#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fq9 h PHE 17 N 0.00 0.00 0.00 1.57 -5.15 -1.99 -3.01 116.94 108.36 1fq9 h PHE 17 Ca 0.00 0.00 -0.11 0.00 -0.20 0.00 0.00 57.97 57.66 1fq9 h PHE 17 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.15 1fq9 h PHE 17 CO 0.00 0.00 -1.10 0.87 -2.00 0.00 0.00 178.31 176.08 1fq9 h LYS 18 N 0.00 0.00 -7.29 6.09 1.79 -2.04 -3.47 116.57 111.65 1fq9 h LYS 18 Ca 0.00 0.00 -0.50 0.00 -2.18 0.00 0.00 60.65 57.97 1fq9 h LYS 18 Cb 0.46 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 31.18 1fq9 h LYS 18 CO 0.00 0.25 0.39 -0.51 -1.08 0.00 0.00 179.45 178.49 1fq9 s ASP 19 N -5.82 5.92 0.91 0.86 1.01 -1.14 -5.02 116.67 113.39 1fq9 s ASP 19 Ca -0.01 1.59 -0.12 0.00 0.71 0.00 0.00 52.55 54.73 1fq9 s ASP 19 Cb 0.08 -2.50 0.14 0.00 1.01 0.00 0.00 42.92 41.65 1fq9 s ASP 19 CO 0.79 -1.08 1.09 -2.84 0.21 0.00 0.00 175.17 173.34 1fq9 s PRO 20 N -4.72 1.13 0.13 8.23 0.02 -1.26 -4.83 135.00 133.70 1fq9 s PRO 20 Ca 0.58 0.84 0.01 0.00 0.02 0.00 0.00 61.00 62.45 1fq9 s PRO 20 Cb -0.13 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 1fq9 s PRO 20 CO 0.47 -2.34 -0.01 0.15 -0.33 0.00 0.00 177.00 174.95 1fq9 s LYS 21 N -4.90 0.95 -0.00 5.54 1.02 0.87 -2.79 119.74 120.42 1fq9 s LYS 21 Ca 0.64 -1.43 0.05 0.00 0.02 0.00 0.00 55.97 55.24 1fq9 s LYS 21 Cb -0.18 -0.10 -0.03 0.00 -0.52 0.00 0.00 37.83 37.00 1fq9 s LYS 21 CO 0.57 -0.13 -0.14 1.03 -0.92 0.00 0.00 175.35 175.77 1fq9 s ARG 22 N -3.92 2.35 -0.43 1.68 0.52 0.70 -0.26 118.95 119.59 1fq9 s ARG 22 Ca 0.19 -0.81 -0.05 0.00 -0.52 0.00 0.00 55.73 54.54 1fq9 s ARG 22 Cb 0.06 -2.33 0.11 0.00 0.52 0.00 0.00 34.95 33.32 1fq9 s ARG 22 CO -0.00 0.59 0.26 -0.51 0.02 0.00 0.00 175.30 175.65 1fq9 s LEU 23 N -1.14 5.42 -0.46 2.53 1.43 -1.26 -0.71 118.68 124.49 1fq9 s LEU 23 Ca 0.14 -1.99 -0.26 0.00 -1.03 0.00 0.00 54.13 50.99 1fq9 s LEU 23 Cb -0.11 -1.90 0.03 0.00 0.03 0.00 0.00 46.19 44.24 1fq9 s LEU 23 CO 0.04 -0.60 0.97 -0.47 0.23 0.00 0.00 176.35 176.51 1fq9 s TYR 24 N 1.22 2.90 -0.06 0.29 6.14 -0.70 -0.60 117.35 126.54 1fq9 s TYR 24 Ca 0.07 0.45 -0.30 0.00 0.64 0.00 0.00 57.07 57.94 1fq9 s TYR 24 Cb -0.24 -4.05 -0.02 0.00 0.42 0.00 0.00 41.96 38.06 1fq9 s TYR 24 CO -0.03 -1.13 1.05 0.00 0.64 0.00 0.00 175.55 176.08 1fq9 h LYS 26 N 7.09 0.15 -5.77 0.00 3.64 -1.23 -2.22 116.57 118.22 1fq9 h LYS 26 Ca -0.34 -0.01 -0.61 0.00 -1.27 0.00 0.00 60.65 58.42 1fq9 h LYS 26 Cb 1.17 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.88 1fq9 h LYS 26 CO 0.84 0.10 1.98 -1.71 -2.27 0.00 0.00 179.45 178.38 1fq9 n ASN 27 N -4.38 4.56 0.00 4.20 5.15 -1.20 -3.88 115.26 119.70 1fq9 n ASN 27 Ca 0.17 -2.87 0.00 0.00 -0.60 0.00 0.00 54.58 51.27 1fq9 n ASN 27 Cb 0.78 -1.75 0.00 0.00 -0.53 0.00 0.00 39.78 38.28 1fq9 n ASN 27 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1fq9 n GLY 28 N 5.47 0.54 2.20 8.20 0.00 -1.26 -4.25 105.19 116.09 1fq9 n GLY 28 Ca 0.48 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.42 1fq9 n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fq9 n GLY 29 N -2.00 0.64 3.73 -0.02 0.00 -0.84 -4.98 105.19 101.72 1fq9 n GLY 29 Ca 0.00 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 1fq9 n GLY 29 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fq9 s PHE 30 N -2.32 3.63 0.08 1.61 0.40 -1.22 -4.42 117.98 115.74 1fq9 s PHE 30 Ca 0.00 1.35 -0.26 0.00 -0.60 0.00 0.00 56.93 57.42 1fq9 s PHE 30 Cb 0.00 -2.83 -0.06 0.00 0.51 0.00 0.00 43.02 40.64 1fq9 s PHE 30 CO 0.00 0.14 0.79 -0.06 0.70 0.00 0.00 175.22 176.80 1fq9 s PHE 31 N 0.54 3.79 0.12 0.36 0.08 0.72 -0.59 117.98 123.00 1fq9 s PHE 31 Ca 0.39 1.55 -0.31 0.00 0.12 0.00 0.00 56.93 58.68 1fq9 s PHE 31 Cb -0.19 -2.84 -0.09 0.00 -0.57 0.00 0.00 43.02 39.34 1fq9 s PHE 31 CO 0.20 0.32 1.51 -1.17 -0.10 0.00 0.00 175.22 175.99 1fq9 s LEU 32 N -0.31 4.37 -0.04 -0.37 2.96 0.24 -1.45 118.68 124.07 1fq9 s LEU 32 Ca 0.39 2.46 0.05 0.00 -0.22 0.00 0.00 54.13 56.81 1fq9 s LEU 32 Cb -0.21 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 42.88 1fq9 s LEU 32 CO 0.25 -0.77 -0.19 -0.60 -1.32 0.00 0.00 176.35 173.71 1fq9 s ARG 33 N 1.48 1.89 -0.24 1.98 3.52 0.64 -4.58 118.95 123.65 1fq9 s ARG 33 Ca 0.68 -0.69 -0.01 0.00 -0.13 0.00 0.00 55.73 55.58 1fq9 s ARG 33 Cb -0.40 -1.67 0.02 0.00 -1.56 0.00 0.00 34.95 31.34 1fq9 s ARG 33 CO 0.31 0.31 -0.08 0.42 -0.81 0.00 0.00 175.30 175.44 1fq9 s ILE 34 N -0.12 2.74 0.54 4.11 1.01 -0.81 -2.26 121.20 126.41 1fq9 s ILE 34 Ca -0.01 -1.01 -0.17 0.00 0.00 0.00 0.00 60.65 59.45 1fq9 s ILE 34 Cb -0.11 -2.36 -0.06 0.00 0.01 0.00 0.00 42.46 39.94 1fq9 s ILE 34 CO 0.02 0.25 1.02 -1.00 0.00 0.00 0.00 174.94 175.23 1fq9 s HIS 35 N 1.32 3.16 0.50 3.97 3.76 -0.38 -4.41 115.29 123.20 1fq9 s HIS 35 Ca 0.01 1.52 0.32 0.00 -0.15 0.00 0.00 55.06 56.76 1fq9 s HIS 35 Cb -0.16 -2.94 1.77 0.00 1.11 0.00 0.00 32.58 32.37 1fq9 s HIS 35 CO -0.06 -0.75 2.19 -1.35 -0.85 0.00 0.00 174.74 173.92 1fq9 h PRO 36 N 0.91 0.00 -0.01 8.40 0.11 -1.88 -1.40 132.00 138.12 1fq9 h PRO 36 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1fq9 h PRO 36 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1fq9 h PRO 36 CO 0.59 0.05 -0.03 -0.40 -0.21 0.00 0.00 178.00 178.00 1fq9 n ASP 37 N -3.54 1.01 0.00 -2.05 5.68 -1.26 -4.92 116.55 111.47 1fq9 n ASP 37 Ca -0.02 -1.26 0.00 0.00 -0.50 0.00 0.00 54.79 53.01 1fq9 n ASP 37 Cb 0.16 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 1fq9 n ASP 37 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1fq9 n GLY 38 N 1.15 1.59 3.76 6.12 0.00 -0.53 -4.98 105.19 112.31 1fq9 n GLY 38 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 1fq9 n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fq9 s ARG 39 N -0.78 3.44 -0.05 1.61 0.52 -1.26 -1.42 118.95 121.01 1fq9 s ARG 39 Ca 0.00 1.92 0.02 0.00 -0.52 0.00 0.00 55.73 57.15 1fq9 s ARG 39 Cb 0.00 -2.28 0.01 0.00 0.52 0.00 0.00 34.95 33.20 1fq9 s ARG 39 CO 0.00 -0.85 -0.11 0.08 0.02 0.00 0.00 175.30 174.44 1fq9 s VAL 40 N -1.48 1.01 0.00 3.52 1.01 -1.26 -1.25 120.40 121.94 1fq9 s VAL 40 Ca 0.68 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.23 1fq9 s VAL 40 Cb -0.32 -0.92 0.00 0.00 0.00 0.00 0.00 36.38 35.13 1fq9 s VAL 40 CO 0.38 0.32 0.00 -0.90 0.00 0.00 0.00 175.10 174.90 1fq9 n ASP 41 N 3.66 0.00 -4.29 3.32 3.85 -0.96 -4.35 116.55 117.78 1fq9 n ASP 41 Ca -0.22 -0.02 -0.19 0.00 -0.71 0.00 0.00 54.79 53.65 1fq9 n ASP 41 Cb 0.52 0.00 -0.11 0.00 -1.35 0.00 0.00 41.12 40.18 1fq9 n ASP 41 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 1fq9 s GLY 42 N -0.21 1.25 -0.04 6.12 0.00 0.11 -0.26 107.32 114.29 1fq9 s GLY 42 Ca 0.00 -1.45 -0.02 0.00 0.00 0.00 0.00 44.72 43.25 1fq9 s GLY 42 CO 0.00 -1.52 0.09 -1.34 0.00 0.00 0.00 173.10 170.33 1fq9 s VAL 43 N -2.40 -0.03 -0.31 1.40 -7.23 -0.53 -4.78 120.40 106.52 1fq9 s VAL 43 Ca 0.15 0.11 0.19 0.00 -1.81 0.00 0.00 61.98 60.62 1fq9 s VAL 43 Cb -0.04 -0.15 0.20 0.00 0.56 0.00 0.00 36.38 36.95 1fq9 s VAL 43 CO 0.05 0.05 1.50 0.03 -0.31 0.00 0.00 175.10 176.42 1fq9 h ARG 44 N 6.74 0.00 -6.25 4.82 3.08 -1.87 0.21 114.38 121.11 1fq9 h ARG 44 Ca -0.36 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.12 1fq9 h ARG 44 Cb 1.16 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.19 1fq9 h ARG 44 CO 0.45 0.22 1.26 -1.21 -1.07 0.00 0.00 179.97 179.63 1fq9 s GLU 45 N -3.10 3.46 0.47 0.04 0.41 -1.26 -4.82 118.70 113.90 1fq9 s GLU 45 Ca 0.05 1.61 0.32 0.00 -0.41 0.00 0.00 54.97 56.54 1fq9 s GLU 45 Cb 0.06 -4.18 1.59 0.00 -1.78 0.00 0.00 34.13 29.83 1fq9 s GLU 45 CO 0.71 -1.71 1.97 -0.22 -0.49 0.00 0.00 175.26 175.52 1fq9 h LYS 46 N 12.50 0.00 -0.02 1.61 3.64 -1.98 -1.91 116.57 130.42 1fq9 h LYS 46 Ca -0.35 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1fq9 h LYS 46 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1fq9 h LYS 46 CO 1.01 0.00 0.00 -1.13 -2.27 0.00 0.00 179.45 177.06 1fq9 n SER 47 N -2.68 1.49 -4.63 4.20 3.41 -1.26 -4.93 113.62 109.22 1fq9 n SER 47 Ca -0.01 -1.50 -0.47 0.00 -0.26 0.00 0.00 58.87 56.62 1fq9 n SER 47 Cb 0.13 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.04 1fq9 n SER 47 