ca 0.57 -0.15 -0.07 0.00 -1.03 0.00 0.00 54.13 53.45 3fl8 s LEU 41 Cb -0.45 -1.92 -0.03 0.00 0.03 0.00 0.00 46.19 43.83 3fl8 s LEU 41 CO 0.59 0.02 0.07 -0.63 0.23 0.00 0.00 176.35 176.63 3fl8 s ILE 42 N 1.26 4.32 0.02 -0.59 -1.09 0.70 -0.93 121.20 124.89 3fl8 s ILE 42 Ca 0.05 -0.17 -0.05 0.00 -2.23 0.00 0.00 60.65 58.24 3fl8 s ILE 42 Cb -0.15 -3.02 -0.01 0.00 -1.58 0.00 0.00 42.46 37.71 3fl8 s ILE 42 CO 0.03 0.34 0.08 0.00 -1.23 0.00 0.00 174.94 174.17 3fl8 s MET 43 N 1.57 0.47 0.89 2.79 0.23 -0.60 0.12 119.30 124.77 3fl8 s MET 43 Ca 0.06 -0.55 -0.11 0.00 -1.03 0.00 0.00 55.69 54.06 3fl8 s MET 43 Cb -0.15 0.19 0.12 0.00 -1.53 0.00 0.00 34.83 33.46 3fl8 s MET 43 CO 0.04 -0.11 1.09 0.20 -2.03 0.00 0.00 175.02 174.21 3fl8 s GLY 44 N -1.61 1.63 0.08 3.16 0.00 -0.99 -0.25 107.32 109.33 3fl8 s GLY 44 Ca -0.12 0.01 -0.24 0.00 0.00 0.00 0.00 44.72 44.36 3fl8 s GLY 44 CO -0.01 0.48 1.70 -0.09 0.00 0.00 0.00 173.10 175.18 3fl8 h ARG 45 N -1.54 -0.11 -0.57 2.90 2.43 -1.90 -1.19 114.38 114.39 3fl8 h ARG 45 Ca -0.49 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 58.79 3fl8 h ARG 45 Cb 1.28 0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 30.77 3fl8 h ARG 45 CO 0.53 -0.05 0.14 0.87 -1.51 0.00 0.00 179.97 179.96 3fl8 h LYS 46 N -0.14 0.27 -0.59 0.20 1.57 -1.93 0.44 116.57 116.39 3fl8 h LYS 46 Ca -0.01 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3fl8 h LYS 46 Cb 0.11 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 3fl8 h LYS 46 CO 0.02 0.18 0.39 -0.97 -0.57 0.00 0.00 179.45 178.50 3fl8 h ASN 47 N 0.28 0.68 -0.62 0.86 -1.24 -1.83 -0.44 115.58 113.27 3fl8 h ASN 47 Ca 0.29 -0.02 -0.09 0.00 0.71 0.00 0.00 56.30 57.20 3fl8 h ASN 47 Cb 0.41 -0.17 -0.02 0.00 0.73 0.00 0.00 38.32 39.27 3fl8 h ASN 47 CO -0.36 0.49 0.04 0.22 -1.29 0.00 0.00 177.43 176.53 3fl8 h TYR 48 N 0.80 1.15 0.00 0.67 3.20 -0.41 -2.79 116.97 119.60 3fl8 h TYR 48 Ca 0.22 -0.18 -0.08 0.00 3.14 0.00 0.00 58.73 61.82 3fl8 h TYR 48 Cb -0.09 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 37.86 3fl8 h TYR 48 CO -0.03 1.00 -0.39 0.93 -1.64 0.00 0.00 178.16 178.03 3fl8 h GLU 49 N 0.97 0.00 -0.02 1.82 5.08 -0.54 -2.21 114.58 119.69 3fl8 h GLU 49 Ca 0.18 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.47 3fl8 h GLU 49 Cb 0.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3fl8 h GLU 49 CO 0.02 0.39 -0.33 0.00 -1.00 0.00 0.00 179.01 178.09 3fl8 h ALA 50 N 1.61 1.42 0.00 3.43 0.00 -0.83 -3.01 119.26 121.88 3fl8 h ALA 50 Ca -0.00 -0.31 -0.20 0.00 0.00 0.00 0.00 54.91 54.39 3fl8 h ALA 50 Cb 0.73 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 3fl8 h ALA 50 CO 0.05 0.43 -1.04 0.82 0.00 0.00 0.00 179.25 179.51 3fl8 h ILE 51 N 0.03 1.39 0.00 0.00 2.04 -1.22 -3.48 117.51 116.26 3fl8 h ILE 51 Ca 0.00 -3.05 0.00 0.00 1.00 0.00 0.00 64.86 62.81 3fl8 h ILE 51 Cb 0.60 2.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.35 3fl8 h ILE 51 CO 0.04 0.79 0.00 0.61 0.00 0.00 0.00 178.15 179.59 3fl8 n GLY 52 N 1.36 2.32 3.13 5.37 0.00 -0.87 -4.97 105.19 111.54 3fl8 n GLY 52 Ca -0.03 -0.53 -0.10 0.00 0.00 0.00 0.00 46.02 45.36 3fl8 n GLY 52 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3fl8 s ARG 53 N 0.00 0.73 0.16 1.61 1.70 -1.26 -4.99 118.95 116.89 3fl8 s ARG 53 Ca 0.00 -1.19 -0.31 0.00 -0.47 0.00 0.00 55.73 53.75 3fl8 s ARG 53 Cb 0.00 -0.14 -0.11 0.00 -0.57 0.00 0.00 34.95 34.14 3fl8 s ARG 53 CO 0.00 -0.02 1.68 -2.14 -1.08 0.00 0.00 175.30 173.74 3fl8 s PRO 54 N -3.38 4.17 -0.36 3.89 0.02 -1.26 -4.94 135.00 133.14 3fl8 s PRO 54 Ca 0.06 2.49 -0.29 0.00 0.02 0.00 0.00 61.00 63.29 3fl8 s PRO 54 Cb 0.03 -3.27 -0.00 0.00 0.02 0.00 0.00 34.50 31.28 3fl8 s PRO 54 CO -0.05 -0.72 1.51 -0.48 -0.33 0.00 0.00 177.00 176.93 3fl8 s LEU 55 N 1.66 3.63 0.64 -5.54 -0.00 -1.26 -4.98 118.68 112.84 3fl8 s LEU 55 Ca 0.74 1.07 -0.18 0.00 -0.00 0.00 0.00 54.13 55.76 3fl8 s LEU 55 Cb -0.46 -3.54 -0.02 0.00 -0.00 0.00 0.00 46.19 42.18 3fl8 s LEU 55 CO 0.33 -1.44 1.12 -2.65 -0.00 0.00 0.00 176.35 173.71 3fl8 n PRO 56 N 8.03 0.93 -0.75 1.48 -0.02 -1.26 -3.51 135.00 139.90 3fl8 n PRO 56 Ca 0.18 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3fl8 n PRO 56 Cb 0.47 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3fl8 n