#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 4.76 -0.36 1.12 1.01 -0.41 -4.97 121.20 122.35 3fl8 s ILE 2 Ca 0.00 1.40 -0.18 0.00 0.00 0.00 0.00 60.65 61.87 3fl8 s ILE 2 Cb 0.00 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.29 3fl8 s ILE 2 CO 0.00 -0.23 0.50 -0.69 0.00 0.00 0.00 174.94 174.52 3fl8 s VAL 3 N 3.03 5.02 -0.09 2.92 1.01 -1.26 -0.87 120.40 130.16 3fl8 s VAL 3 Ca 0.35 0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.59 3fl8 s VAL 3 Cb -0.14 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 32.25 3fl8 s VAL 3 CO 0.11 -0.26 -0.19 -0.44 0.00 0.00 0.00 175.10 174.33 3fl8 s SER 4 N 1.78 3.58 -0.02 3.32 0.01 0.20 0.11 113.70 122.68 3fl8 s SER 4 Ca 0.18 -0.40 -0.24 0.00 1.31 0.00 0.00 55.95 56.80 3fl8 s SER 4 Cb -0.16 -1.23 -0.04 0.00 0.21 0.00 0.00 66.02 64.80 3fl8 s SER 4 CO 0.14 0.22 0.72 -0.36 0.41 0.00 0.00 173.24 174.36 3fl8 s PHE 5 N 0.02 3.65 -0.24 2.43 0.40 -0.13 0.22 117.98 124.32 3fl8 s PHE 5 Ca -0.07 1.34 -0.02 0.00 -0.60 0.00 0.00 56.93 57.58 3fl8 s PHE 5 Cb -0.15 -2.80 0.02 0.00 0.51 0.00 0.00 43.02 40.61 3fl8 s PHE 5 CO 0.05 0.18 -0.07 1.41 0.70 0.00 0.00 175.22 177.49 3fl8 s MET 6 N 0.40 2.89 -0.03 0.44 -2.45 -0.50 -0.29 119.30 119.77 3fl8 s MET 6 Ca 0.38 -0.94 -0.08 0.00 -1.25 0.00 0.00 55.69 53.80 3fl8 s MET 6 Cb -0.19 -2.96 0.01 0.00 1.25 0.00 0.00 34.83 32.94 3fl8 s MET 6 CO 0.20 -0.37 0.17 0.54 1.05 0.00 0.00 175.02 176.61 3fl8 s VAL 7 N 1.34 0.05 -0.10 10.11 0.11 0.21 -4.55 120.40 127.57 3fl8 s VAL 7 Ca 0.01 -0.42 0.03 0.00 -2.93 0.00 0.00 61.98 58.67 3fl8 s VAL 7 Cb -0.16 -0.39 0.01 0.00 -1.53 0.00 0.00 36.38 34.30 3fl8 s VAL 7 CO -0.05 -0.23 -0.20 0.00 -3.33 0.00 0.00 175.10 171.30 3fl8 s ALA 8 N -0.83 1.90 0.10 1.54 0.00 -1.26 -0.02 121.76 123.18 3fl8 s ALA 8 Ca -0.09 -0.82 -0.10 0.00 0.00 0.00 0.00 51.96 50.95 3fl8 s ALA 8 Cb -0.05 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.29 3fl8 s ALA 8 CO 0.01 0.16 0.23 0.00 0.00 0.00 0.00 175.76 176.16 3fl8 s MET 9 N 0.57 0.89 0.00 0.00 0.00 -0.02 -4.58 119.30 116.16 3fl8 s MET 9 Ca -0.15 -0.92 0.00 0.00 0.00 0.00 0.00 55.69 54.62 3fl8 s MET 9 Cb -0.17 0.36 0.00 0.00 0.00 0.00 0.00 34.83 35.03 3fl8 s MET 9 CO 0.05 -0.29 0.00 -0.40 0.00 0.00 0.00 175.02 174.37 3fl8 n ASP 10 N -0.09 0.00 0.29 -1.18 5.75 -0.88 -0.43 116.55 120.01 3fl8 n ASP 10 Ca -0.15 -0.67 0.16 0.00 -0.01 0.00 0.00 54.79 54.12 3fl8 n ASP 10 Cb 0.63 0.00 0.89 0.00 -1.03 0.00 0.00 41.12 41.60 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 -0.22 0.11 5.08 -1.32 -1.84 114.58 116.39 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 0.05 0.00 0.09 -1.00 0.00 0.00 179.01 178.15 3fl8 n ASN 12 N -3.56 3.42 -0.38 1.42 5.03 -1.26 -4.95 115.26 114.97 3fl8 n ASN 12 Ca -0.02 -2.85 -0.05 0.00 0.87 0.00 0.00 54.58 52.52 3fl8 n ASN 12 Cb 0.16 -0.46 -0.02 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 -0.53 -0.53 -1.87 3.52 1.74 -0.69 -4.88 116.66 113.41 3fl8 n ARG 13 Ca 0.18 0.58 -0.42 0.00 -0.77 0.00 0.00 57.85 57.43 3fl8 n ARG 13 Cb 0.76 -4.29 -0.03 0.00 -1.02 0.00 0.00 32.46 27.89 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 -2.09 2.39 0.00 1.55 1.01 -1.26 -0.39 120.40 121.61 3fl8 s VAL 14 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.27 3fl8 s VAL 14 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.19 3fl8 s VAL 14 CO 0.00 0.03 0.24 2.30 0.00 0.00 0.00 175.10 177.67 3fl8 n ILE 15 N 3.38 0.00 -3.54 2.22 -5.35 -0.36 -2.07 119.36 113.63 3fl8 n ILE 15 Ca 0.12 -0.43 -0.11 0.00 -0.27 0.00 0.00 62.75 62.07 3fl8 n ILE 15 Cb 0.38 1.08 -0.04 0.00 -1.74 0.00 0.00 39.64 39.32 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 -0.38 -0.39 -0.05 3.28 0.00 -1.20 -4.76 107.32 103.82 3fl8 s GLY 16 Ca 0.00 1.54 -0.00 0.00 0.00 0.00 0.00 44.72 46.26 3fl8 s GLY 16 CO 0.00 0.75 -0.02 1.25 0.00 0.00 0.00 173.10 175.08 3fl8 s LYS 17 N -1.90 0.65 0.00 2.90 2.47 0.27 -1.16 119.74 122.97 3fl8 s LYS 17 Ca -0.00 0.01 0.00 0.00 -1.56 0.00 0.00 55.97 54.42 3fl8 s LYS 17 Cb -0.01 -0.83 0.00 0.00 -1.46 0.00 0.00 37.83 35.54 3fl8 s LYS 17 CO -0.01 -0.18 0.00 -0.25 0.16 0.00 0.00 175.35 175.07 3fl8 n ASP 18 N 4.50 0.00 -0.17 1.43 8.00 -1.26 -1.14 116.55 127.91 3fl8 n ASP 18 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 3fl8 n ASP 18 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 3fl8 n ASP 18 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3fl8 n ASN 19 N 0.41 0.00 -4.38 -2.24 3.02 -1.26 -5.01 115.26 105.80 3fl8 n ASN 19 Ca 0.00 -0.72 -0.28 0.00 -0.03 0.00 0.00 54.58 53.55 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 3.23 -0.02 6.41 0.01 -0.29 -4.63 114.94 119.65 3fl8 s ASN 20 Ca 0.00 -1.62 -0.29 0.00 -0.71 0.00 0.00 52.86 50.24 3fl8 s ASN 20 Cb 0.00 0.41 -0.03 0.00 0.41 0.00 0.00 41.25 42.04 3fl8 s ASN 20 CO 0.00 -0.85 0.93 -0.76 -1.51 0.00 0.00 177.10 174.91 3fl8 s LEU 21 N -3.69 4.35 0.27 0.60 1.43 -1.26 -0.56 118.68 119.82 3fl8 s LEU 21 Ca 0.20 1.57 0.22 0.00 -1.03 0.00 0.00 54.13 55.08 3fl8 s LEU 21 Cb 0.03 -3.48 1.02 0.00 0.03 0.00 0.00 46.19 43.79 3fl8 s LEU 21 CO 0.11 -0.24 1.66 -2.65 0.23 0.00 0.00 176.35 175.46 3fl8 n PRO 22 N 3.93 0.16 -4.44 1.29 -0.02 -1.26 -4.73 135.00 129.93 3fl8 n PRO 22 Ca 0.05 0.52 -0.22 0.00 -2.02 0.00 0.00 63.50 61.83 3fl8 n PRO 22 Cb 0.51 -1.89 -0.10 0.00 -0.02 0.00 0.00 33.50 32.00 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 -3.40 2.05 -0.29 6.00 -2.14 -1.26 -5.02 118.94 114.88 3fl8 s TRP 23 Ca 0.01 -0.55 0.02 0.00 2.66 0.00 0.00 56.10 58.24 3fl8 s TRP 23 Cb 0.08 -1.06 0.08 0.00 -3.10 0.00 0.00 33.47 29.47 3fl8 s TRP 23 CO 0.29 0.45 0.01 0.50 -2.66 0.00 0.00 176.95 175.54 3fl8 s ARG 24 N -3.64 1.42 -0.54 3.25 3.52 -1.26 -5.05 118.95 116.66 3fl8 s ARG 24 Ca 0.28 -1.32 0.04 0.00 -0.13 0.00 0.00 55.73 54.60 3fl8 s ARG 24 Cb 0.00 -2.68 0.16 0.00 -1.56 0.00 0.00 34.95 30.87 3fl8 s ARG 24 CO 0.12 -0.79 0.37 -0.51 -0.81 0.00 0.00 175.30 173.68 3fl8 s LEU 25 N 1.26 3.14 0.31 -0.88 1.43 -1.26 -4.59 118.68 118.09 3fl8 s LEU 25 Ca 0.03 -3.25 0.07 0.00 -1.03 0.00 0.00 54.13 49.95 3fl8 s LEU 25 Cb -0.19 -1.09 0.80 0.00 0.03 0.00 0.00 46.19 45.74 3fl8 s LEU 25 CO -0.11 -0.16 1.77 -0.65 0.23 0.00 0.00 176.35 177.43 3fl8 h PRO 26 N 5.86 0.68 -0.43 1.29 0.11 -1.97 0.45 132.00 137.99 3fl8 h PRO 26 Ca 0.14 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.13 3fl8 h PRO 26 Cb 0.85 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.79 3fl8 h PRO 26 CO 0.54 0.45 -0.05 1.03 -0.21 0.00 0.00 178.00 179.76 3fl8 h SER 27 N 0.70 0.70 -0.16 -2.05 0.87 -1.92 -1.23 113.55 110.46 3fl8 h SER 27 Ca 0.59 -0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.97 3fl8 h SER 27 Cb 1.00 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.76 3fl8 h SER 27 CO -0.39 0.81 0.09 -0.08 -0.53 0.00 0.00 176.83 176.73 3fl8 h GLU 28 N 0.67 0.23 -0.38 2.24 4.22 -1.29 -1.84 114.58 118.43 3fl8 h GLU 28 Ca 0.13 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.54 3fl8 h GLU 28 Cb 0.50 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 3fl8 h GLU 28 CO 0.03 0.23 0.24 -0.07 -2.18 0.00 0.00 179.01 177.25 3fl8 h LEU 29 N 0.17 0.44 -1.00 1.64 3.38 -1.17 -0.56 115.31 118.21 3fl8 h LEU 29 Ca 0.06 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 3fl8 h LEU 29 Cb 0.07 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3fl8 h LEU 29 CO -0.01 0.33 -0.29 -0.61 0.09 0.00 0.00 178.44 177.95 3fl8 h GLN 30 N 0.52 0.36 -0.18 1.13 5.75 -0.90 -0.59 115.11 121.21 3fl8 h GLN 30 Ca 0.14 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 3fl8 h GLN 30 Cb -0.04 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.49 3fl8 h GLN 30 CO -0.03 0.62 0.03 -0.92 -2.65 0.00 0.00 178.83 175.89 3fl8 h TYR 31 N 0.32 0.31 -0.50 3.99 3.20 -0.31 -0.95 116.97 123.02 3fl8 h TYR 31 Ca 0.04 -0.04 0.09 0.00 3.14 0.00 0.00 58.73 61.97 3fl8 h TYR 31 Cb 0.68 -0.09 -0.08 0.00 1.54 0.00 0.00 36.73 38.79 3fl8 h TYR 31 CO 0.02 0.44 0.02 0.28 -1.64 0.00 0.00 178.16 177.27 3fl8 h VAL 32 N 0.09 0.63 -0.36 1.81 2.07 -0.84 0.28 116.25 119.92 3fl8 h VAL 32 Ca 0.05 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 3fl8 h VAL 32 Cb 0.29 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 3fl8 h VAL 32 CO 0.00 0.02 0.18 0.50 0.02 0.00 0.00 177.57 178.30 3fl8 h LYS 33 N 0.14 0.52 -0.51 1.57 3.64 -0.94 -1.23 116.57 119.76 3fl8 h LYS 33 Ca 0.25 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3fl8 h LYS 33 Cb 0.37 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3fl8 h LYS 33 CO -0.40 0.45 0.30 -0.22 -2.27 0.00 0.00 179.45 177.31 3fl8 h LYS 34 N 0.45 0.70 -0.25 1.90 3.64 -0.73 -2.82 116.57 119.45 3fl8 h LYS 34 Ca 0.13 -0.07 -0.16 0.00 -1.27 0.00 0.00 60.65 59.28 3fl8 h LYS 34 Cb 0.10 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 3fl8 h LYS 34 CO -0.02 0.52 -0.47 1.15 -2.27 0.00 0.00 179.45 178.36 3fl8 h THR 35 N 0.68 1.30 -0.35 1.00 2.02 -0.63 -3.21 112.91 113.72 3fl8 h THR 35 Ca 0.18 -1.67 0.00 0.00 0.77 0.00 0.00 66.41 65.69 3fl8 h THR 35 Cb 0.01 1.61 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 3fl8 h THR 35 CO -0.03 0.53 0.00 0.35 0.37 0.00 0.00 175.52 176.74 3fl8 n THR 36 N -4.00 0.46 -1.88 3.16 -2.24 -0.49 -4.95 114.28 104.33 3fl8 n THR 36 Ca -0.03 -0.59 -0.42 0.00 -2.27 0.00 0.00 64.05 60.74 3fl8 n THR 36 Cb 0.57 0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 69.34 3fl8 n THR 36 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3fl8 s MET 37 N -1.54 4.18 0.00 -0.78 1.00 -1.07 -2.00 119.30 119.09 3fl8 s MET 37 Ca 0.35 2.37 0.00 0.00 0.00 0.00 0.00 55.69 58.41 3fl8 s MET 37 Cb 0.19 -3.80 0.00 0.00 0.00 0.00 0.00 34.83 31.22 3fl8 s MET 37 CO 0.27 -0.81 0.00 0.41 0.00 0.00 0.00 175.02 174.89 3fl8 n GLY 38 N 4.15 0.59 3.16 -0.03 0.00 -1.24 -5.05 105.19 106.76 3fl8 n GLY 38 Ca 0.17 -0.28 -0.19 0.00 0.00 0.00 0.00 46.02 45.73 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 1.19 0.40 1.61 3.76 -0.85 -5.01 115.29 114.38 3fl8 s HIS 39 Ca 0.00 -0.42 -0.27 0.00 -0.15 0.00 0.00 55.06 54.21 3fl8 s HIS 39 Cb 0.00 -0.68 -0.10 0.00 1.11 0.00 0.00 32.58 32.91 3fl8 s HIS 39 CO 0.00 0.04 1.44 -2.14 -0.85 0.00 0.00 174.74 173.23 3fl8 s PRO 40 N -1.53 4.00 -0.24 8.40 0.02 -1.26 -4.33 135.00 140.07 3fl8 s PRO 40 Ca -0.01 2.46 -0.08 0.00 0.02 0.00 0.00 61.00 63.39 3fl8 s PRO 40 Cb -0.09 -2.87 -0.04 0.00 0.02 0.00 0.00 34.50 31.52 3fl8 s PRO 40 CO 0.02 -0.58 0.09 -0.51 -0.33 0.00 0.00 177.00 175.69 3fl8 s LEU 41 N -2.27 3.66 -0.26 -5.54 1.43 0.16 -1.68 118.68 114.18 3fl8 s LEU 41 Ca 0.55 -0.09 -0.07 0.00 -1.03 0.00 0.00 54.13 53.50 3fl8 s LEU 41 Cb -0.44 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 43.79 3fl8 s LEU 41 CO 0.59 0.02 0.06 -0.63 0.23 0.00 0.00 176.35 176.62 3fl8 s ILE 42 N 1.30 4.09 0.03 -0.59 -1.09 0.35 -0.98 121.20 124.31 3fl8 s ILE 42 Ca 0.05 -0.36 -0.01 0.00 -2.23 