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1fq9 n ASP 48 N 0.16 2.23 0.00 4.04 2.03 -0.72 -4.84 116.55 119.45 1fq9 n ASP 48 Ca 0.19 1.13 0.10 0.00 0.52 0.00 0.00 54.79 56.72 1fq9 n ASP 48 Cb 0.35 -1.33 0.52 0.00 -0.72 0.00 0.00 41.12 39.94 1fq9 n ASP 48 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1fq9 n PRO 49 N 2.32 0.37 -0.31 -0.67 -0.04 -1.26 -3.47 135.00 131.93 1fq9 n PRO 49 Ca 0.15 0.08 0.08 0.00 -0.04 0.00 0.00 63.50 63.77 1fq9 n PRO 49 Cb 0.27 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.39 1fq9 n PRO 49 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1fq9 n HIS 50 N -1.21 0.00 0.52 0.54 8.25 -1.26 -4.65 115.22 117.40 1fq9 n HIS 50 Ca 0.11 -1.14 0.07 0.00 -0.26 0.00 0.00 57.72 56.50 1fq9 n HIS 50 Cb 0.13 -0.18 0.07 0.00 1.12 0.00 0.00 29.99 31.13 1fq9 n HIS 50 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1fq9 n ILE 51 N -1.23 0.10 -2.71 1.59 -5.35 -1.23 -1.92 119.36 108.61 1fq9 n ILE 51 Ca 0.16 -0.55 -0.43 0.00 -0.27 0.00 0.00 62.75 61.67 1fq9 n ILE 51 Cb 0.67 1.22 -0.03 0.00 -1.74 0.00 0.00 39.64 39.76 1fq9 n ILE 51 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1fq9 s LYS 52 N -1.17 3.76 0.00 6.28 1.02 -1.26 -4.39 119.74 123.97 1fq9 s LYS 52 Ca 0.18 0.54 0.02 0.00 0.02 0.00 0.00 55.97 56.73 1fq9 s LYS 52 Cb 0.12 -3.86 -0.04 0.00 -0.52 0.00 0.00 37.83 33.54 1fq9 s LYS 52 CO 0.18 -1.17 -0.03 -0.51 -0.92 0.00 0.00 175.35 172.91 1fq9 s LEU 53 N 3.92 3.36 -0.44 3.17 1.43 0.65 -1.16 118.68 129.61 1fq9 s LEU 53 Ca 0.42 -0.07 -0.07 0.00 -1.03 0.00 0.00 54.13 53.38 1fq9 s LEU 53 Cb -0.10 -1.93 0.11 0.00 0.03 0.00 0.00 46.19 44.30 1fq9 s LEU 53 CO 0.25 0.28 0.28 -1.58 0.23 0.00 0.00 176.35 175.80 1fq9 s GLN 54 N -1.51 2.38 -0.11 1.70 2.00 0.11 -0.09 119.66 124.13 1fq9 s GLN 54 Ca 0.19 -1.69 -0.24 0.00 -2.00 0.00 0.00 55.36 51.62 1fq9 s GLN 54 Cb -0.11 -3.78 -0.03 0.00 0.80 0.00 0.00 33.01 29.89 1fq9 s GLN 54 CO 0.09 -1.09 0.73 -0.51 -0.50 0.00 0.00 175.29 174.01 1fq9 s LEU 55 N 1.31 4.26 0.03 3.68 1.43 -1.26 -2.07 118.68 126.07 1fq9 s LEU 55 Ca 0.05 1.15 0.07 0.00 -1.03 0.00 0.00 54.13 54.38 1fq9 s LEU 55 Cb -0.24 -3.11 -0.02 0.00 0.03 0.00 0.00 46.19 42.85 1fq9 s LEU 55 CO -0.01 -0.21 -0.22 -1.58 0.23 0.00 0.00 176.35 174.57 1fq9 s GLN 56 N 1.27 1.53 -0.00 1.70 2.00 -0.91 -4.97 119.66 120.27 1fq9 s GLN 56 Ca 0.37 -0.93 -0.16 0.00 -2.00 0.00 0.00 55.36 52.64 1fq9 s GLN 56 Cb -0.17 -1.62 -0.06 0.00 0.80 0.00 0.00 33.01 31.97 1fq9 s GLN 56 CO 0.16 0.42 0.44 0.00 -0.50 0.00 0.00 175.29 175.81 1fq9 s ALA 57 N -0.74 3.66 -0.69 1.58 0.00 -1.26 -0.37 121.76 123.94 1fq9 s ALA 57 Ca 0.08 -0.18 0.21 0.00 0.00 0.00 0.00 51.96 52.07 1fq9 s ALA 57 Cb -0.09 -2.45 -0.25 0.00 0.00 0.00 0.00 23.12 20.33 1fq9 s ALA 57 CO 0.01 0.41 0.75 -1.91 0.00 0.00 0.00 175.76 175.02 1fq9 n GLU 58 N 2.04 0.36 0.00 0.00 4.07 0.88 -4.91 120.64 123.08 1fq9 n GLU 58 Ca -0.13 -0.06 0.00 0.00 -0.06 0.00 0.00 57.16 56.92 1fq9 n GLU 58 Cb 0.52 -1.48 0.00 0.00 -0.06 0.00 0.00 31.44 30.42 1fq9 n GLU 58 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 1fq9 n GLU 59 N -1.70 0.00 -1.13 5.31 0.28 -1.19 -5.02 120.64 117.20 1fq9 n GLU 59 Ca 0.02 0.00 -0.46 0.00 -0.16 0.00 0.00 57.16 56.56 1fq9 n GLU 59 Cb 0.39 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 33.18 1fq9 n GLU 59 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 1fq9 n ARG 60 N -0.53 0.00 -0.84 3.44 0.63 -1.26 0.29 116.66 118.39 1fq9 n ARG 60 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1fq9 n ARG 60 Cb 0.00 -1.05 0.00 0.00 0.45 0.00 0.00 32.46 31.86 1fq9 n ARG 60 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1fq9 n GLY 61 N 3.48 0.58 3.18 5.14 0.00 -1.26 -4.99 105.19 111.32 1fq9 n GLY 61 Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.97 1fq9 n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fq9 s VAL 62 N -2.70 1.92 0.17 1.61 1.01 0.15 -1.29 120.40 121.27 1fq9 s VAL 62 Ca 0.00 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.11 1fq9 s VAL 62 Cb 0.00 -1.67 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 