PRO 56 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fl8 n GLY 57 N 1.09 0.80 3.03 -1.23 0.00 -1.26 -5.03 105.19 102.59 3fl8 n GLY 57 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 3fl8 n GLY 57 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fl8 s ARG 58 N -0.25 0.44 -0.25 1.61 3.00 -1.23 -3.80 118.95 118.47 3fl8 s ARG 58 Ca 0.00 -0.73 -0.29 0.00 0.00 0.00 0.00 55.73 54.71 3fl8 s ARG 58 Cb 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 34.95 34.84 3fl8 s ARG 58 CO 0.00 -0.01 1.88 1.03 0.00 0.00 0.00 175.30 178.20 3fl8 s ARG 59 N -1.71 3.43 -0.40 3.54 0.52 -1.26 -4.91 118.95 118.17 3fl8 s ARG 59 Ca -0.11 1.71 -0.21 0.00 -0.52 0.00 0.00 55.73 56.60 3fl8 s ARG 59 Cb -0.09 -4.20 0.01 0.00 0.52 0.00 0.00 34.95 31.19 3fl8 s ARG 59 CO -0.01 -1.74 0.65 -0.80 0.02 0.00 0.00 175.30 173.42 3fl8 s ASN 60 N 6.14 6.38 -0.26 0.23 0.02 -1.26 -0.67 114.94 125.52 3fl8 s ASN 60 Ca 0.84 -0.07 -0.05 0.00 -1.02 0.00 0.00 52.86 52.56 3fl8 s ASN 60 Cb -0.27 -2.33 0.00 0.00 0.02 0.00 0.00 41.25 38.68 3fl8 s ASN 60 CO 0.34 -0.69 0.02 -0.63 0.02 0.00 0.00 177.10 176.15 3fl8 s ILE 61 N 2.80 3.65 -0.18 0.60 1.01 -0.11 -1.26 121.20 127.71 3fl8 s ILE 61 Ca 0.24 -0.64 -0.12 0.00 0.00 0.00 0.00 60.65 60.14 3fl8 s ILE 61 Cb -0.14 -2.80 -0.05 0.00 0.01 0.00 0.00 42.46 39.48 3fl8 s ILE 61 CO 0.17 0.22 0.20 -0.63 0.00 0.00 0.00 174.94 174.91 3fl8 s ILE 62 N 1.48 5.37 -0.30 2.92 1.01 0.16 -1.55 121.20 130.28 3fl8 s ILE 62 Ca 0.03 0.35 -0.10 0.00 0.00 0.00 0.00 60.65 60.94 3fl8 s ILE 62 Cb -0.16 -3.54 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 3fl8 s ILE 62 CO -0.00 0.43 0.15 -0.69 0.00 0.00 0.00 174.94 174.82 3fl8 s VAL 63 N 0.34 4.70 -0.05 2.92 1.01 0.65 -0.98 120.40 128.99 3fl8 s VAL 63 Ca 0.12 -0.27 -0.16 0.00 0.00 0.00 0.00 61.98 61.68 3fl8 s VAL 63 Cb -0.12 -3.33 0.03 0.00 0.00 0.00 0.00 36.38 32.96 3fl8 s VAL 63 CO 0.01 0.14 0.36 0.28 0.00 0.00 0.00 175.10 175.89 3fl8 s THR 64 N 1.64 0.04 0.17 3.92 -1.32 -0.40 -3.04 115.64 116.66 3fl8 s THR 64 Ca 0.05 -0.32 0.24 0.00 -1.21 0.00 0.00 61.69 60.46 3fl8 s THR 64 Cb -0.17 -0.63 0.24 0.00 -1.51 0.00 0.00 72.50 70.43 3fl8 s THR 64 CO 0.07 -0.17 1.85 -0.09 -2.21 0.00 0.00 174.62 174.07 3fl8 h ARG 65 N 4.21 0.00 -6.22 7.08 2.43 -1.84 -3.34 114.38 116.69 3fl8 h ARG 65 Ca -0.29 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 58.33 3fl8 h ARG 65 Cb 1.18 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.69 3fl8 h ARG 65 CO 0.37 0.22 1.26 1.21 -1.51 0.00 0.00 179.97 181.52 3fl8 s ASN 66 N -6.19 5.77 0.50 -3.80 2.47 -1.26 -4.88 114.94 107.56 3fl8 s ASN 66 Ca 0.00 0.89 0.34 0.00 0.42 0.00 0.00 52.86 54.51 3fl8 s ASN 66 Cb 0.11 -2.53 1.60 0.00 -1.45 0.00 0.00 41.25 38.98 3fl8 s ASN 66 CO 0.63 -1.88 2.01 -0.33 -3.72 0.00 0.00 177.10 173.81 3fl8 h GLU 67 N 13.13 0.00 0.00 0.43 4.39 -1.99 -2.50 114.58 128.04 3fl8 h GLU 67 Ca -0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.40 3fl8 h GLU 67 Cb 1.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 3fl8 h GLU 67 CO 1.10 0.00 -0.81 0.41 -1.16 0.00 0.00 179.01 178.56 3fl8 n GLY 68 N -0.50 -1.36 3.71 -3.84 0.00 -1.26 -4.95 105.19 97.00 3fl8 n GLY 68 Ca -0.01 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 3fl8 n GLY 68 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3fl8 n TYR 69 N -2.15 2.72 -3.90 1.61 9.36 -0.94 -5.01 117.16 118.85 3fl8 n TYR 69 Ca 0.02 -0.05 -0.11 0.00 3.32 0.00 0.00 57.90 61.09 3fl8 n TYR 69 Cb 0.45 -2.70 -0.10 0.00 -0.63 0.00 0.00 39.34 36.36 3fl8 n TYR 69 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 3fl8 s HIS 70 N 1.80 0.09 -0.19 2.98 3.76 -1.26 -4.93 115.29 117.54 3fl8 s HIS 70 Ca 0.78 -0.21 -0.08 0.00 -0.15 0.00 0.00 55.06 55.40 3fl8 s HIS 70 Cb -0.49 -0.08 0.08 0.00 1.11 0.00 0.00 32.58 33.20 3fl8 s HIS 70 CO 0.34 -0.25 0.42 0.54 -0.85 0.00 0.00 174.74 174.95 3fl8 s VAL 71 N -1.31 -0.33 0.22 -0.90 0.11 -1.26 -5.13 120.40 111.80 3fl8 s VAL 71 Ca -0.14 0.13 -0.32 0.00 -2.93 0.00 0.00 61.98 58.72 3fl8 s VAL 71 Cb -0.08 -0.65 -0.12 0.00 -1.53 0.00 0.00 36.38 34.00 3fl8 s VAL 71 CO 0.01 0.05 1.63 -1.84 -3.33 0.00 0.00 175.10 171.62 3fl8 n GLU 72 N 4.83 2.55 -0.47 1.54 0.28 -1.26 -1.74 120.64 126.37 3fl8 n GLU 72 Ca -0.16 0.91 0.00 0.00 -0.16 0.00 0.00 57.16 57.76 3fl8 n GLU 72 Cb 0.52 -2.71 0.00 0.00 1.43 0.00 0.00 31.44 30.68 3fl8 n GLU 72 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3fl8 n GLY 73 N 3.23 0.89 3.27 -1.84 0.00 -1.26 -4.92 105.19 104.57 3fl8 n GLY 73 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 3fl8 n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fl8 s GLU 75 N -1.94 3.49 -0.09 0.00 2.02 -0.39 -4.65 118.70 117.15 3fl8 s GLU 75 Ca 0.06 -0.43 0.03 0.00 0.02 0.00 0.00 54.97 54.65 3fl8 s GLU 75 Cb -0.10 -2.84 0.01 0.00 0.10 0.00 0.00 34.13 31.30 3fl8 s GLU 75 CO 0.04 0.39 -0.17 0.08 0.02 0.00 0.00 175.26 175.62 3fl8 s VAL 76 N -1.91 1.54 0.21 2.63 1.01 -1.26 -0.66 120.40 121.95 3fl8 s VAL 76 Ca 0.37 -0.71 0.11 0.00 0.00 0.00 0.00 61.98 61.76 3fl8 s VAL 76 Cb -0.11 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 3fl8 s VAL 76 CO 0.30 0.45 -0.21 0.00 0.00 0.00 0.00 175.10 175.63 3fl8 s ALA 77 N 0.60 2.65 0.00 5.51 0.00 -0.15 -4.95 121.76 125.42 3fl8 s ALA 77 Ca -0.15 -1.67 0.00 0.00 0.00 0.00 0.00 51.96 50.15 3fl8 s ALA 77 Cb -0.16 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.57 3fl8 s ALA 77 CO 0.05 0.40 0.85 0.72 0.00 0.00 0.00 175.76 177.78 3fl8 n HIS 78 N 0.04 0.00 -3.59 0.00 8.25 -1.25 -1.28 115.22 117.39 3fl8 n HIS 78 Ca -0.11 -0.36 -0.05 0.00 -0.26 0.00 0.00 57.72 56.95 3fl8 n HIS 78 Cb 0.57 -0.04 -0.02 0.00 1.12 0.00 0.00 29.99 31.63 3fl8 n HIS 78 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3fl8 s SER 79 N -0.71 -0.21 0.16 0.41 1.04 -1.26 -4.62 113.70 108.51 3fl8 s SER 79 Ca 0.00 -0.08 -0.16 0.00 0.48 0.00 0.00 55.95 56.19 3fl8 s SER 79 Cb 0.00 0.28 0.07 0.00 0.10 0.00 0.00 66.02 66.47 3fl8 s SER 79 CO 0.00 -0.48 1.76 0.58 0.98 0.00 0.00 173.24 176.08 3fl8 h VAL 80 N 2.00 0.91 -0.51 5.02 2.07 -1.96 -1.76 116.25 122.02 3fl8 h VAL 80 Ca -0.19 -0.11 0.10 0.00 0.82 0.00 0.00 66.70 67.32 3fl8 h VAL 80 Cb 1.21 0.56 -0.10 0.00 -1.52 0.00 0.00 31.29 31.44 3fl8 h VAL 80 CO 0.27 0.06 -0.17 -0.08 0.02 0.00 0.00 177.57 177.66 3fl8 h GLU 81 N 0.32 -0.05 -0.65 1.57 4.81 -1.99 0.45 114.58 119.05 3fl8 h GLU 81 Ca 0.17 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.36 3fl8 h GLU 81 Cb 0.13 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 3fl8 h GLU 81 CO -0.16 -0.03 0.24 0.93 -0.73 0.00 0.00 179.01 179.25 3fl8 h GLU 82 N -0.05 0.96 -0.26 1.92 5.08 -1.84 -0.14 114.58 120.25 3fl8 h GLU 82 Ca 0.24 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3fl8 h GLU 82 Cb 0.43 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3fl8 h GLU 82 CO -0.55 0.80 0.15 0.28 -1.00 0.00 0.00 179.01 178.69 3fl8 h VAL 83 N 0.94 1.11 -0.15 3.13 2.07 -0.39 0.74 116.25 123.70 3fl8 h VAL 83 Ca 0.22 -0.27 -0.09 0.00 0.82 0.00 0.00 66.70 67.38 3fl8 h VAL 83 Cb 0.21 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 3fl8 h VAL 83 CO -0.02 0.11 -0.29 -0.26 0.02 0.00 0.00 177.57 177.13 3fl8 h PHE 84 N 0.32 0.32 0.41 1.57 0.04 -0.48 0.21 116.94 119.32 3fl8 h PHE 84 Ca 0.09 -0.07 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 3fl8 h PHE 84 Cb 0.04 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.11 3fl8 h PHE 84 CO -0.04 0.55 -0.19 1.49 -0.60 0.00 0.00 178.31 179.52 3fl8 h GLU 85 N 0.25 -0.52 -0.89 1.51 4.57 -0.69 -2.04 114.58 116.77 3fl8 h GLU 85 Ca 0.04 0.04 0.16 0.00 -1.18 0.00 0.00 59.36 58.41 3fl8 h GLU 85 Cb 0.65 0.12 -0.10 0.00 -0.16 0.00 0.00 28.75 29.26 3fl8 h GLU 85 CO 0.05 -0.26 0.47 -0.07 -1.18 0.00 0.00 179.01 178.02 3fl8 h LEU 86 N -0.72 0.57 -3.27 1.64 3.38 -0.52 -1.62 115.31 114.78 3fl8 h LEU 86 Ca -0.06 0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 3fl8 h LEU 86 Cb 0.51 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 3fl8 h LEU 86 CO 0.09 0.22 0.09 0.00 0.09 0.00 0.00 178.44 178.93 3fl8 n LYS 88 N 0.30 -0.06 -0.06 0.00 4.81 -0.61 -0.78 118.16 121.76 3fl8 n LYS 88 Ca 0.28 1.04 0.10 0.00 -0.87 0.00 0.00 58.31 58.87 3fl8 n LYS 88 Cb 1.14 -1.60 0.12 0.00 0.02 0.00 0.00 35.03 34.71 3fl8 n LYS 88 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3fl8 n ASN 89 N -5.03 2.89 -4.77 3.14 3.02 -1.26 -4.96 115.26 108.28 3fl8 n ASN 89 Ca 0.13 -1.88 -0.38 0.00 -0.03 0.00 0.00 54.58 52.42 3fl8 n ASN 89 Cb 0.41 -0.08 -0.03 0.00 -0.61 0.00 0.00 39.78 39.46 