0.00 0.00 60.65 58.10 3fl8 s ILE 42 Cb -0.15 -2.96 -0.02 0.00 -1.58 0.00 0.00 42.46 37.75 3fl8 s ILE 42 CO 0.04 0.27 -0.01 0.00 -1.23 0.00 0.00 174.94 174.02 3fl8 s MET 43 N 1.57 0.41 0.89 2.79 0.23 -0.61 1.00 119.30 125.57 3fl8 s MET 43 Ca 0.05 -0.74 -0.12 0.00 -1.03 0.00 0.00 55.69 53.86 3fl8 s MET 43 Cb -0.16 0.15 0.12 0.00 -1.53 0.00 0.00 34.83 33.41 3fl8 s MET 43 CO 0.02 -0.08 1.09 0.20 -2.03 0.00 0.00 175.02 174.23 3fl8 s GLY 44 N -1.82 1.62 0.07 3.16 0.00 -1.04 -0.26 107.32 109.06 3fl8 s GLY 44 Ca -0.10 -0.09 -0.25 0.00 0.00 0.00 0.00 44.72 44.28 3fl8 s GLY 44 CO -0.03 0.40 1.66 -0.09 0.00 0.00 0.00 173.10 175.03 3fl8 h ARG 45 N -1.50 -0.18 -0.53 2.90 2.43 -1.90 -1.26 114.38 114.35 3fl8 h ARG 45 Ca -0.49 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 58.78 3fl8 h ARG 45 Cb 1.28 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 30.80 3fl8 h ARG 45 CO 0.55 -0.07 0.09 0.87 -1.51 0.00 0.00 179.97 179.90 3fl8 h LYS 46 N -0.24 0.21 -0.53 0.20 1.57 -1.93 0.01 116.57 115.86 3fl8 h LYS 46 Ca -0.02 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.78 3fl8 h LYS 46 Cb 0.19 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 3fl8 h LYS 46 CO 0.03 0.14 0.30 -0.97 -0.57 0.00 0.00 179.45 178.38 3fl8 h ASN 47 N 0.22 0.46 -0.64 0.86 -1.24 -1.83 -0.64 115.58 112.77 3fl8 h ASN 47 Ca 0.27 0.02 -0.06 0.00 0.71 0.00 0.00 56.30 57.24 3fl8 h ASN 47 Cb 0.38 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 39.33 3fl8 h ASN 47 CO -0.36 0.32 0.18 0.22 -1.29 0.00 0.00 177.43 176.49 3fl8 h TYR 48 N 0.58 1.06 0.00 0.67 3.20 -0.34 -2.72 116.97 119.43 3fl8 h TYR 48 Ca 0.23 -0.12 -0.08 0.00 3.14 0.00 0.00 58.73 61.89 3fl8 h TYR 48 Cb 0.08 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.04 3fl8 h TYR 48 CO -0.08 0.87 -0.40 0.93 -1.64 0.00 0.00 178.16 177.85 3fl8 h GLU 49 N 0.94 0.00 -0.06 1.82 5.08 -0.66 -1.95 114.58 119.76 3fl8 h GLU 49 Ca 0.20 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.51 3fl8 h GLU 49 Cb 0.33 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 3fl8 h GLU 49 CO -0.00 0.40 -0.24 0.00 -1.00 0.00 0.00 179.01 178.16 3fl8 h ALA 50 N 1.60 1.49 0.00 3.43 0.00 -0.82 -2.92 119.26 122.04 3fl8 h ALA 50 Ca -0.00 -0.25 -0.20 0.00 0.00 0.00 0.00 54.91 54.45 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 0.37 -1.10 0.82 0.00 0.00 0.00 179.25 179.39 3fl8 h ILE 51 N 0.09 1.27 0.00 0.00 2.04 -1.17 -3.48 117.51 116.25 3fl8 h ILE 51 Ca 0.02 -2.93 0.00 0.00 1.00 0.00 0.00 64.86 62.95 3fl8 h ILE 51 Cb 0.48 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 39.17 3fl8 h ILE 51 CO 0.03 0.72 0.00 0.61 0.00 0.00 0.00 178.15 179.52 3fl8 n GLY 52 N 1.38 2.26 3.14 5.37 0.00 -0.78 -4.97 105.19 111.58 3fl8 n GLY 52 Ca -0.04 -0.51 -0.11 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 0.74 0.19 1.61 1.70 -1.26 -4.98 118.95 116.95 3fl8 s ARG 53 Ca 0.00 -1.19 -0.31 0.00 -0.47 0.00 0.00 55.73 53.76 3fl8 s ARG 53 Cb 0.00 -0.18 -0.10 0.00 -0.57 0.00 0.00 34.95 34.10 3fl8 s ARG 53 CO 0.00 -0.01 1.58 -2.14 -1.08 0.00 0.00 175.30 173.65 3fl8 s PRO 54 N -3.33 4.20 -0.39 3.89 0.02 -1.26 -4.94 135.00 133.18 3fl8 s PRO 54 Ca 0.06 2.41 -0.29 0.00 0.02 0.00 0.00 61.00 63.21 3fl8 s PRO 54 Cb 0.02 -3.12 0.02 0.00 0.02 0.00 0.00 34.50 31.43 3fl8 s PRO 54 CO -0.04 -0.61 1.23 -0.51 -0.33 0.00 0.00 177.00 176.74 3fl8 s LEU 55 N 0.83 3.73 0.64 -5.54 1.43 -1.26 -4.98 118.68 113.54 3fl8 s LEU 55 Ca 0.69 0.83 -0.18 0.00 -1.03 0.00 0.00 54.13 54.44 3fl8 s LEU 55 Cb -0.45 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.21 3fl8 s LEU 55 CO 0.34 -1.19 1.19 -2.65 0.23 0.00 0.00 176.35 174.27 3fl8 n PRO 56 N 7.61 1.01 -0.74 1.29 -0.02 -1.26 -3.46 135.00 139.43 3fl8 n PRO 56 Ca 0.14 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3fl8 n PRO 56 Cb 0.48 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 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 1.02 0.78 3.02 -1.23 0.00 -1.26 -5.03 105.19 102.50 3fl8 n GLY 57 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.26 0.43 -0.23 1.61 3.00 -1.22 -3.73 118.95 118.55 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 -0.03 -0.04 0.00 0.00 0.00 0.00 34.95 34.88 3fl8 s ARG 58 CO 0.00 -0.02 1.85 1.03 0.00 0.00 0.00 175.30 178.16 3fl8 s ARG 59 N -1.77 3.53 -0.38 3.54 0.52 -1.26 -4.89 118.95 118.24 3fl8 s ARG 59 Ca -0.11 1.78 -0.20 0.00 -0.52 0.00 0.00 55.73 56.68 3fl8 s ARG 59 Cb -0.08 -4.18 0.01 0.00 0.52 0.00 0.00 34.95 31.22 3fl8 s ARG 59 CO -0.01 -1.62 0.60 -0.80 0.02 0.00 0.00 175.30 173.48 3fl8 s ASN 60 N 5.78 6.36 -0.25 0.23 0.02 -1.26 -0.67 114.94 125.16 3fl8 s ASN 60 Ca 0.83 -0.04 -0.04 0.00 -1.02 0.00 0.00 52.86 52.59 3fl8 s ASN 60 Cb -0.28 -2.31 0.01 0.00 0.02 0.00 0.00 41.25 38.69 3fl8 s ASN 60 CO 0.33 -0.61 -0.02 -0.63 0.02 0.00 0.00 177.10 176.19 3fl8 s ILE 61 N 2.63 3.31 -0.20 0.60 1.01 -0.15 -1.03 121.20 127.37 3fl8 s ILE 61 Ca 0.22 -0.73 -0.10 0.00 0.00 0.00 0.00 60.65 60.04 3fl8 s ILE 61 Cb -0.15 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.66 3fl8 s ILE 61 CO 0.15 0.27 0.13 -0.63 0.00 0.00 0.00 174.94 174.86 3fl8 s ILE 62 N 1.43 5.38 -0.29 2.92 1.01 0.06 -1.57 121.20 130.13 3fl8 s ILE 62 Ca 0.03 0.18 -0.10 0.00 0.00 0.00 0.00 60.65 60.76 3fl8 s ILE 62 Cb -0.16 -3.46 -0.02 0.00 0.01 0.00 0.00 42.46 38.83 3fl8 s ILE 62 CO -0.03 0.43 0.15 -0.69 0.00 0.00 0.00 174.94 174.81 3fl8 s VAL 63 N 0.43 4.79 -0.06 2.92 1.01 0.65 -0.88 120.40 129.26 3fl8 s VAL 63 Ca 0.08 -0.18 -0.17 0.00 0.00 0.00 0.00 61.98 61.70 3fl8 s VAL 63 Cb -0.11 -3.36 0.03 0.00 0.00 0.00 0.00 36.38 32.94 3fl8 s VAL 63 CO -0.01 0.17 0.39 0.28 0.00 0.00 0.00 175.10 175.92 3fl8 s THR 64 N 1.66 0.03 0.12 3.92 -1.32 -0.37 -3.01 115.64 116.68 3fl8 s THR 64 Ca 0.06 -0.29 0.27 0.00 -1.21 0.00 0.00 61.69 60.52 3fl8 s THR 64 Cb -0.16 -0.66 0.29 0.00 -1.51 0.00 0.00 72.50 70.46 3fl8 s THR 64 CO 0.07 -0.16 1.88 -0.09 -2.21 0.00 0.00 174.62 174.12 3fl8 h ARG 65 N 4.18 0.00 -6.33 7.08 2.43 -1.85 -3.34 114.38 116.55 3fl8 h ARG 65 Ca -0.29 0.00 -0.56 0.00 -0.81 0.00 0.00 59.98 58.33 3fl8 h ARG 65 Cb 1.17 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.68 3fl8 h ARG 65 CO 0.36 0.15 1.20 1.21 -1.51 0.00 0.00 179.97 181.37 3fl8 s ASN 66 N -6.04 5.97 0.43 -3.80 2.47 -1.26 -4.88 114.94 107.83 3fl8 s ASN 66 Ca 0.01 0.85 0.30 0.00 0.42 0.00 0.00 52.86 54.43 3fl8 s ASN 66 Cb 0.10 -2.53 1.29 0.00 -1.45 0.00 0.00 41.25 38.66 3fl8 s ASN 66 CO 0.61 -1.73 1.89 -0.33 -3.72 0.00 0.00 177.10 173.82 3fl8 h GLU 67 N 12.23 0.00 0.00 0.43 4.39 -2.00 -2.49 114.58 127.14 3fl8 h GLU 67 Ca -0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.41 3fl8 h GLU 67 Cb 1.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 3fl8 h GLU 67 CO 1.10 0.00 -0.80 0.41 -1.16 0.00 0.00 179.01 178.56 3fl8 n GLY 68 N -0.18 -1.33 3.70 -3.84 0.00 -1.26 -4.95 105.19 97.33 3fl8 n GLY 68 Ca 0.01 -0.31 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.06 2.62 -3.92 1.61 9.36 -0.94 -5.01 117.16 118.83 3fl8 n TYR 69 Ca 0.03 -0.05 -0.10 0.00 3.32 0.00 0.00 57.90 61.09 3fl8 n TYR 69 Cb 0.44 -2.70 -0.10 0.00 -0.63 0.00 0.00 39.34 36.35 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 2.15 0.14 -0.19 2.98 3.76 -1.26 -4.92 115.29 117.96 3fl8 s HIS 70 Ca 0.80 -0.32 -0.09 0.00 -0.15 0.00 0.00 55.06 55.30 3fl8 s HIS 70 Cb -0.51 -0.11 0.07 0.00 1.11 0.00 0.00 32.58 33.13 3fl8 s HIS 70 CO 0.36 -0.24 0.44 0.54 -0.85 0.00 0.00 174.74 174.99 3fl8 s VAL 71 N -1.41 -0.19 0.42 -0.90 0.11 -1.26 -5.13 120.40 112.04 3fl8 s VAL 71 Ca -0.15 0.10 -0.24 0.00 -2.93 0.00 0.00 61.98 58.76 3fl8 s VAL 71 Cb -0.09 -0.66 -0.11 0.00 -1.53 0.00 0.00 36.38 33.99 3fl8 s VAL 71 CO 0.00 0.04 0.97 -1.84 -3.33 0.00 0.00 175.10 170.94 3fl8 n GLU 72 N 4.55 1.26 -0.76 1.54 0.00 -1.26 -1.82 120.64 124.15 3fl8 n GLU 72 Ca -0.19 0.45 0.00 0.00 0.00 0.00 0.00 57.16 57.42 3fl8 n GLU 72 Cb 0.54 -2.00 0.00 0.00 0.00 0.00 0.00 31.44 29.99 3fl8 n GLU 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3fl8 n GLY 73 N 1.24 0.96 3.33 -1.84 0.00 -1.26 -4.92 105.19 102.70 3fl8 n GLY 73 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.95 3.52 -0.08 0.00 2.02 -0.20 -4.66 118.70 117.36 3fl8 s GLU 75 Ca 0.10 -0.35 0.04 0.00 0.02 0.00 0.00 54.97 54.77 3fl8 s GLU 75 Cb -0.10 -2.82 0.00 0.00 0.10 0.00 0.00 34.13 31.32 3fl8 s GLU 75 CO 0.05 0.37 -0.19 0.08 0.02 0.00 0.00 175.26 175.58 3fl8 s VAL 76 N -1.93 1.69 0.17 2.63 1.01 -1.26 -0.76 120.40 121.95 3fl8 s VAL 76 Ca 0.39 -0.81 0.11 0.00 0.00 0.00 0.00 61.98 61.66 3fl8 s VAL 76 Cb -0.11 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 3fl8 s VAL 76 CO 0.30 0.48 -0.24 0.00 0.00 0.00 0.00 175.10 175.63 3fl8 s ALA 77 N 0.40 2.51 -0.21 5.51 0.00 -0.06 -4.94 121.76 124.98 3fl8 s ALA 77 Ca -0.15 -1.57 0.02 0.00 0.00 0.00 0.00 51.96 50.26 3fl8 s ALA 77 Cb -0.17 -0.38 0.05 0.00 0.00 0.00 0.00 23.12 22.62 3fl8 s ALA 77 CO 0.06 0.47 0.91 0.72 0.00 0.00 0.00 175.76 177.93 3fl8 n HIS 78 N 0.48 0.07 -3.61 0.00 8.25 -1.25 -1.23 115.22 117.92 3fl8 n HIS 78 Ca -0.14 -0.36 -0.04 0.00 -0.26 0.00 0.00 57.72 56.92 3fl8 n HIS 78 Cb 0.55 -0.03 -0.02 0.00 1.12 0.00 0.00 29.99 31.61 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 -0.77 -0.19 0.15 0.41 1.04 -1.26 -4.62 113.70 108.47 3fl8 s SER 79 Ca 0.04 -0.11 -0.16 0.00 0.48 0.00 0.00 55.95 56.20 3fl8 s SER 79 Cb 0.02 0.28 0.05 0.00 0.10 0.00 0.00 66.02 66.47 3fl8 s SER 79 CO 0.03 -0.48 1.76 0.58 0.98 0.00 0.00 173.24 176.11 3fl8 h VAL 80 N 2.00 0.94 -0.52 5.02 2.07 -1.96 -1.50 116.25 122.30 3fl8 h VAL 80 Ca -0.20 -0.11 0.10 0.00 0.82 0.00 0.00 66.70 67.31 3fl8 h VAL 80 Cb 1.21 0.58 -0.09 0.00 -1.52 0.00 0.00 31.29 31.47 3fl8 h VAL 80 CO 0.27 0.06 -0.04 -0.08 0.02 0.00 0.00 177.57 177.80 3fl8 h GLU 81 N 0.33 0.08 -0.62 1.57 4.81 -1.99 0.36 114.58 119.12 3fl8 h GLU 81 Ca 0.16 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.33 3fl8 h GLU 81 Cb 0.10 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 3fl8 h GLU 81 CO -0.14 0.05 0.16 0.93 -0.73 0.00 0.00 179.01 179.28 3fl8 h GLU 82 N 0.08 0.96 -0.36 1.92 5.08 -1.82 -0.36 114.58 120.08 3fl8 h GLU 82 Ca 0.26 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3fl8 h GLU 82 Cb 0.40 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 3fl8 h GLU 82 CO -0.47 0.85 0.21 0.28 -1.00 0.00 0.00 179.01 178.88 3fl8 h VAL 83 N 0.92 1.13 -0.17 3.13 2.07 -0.19 0.97 116.25 124.10 3fl8 h VAL 83 Ca 0.20 -0.32 -0.09 0.00 0.82 0.00 0.00 66.70 67.31 3fl8 h VAL 83 Cb 0.32 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 3fl8 h VAL 83 CO -0.00 0.13 -0.30 -0.26 0.02 0.00 0.00 177.57 177.16 3fl8 h PHE 84 N 0.47 0.38 0.13 1.57 0.04 -0.61 -0.44 116.94 118.49 3fl8 h PHE 84 Ca 0.13 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 3fl8 h PHE 84 Cb 0.03 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.09 3fl8 h PHE 