1fq9 s VAL 62 CO 0.00 0.53 -0.11 0.68 0.00 0.00 0.00 175.10 176.20 1fq9 s VAL 63 N 0.49 1.35 0.16 2.92 -7.23 0.06 -0.08 120.40 118.06 1fq9 s VAL 63 Ca -0.16 -2.11 0.06 0.00 -1.81 0.00 0.00 61.98 57.97 1fq9 s VAL 63 Cb -0.17 -1.96 -0.04 0.00 0.56 0.00 0.00 36.38 34.77 1fq9 s VAL 63 CO 0.06 -0.66 0.03 -0.94 -0.31 0.00 0.00 175.10 173.29 1fq9 s SER 64 N -3.23 5.00 -0.19 4.85 1.04 0.50 -1.06 113.70 120.60 1fq9 s SER 64 Ca 0.20 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.33 1fq9 s SER 64 Cb 0.02 -1.15 0.05 0.00 0.10 0.00 0.00 66.02 65.04 1fq9 s SER 64 CO 0.03 0.10 -0.06 -0.63 0.98 0.00 0.00 173.24 173.66 1fq9 s ILE 65 N -1.66 1.32 -0.17 -1.02 1.01 -1.26 -2.14 121.20 117.27 1fq9 s ILE 65 Ca 0.28 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 60.05 1fq9 s ILE 65 Cb -0.10 -1.51 -0.01 0.00 0.01 0.00 0.00 42.46 40.85 1fq9 s ILE 65 CO 0.20 0.07 -0.09 -0.75 0.00 0.00 0.00 174.94 174.36 1fq9 s LYS 66 N 1.53 3.38 -0.11 2.79 2.20 -0.88 -0.82 119.74 127.83 1fq9 s LYS 66 Ca -0.01 -0.66 -0.30 0.00 -0.36 0.00 0.00 55.97 54.64 1fq9 s LYS 66 Cb -0.16 -2.80 -0.03 0.00 -1.51 0.00 0.00 37.83 33.33 1fq9 s LYS 66 CO -0.07 0.03 1.37 0.20 -0.36 0.00 0.00 175.35 176.51 1fq9 s GLY 67 N 0.84 1.68 0.08 5.54 0.00 -0.26 0.06 107.32 115.27 1fq9 s GLY 67 Ca -0.03 0.63 -0.23 0.00 0.00 0.00 0.00 44.72 45.10 1fq9 s GLY 67 CO 0.01 2.61 1.70 -2.08 0.00 0.00 0.00 173.10 175.33 1fq9 h VAL 68 N 5.41 1.05 0.13 1.40 2.07 -1.46 0.10 116.25 124.95 1fq9 h VAL 68 Ca -0.31 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 1fq9 h VAL 68 Cb 1.13 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1fq9 h VAL 68 CO 0.95 0.04 -0.06 -1.28 0.02 0.00 0.00 177.57 177.24 1fq9 h SER 69 N -0.01 -0.14 0.69 0.57 0.87 -1.83 -3.11 113.55 110.59 1fq9 h SER 69 Ca 0.01 -0.30 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 1fq9 h SER 69 Cb 0.05 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1fq9 h SER 69 CO -0.00 0.24 0.00 0.00 -0.53 0.00 0.00 176.83 176.54 1fq9 h ALA 70 N 0.24 1.00 -6.44 6.23 0.00 -1.77 -3.47 119.26 115.05 1fq9 h ALA 70 Ca -0.02 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.41 1fq9 h ALA 70 Cb 0.44 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1fq9 h ALA 70 CO 0.03 0.00 -0.90 -1.71 0.00 0.00 0.00 179.25 176.67 1fq9 n ASN 71 N -2.58 -1.57 -4.14 0.00 5.15 0.02 -4.76 115.26 107.39 1fq9 n ASN 71 Ca 0.01 -1.01 -0.10 0.00 -0.60 0.00 0.00 54.58 52.87 1fq9 n ASN 71 Cb 0.22 -3.11 -0.10 0.00 -0.53 0.00 0.00 39.78 36.27 1fq9 n ASN 71 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1fq9 s ARG 72 N -6.44 1.01 -0.09 1.20 0.52 -1.20 -4.73 118.95 109.23 1fq9 s ARG 72 Ca 0.12 -1.45 0.02 0.00 -0.52 0.00 0.00 55.73 53.91 1fq9 s ARG 72 Cb -0.05 0.27 -0.02 0.00 0.52 0.00 0.00 34.95 35.67 1fq9 s ARG 72 CO 0.88 -0.31 -0.14 0.71 0.02 0.00 0.00 175.30 176.46 1fq9 s TYR 73 N -4.06 2.74 -0.11 -0.53 1.51 0.21 -1.10 117.35 116.01 1fq9 s TYR 73 Ca 0.26 -0.43 -0.29 0.00 -1.01 0.00 0.00 57.07 55.60 1fq9 s TYR 73 Cb 0.07 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 40.14 1fq9 s TYR 73 CO 0.04 -0.03 1.61 -1.17 -1.11 0.00 0.00 175.55 174.88 1fq9 s LEU 74 N -0.16 4.18 0.01 -1.29 2.96 0.00 -0.41 118.68 123.97 1fq9 s LEU 74 Ca -0.01 2.00 0.04 0.00 -0.22 0.00 0.00 54.13 55.94 1fq9 s LEU 74 Cb -0.13 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.01 1fq9 s LEU 74 CO 0.03 -1.01 -0.12 0.00 -1.32 0.00 0.00 176.35 173.94 1fq9 s ALA 75 N 4.34 0.95 -0.24 5.97 0.00 0.96 -4.39 121.76 129.35 1fq9 s ALA 75 Ca 0.71 -0.60 -0.06 0.00 0.00 0.00 0.00 51.96 52.01 1fq9 s ALA 75 Cb -0.30 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.62 1fq9 s ALA 75 CO 0.28 0.20 0.03 1.41 0.00 0.00 0.00 175.76 177.67 1fq9 s MET 76 N -0.65 3.49 0.89 0.00 1.75 -0.89 -2.08 119.30 121.80 1fq9 s MET 76 Ca 0.02 -0.57 -0.12 0.00 -1.25 0.00 0.00 55.69 53.77 1fq9 s MET 76 Cb -0.06 -3.21 0.13 0.00 2.84 0.00 0.00 34.83 34.53 1fq9 s MET 76 CO 0.00 -0.22 1.14 0.15 -0.65 0.00 0.00 175.02 175.45 1fq9 s LYS 77 N 1.55 1.31 0.42 4.11 -0.14 -0.41 -4.89 119.74 121.69 1fq9 s LYS 77 Ca 0.06 0.28 0.12 0.00 -1.36 0.00 0.00 55.97 55.06 1fq9 s LYS 77 Cb -0.15 -1.86 0.96 0.00 -1.68 0.00 0.00 37.83 35.11 1fq9 s LYS 77 CO 0.01 -2.08 1.98 1.05 -0.76 0.00 0.00 175.35 175.55 1fq9 h GLU 78 N -1.41 0.47 0.00 1.68 9.09 -1.99 0.47 114.58 122.88 1fq9 h GLU 78 Ca -0.50 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 58.88 1fq9 h GLU 78 Cb 1.33 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 28.32 1fq9 h GLU 78 CO 0.63 0.31 0.00 -0.40 0.05 0.00 0.00 179.01 179.60 1fq9 n ASP 79 N -4.48 0.00 0.00 3.06 3.85 -1.26 -4.88 116.55 112.85 1fq9 n ASP 79 Ca 0.10 0.40 0.00 0.00 -0.71 0.00 0.00 54.79 54.58 1fq9 n ASP 79 Cb 0.33 -0.46 0.00 0.00 -1.35 0.00 0.00 41.12 39.64 1fq9 n ASP 79 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1fq9 n GLY 80 N 0.78 0.93 3.89 6.12 0.00 0.16 -4.37 105.19 112.71 1fq9 n GLY 80 Ca 0.06 -0.32 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 1fq9 n GLY 80 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1fq9 s ARG 81 N -0.83 3.34 0.31 1.61 1.70 -1.25 0.13 118.95 123.96 1fq9 s ARG 81 Ca 0.00 -0.48 0.00 0.00 -0.47 0.00 0.00 55.73 54.78 1fq9 s ARG 81 Cb 0.00 -2.99 -0.04 0.00 -0.57 0.00 0.00 34.95 31.36 1fq9 s ARG 81 CO 0.00 0.60 0.51 -0.51 -1.08 0.00 0.00 175.30 174.82 1fq9 s LEU 82 N -2.48 4.08 -0.18 -1.89 1.43 -1.26 -1.28 118.68 117.09 1fq9 s LEU 82 Ca 0.34 0.43 -0.35 0.00 -1.03 0.00 0.00 54.13 53.51 1fq9 s LEU 82 Cb -0.13 -3.27 0.15 0.00 0.03 0.00 0.00 46.19 42.98 1fq9 s LEU 82 CO 0.27 -0.23 1.38 -1.48 0.23 0.00 0.00 176.35 176.52 1fq9 s LEU 83 N -4.07 -0.02 -0.20 1.79 0.05 -0.88 -4.65 118.68 110.69 1fq9 s LEU 83 Ca 0.39 -0.02 0.01 0.00 0.05 0.00 0.00 54.13 54.57 1fq9 s LEU 83 Cb -0.10 1.09 0.04 0.00 -2.05 0.00 0.00 46.19 45.17 1fq9 s LEU 83 CO 0.34 -0.06 -0.14 0.00 -0.55 0.00 0.00 176.35 175.94 1fq9 s ALA 84 N -2.10 2.19 0.61 1.48 0.00 -0.51 -0.03 121.76 123.40 1fq9 s ALA 84 Ca 0.13 -1.28 -0.15 0.00 0.00 0.00 0.00 51.96 50.66 1fq9 s ALA 84 Cb 0.03 -1.28 -0.03 0.00 0.00 0.00 0.00 23.12 21.84 1fq9 s ALA 84 CO -0.04 -0.71 1.06 0.45 0.00 0.00 0.00 175.76 176.52 1fq9 s SER 85 N 1.32 5.66 0.14 0.00 0.15 0.45 -4.49 113.70 116.93 1fq9 s SER 85 Ca -0.00 1.82 0.08 0.00 0.70 0.00 0.00 55.95 58.55 1fq9 s SER 85 Cb -0.16 -2.53 -0.15 0.00 -1.71 0.00 0.00 66.02 61.47 1fq9 s SER 85 CO -0.09 -1.25 1.31 0.50 1.20 0.00 0.00 173.24 174.91 1fq9 h LYS 86 N 0.27 0.00 -5.83 5.44 1.63 -1.89 0.60 116.57 116.79 1fq9 h LYS 86 Ca -0.46 0.00 -0.50 0.00 -0.85 0.00 0.00 60.65 58.84 1fq9 h LYS 86 Cb 1.22 0.00 -0.18 0.00 -0.60 0.00 0.00 32.23 32.67 1fq9 h LYS 86 CO 0.57 0.93 -0.78 -1.54 -3.45 0.00 0.00 179.45 175.18 1fq9 s SER 87 N -6.69 2.52 0.45 4.20 1.04 -1.26 -4.77 113.70 109.19 1fq9 s SER 87 Ca 0.01 -0.84 -0.23 0.00 0.48 0.00 0.00 55.95 55.37 1fq9 s SER 87 Cb 0.10 -0.14 -0.08 0.00 0.10 0.00 0.00 66.02 66.00 1fq9 s SER 87 CO 0.81 -0.05 1.15 -0.69 0.98 0.00 0.00 173.24 175.43 1fq9 s VAL 88 N -2.03 3.21 0.14 5.02 1.01 -1.26 -4.85 120.40 121.64 1fq9 s VAL 88 Ca 0.14 0.92 -0.06 0.00 0.00 0.00 0.00 61.98 62.98 1fq9 s VAL 88 Cb -0.06 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 1fq9 s VAL 88 CO 0.06 -0.00 0.18 0.42 0.00 0.00 0.00 175.10 175.75 1fq9 s THR 89 N -1.56 0.10 -1.39 3.92 -4.23 -1.26 -5.02 115.64 106.20 1fq9 s THR 89 Ca 0.62 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 1fq9 s THR 89 Cb -0.28 -1.82 0.00 0.00 1.34 0.00 0.00 72.50 71.74 1fq9 s THR 89 CO 0.34 -0.45 0.72 -0.90 -0.54 0.00 0.00 174.62 173.79 1fq9 n ASP 90 N -0.13 0.00 -1.20 3.99 5.75 -1.26 -0.93 116.55 122.78 1fq9 n ASP 90 Ca -0.08 0.24 0.12 0.00 -0.01 0.00 0.00 54.79 55.05 1fq9 n ASP 90 Cb 0.63 -0.24 0.26 0.00 -1.03 0.00 0.00 41.12 40.74 1fq9 n ASP 90 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1fq9 n GLU 91 N -1.22 2.54 -0.51 0.11 1.02 -1.26 -4.13 120.64 117.19 1fq9 n GLU 91 Ca 0.00 -2.35 0.09 0.00 -0.02 0.00 0.00 57.16 54.88 1fq9 n GLU 91 Cb 0.02 -1.53 0.31 0.00 -0.02 0.00 0.00 31.44 30.22 1fq9 n GLU 91 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1fq9 