3fl8 n ASN 89 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3fl8 s GLU 90 N -1.56 4.25 0.18 3.52 0.41 0.04 -4.96 118.70 120.58 3fl8 s GLU 90 Ca 0.27 1.73 0.06 0.00 -0.41 0.00 0.00 54.97 56.62 3fl8 s GLU 90 Cb 0.18 -2.77 0.04 0.00 -1.78 0.00 0.00 34.13 29.81 3fl8 s GLU 90 CO 0.26 -0.12 1.42 1.05 -0.49 0.00 0.00 175.26 177.38 3fl8 h GLU 91 N 2.90 0.08 -1.85 1.61 4.11 -1.94 -3.41 114.58 116.08 3fl8 h GLU 91 Ca -0.48 -0.09 0.01 0.00 0.07 0.00 0.00 59.36 58.88 3fl8 h GLU 91 Cb 1.22 0.02 -0.23 0.00 0.50 0.00 0.00 28.75 30.27 3fl8 h GLU 91 CO 0.64 0.86 0.21 -2.00 0.07 0.00 0.00 179.01 178.79 3fl8 s GLU 92 N -3.19 0.68 0.16 1.06 2.12 -1.26 -1.59 118.70 116.68 3fl8 s GLU 92 Ca -0.01 0.92 0.09 0.00 0.36 0.00 0.00 54.97 56.32 3fl8 s GLU 92 Cb 0.11 0.27 -0.04 0.00 0.26 0.00 0.00 34.13 34.73 3fl8 s GLU 92 CO 0.81 -0.10 -0.20 0.96 -0.54 0.00 0.00 175.26 176.19 3fl8 s ILE 93 N 0.73 1.87 -0.29 -3.70 -4.36 -0.02 -4.14 121.20 111.29 3fl8 s ILE 93 Ca -0.02 -1.86 0.01 0.00 -0.26 0.00 0.00 60.65 58.51 3fl8 s ILE 93 Cb -0.05 -1.83 0.06 0.00 1.25 0.00 0.00 42.46 41.89 3fl8 s ILE 93 CO -0.07 -0.24 -0.04 -0.36 0.24 0.00 0.00 174.94 174.47 3fl8 s PHE 94 N -1.83 3.32 -0.33 1.37 0.08 -0.66 -0.63 117.98 119.30 3fl8 s PHE 94 Ca 0.15 -2.20 -0.29 0.00 0.12 0.00 0.00 56.93 54.71 3fl8 s PHE 94 Cb -0.07 -2.13 -0.01 0.00 -0.57 0.00 0.00 43.02 40.24 3fl8 s PHE 94 CO 0.07 -0.86 1.57 0.42 -0.10 0.00 0.00 175.22 176.32 3fl8 s ILE 95 N 1.15 3.74 -2.53 0.64 -1.09 0.15 -0.21 121.20 123.04 3fl8 s ILE 95 Ca -0.05 0.79 0.25 0.00 -2.23 0.00 0.00 60.65 59.41 3fl8 s ILE 95 Cb -0.20 -3.90 0.27 0.00 -1.58 0.00 0.00 42.46 37.04 3fl8 s ILE 95 CO -0.04 -0.51 1.41 0.33 -1.23 0.00 0.00 174.94 174.90 3fl8 n PHE 96 N 9.05 0.00 0.00 3.97 7.35 0.32 -1.56 117.46 136.59 3fl8 n PHE 96 Ca 0.19 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.88 3fl8 n PHE 96 Cb 0.47 -0.01 0.00 0.00 0.35 0.00 0.00 39.48 40.28 3fl8 n PHE 96 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3fl8 n GLY 97 N 1.31 -0.58 0.12 7.13 0.00 -1.24 -4.94 105.19 106.99 3fl8 n GLY 97 Ca 0.14 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.97 3fl8 n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fl8 n GLY 98 N 0.00 0.31 0.27 -0.02 0.00 -1.26 -2.34 105.19 102.15 3fl8 n GLY 98 Ca 0.00 -1.07 0.06 0.00 0.00 0.00 0.00 46.02 45.00 3fl8 n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fl8 h ALA 99 N 0.00 0.99 -0.37 4.61 0.00 -1.98 -0.85 119.26 121.66 3fl8 h ALA 99 Ca 0.00 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 3fl8 h ALA 99 Cb 0.00 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3fl8 h ALA 99 CO 0.00 -0.31 -0.08 1.96 0.00 0.00 0.00 179.25 180.82 3fl8 h GLN 100 N 0.31 0.63 -0.55 0.00 4.20 -1.92 -1.65 115.11 116.12 3fl8 h GLN 100 Ca 0.42 -0.18 -0.09 0.00 0.06 0.00 0.00 58.65 58.86 3fl8 h GLN 100 Cb 0.70 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.39 3fl8 h GLN 100 CO -0.49 0.71 -0.03 0.82 -0.67 0.00 0.00 178.83 179.17 3fl8 h ILE 101 N 0.59 1.26 -0.63 2.54 1.08 -1.51 -1.33 117.51 119.51 3fl8 h ILE 101 Ca 0.11 -1.14 0.00 0.00 -0.39 0.00 0.00 64.86 63.44 3fl8 h ILE 101 Cb 0.48 0.86 -0.03 0.00 -3.07 0.00 0.00 36.82 35.07 3fl8 h ILE 101 CO 0.03 0.41 0.40 1.88 -0.69 0.00 0.00 178.15 180.18 3fl8 h TYR 102 N 0.88 0.80 -0.91 1.37 0.05 -0.64 -2.67 116.97 115.85 3fl8 h TYR 102 Ca 0.16 0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.96 3fl8 h TYR 102 Cb 0.55 -0.27 -0.04 0.00 1.01 0.00 0.00 36.73 37.98 3fl8 h TYR 102 CO 0.04 0.52 0.60 -0.44 -1.05 0.00 0.00 178.16 177.83 3fl8 h ASP 103 N 0.85 1.04 -0.53 3.88 3.32 -0.90 -1.38 116.42 122.69 3fl8 h ASP 103 Ca 0.23 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 3fl8 h ASP 103 Cb -0.07 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.19 3fl8 h ASP 103 CO -0.05 0.75 0.31 -0.07 -1.72 0.00 0.00 179.24 178.47 3fl8 h LEU 104 N 1.23 0.67 -1.34 1.55 3.38 -0.97 -3.06 115.31 116.76 3fl8 h LEU 104 Ca 0.33 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.26 3fl8 h LEU 104 Cb -0.14 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.44 3fl8 h LEU 104 CO -0.07 0.53 -0.18 0.49 0.09 0.00 0.00 178.44 179.29 3fl8 n PHE 105 N -4.41 0.00 -0.33 1.13 3.72 -0.88 -4.45 117.46 112.24 3fl8 