84 CO -0.03 0.61 -0.06 1.49 -0.60 0.00 0.00 178.31 179.71 3fl8 h GLU 85 N 0.30 -0.17 -0.75 1.51 4.57 -0.76 -1.64 114.58 117.64 3fl8 h GLU 85 Ca 0.04 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.31 3fl8 h GLU 85 Cb 0.68 0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 29.26 3fl8 h GLU 85 CO 0.05 0.07 0.49 -0.07 -1.18 0.00 0.00 179.01 178.37 3fl8 h LEU 86 N -0.39 0.67 -3.53 1.64 3.38 -0.43 -2.11 115.31 114.55 3fl8 h LEU 86 Ca -0.02 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3fl8 h LEU 86 Cb 0.31 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3fl8 h LEU 86 CO 0.03 0.42 0.00 0.00 0.09 0.00 0.00 178.44 178.98 3fl8 n LYS 88 N 0.63 -0.05 -0.09 0.00 4.81 -0.63 -0.62 118.16 122.22 3fl8 n LYS 88 Ca 0.28 0.84 0.10 0.00 -0.87 0.00 0.00 58.31 58.66 3fl8 n LYS 88 Cb 1.17 -1.28 0.14 0.00 0.02 0.00 0.00 35.03 35.08 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 -4.85 2.95 -4.77 3.14 3.02 -1.26 -4.98 115.26 108.51 3fl8 n ASN 89 Ca 0.09 -1.88 -0.38 0.00 -0.03 0.00 0.00 54.58 52.38 3fl8 n ASN 89 Cb 0.30 -0.11 -0.04 0.00 -0.61 0.00 0.00 39.78 39.32 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 -1.49 4.31 0.10 3.52 0.41 0.21 -4.96 118.70 120.80 3fl8 s GLU 90 Ca 0.28 1.71 -0.07 0.00 -0.41 0.00 0.00 54.97 56.48 3fl8 s GLU 90 Cb 0.18 -2.82 -0.18 0.00 -1.78 0.00 0.00 34.13 29.53 3fl8 s GLU 90 CO 0.26 -0.06 1.22 1.49 -0.49 0.00 0.00 175.26 177.68 3fl8 h GLU 91 N 3.02 0.45 -2.24 1.61 4.81 -1.94 -3.39 114.58 116.90 3fl8 h GLU 91 Ca -0.48 -0.55 -0.05 0.00 -0.13 0.00 0.00 59.36 58.15 3fl8 h GLU 91 Cb 1.22 0.17 -0.22 0.00 0.63 0.00 0.00 28.75 30.55 3fl8 h GLU 91 CO 0.64 1.20 -0.03 -2.00 -0.73 0.00 0.00 179.01 178.10 3fl8 s GLU 92 N -3.09 0.68 0.16 1.92 2.12 -1.26 -1.28 118.70 117.94 3fl8 s GLU 92 Ca -0.06 0.93 0.09 0.00 0.36 0.00 0.00 54.97 56.29 3fl8 s GLU 92 Cb 0.08 0.26 -0.04 0.00 0.26 0.00 0.00 34.13 34.68 3fl8 s GLU 92 CO 0.89 -0.11 -0.21 0.96 -0.54 0.00 0.00 175.26 176.25 3fl8 s ILE 93 N 0.75 1.94 -0.29 -3.70 -4.36 -0.05 -4.09 121.20 111.41 3fl8 s ILE 93 Ca -0.03 -1.86 0.01 0.00 -0.26 0.00 0.00 60.65 58.51 3fl8 s ILE 93 Cb -0.05 -1.86 0.06 0.00 1.25 0.00 0.00 42.46 41.87 3fl8 s ILE 93 CO -0.05 -0.20 -0.04 -0.36 0.24 0.00 0.00 174.94 174.52 3fl8 s PHE 94 N -1.74 3.34 -0.23 1.37 0.08 -0.68 -0.63 117.98 119.49 3fl8 s PHE 94 Ca 0.15 -2.26 -0.29 0.00 0.12 0.00 0.00 56.93 54.65 3fl8 s PHE 94 Cb -0.07 -2.17 -0.02 0.00 -0.57 0.00 0.00 43.02 40.19 3fl8 s PHE 94 CO 0.07 -0.87 1.59 0.42 -0.10 0.00 0.00 175.22 176.33 3fl8 s ILE 95 N 1.13 3.73 -2.55 0.64 -1.09 0.13 -0.50 121.20 122.69 3fl8 s ILE 95 Ca -0.05 0.82 0.24 0.00 -2.23 0.00 0.00 60.65 59.43 3fl8 s ILE 95 Cb -0.20 -3.75 0.14 0.00 -1.58 0.00 0.00 42.46 37.07 3fl8 s ILE 95 CO -0.04 -0.32 1.24 0.33 -1.23 0.00 0.00 174.94 174.92 3fl8 n PHE 96 N 8.45 0.00 0.00 3.97 7.35 0.28 -1.41 117.46 136.10 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 0.45 -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 1.37 -0.85 0.08 7.13 0.00 -1.24 -4.93 105.19 106.74 3fl8 n GLY 97 Ca 0.12 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.98 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 0.59 0.28 -0.02 0.00 -1.26 -2.48 105.19 102.30 3fl8 n GLY 98 Ca 0.00 -1.04 0.06 0.00 0.00 0.00 0.00 46.02 45.04 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 0.87 -0.49 4.61 0.00 -1.98 -0.59 119.26 121.68 3fl8 h ALA 99 Ca 0.00 0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 3fl8 h ALA 99 Cb 0.00 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3fl8 h ALA 99 CO 0.00 -0.43 0.13 1.96 0.00 0.00 0.00 179.25 180.91 3fl8 h GLN 100 N 0.13 0.73 -0.47 0.00 4.20 -1.92 -1.64 115.11 116.13 3fl8 h GLN 100 Ca 0.44 -0.13 -0.11 0.00 0.06 0.00 0.00 58.65 58.90 3fl8 h GLN 100 Cb 0.79 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 3fl8 h GLN 100 CO -0.66 0.66 -0.14 0.82 -0.67 0.00 0.00 178.83 178.84 3fl8 h ILE 101 N 0.71 1.27 -0.60 2.54 1.08 -1.44 -1.37 117.51 119.70 3fl8 h ILE 101 Ca 0.16 -1.26 -0.01 0.00 -0.39 0.00 0.00 64.86 63.36 3fl8 h ILE 101 Cb 0.25 1.05 -0.03 0.00 -3.07 0.00 0.00 36.82 35.02 3fl8 h ILE 101 CO -0.00 0.44 0.34 1.88 -0.69 0.00 0.00 178.15 180.11 3fl8 h TYR 102 N 0.79 0.81 -0.95 1.37 0.05 -0.65 -2.59 116.97 115.81 3fl8 h TYR 102 Ca 0.12 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.88 3fl8 h TYR 102 Cb 0.67 -0.26 -0.05 0.00 1.01 0.00 0.00 36.73 38.10 3fl8 h TYR 102 CO 0.04 0.57 0.57 -0.44 -1.05 0.00 0.00 178.16 177.85 3fl8 h ASP 103 N 0.81 1.14 -0.49 3.88 3.32 -0.85 -1.38 116.42 122.85 3fl8 h ASP 103 Ca 0.21 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 3fl8 h ASP 103 Cb 0.02 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.25 3fl8 h ASP 103 CO -0.04 0.87 0.25 -0.07 -1.72 0.00 0.00 179.24 178.53 3fl8 h LEU 104 N 1.31 0.67 -1.12 1.55 3.38 -0.97 -3.04 115.31 117.09 3fl8 h LEU 104 Ca 0.34 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3fl8 h LEU 104 Cb -0.05 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.53 3fl8 h LEU 104 CO -0.06 0.58 -0.24 0.49 0.09 0.00 0.00 178.44 179.29 3fl8 n PHE 105 N -4.37 0.00 -0.35 1.13 3.72 -0.85 -4.48 117.46 112.26 3fl8 n PHE 105 Ca 0.04 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.58 3fl8 n PHE 105 Cb 0.13 -0.03 0.34 0.00 -0.94 0.00 0.00 39.48 38.99 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 2.73 0.75 -0.12 4.37 5.85 -1.15 0.33 115.31 128.08 