s PHE 93 N -1.82 2.76 0.09 0.00 0.08 -1.26 -4.09 117.98 113.74 1fq9 s PHE 93 Ca 0.45 -0.54 0.03 0.00 0.12 0.00 0.00 56.93 56.99 1fq9 s PHE 93 Cb 0.29 -1.77 -0.04 0.00 -0.57 0.00 0.00 43.02 40.93 1fq9 s PHE 93 CO 0.21 -0.12 -0.10 -0.06 -0.10 0.00 0.00 175.22 175.05 1fq9 s PHE 94 N 0.06 1.02 -0.48 0.36 0.08 -0.23 -1.63 117.98 117.16 1fq9 s PHE 94 Ca -0.05 -0.66 -0.23 0.00 0.12 0.00 0.00 56.93 56.10 1fq9 s PHE 94 Cb -0.15 -0.56 0.03 0.00 -0.57 0.00 0.00 43.02 41.77 1fq9 s PHE 94 CO 0.04 -0.02 0.84 -0.06 -0.10 0.00 0.00 175.22 175.93 1fq9 s PHE 95 N -2.42 2.93 -0.16 0.36 0.40 0.19 -0.76 117.98 118.52 1fq9 s PHE 95 Ca 0.05 0.10 -0.27 0.00 -0.60 0.00 0.00 56.93 56.21 1fq9 s PHE 95 Cb -0.03 -3.82 -0.01 0.00 0.51 0.00 0.00 43.02 39.67 1fq9 s PHE 95 CO -0.00 -1.11 0.89 -2.00 0.70 0.00 0.00 175.22 173.70 1fq9 s GLU 96 N 3.50 4.32 -0.05 0.44 2.12 -0.41 -2.52 118.70 126.10 1fq9 s GLU 96 Ca 0.30 1.14 0.01 0.00 0.36 0.00 0.00 54.97 56.78 1fq9 s GLU 96 Cb -0.12 -3.57 0.02 0.00 0.26 0.00 0.00 34.13 30.72 1fq9 s GLU 96 CO 0.22 -0.35 -0.06 0.50 -0.54 0.00 0.00 175.26 175.03 1fq9 s ARG 97 N 2.20 1.02 -0.64 4.30 3.52 -0.81 -4.82 118.95 123.73 1fq9 s ARG 97 Ca 0.41 -0.16 -0.23 0.00 -0.13 0.00 0.00 55.73 55.62 1fq9 s ARG 97 Cb -0.17 -0.98 0.06 0.00 -1.56 0.00 0.00 34.95 32.30 1fq9 s ARG 97 CO 0.13 -0.07 0.98 -1.17 -0.81 0.00 0.00 175.30 174.36 1fq9 s LEU 98 N 0.93 4.21 1.02 -0.88 2.96 -1.26 -1.51 118.68 124.16 1fq9 s LEU 98 Ca -0.11 -0.78 -0.12 0.00 -0.22 0.00 0.00 54.13 52.90 1fq9 s LEU 98 Cb -0.14 -2.53 0.20 0.00 0.50 0.00 0.00 46.19 44.21 1fq9 s LEU 98 CO 0.00 -1.42 1.08 -1.61 -1.32 0.00 0.00 176.35 173.08 1fq9 s GLU 99 N 4.16 0.27 0.47 1.98 0.41 -0.16 -4.89 118.70 120.94 1fq9 s GLU 99 Ca 0.25 0.84 0.32 0.00 -0.41 0.00 0.00 54.97 55.97 1fq9 s GLU 99 Cb -0.15 -1.69 1.58 0.00 -1.78 0.00 0.00 34.13 32.09 1fq9 s GLU 99 CO 0.13 -2.92 1.96 0.66 -0.49 0.00 0.00 175.26 174.60 1fq9 h SER 100 N -2.05 0.00 -0.63 -0.19 4.64 -1.95 -1.78 113.55 111.59 1fq9 h SER 100 Ca -0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.78 1fq9 h SER 100 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1fq9 h SER 100 CO 0.52 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.02 1fq9 n ASN 101 N -2.68 3.52 -0.10 4.97 0.23 -1.26 -4.94 115.26 114.99 1fq9 n ASN 101 Ca -0.01 -2.05 -0.01 0.00 -0.53 0.00 0.00 54.58 51.98 1fq9 n ASN 101 Cb 0.14 -0.44 -0.01 0.00 -2.08 0.00 0.00 39.78 37.39 1fq9 n ASN 101 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1fq9 n ASN 102 N 1.32 -3.33 -4.79 0.53 3.02 -0.67 -5.04 115.26 106.29 1fq9 n ASN 102 Ca 0.22 0.03 -0.22 0.00 -0.03 0.00 0.00 54.58 54.58 1fq9 n ASN 102 Cb 0.57 -0.95 -0.05 0.00 -0.61 0.00 0.00 39.78 38.74 1fq9 n ASN 102 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1fq9 s TYR 103 N -1.99 2.76 0.18 3.10 2.02 -1.26 -4.90 117.35 117.25 1fq9 s TYR 103 Ca 0.00 -0.40 0.06 0.00 -0.37 0.00 0.00 57.07 56.37 1fq9 s TYR 103 Cb 0.00 -1.81 -0.04 0.00 -0.40 0.00 0.00 41.96 39.71 1fq9 s TYR 103 CO 0.00 0.20 0.09 -0.80 -1.57 0.00 0.00 175.55 173.46 1fq9 s ASN 104 N -3.95 5.21 -0.04 2.29 -0.87 0.46 -0.99 114.94 117.04 1fq9 s ASN 104 Ca 0.41 -0.26 0.02 0.00 -1.57 0.00 0.00 52.86 51.45 1fq9 s ASN 104 Cb -0.03 -1.26 0.02 0.00 -0.02 0.00 0.00 41.25 39.96 1fq9 s ASN 104 CO 0.25 0.06 -0.07 0.42 -2.57 0.00 0.00 177.10 175.19 1fq9 s THR 105 N -1.81 0.73 -0.56 1.60 -4.23 -0.57 -0.01 115.64 110.79 1fq9 s THR 105 Ca 0.30 -0.26 -0.05 0.00 -1.18 0.00 0.00 61.69 60.50 1fq9 s THR 105 Cb -0.09 -0.70 0.14 0.00 1.34 0.00 0.00 72.50 73.19 1fq9 s THR 105 CO 0.22 0.26 0.39 -0.31 -0.54 0.00 0.00 174.62 174.63 1fq9 s TYR 106 N 0.69 3.49 -0.19 3.99 2.02 -1.26 -1.92 117.35 124.17 1fq9 s TYR 106 Ca -0.11 -2.42 -0.18 0.00 -0.37 0.00 0.00 57.07 54.00 1fq9 s TYR 106 Cb -0.14 -3.32 -0.04 0.00 -0.40 0.00 0.00 41.96 38.07 1fq9 s TYR 106 CO 0.01 -0.92 0.48 0.50 -1.57 0.00 0.00 175.55 174.06 1fq9 s ARG 107 N 0.55 4.21 -0.01 -0.62 3.52 -1.05 -0.84 118.95 124.71 1fq9 s ARG 107 Ca 0.13 0.37 -0.33 0.00 -0.13 0.00 0.00 55.73 