n PHE 105 Ca 0.05 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.58 3fl8 n PHE 105 Cb 0.09 -0.01 0.31 0.00 -0.94 0.00 0.00 39.48 38.93 3fl8 n PHE 105 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 3fl8 h LEU 106 N 3.28 0.64 0.00 4.37 5.85 -1.16 0.38 115.31 128.67 3fl8 h LEU 106 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3fl8 h LEU 106 Cb 0.80 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.84 3fl8 h LEU 106 CO 0.00 0.19 0.00 -2.65 -0.34 0.00 0.00 178.44 175.64 3fl8 n PRO 107 N -4.86 0.00 0.00 5.25 -0.02 -1.26 -3.10 135.00 131.01 3fl8 n PRO 107 Ca 0.23 0.29 0.01 0.00 -2.02 0.00 0.00 63.50 62.00 3fl8 n PRO 107 Cb 0.59 -1.50 -0.00 0.00 -0.02 0.00 0.00 33.50 32.57 3fl8 n PRO 107 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3fl8 n TYR 108 N -1.50 0.00 -2.06 6.00 4.01 0.08 -5.05 117.16 118.64 3fl8 n TYR 108 Ca 0.03 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.36 3fl8 n TYR 108 Cb 0.14 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.15 3fl8 n TYR 108 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3fl8 s VAL 109 N -0.59 2.67 -0.01 -0.72 0.11 -0.94 -4.57 120.40 116.35 3fl8 s VAL 109 Ca 0.01 0.63 0.03 0.00 -2.93 0.00 0.00 61.98 59.71 3fl8 s VAL 109 Cb 0.01 -3.40 -0.05 0.00 -1.53 0.00 0.00 36.38 31.41 3fl8 s VAL 109 CO 0.03 0.13 0.05 0.47 -3.33 0.00 0.00 175.10 172.45 3fl8 n ASP 110 N 1.34 4.28 -3.76 3.54 8.00 0.82 -4.96 116.55 125.81 3fl8 n ASP 110 Ca 0.02 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.40 3fl8 n ASP 110 Cb 0.41 0.97 -0.11 0.00 -0.02 0.00 0.00 41.12 42.37 3fl8 n ASP 110 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3fl8 s LYS 111 N -2.17 0.36 -0.18 -1.24 2.20 -1.06 -3.18 119.74 114.47 3fl8 s LYS 111 Ca -0.01 0.45 0.01 0.00 -0.36 0.00 0.00 55.97 56.06 3fl8 s LYS 111 Cb 0.02 0.16 0.02 0.00 -1.51 0.00 0.00 37.83 36.52 3fl8 s LYS 111 CO 0.13 -0.05 -0.19 -0.51 -0.36 0.00 0.00 175.35 174.37 3fl8 s LEU 112 N 0.24 2.17 -0.43 5.43 1.43 0.13 -0.92 118.68 126.73 3fl8 s LEU 112 Ca -0.01 -0.68 -0.08 0.00 -1.03 0.00 0.00 54.13 52.33 3fl8 s LEU 112 Cb -0.03 -1.46 0.10 0.00 0.03 0.00 0.00 46.19 44.83 3fl8 s LEU 112 CO -0.00 -0.02 0.27 -0.31 0.23 0.00 0.00 176.35 176.53 3fl8 s TYR 113 N 1.30 3.40 -0.17 0.29 1.51 0.57 0.06 117.35 124.30 3fl8 s TYR 113 Ca 0.04 -1.76 0.01 0.00 -1.01 0.00 0.00 57.07 54.35 3fl8 s TYR 113 Cb -0.13 -3.15 0.03 0.00 -0.11 0.00 0.00 41.96 38.60 3fl8 s TYR 113 CO -0.12 -0.91 -0.14 0.42 -1.11 0.00 0.00 175.55 173.68 3fl8 s ILE 114 N 1.36 1.73 -0.24 2.71 1.01 0.82 -0.68 121.20 127.91 3fl8 s ILE 114 Ca 0.04 -0.85 -0.19 0.00 0.00 0.00 0.00 60.65 59.65 3fl8 s ILE 114 Cb -0.24 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 3fl8 s ILE 114 CO 0.00 0.37 0.56 -0.89 0.00 0.00 0.00 174.94 174.98 3fl8 s THR 115 N 1.40 5.04 -0.34 2.92 2.01 0.44 -0.48 115.64 126.64 3fl8 s THR 115 Ca 0.03 1.00 -0.10 0.00 0.31 0.00 0.00 61.69 62.92 3fl8 s THR 115 Cb -0.14 -3.87 0.01 0.00 0.01 0.00 0.00 72.50 68.50 3fl8 s THR 115 CO -0.10 0.08 0.17 -0.54 -0.69 0.00 0.00 174.62 173.54 3fl8 s LYS 116 N 2.24 3.10 -0.25 4.92 1.02 -0.33 -0.92 119.74 129.53 3fl8 s LYS 116 Ca 0.24 -0.88 -0.16 0.00 0.02 0.00 0.00 55.97 55.18 3fl8 s LYS 116 Cb -0.16 -3.63 -0.03 0.00 -0.52 0.00 0.00 37.83 33.49 3fl8 s LYS 116 CO 0.09 -0.54 0.43 0.42 -0.92 0.00 0.00 175.35 174.83 3fl8 s ILE 117 N 1.58 5.15 -1.49 2.17 1.01 0.41 -2.02 121.20 128.01 3fl8 s ILE 117 Ca 0.03 0.71 -0.11 0.00 0.00 0.00 0.00 60.65 61.28 3fl8 s ILE 117 Cb -0.18 -3.75 -0.06 0.00 0.01 0.00 0.00 42.46 38.48 3fl8 s ILE 117 CO 0.06 0.16 2.67 1.41 0.00 0.00 0.00 174.94 179.24 3fl8 n HIS 118 N 5.14 2.57 -3.45 3.97 8.25 -0.11 -2.75 115.22 128.84 3fl8 n HIS 118 Ca -0.07 -2.91 -0.13 0.00 -0.26 0.00 0.00 57.72 54.35 3fl8 n HIS 118 Cb 0.50 -2.41 -0.03 0.00 1.12 0.00 0.00 29.99 29.18 3fl8 n HIS 118 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3fl8 s HIS 119 N 2.64 -0.54 -0.37 4.41 5.04 -1.26 -4.74 115.29 120.47 3fl8 s HIS 119 Ca 0.61 0.46 -0.05 0.00 -1.54 0.00 0.00 55.06 54.54 3fl8 s HIS 119 Cb 0.16 0.53 0.07 0.00 0.04 0.00 0.00 32.58 33.38 3fl8 s HIS 119 CO -0.06 -0.76 0.15 0.00 -2.34 0.00 0.00 174.74 171.73 3fl8 s ALA 120 N -3.18 3.10 0.55 1.58 0.00 -1.26 -2.34 121.76 120.19 