3fl8 h LEU 106 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3fl8 h LEU 106 Cb 0.73 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.72 3fl8 h LEU 106 CO 0.00 0.25 0.00 -2.65 -0.34 0.00 0.00 178.44 175.70 3fl8 n PRO 107 N -4.77 0.03 0.00 5.25 -0.02 -1.26 -3.19 135.00 131.04 3fl8 n PRO 107 Ca 0.24 0.28 0.01 0.00 -2.02 0.00 0.00 63.50 62.01 3fl8 n PRO 107 Cb 0.61 -1.56 0.01 0.00 -0.02 0.00 0.00 33.50 32.53 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 -1.62 0.00 -2.31 6.00 4.01 0.07 -5.05 117.16 118.26 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 0.18 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.18 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 -0.43 3.33 -0.02 -0.72 0.11 -1.00 -4.53 120.40 117.14 3fl8 s VAL 109 Ca 0.03 1.18 0.07 0.00 -2.93 0.00 0.00 61.98 60.32 3fl8 s VAL 109 Cb 0.02 -3.75 -0.10 0.00 -1.53 0.00 0.00 36.38 31.02 3fl8 s VAL 109 CO 0.05 0.22 0.13 0.47 -3.33 0.00 0.00 175.10 172.63 3fl8 n ASP 110 N 2.04 3.44 -3.72 3.54 8.00 0.12 -4.97 116.55 124.99 3fl8 n ASP 110 Ca 0.03 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.41 3fl8 n ASP 110 Cb 0.44 1.21 -0.10 0.00 -0.02 0.00 0.00 41.12 42.64 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 -2.42 0.45 -0.19 -1.24 2.20 -1.05 -3.91 119.74 113.57 3fl8 s LYS 111 Ca -0.03 0.64 -0.01 0.00 -0.36 0.00 0.00 55.97 56.21 3fl8 s LYS 111 Cb 0.04 0.15 0.01 0.00 -1.51 0.00 0.00 37.83 36.51 3fl8 s LYS 111 CO 0.28 -0.09 -0.13 -0.51 -0.36 0.00 0.00 175.35 174.54 3fl8 s LEU 112 N 0.60 2.48 -0.44 5.43 1.43 0.19 -0.96 118.68 127.41 3fl8 s LEU 112 Ca -0.03 -0.52 -0.08 0.00 -1.03 0.00 0.00 54.13 52.47 3fl8 s LEU 112 Cb -0.05 -1.59 0.10 0.00 0.03 0.00 0.00 46.19 44.68 3fl8 s LEU 112 CO -0.04 0.01 0.28 -0.31 0.23 0.00 0.00 176.35 176.52 3fl8 s TYR 113 N 1.28 3.42 -0.19 0.29 1.51 0.60 -0.18 117.35 124.08 3fl8 s TYR 113 Ca 0.03 -1.86 0.01 0.00 -1.01 0.00 0.00 57.07 54.25 3fl8 s TYR 113 Cb -0.14 -3.22 0.03 0.00 -0.11 0.00 0.00 41.96 38.52 3fl8 s TYR 113 CO -0.07 -0.93 -0.17 0.42 -1.11 0.00 0.00 175.55 173.69 3fl8 s ILE 114 N 1.34 1.96 -0.24 2.71 1.01 0.10 -0.62 121.20 127.45 3fl8 s ILE 114 Ca 0.05 -1.02 -0.19 0.00 0.00 0.00 0.00 60.65 59.49 3fl8 s ILE 114 Cb -0.24 -1.86 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 3fl8 s ILE 114 CO -0.00 0.39 0.57 -0.89 0.00 0.00 0.00 174.94 175.01 3fl8 s THR 115 N 1.30 5.04 -0.32 2.92 2.01 0.96 -0.88 115.64 126.67 3fl8 s THR 115 Ca 0.02 1.01 -0.09 0.00 0.31 0.00 0.00 61.69 62.94 3fl8 s THR 115 Cb -0.14 -3.88 0.01 0.00 0.01 0.00 0.00 72.50 68.49 3fl8 s THR 115 CO -0.11 0.08 0.14 -0.54 -0.69 0.00 0.00 174.62 173.50 3fl8 s LYS 116 N 2.25 3.15 -0.23 4.92 1.02 0.05 -0.84 119.74 130.05 3fl8 s LYS 116 Ca 0.24 -0.84 -0.15 0.00 0.02 0.00 0.00 55.97 55.24 3fl8 s LYS 116 Cb -0.16 -3.54 -0.04 0.00 -0.52 0.00 0.00 37.83 33.58 3fl8 s LYS 116 CO 0.09 -0.49 0.38 0.42 -0.92 0.00 0.00 175.35 174.83 3fl8 s ILE 117 N 1.56 5.20 -1.50 2.17 1.01 0.42 -1.54 121.20 128.53 3fl8 s ILE 117 Ca 0.03 0.63 -0.11 0.00 0.00 0.00 0.00 60.65 61.20 3fl8 s ILE 117 Cb -0.18 -3.71 0.01 0.00 0.01 0.00 0.00 42.46 38.60 3fl8 s ILE 117 CO 0.05 0.22 2.49 1.41 0.00 0.00 0.00 174.94 179.11 3fl8 n HIS 118 N 4.80 2.96 -3.46 3.97 8.25 0.88 -2.82 115.22 129.80 3fl8 n HIS 118 Ca -0.09 -2.99 -0.11 0.00 -0.26 0.00 0.00 57.72 54.27 3fl8 n HIS 118 Cb 0.51 -2.41 -0.02 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 2.15 -0.48 -0.36 4.41 5.04 -1.26 -4.70 115.29 120.09 3fl8 s HIS 119 Ca 0.56 0.35 -0.04 0.00 -1.54 0.00 0.00 55.06 54.39 3fl8 s HIS 119 Cb 0.15 0.54 0.07 0.00 0.04 0.00 0.00 32.58 33.39 3fl8 s HIS 119 CO -0.07 -0.72 0.12 0.00 -2.34 0.00 0.00 174.74 171.73 3fl8 s ALA 120 N -3.33 3.04 0.59 1.58 0.00 -1.26 -2.49 121.76 119.88 3fl8 s ALA 120 Ca 0.02 -2.09 0.03 0.00 0.00 0.00 0.00 51.96 49.92 3fl8 s ALA 120 Cb -0.01 -2.26 0.07 0.00 0.00 0.00 0.00 23.12 20.92 3fl8 s ALA 120 CO -0.10 -1.52 0.81 -0.06 0.00 0.00 0.00 175.76 174.89 3fl8 s PHE 121 N 1.26 2.21 -0.23 0.00 0.40 -1.26 -5.07 117.98 115.29 3fl8 s PHE 121 Ca 0.01 -0.28 -0.23 0.00 -0.60 0.00 0.00 56.93 55.83 3fl8 s PHE 121 Cb -0.21 -2.67 -0.01 0.00 0.51 0.00 0.00 43.02 40.64 3fl8 s PHE 121 CO -0.01 -1.11 0.77 -2.00 0.70 0.00 0.00 175.22 173.57 3fl8 s GLU 122 N -4.80 4.18 0.12 0.44 2.56 -1.26 -5.04 118.70 114.92 3fl8 s GLU 122 Ca 0.60 0.84 -0.03 0.00 0.00 0.00 0.00 54.97 56.38 3fl8 s GLU 122 Cb -0.08 -3.63 -0.03 0.00 2.00 0.00 0.00 34.13 32.39 3fl8 s GLU 122 CO 0.39 -0.45 0.10 0.20 -0.56 0.00 0.00 175.26 174.95 3fl8 s GLY 123 N 1.33 0.74 0.00 -1.50 0.00 -1.26 -4.62 107.32 102.01 3fl8 s GLY 123 Ca 0.33 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.80 3fl8 s GLY 123 CO 0.08 -1.20 0.19 2.09 0.00 0.00 0.00 173.10 174.27 3fl8 n ASP 124 N -0.09 0.39 -4.01 1.64 5.68 -0.31 -4.97 116.55 114.88 3fl8 n ASP 124 Ca -0.08 -0.73 -0.14 0.00 -0.50 0.00 0.00 54.79 53.34 3fl8 n ASP 124 Cb 0.63 0.25 -0.13 0.00 -1.14 0.00 0.00 41.12 40.73 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 -0.25 0.45 0.06 2.12 -1.32 -1.15 -5.03 115.64 110.53 3fl8 s THR 125 Ca 0.00 -0.72 0.04 0.00 -1.21 0.00 0.00 61.69 59.80 3fl8 s THR 125 Cb 0.00 -0.47 -0.03 0.00 -1.51 0.00 0.00 72.50 70.49 3fl8 s THR 125 CO 0.00 -0.19 -0.11 -0.36 -2.21 0.00 0.00 174.62 171.75 3fl8 s PHE 126 N -0.88 0.95 -0.23 9.09 0.40 -1.26 -1.23 117.98 124.82 3fl8 s PHE 126 Ca -0.06 -0.50 -0.29 0.00 -0.60 0.00 0.00 