55.76 1fq9 s ARG 107 Cb -0.21 -3.54 -0.11 0.00 -1.56 0.00 0.00 34.95 29.53 1fq9 s ARG 107 CO -0.04 -0.08 1.88 0.45 -0.81 0.00 0.00 175.30 176.71 1fq9 n SER 108 N 4.54 3.69 0.24 -2.12 2.88 -0.22 0.55 113.62 123.18 1fq9 n SER 108 Ca -0.06 0.96 0.09 0.00 -1.33 0.00 0.00 58.87 58.54 1fq9 n SER 108 Cb 0.51 -1.44 0.59 0.00 -0.75 0.00 0.00 64.21 63.12 1fq9 n SER 108 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1fq9 h ARG 109 N 9.26 0.00 0.00 -1.46 2.43 -1.63 -1.83 114.38 121.14 1fq9 h ARG 109 Ca -0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1fq9 h ARG 109 Cb 1.26 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 1fq9 h ARG 109 CO 0.94 0.19 -0.03 -0.22 -1.51 0.00 0.00 179.97 179.34 1fq9 h LYS 110 N 0.00 0.00 -2.39 0.20 3.64 -1.82 -3.35 116.57 112.84 1fq9 h LYS 110 Ca -0.00 0.00 -0.75 0.00 -1.27 0.00 0.00 60.65 58.63 1fq9 h LYS 110 Cb 0.44 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 32.07 1fq9 h LYS 110 CO 0.03 0.00 1.67 0.66 -2.27 0.00 0.00 179.45 179.53 1fq9 n TYR 111 N -4.59 2.59 0.00 1.91 4.01 -1.22 -4.88 117.16 114.99 1fq9 n TYR 111 Ca -0.00 -2.62 0.00 0.00 -0.16 0.00 0.00 57.90 55.11 1fq9 n TYR 111 Cb 0.02 -1.53 0.00 0.00 -0.31 0.00 0.00 39.34 37.52 1fq9 n TYR 111 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1fq9 n THR 112 N 0.87 0.00 0.24 -0.72 -2.24 -0.69 -0.68 114.28 111.07 1fq9 n THR 112 Ca 0.55 0.15 0.04 0.00 -2.27 0.00 0.00 64.05 62.52 1fq9 n THR 112 Cb 0.28 -0.56 0.04 0.00 -2.10 0.00 0.00 70.33 67.99 1fq9 n THR 112 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1fq9 n SER 113 N -0.36 1.81 -4.57 3.42 3.41 -1.26 -4.86 113.62 111.22 1fq9 n SER 113 Ca 0.00 -1.44 -0.30 0.00 -0.26 0.00 0.00 58.87 56.87 1fq9 n SER 113 Cb 0.15 -0.03 -0.10 0.00 -0.26 0.00 0.00 64.21 63.97 1fq9 n SER 113 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1fq9 s TRP 114 N -0.70 2.73 0.36 7.33 0.51 0.15 -4.81 118.94 124.50 1fq9 s TRP 114 Ca 0.10 -0.16 0.09 0.00 -2.12 0.00 0.00 56.10 54.01 1fq9 s TRP 114 Cb 0.07 -1.45 -0.06 0.00 -0.81 0.00 0.00 33.47 31.22 1fq9 s TRP 114 CO 0.10 0.41 -0.02 0.71 -0.51 0.00 0.00 176.95 177.64 1fq9 s TYR 115 N -1.17 2.49 -0.03 -1.98 1.51 -1.26 -1.06 117.35 115.86 1fq9 s TYR 115 Ca 0.20 -0.50 -0.23 0.00 -1.01 0.00 0.00 57.07 55.53 1fq9 s TYR 115 Cb -0.11 -1.52 -0.04 0.00 -0.11 0.00 0.00 41.96 40.18 1fq9 s TYR 115 CO 0.12 0.50 0.70 0.08 -1.11 0.00 0.00 175.55 175.84 1fq9 s VAL 116 N -2.58 4.94 0.17 0.71 1.01 -0.02 -4.47 120.40 120.16 1fq9 s VAL 116 Ca 0.34 1.47 -0.18 0.00 0.00 0.00 0.00 61.98 63.61 1fq9 s VAL 116 Cb 0.02 -4.05 0.04 0.00 0.00 0.00 0.00 36.38 32.40 1fq9 s VAL 116 CO 0.18 0.30 0.50 0.00 0.00 0.00 0.00 175.10 176.08 1fq9 s ALA 117 N 0.43 -1.03 0.03 5.51 0.00 -1.26 -4.48 121.76 120.96 1fq9 s ALA 117 Ca 0.37 -0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.32 1fq9 s ALA 117 Cb -0.19 0.81 -0.02 0.00 0.00 0.00 0.00 23.12 23.72 1fq9 s ALA 117 CO 0.19 -0.75 -0.18 -0.51 0.00 0.00 0.00 175.76 174.51 1fq9 s LEU 118 N -2.83 2.13 0.74 0.00 1.43 -1.07 -1.57 118.68 117.51 1fq9 s LEU 118 Ca 0.06 -0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 52.60 1fq9 s LEU 118 Cb -0.00 -0.85 0.04 0.00 0.03 0.00 0.00 46.19 45.41 1fq9 s LEU 118 CO -0.07 0.14 1.10 -0.54 0.23 0.00 0.00 176.35 177.21 1fq9 s LYS 119 N -0.97 2.54 0.00 1.70 1.02 0.28 -4.53 119.74 119.78 1fq9 s LYS 119 Ca 0.06 0.51 0.00 0.00 0.02 0.00 0.00 55.97 56.56 1fq9 s LYS 119 Cb -0.08 -1.98 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 1fq9 s LYS 119 CO 0.01 -1.27 0.66 2.89 -0.92 0.00 0.00 175.35 176.73 1fq9 n ARG 120 N -3.17 0.79 -0.05 1.68 0.00 -1.26 -2.14 116.66 112.51 1fq9 n ARG 120 Ca 0.07 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 57.97 1fq9 n ARG 120 Cb 0.57 -1.13 0.07 0.00 -0.00 0.00 0.00 32.46 31.97 1fq9 n ARG 120 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1fq9 n THR 121 N -0.31 0.31 -0.51 8.89 -2.24 -1.26 -4.90 114.28 114.26 1fq9 n THR 121 Ca 0.00 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 1fq9 n THR 121 Cb 0.06 