3fl8 s ALA 120 Ca -0.01 -2.07 0.02 0.00 0.00 0.00 0.00 51.96 49.91 3fl8 s ALA 120 Cb -0.01 -2.35 0.04 0.00 0.00 0.00 0.00 23.12 20.80 3fl8 s ALA 120 CO -0.08 -1.53 0.76 -0.06 0.00 0.00 0.00 175.76 174.85 3fl8 s PHE 121 N 1.31 2.74 -0.26 0.00 0.40 -1.26 -5.07 117.98 115.84 3fl8 s PHE 121 Ca 0.01 -0.10 -0.22 0.00 -0.60 0.00 0.00 56.93 56.03 3fl8 s PHE 121 Cb -0.21 -2.71 -0.01 0.00 0.51 0.00 0.00 43.02 40.59 3fl8 s PHE 121 CO 0.00 -0.88 0.69 -1.83 0.70 0.00 0.00 175.22 173.91 3fl8 s GLU 122 N -4.73 4.09 0.17 0.44 1.03 -1.26 -5.03 118.70 113.41 3fl8 s GLU 122 Ca 0.58 0.62 -0.00 0.00 0.03 0.00 0.00 54.97 56.20 3fl8 s GLU 122 Cb -0.10 -3.66 -0.04 0.00 -0.80 0.00 0.00 34.13 29.52 3fl8 s GLU 122 CO 0.38 -0.48 0.07 0.20 -1.33 0.00 0.00 175.26 174.10 3fl8 s GLY 123 N 1.47 1.25 0.00 -3.83 0.00 -1.26 -4.66 107.32 100.29 3fl8 s GLY 123 Ca 0.29 -1.61 0.00 0.00 0.00 0.00 0.00 44.72 43.40 3fl8 s GLY 123 CO 0.09 -1.44 0.23 2.09 0.00 0.00 0.00 173.10 174.07 3fl8 n ASP 124 N -0.22 0.45 -3.97 1.64 5.68 -0.37 -4.97 116.55 114.80 3fl8 n ASP 124 Ca -0.03 -0.82 -0.13 0.00 -0.50 0.00 0.00 54.79 53.32 3fl8 n ASP 124 Cb 0.65 0.16 -0.13 0.00 -1.14 0.00 0.00 41.12 40.66 3fl8 n ASP 124 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3fl8 s THR 125 N -0.16 0.29 0.07 2.12 -1.32 -1.17 -5.04 115.64 110.42 3fl8 s THR 125 Ca 0.00 -0.57 0.03 0.00 -1.21 0.00 0.00 61.69 59.94 3fl8 s THR 125 Cb 0.00 -0.33 -0.03 0.00 -1.51 0.00 0.00 72.50 70.63 3fl8 s THR 125 CO 0.00 -0.19 -0.10 -0.36 -2.21 0.00 0.00 174.62 171.76 3fl8 s PHE 126 N -0.75 0.94 -0.25 9.09 0.40 -1.26 -1.19 117.98 124.96 3fl8 s PHE 126 Ca -0.06 -0.53 -0.29 0.00 -0.60 0.00 0.00 56.93 55.45 3fl8 s PHE 126 Cb -0.06 -0.54 0.00 0.00 0.51 0.00 0.00 43.02 42.94 3fl8 s PHE 126 CO -0.00 -0.02 1.17 0.12 0.70 0.00 0.00 175.22 177.19 3fl8 s PHE 127 N -1.65 3.00 0.53 0.36 5.36 0.42 -4.68 117.98 121.32 3fl8 s PHE 127 Ca -0.03 1.13 -0.20 0.00 -0.96 0.00 0.00 56.93 56.86 3fl8 s PHE 127 Cb -0.08 -3.60 -0.08 0.00 -0.34 0.00 0.00 43.02 38.92 3fl8 s PHE 127 CO 0.01 -1.19 0.85 -2.30 -1.46 0.00 0.00 175.22 171.13 3fl8 n PRO 128 N 6.79 0.91 -1.65 10.12 -0.02 -1.26 -4.90 135.00 144.99 3fl8 n PRO 128 Ca 0.13 0.34 -0.38 0.00 -2.02 0.00 0.00 63.50 61.57 3fl8 n PRO 128 Cb 0.46 -1.99 0.05 0.00 -0.02 0.00 0.00 33.50 32.00 3fl8 n PRO 128 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3fl8 n GLU 129 N -0.37 1.10 -3.86 -0.52 -0.58 -1.26 -5.04 120.64 110.11 3fl8 n GLU 129 Ca 0.12 0.42 -0.12 0.00 -0.42 0.00 0.00 57.16 57.16 3fl8 n GLU 129 Cb 0.45 -2.27 -0.13 0.00 -0.57 0.00 0.00 31.44 28.91 3fl8 n GLU 129 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 3fl8 s MET 130 N -2.78 0.06 -0.64 3.49 -1.94 -1.26 -5.09 119.30 111.14 3fl8 s MET 130 Ca 0.75 0.04 -0.27 0.00 -1.71 0.00 0.00 55.69 54.49 3fl8 s MET 130 Cb -0.43 0.03 0.01 0.00 2.01 0.00 0.00 34.83 36.45 3fl8 s MET 130 CO 0.48 -0.01 1.50 0.34 -0.01 0.00 0.00 175.02 177.31 3fl8 s ASP 131 N -0.02 5.90 0.00 3.03 2.15 -1.26 -4.86 116.67 121.60 3fl8 s ASP 131 Ca -0.01 0.04 0.30 0.00 0.43 0.00 0.00 52.55 53.31 3fl8 s ASP 131 Cb -0.01 -2.55 1.45 0.00 -0.30 0.00 0.00 42.92 41.52 3fl8 s ASP 131 CO 0.00 -1.95 2.01 0.23 -0.17 0.00 0.00 175.17 175.29 3fl8 n MET 132 N 9.07 0.45 0.13 4.34 2.81 -1.26 -3.06 117.12 129.61 3fl8 n MET 132 Ca 0.11 -0.04 0.12 0.00 -1.81 0.00 0.00 57.70 56.08 3fl8 n MET 132 Cb 0.50 -1.50 0.50 0.00 -0.71 0.00 0.00 33.22 32.01 3fl8 n MET 132 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3fl8 n THR 133 N -1.24 0.84 1.38 2.03 -2.24 -1.26 -0.95 114.28 112.83 3fl8 n THR 133 Ca 0.14 0.26 0.14 0.00 -2.27 0.00 0.00 64.05 62.32 3fl8 n THR 133 Cb 0.25 -1.20 0.57 0.00 -2.10 0.00 0.00 70.33 67.85 3fl8 n THR 133 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3fl8 n ASN 134 N -2.25 0.57 -4.48 3.42 5.03 -1.17 -4.93 115.26 111.44 3fl8 n ASN 134 Ca 0.02 -0.63 -0.28 0.00 0.87 0.00 0.00 54.58 54.55 3fl8 n ASN 134 Cb 0.22 -0.04 -0.11 0.00 -1.02 0.00 0.00 39.78 38.83 3fl8 n ASN 134 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 3fl8 s TRP 135 N -2.48 2.50 -0.08 3.10 0.52 -0.13 -0.67 118.94 121.70 3fl8 s TRP 135 Ca 0.28 -0.28 0.02 0.00 0.02 0.00 0.00 56.10 56.14 3fl8 s TRP 135 Cb 0.20 -1.29 0.01 0.00 -1.15 0.00 0.00 