56.93 55.49 3fl8 s PHE 126 Cb -0.07 -0.54 0.00 0.00 0.51 0.00 0.00 43.02 42.92 3fl8 s PHE 126 CO 0.00 -0.01 1.16 0.12 0.70 0.00 0.00 175.22 177.19 3fl8 s PHE 127 N -1.44 3.04 0.57 0.36 5.36 0.48 -4.68 117.98 121.68 3fl8 s PHE 127 Ca -0.05 1.17 -0.19 0.00 -0.96 0.00 0.00 56.93 56.90 3fl8 s PHE 127 Cb -0.09 -3.52 -0.06 0.00 -0.34 0.00 0.00 43.02 39.00 3fl8 s PHE 127 CO 0.01 -1.14 0.86 -2.30 -1.46 0.00 0.00 175.22 171.19 3fl8 n PRO 128 N 6.67 0.85 -1.69 10.12 -0.02 -1.26 -4.90 135.00 144.77 3fl8 n PRO 128 Ca 0.13 0.33 -0.38 0.00 -2.02 0.00 0.00 63.50 61.55 3fl8 n PRO 128 Cb 0.46 -2.03 0.05 0.00 -0.02 0.00 0.00 33.50 31.95 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 -0.63 1.33 -3.88 -0.52 -0.58 -1.26 -5.04 120.64 110.06 3fl8 n GLU 129 Ca 0.13 0.50 -0.12 0.00 -0.42 0.00 0.00 57.16 57.25 3fl8 n GLU 129 Cb 0.46 -2.41 -0.14 0.00 -0.57 0.00 0.00 31.44 28.79 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 -2.87 0.05 -0.67 3.49 -1.94 -1.26 -5.10 119.30 111.01 3fl8 s MET 130 Ca 0.74 -0.07 -0.27 0.00 -1.71 0.00 0.00 55.69 54.38 3fl8 s MET 130 Cb -0.42 0.02 0.02 0.00 2.01 0.00 0.00 34.83 36.46 3fl8 s MET 130 CO 0.47 -0.01 1.34 0.34 -0.01 0.00 0.00 175.02 177.16 3fl8 s ASP 131 N -0.19 6.12 0.00 3.03 2.15 -1.26 -4.86 116.67 121.66 3fl8 s ASP 131 Ca -0.02 -0.14 0.30 0.00 0.43 0.00 0.00 52.55 53.12 3fl8 s ASP 131 Cb -0.01 -2.55 1.45 0.00 -0.30 0.00 0.00 42.92 41.50 3fl8 s ASP 131 CO -0.00 -1.80 2.02 0.23 -0.17 0.00 0.00 175.17 175.44 3fl8 n MET 132 N 9.06 0.38 0.15 4.34 2.81 -1.26 -2.97 117.12 129.63 3fl8 n MET 132 Ca 0.07 -0.02 0.12 0.00 -1.81 0.00 0.00 57.70 56.07 3fl8 n MET 132 Cb 0.49 -1.50 0.53 0.00 -0.71 0.00 0.00 33.22 32.04 3fl8 n MET 132 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 3fl8 h THR 133 N 0.04 0.00 -0.00 2.03 1.35 -2.03 -0.45 112.91 113.85 3fl8 h THR 133 Ca 0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 3fl8 h THR 133 Cb 0.33 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 3fl8 h THR 133 CO 0.00 0.00 -0.15 0.59 -0.25 0.00 0.00 175.52 175.71 3fl8 n ASN 134 N -2.32 0.60 -4.49 5.36 5.03 -1.16 -4.88 115.26 113.40 3fl8 n ASN 134 Ca 0.01 -0.63 -0.29 0.00 0.87 0.00 0.00 54.58 54.55 3fl8 n ASN 134 Cb 0.20 -0.03 -0.11 0.00 -1.02 0.00 0.00 39.78 38.82 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 -2.50 2.52 -0.08 3.10 0.52 -0.18 -0.42 118.94 121.90 3fl8 s TRP 135 Ca 0.27 -0.27 0.02 0.00 0.02 0.00 0.00 56.10 56.15 3fl8 s TRP 135 Cb 0.20 -1.31 0.01 0.00 -1.15 0.00 0.00 33.47 31.22 3fl8 s TRP 135 CO 0.49 0.41 -0.15 0.21 0.02 0.00 0.00 176.95 177.93 3fl8 s LYS 136 N -2.30 2.09 -0.02 4.98 2.20 0.20 -4.69 119.74 122.21 3fl8 s LYS 136 Ca 0.19 -0.54 -0.30 0.00 -0.36 0.00 0.00 55.97 54.96 3fl8 s LYS 136 Cb -0.10 -1.71 -0.04 0.00 -1.51 0.00 0.00 37.83 34.47 3fl8 s LYS 136 CO 0.11 0.03 1.28 -2.00 -0.36 0.00 0.00 175.35 174.41 3fl8 s GLU 137 N 0.70 4.33 -0.00 4.03 2.12 -1.26 -0.97 118.70 127.65 3fl8 s GLU 137 Ca -0.13 1.80 0.07 0.00 0.36 0.00 0.00 54.97 57.07 3fl8 s GLU 137 Cb -0.16 -3.54 -0.08 0.00 0.26 0.00 0.00 34.13 30.60 3fl8 s GLU 137 CO 0.03 -0.48 0.22 1.33 -0.54 0.00 0.00 175.26 175.82 3fl8 n VAL 138 N 4.57 0.00 -3.62 3.70 0.24 -0.25 -4.96 118.33 118.02 3fl8 n VAL 138 Ca 0.12 -0.27 -0.15 0.00 -2.04 0.00 0.00 64.34 62.00 3fl8 n VAL 138 Cb 0.45 0.74 -0.07 0.00 -1.47 0.00 0.00 33.84 33.49 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 -1.96 -0.63 -0.01 6.34 5.36 -1.15 -4.99 117.98 120.93 3fl8 s PHE 139 Ca 0.00 1.36 -0.08 0.00 -0.96 0.00 0.00 56.93 57.25 3fl8 s PHE 139 Cb 0.05 0.29 0.01 0.00 -0.34 0.00 0.00 43.02 43.02 3fl8 s PHE 139 CO 0.27 -0.44 0.17 0.54 -1.46 0.00 0.00 175.22 174.31 3fl8 s VAL 140 N -0.37 0.06 -0.28 3.12 0.11 -1.26 -0.64 120.40 121.15 3fl8 s VAL 140 Ca -0.05 -0.53 -0.17 0.00 -2.93 0.00 0.00 61.98 58.29 3fl8 s VAL 140 Cb -0.03 -0.43 0.08 0.00 -1.53 0.00 0.00 36.38 34.47 3fl8 s VAL 140 CO 0.04 -0.29 0.69 -0.70 -3.33 0.00 0.00 175.10 171.51 3fl8 s GLU 141 N -1.11 0.73 0.10 1.54 2.12 0.41 -4.98 118.70 117.51 3fl8 s GLU 141 Ca -0.12 1.19 -0.31 0.00 0.36 0.00 0.00 54.97 56.09 3fl8 s GLU 141 Cb -0.06 0.18 -0.07 0.00 0.26 0.00 0.00 34.13 34.44 3fl8 s GLU 141 CO 0.02 -0.14 1.28 0.21 -0.54 0.00 0.00 175.26 176.09 3fl8 s LYS 142 N 1.44 4.39 0.80 4.30 2.20 -1.26 0.21 119.74 131.82 3fl8 s LYS 142 Ca -0.08 1.91 -0.11 0.00 -0.36 0.00 0.00 55.97 57.33 3fl8 s LYS 142 Cb -0.05 -3.29 0.07 0.00 -1.51 0.00 0.00 37.83 33.05 3fl8 s LYS 142 CO -0.17 -0.32 1.09 0.20 -0.36 0.00 0.00 175.35 175.80 3fl8 s GLY 143 N 0.98 1.63 -0.28 5.54 0.00 0.95 -4.88 107.32 111.25 3fl8 s GLY 143 Ca 0.61 -0.15 -0.29 0.00 0.00 0.00 0.00 44.72 44.89 3fl8 s GLY 143 CO 0.30 0.27 1.13 -2.27 0.00 0.00 0.00 173.10 172.53 3fl8 s LEU 144 N -5.80 3.98 -0.22 0.66 2.96 -1.26 -4.75 118.68 114.25 3fl8 s LEU 144 Ca 0.61 1.20 -0.06 0.00 -0.22 0.00 0.00 54.13 55.66 3fl8 s LEU 144 Cb -0.15 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 3fl8 s LEU 144 CO 0.55 -0.87 0.03 -0.89 -1.32 0.00 0.00 176.35 173.84 3fl8 s THR 145 N 3.69 4.08 0.00 3.68 2.01 -1.26 -4.75 115.64 123.09 3fl8 s THR 145 Ca 0.48 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.22 3fl8 s THR 145 Cb -0.14 -2.87 0.00 0.00 0.01 0.00 0.00 72.50 69.49 3fl8 s THR 145 CO 0.15 0.40 0.00 -0.90 -0.69 0.00 0.00 174.62 173.58 3fl8 n ASP 146 N 4.48 0.00 -0.27 3.53 5.68 -0.56 -4.96 116.55 124.45 3fl8 n ASP 146 Ca -0.17 -0.36 0.04 