33.47 31.24 3fl8 s TRP 135 CO 0.48 0.43 -0.14 0.21 0.02 0.00 0.00 176.95 177.95 3fl8 s LYS 136 N -2.36 1.94 -0.01 4.98 2.20 -0.05 -4.84 119.74 121.59 3fl8 s LYS 136 Ca 0.19 -0.48 -0.30 0.00 -0.36 0.00 0.00 55.97 55.03 3fl8 s LYS 136 Cb -0.10 -1.63 -0.05 0.00 -1.51 0.00 0.00 37.83 34.54 3fl8 s LYS 136 CO 0.11 -0.01 1.37 -2.00 -0.36 0.00 0.00 175.35 174.45 3fl8 s GLU 137 N 0.83 4.29 -0.00 4.03 2.12 -1.26 -1.65 118.70 127.05 3fl8 s GLU 137 Ca -0.11 1.91 0.10 0.00 0.36 0.00 0.00 54.97 57.23 3fl8 s GLU 137 Cb -0.15 -3.57 -0.11 0.00 0.26 0.00 0.00 34.13 30.55 3fl8 s GLU 137 CO 0.02 -0.56 0.37 1.33 -0.54 0.00 0.00 175.26 175.88 3fl8 n VAL 138 N 4.66 0.00 -3.62 3.70 0.24 -0.49 -4.97 118.33 117.85 3fl8 n VAL 138 Ca 0.13 -0.26 -0.15 0.00 -2.04 0.00 0.00 64.34 62.01 3fl8 n VAL 138 Cb 0.44 0.86 -0.07 0.00 -1.47 0.00 0.00 33.84 33.59 3fl8 n VAL 138 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3fl8 s PHE 139 N -2.06 -0.63 -0.00 6.34 5.36 -1.22 -5.00 117.98 120.76 3fl8 s PHE 139 Ca 0.02 1.37 -0.07 0.00 -0.96 0.00 0.00 56.93 57.29 3fl8 s PHE 139 Cb 0.07 0.28 0.00 0.00 -0.34 0.00 0.00 43.02 43.03 3fl8 s PHE 139 CO 0.40 -0.43 0.14 0.54 -1.46 0.00 0.00 175.22 174.40 3fl8 s VAL 140 N -0.34 0.08 -0.27 3.12 0.11 -1.26 -1.13 120.40 120.70 3fl8 s VAL 140 Ca -0.05 -0.64 -0.17 0.00 -2.93 0.00 0.00 61.98 58.19 3fl8 s VAL 140 Cb -0.03 -0.42 0.08 0.00 -1.53 0.00 0.00 36.38 34.48 3fl8 s VAL 140 CO 0.04 -0.35 0.68 -0.70 -3.33 0.00 0.00 175.10 171.44 3fl8 s GLU 141 N -1.28 0.71 0.08 1.54 2.12 -0.42 -4.99 118.70 116.46 3fl8 s GLU 141 Ca -0.14 1.19 -0.31 0.00 0.36 0.00 0.00 54.97 56.07 3fl8 s GLU 141 Cb -0.07 0.16 -0.07 0.00 0.26 0.00 0.00 34.13 34.41 3fl8 s GLU 141 CO 0.01 -0.15 1.38 0.21 -0.54 0.00 0.00 175.26 176.18 3fl8 s LYS 142 N 1.51 4.32 0.88 4.30 2.20 -1.26 -0.06 119.74 131.63 3fl8 s LYS 142 Ca -0.09 2.02 -0.12 0.00 -0.36 0.00 0.00 55.97 57.42 3fl8 s LYS 142 Cb -0.05 -3.35 0.12 0.00 -1.51 0.00 0.00 37.83 33.04 3fl8 s LYS 142 CO -0.18 -0.46 1.09 0.20 -0.36 0.00 0.00 175.35 175.65 3fl8 s GLY 143 N 1.33 1.62 -0.34 5.54 0.00 0.12 -4.88 107.32 110.71 3fl8 s GLY 143 Ca 0.64 -0.11 -0.29 0.00 0.00 0.00 0.00 44.72 44.96 3fl8 s GLY 143 CO 0.29 0.37 1.06 -2.27 0.00 0.00 0.00 173.10 172.56 3fl8 s LEU 144 N -6.14 3.90 -0.24 0.66 2.96 -1.26 -4.71 118.68 113.85 3fl8 s LEU 144 Ca 0.63 0.92 -0.08 0.00 -0.22 0.00 0.00 54.13 55.38 3fl8 s LEU 144 Cb -0.17 -3.51 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 3fl8 s LEU 144 CO 0.56 -0.92 0.08 -0.89 -1.32 0.00 0.00 176.35 173.86 3fl8 s THR 145 N 3.73 4.48 0.00 3.68 2.01 -1.26 -4.75 115.64 123.53 3fl8 s THR 145 Ca 0.45 -0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.33 3fl8 s THR 145 Cb -0.12 -3.09 0.00 0.00 0.01 0.00 0.00 72.50 69.30 3fl8 s THR 145 CO 0.18 0.34 0.00 -0.90 -0.69 0.00 0.00 174.62 173.55 3fl8 n ASP 146 N 4.77 0.00 -0.24 3.53 5.68 -0.54 -4.97 116.55 124.78 3fl8 n ASP 146 Ca -0.16 -0.41 0.02 0.00 -0.50 0.00 0.00 54.79 53.75 3fl8 n ASP 146 Cb 0.52 0.00 0.15 0.00 -1.14 0.00 0.00 41.12 40.64 3fl8 n ASP 146 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3fl8 h GLU 147 N 0.00 0.48 0.00 0.11 3.07 -1.97 -1.40 114.58 114.88 3fl8 h GLU 147 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3fl8 h GLU 147 Cb 0.00 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 27.80 3fl8 h GLU 147 CO 0.00 0.32 -0.35 1.63 -1.40 0.00 0.00 179.01 179.21 3fl8 n LYS 148 N -4.94 0.11 -3.56 2.33 5.02 -1.26 -4.48 118.16 111.38 3fl8 n LYS 148 Ca 0.12 0.05 -0.27 0.00 -2.02 0.00 0.00 58.31 56.18 3fl8 n LYS 148 Cb 0.32 -1.59 -0.11 0.00 -0.02 0.00 0.00 35.03 33.64 3fl8 n LYS 148 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3fl8 n ASN 149 N -1.75 0.81 0.22 4.39 3.02 -0.54 -4.37 115.26 117.05 3fl8 n ASN 149 Ca 0.05 -2.69 0.07 0.00 -0.03 0.00 0.00 54.58 51.98 3fl8 n ASN 149 Cb 0.38 -0.63 0.53 0.00 -0.61 0.00 0.00 39.78 39.45 3fl8 n ASN 149 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3fl8 h PRO 150 N 5.48 0.00 -6.77 3.52 0.11 -1.76 -1.45 132.00 131.13 3fl8 h PRO 150 Ca 0.22 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.89 3fl8 h PRO 150 Cb 0.85 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.00 3fl8 h PRO 150 CO 0.50 0.23 -0.07 0.71 -0.21 0.00 0.00 178.00 179.16 3fl8 s TYR 151 N -4.30 3.01 -0.04 0.65 2.02 -1.26 -4.75 117.35 112.67 3fl8 s TYR 151 Ca -0.03 0.08 -0.24 0.00 -0.37 0.00 0.00 57.07 56.51 3fl8 s TYR 151 Cb 0.14 -2.56 -0.04 0.00 -0.40 0.00 0.00 41.96 39.10 3fl8 s TYR 151 CO 0.67 -0.65 0.71 0.99 -1.57 0.00 0.00 175.55 175.70 3fl8 s THR 152 N -2.67 4.98 0.13 -0.71 2.01 -1.26 -4.54 115.64 113.58 3fl8 s THR 152 Ca 0.53 1.48 -0.17 0.00 0.31 0.00 0.00 61.69 63.85 3fl8 s THR 152 Cb -0.10 -4.05 0.04 0.00 0.01 0.00 0.00 72.50 68.39 3fl8 s THR 152 CO 0.38 0.28 0.43 -0.72 -0.69 0.00 0.00 174.62 174.30 3fl8 s TYR 153 N 0.58 -0.25 -0.02 4.92 -0.85 -1.26 -0.94 117.35 119.52 3fl8 s TYR 153 Ca 0.38 -0.05 -0.00 0.00 -0.52 0.00 0.00 57.07 56.88 3fl8 s TYR 153 Cb -0.18 0.30 0.03 0.00 0.38 0.00 0.00 41.96 42.48 3fl8 s TYR 153 CO 0.19 -0.72 0.04 0.71 -1.52 0.00 0.00 175.55 174.25 3fl8 s TYR 154 N -3.78 0.00 0.02 -3.49 1.51 -0.86 0.16 117.35 110.92 3fl8 s TYR 154 Ca 0.03 0.15 -0.29 0.00 -1.01 0.00 0.00 57.07 55.95 3fl8 s TYR 154 Cb 0.01 -0.18 -0.04 0.00 -0.11 0.00 0.00 41.96 41.65 3fl8 s TYR 154 CO -0.12 -0.08 0.94 0.71 -1.11 0.00 0.00 175.55 175.88 3fl8 s TYR 155 N 0.91 3.69 -0.04 2.71 1.51 0.92 -1.18 117.35 125.87 3fl8 s TYR 155 Ca -0.07 1.67 0.05 0.00 -1.01 0.00 0.00 57.07 57.71 3fl8 s TYR 155 Cb -0.11 -3.06 -0.01 0.00 -0.11 0.00 0.00 41.96 38.67 3fl8 s TYR 155 CO -0.03 0.06 -0.19 -1.01 -1.11 0.00 0.00 175.55 173.27 3fl8 s HIS 156 N 0.71 1.84 -0.06 2.71 3.76 0.37 -1.29 115.29 123.33 3fl8 s HIS 156 Ca 0.49 -0.47 0.05 0.00 -0.15 0.00 0.00 55.06 54.97 3fl8 s HIS 156 Cb -0.21 -1.22 -0.02 0.00 1.11 0.00 0.00 32.58 32.24 3fl8 s HIS 156 CO 0.27 -0.13 -0.19 0.08 -0.85 0.00 0.00 174.74 173.92 3fl8 s VAL 157 N -0.16 2.57 0.01 -0.90 1.01 -0.29 -0.12 120.40 122.51 3fl8 s VAL 157 Ca 0.00 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.13 3fl8 s VAL 157 Cb -0.11 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 3fl8 s VAL 157 CO 0.01 0.57 -0.12 -0.31 0.00 0.00 0.00 175.10 175.26 3fl8 s TYR 158 N -0.37 1.06 0.24 5.22 2.02 0.11 -1.40 117.35 124.23 3fl8 s TYR 158 Ca 0.03 -0.25 0.12 0.00 -0.37 0.00 0.00 57.07 56.60 3fl8 s TYR 158 Cb -0.12 -0.66 -0.05 0.00 -0.40 0.00 0.00 41.96 40.73 3fl8 s TYR 158 CO 0.02 -0.01 -0.22 -1.21 -1.57 0.00 0.00 175.55 172.57 3fl8 s GLU 159 N -0.56 1.61 0.47 -0.62 2.02 -0.66 0.20 118.70 121.16 3fl8 s GLU 159 Ca 0.03 -1.67 -0.24 0.00 0.02 0.00 0.00 54.97 53.11 3fl8 s GLU 159 Cb -0.06 -1.80 -0.07 0.00 0.10 0.00 0.00 34.13 32.31 3fl8 s GLU 159 CO 0.00 0.36 1.33 0.15 0.02 0.00 0.00 175.26 177.12 3fl8 s LYS 160 N -3.16 3.58 0.04 1.61 1.02 -1.19 -0.87 119.74 120.76 3fl8 s LYS 160 Ca 0.26 2.18 0.00 0.00 0.02 0.00 0.00 55.97 58.44 3fl8 s LYS 160 Cb -0.06 -2.50 -0.04 0.00 -0.52 0.00 0.00 37.83 34.71 3fl8 s LYS 160 CO 0.13 -0.82 0.14 -1.14 -0.92 0.00 0.00 175.35 172.74 3fl8 s GLN 161 N -2.60 3.22 4.00 1.68 0.74 0.16 -4.75 119.66 122.10 3fl8 s GLN 161 Ca 0.64 -0.49 0.00 0.00 0.05 0.00 0.00 55.36 55.56 3fl8 s GLN 161 Cb -0.39 -2.93 0.00 0.00 1.10 0.00 0.00 33.01 30.79 3fl8 s GLN 161 CO 0.48 0.62 0.00 1.04 -0.55 0.00 0.00 175.29 176.88 3fl8 n GLN 162 N 0.64 0.00 -2.80 1.67 6.02 -1.26 -4.96 117.38 116.70 3fl8 n GLN 162 Ca -0.09 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.70 3fl8 n GLN 162 Cb 0.52 0.00 0.05 0.00 1.02 0.00 0.00 30.24 31.83 3fl8 n GLN 162 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3fl8 s LEU 163 N 0.00 3.26 -0.23 1.08 1.43 -1.26 -5.15 118.68 117.80 3fl8 s LEU 163 Ca 0.00 -0.37 -0.09 0.00 -1.03 0.00 0.00 54.13 52.65 3fl8 s LEU 163 Cb 0.00 -2.35 -0.04 0.00 0.03 0.00 0.00 46.19 43.83 3fl8 s LEU 163 CO 0.00 -1.27 0.11 -0.69 0.23 0.00 0.00 176.35 174.74 3fl8 s VAL 164 N -2.74 4.89 0.58 -1.59 1.01 -1.26 -5.09 120.40 116.21 3fl8 s VAL 164 Ca 0.60 0.02 -0.20 0.00 0.00 0.00 0.00 61.98 62.39 3fl8 s VAL 164 Cb -0.08 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 3fl8 s VAL 164 CO 0.39 0.36 1.30 -2.84 0.00 0.00 0.00 175.10 174.31 3fl8 s PRO 165 N 1.12 2.95 0.00 2.72 0.02 -1.26 -5.34 135.00 135.22 3fl8 s PRO 165 Ca 0.06 2.08 0.07 0.00 0.02 0.00 0.00 61.00 63.22 3fl8 s PRO 165 Cb -0.14 -2.07 0.39 0.00 0.02 0.00 0.00 34.50 32.70 3fl8 s PRO 165 CO 0.04 -1.29 0.86 2.89 -0.33 0.00 0.00 177.00 179.17