0.00 -0.50 0.00 0.00 54.79 53.81 3fl8 n ASP 146 Cb 0.52 0.00 0.18 0.00 -1.14 0.00 0.00 41.12 40.68 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 0.59 0.00 0.11 3.07 -1.97 -2.03 114.58 114.35 3fl8 h GLU 147 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 3fl8 h GLU 147 Cb 0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.78 3fl8 h GLU 147 CO 0.00 0.39 -0.45 1.63 -1.40 0.00 0.00 179.01 179.18 3fl8 n LYS 148 N -4.87 0.26 -3.54 2.33 5.02 -1.26 -4.46 118.16 111.64 3fl8 n LYS 148 Ca 0.14 0.11 -0.27 0.00 -2.02 0.00 0.00 58.31 56.27 3fl8 n LYS 148 Cb 0.36 -1.70 -0.10 0.00 -0.02 0.00 0.00 35.03 33.57 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 -2.10 1.04 -0.00 4.39 3.02 -0.77 -4.40 115.26 116.44 3fl8 n ASN 149 Ca 0.04 -2.76 0.00 0.00 -0.03 0.00 0.00 54.58 51.83 3fl8 n ASN 149 Cb 0.43 -0.64 0.31 0.00 -0.61 0.00 0.00 39.78 39.27 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 5.27 0.53 -6.95 3.52 0.11 -1.76 -1.48 132.00 131.23 3fl8 h PRO 150 Ca 0.20 -0.10 -0.47 0.00 0.11 0.00 0.00 66.00 65.75 3fl8 h PRO 150 Cb 0.84 -0.08 0.05 0.00 0.11 0.00 0.00 31.00 31.91 3fl8 h PRO 150 CO 0.53 0.53 0.06 0.71 -0.21 0.00 0.00 178.00 179.62 3fl8 s TYR 151 N -5.03 3.19 -0.07 0.65 2.02 -1.26 -4.74 117.35 112.11 3fl8 s TYR 151 Ca -0.08 0.43 -0.20 0.00 -0.37 0.00 0.00 57.07 56.85 3fl8 s TYR 151 Cb 0.16 -2.61 -0.04 0.00 -0.40 0.00 0.00 41.96 39.06 3fl8 s TYR 151 CO 0.76 -0.69 0.56 0.99 -1.57 0.00 0.00 175.55 175.60 3fl8 s THR 152 N -2.83 5.08 0.00 -0.71 2.01 -1.26 -4.62 115.64 113.31 3fl8 s THR 152 Ca 0.53 1.15 -0.23 0.00 0.31 0.00 0.00 61.69 63.44 3fl8 s THR 152 Cb -0.10 -3.90 0.05 0.00 0.01 0.00 0.00 72.50 68.56 3fl8 s THR 152 CO 0.42 0.34 0.51 -0.72 -0.69 0.00 0.00 174.62 174.48 3fl8 s TYR 153 N 0.41 -0.43 -0.01 4.92 -0.85 -1.26 -0.09 117.35 120.04 3fl8 s TYR 153 Ca 0.30 0.60 0.05 0.00 -0.52 0.00 0.00 57.07 57.51 3fl8 s TYR 153 Cb -0.17 0.29 -0.01 0.00 0.38 0.00 0.00 41.96 42.46 3fl8 s TYR 153 CO 0.14 -0.57 -0.16 0.71 -1.52 0.00 0.00 175.55 174.15 3fl8 s TYR 154 N -1.80 1.48 -0.17 -3.49 1.51 -0.59 -0.03 117.35 114.25 3fl8 s TYR 154 Ca -0.09 -0.28 -0.22 0.00 -1.01 0.00 0.00 57.07 55.47 3fl8 s TYR 154 Cb -0.01 -0.94 -0.03 0.00 -0.11 0.00 0.00 41.96 40.87 3fl8 s TYR 154 CO 0.03 -0.02 0.67 0.71 -1.11 0.00 0.00 175.55 175.83 3fl8 s TYR 155 N -0.42 3.41 -0.02 2.71 4.12 0.13 -0.77 117.35 126.51 3fl8 s TYR 155 Ca 0.06 1.03 0.07 0.00 0.02 0.00 0.00 57.07 58.25 3fl8 s TYR 155 Cb -0.06 -2.83 -0.02 0.00 -1.52 0.00 0.00 41.96 37.53 3fl8 s TYR 155 CO -0.00 -0.14 -0.25 -1.01 0.02 0.00 0.00 175.55 174.17 3fl8 s HIS 156 N 1.77 2.26 -0.08 2.71 3.76 -0.06 -0.44 115.29 125.20 3fl8 s HIS 156 Ca 0.31 -0.47 0.05 0.00 -0.15 0.00 0.00 55.06 54.81 3fl8 s HIS 156 Cb -0.16 -1.46 -0.00 0.00 1.11 0.00 0.00 32.58 32.07 3fl8 s HIS 156 CO 0.12 -0.07 -0.24 0.08 -0.85 0.00 0.00 174.74 173.78 3fl8 s VAL 157 N -0.52 1.99 0.01 -0.90 1.01 0.19 -0.72 120.40 121.47 3fl8 s VAL 157 Ca 0.08 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 61.10 3fl8 s VAL 157 Cb -0.10 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 3fl8 s VAL 157 CO -0.00 0.55 -0.15 -0.31 0.00 0.00 0.00 175.10 175.18 3fl8 s TYR 158 N 0.15 1.36 0.39 5.22 2.02 0.75 -1.09 117.35 126.15 3fl8 s TYR 158 Ca -0.12 -0.30 0.05 0.00 -0.37 0.00 0.00 57.07 56.33 3fl8 s TYR 158 Cb -0.16 -0.84 -0.06 0.00 -0.40 0.00 0.00 41.96 40.50 3fl8 s TYR 158 CO 0.06 0.01 0.04 -1.21 -1.57 0.00 0.00 175.55 172.88 3fl8 s GLU 159 N -0.72 1.88 0.30 -0.62 2.02 -0.14 -0.64 118.70 120.77 3fl8 s GLU 159 Ca 0.05 -2.08 -0.29 0.00 0.02 0.00 0.00 54.97 52.66 3fl8 s GLU 159 Cb -0.07 -1.27 -0.10 0.00 0.10 0.00 0.00 34.13 32.79 3fl8 s GLU 159 CO 0.00 -0.17 1.29 0.15 0.02 0.00 0.00 175.26 176.55 3fl8 s LYS 160 N -3.80 4.39 0.12 1.61 1.02 -1.25 0.61 119.74 122.44 3fl8 s LYS 160 Ca 0.31 2.15 -0.31 0.00 0.02 0.00 0.00 55.97 58.14 3fl8 s LYS 160 Cb 0.08 -3.10 -0.09 0.00 -0.52 0.00 0.00 37.83 34.20 3fl8 s LYS 160 CO 0.15 -0.16 1.55 -1.14 -0.92 0.00 0.00 175.35 174.83 3fl8 s GLN 161 N -1.46 4.23 0.40 1.68 2.00 0.44 -4.61 119.66 122.34 3fl8 s GLN 161 Ca 0.50 2.29 -0.24 0.00 -2.00 0.00 0.00 55.36 55.90 3fl8 s GLN 161 Cb -0.39 -3.31 -0.09 0.00 0.80 0.00 0.00 33.01 30.03 3fl8 s GLN 161 CO 0.49 -0.61 1.08 1.14 -0.50 0.00 0.00 175.29 176.89 3fl8 s GLN 162 N 1.59 4.14 -0.12 1.67 -2.07 -1.26 -4.96 119.66 118.64 3fl8 s GLN 162 Ca 0.70 1.59 -0.30 0.00 -1.82 0.00 0.00 55.36 55.53 3fl8 s GLN 162 Cb -0.41 -2.58 -0.02 0.00 -1.09 0.00 0.00 33.01 28.91 3fl8 s GLN 162 CO 0.31 -0.18 1.21 -0.51 -1.32 0.00 0.00 175.29 174.80 3fl8 s LEU 163 N -2.59 4.22 -0.28 2.60 1.02 -1.26 -5.02 118.68 117.36 3fl8 s LEU 163 Ca 0.57 1.72 -0.19 0.00 0.02 0.00 0.00 54.13 56.25 3fl8 s LEU 163 Cb -0.24 -3.55 -0.02 0.00 0.02 0.00 0.00 46.19 42.40 3fl8 s LEU 163 CO 0.30 -0.66 0.55 -0.69 0.02 0.00 0.00 176.35 175.87 3fl8 s VAL 164 N 2.86 5.02 0.48 -1.59 1.01 -1.26 -5.07 120.40 121.85 3fl8 s VAL 164 Ca 0.54 0.81 -0.23 0.00 0.00 0.00 0.00 61.98 63.10 3fl8 s VAL 164 Cb -0.22 -3.90 -0.07 0.00 0.00 0.00 0.00 36.38 32.19 3fl8 s VAL 164 CO 0.17 -0.02 1.28 -2.84 0.00 0.00 0.00 175.10 173.69 3fl8 s PRO 165 N 2.41 3.59 0.00 2.72 0.02 -1.26 -5.33 135.00 137.15 3fl8 s PRO 165 Ca 0.22 2.05 0.31 0.00 0.02 0.00 0.00 61.00 63.60 3fl8 s PRO 165 Cb -0.15 -2.45 1.74 0.00 0.02 0.00 0.00 34.50 33.65 3fl8 s PRO 165 CO 0.10 -0.77 2.13 2.89 -0.33 0.00 0.00 177.00 181.02