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 1fq9 n THR 121 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fq9 n GLY 122 N 0.47 0.75 3.59 3.38 0.00 -0.91 -5.01 105.19 107.47 1fq9 n GLY 122 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 1fq9 n GLY 122 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fq9 s GLN 123 N -0.49 2.14 1.32 1.61 -0.21 -1.26 0.07 119.66 122.84 1fq9 s GLN 123 Ca 0.00 -1.28 -0.22 0.00 0.02 0.00 0.00 55.36 53.88 1fq9 s GLN 123 Cb 0.00 -2.18 0.33 0.00 1.00 0.00 0.00 33.01 32.16 1fq9 s GLN 123 CO 0.00 0.42 1.03 1.52 -2.12 0.00 0.00 175.29 176.14 1fq9 s TYR 124 N -1.83 -0.18 -0.07 0.91 -0.85 -1.26 0.99 117.35 115.06 1fq9 s TYR 124 Ca 0.26 0.48 0.02 0.00 -0.52 0.00 0.00 57.07 57.32 1fq9 s TYR 124 Cb -0.08 -3.22 0.01 0.00 0.38 0.00 0.00 41.96 39.05 1fq9 s TYR 124 CO 0.16 -4.47 -0.13 0.21 -1.52 0.00 0.00 175.55 169.80 1fq9 s LYS 125 N -5.31 1.79 -0.02 -3.49 2.20 -0.61 -4.18 119.74 110.12 1fq9 s LYS 125 Ca 0.70 -0.44 -0.36 0.00 -0.36 0.00 0.00 55.97 55.51 1fq9 s LYS 125 Cb -0.10 -1.47 -0.15 0.00 -1.51 0.00 0.00 37.83 34.60 1fq9 s LYS 125 CO 0.57 0.03 1.62 1.28 -0.36 0.00 0.00 175.35 178.48 1fq9 n LEU 126 N 3.83 2.60 -0.34 5.43 4.77 -1.26 -4.49 117.00 127.54 1fq9 n LEU 126 Ca -0.22 1.07 0.18 0.00 -0.03 0.00 0.00 56.01 57.00 1fq9 n LEU 126 Cb 0.52 -1.28 0.39 0.00 -2.33 0.00 0.00 43.42 40.72 1fq9 n LEU 126 CO 0.25 -0.48 1.16 1.23 -1.33 0.00 0.00 177.39 178.22 1fq9 h GLY 127 N 6.60 1.91 1.81 -0.72 0.00 0.89 1.25 103.07 114.81 1fq9 h GLY 127 Ca -0.47 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.55 1fq9 h GLY 127 CO 0.89 -0.25 0.04 -1.14 0.00 0.00 0.00 176.54 176.07 1fq9 n SER 128 N -4.89 0.00 -0.23 0.19 3.41 -1.26 -0.04 113.62 110.80 1fq9 n SER 128 Ca 0.27 0.44 0.02 0.00 -0.26 0.00 0.00 58.87 59.35 1fq9 n SER 128 Cb 0.76 -0.44 0.04 0.00 -0.26 0.00 0.00 64.21 64.31 1fq9 n SER 128 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1fq9 n LYS 129 N -1.44 1.06 -3.26 4.33 5.02 0.43 -5.03 118.16 119.26 1fq9 n LYS 129 Ca 0.00 -1.19 -0.32 0.00 -2.02 0.00 0.00 58.31 54.78 1fq9 n LYS 129 Cb 0.04 -1.11 -0.05 0.00 -0.02 0.00 0.00 35.03 33.89 1fq9 n LYS 129 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1fq9 s THR 130 N -0.66 4.84 -0.05 -0.18 -4.23 0.94 -4.97 115.64 111.33 1fq9 s THR 130 Ca 0.08 0.63 -0.30 0.00 -1.18 0.00 0.00 61.69 60.91 1fq9 s THR 130 Cb 0.05 -3.63 0.08 0.00 1.34 0.00 0.00 72.50 70.33 1fq9 s THR 130 CO 0.07 -0.17 0.70 -0.83 -0.54 0.00 0.00 174.62 173.85 1fq9 s GLY 131 N -2.45 -0.55 0.27 3.99 0.00 -1.26 -4.78 107.32 102.53 1fq9 s GLY 131 Ca 0.50 1.33 0.03 0.00 0.00 0.00 0.00 44.72 46.58 1fq9 s GLY 131 CO 0.21 0.92 1.34 -1.05 0.00 0.00 0.00 173.10 174.52 1fq9 n PRO 132 N 0.81 -0.07 0.00 2.90 -0.02 -1.26 -0.42 135.00 136.95 1fq9 n PRO 132 Ca -0.18 1.28 0.15 0.00 -2.02 0.00 0.00 63.50 62.72 1fq9 n PRO 132 Cb 0.58 -2.05 0.76 0.00 -0.02 0.00 0.00 33.50 32.77 1fq9 n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fq9 n GLY 133 N -1.42 -1.22 3.81 -1.23 0.00 -1.26 -4.92 105.19 98.96 1fq9 n GLY 133 Ca 0.21 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1fq9 n GLY 133 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fq9 s GLN 134 N -2.50 3.96 0.25 1.61 -0.21 0.44 -4.98 119.66 118.24 1fq9 s GLN 134 Ca 0.30 1.27 0.19 0.00 0.02 0.00 0.00 55.36 57.14 1fq9 s GLN 134 Cb 0.20 -2.13 0.07 0.00 1.00 0.00 0.00 33.01 32.16 1fq9 s GLN 134 CO 0.44 -0.28 1.26 0.87 -2.12 0.00 0.00 175.29 175.45 1fq9 h LYS 135 N 1.67 0.00 -0.12 2.91 1.57 -1.91 -3.33 116.57 117.37 1fq9 h LYS 135 Ca -0.49 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.26 1fq9 h LYS 135 Cb 1.20 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 1fq9 h LYS 135 CO 0.60 0.23 -0.04 0.00 -0.57 0.00 0.00 179.45 179.66 1fq9 h ALA 136 N 1.71 1.72 0.00 3.86 0.00 -1.94 -2.96 119.26 121.65 1fq9 h ALA 136 Ca -0.04 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1fq9 h ALA 136 Cb 1.25 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1fq9 h ALA 136 CO 0.03 0.21 -0.25 -0.84 0.00 0.00 0.00 179.25 178.40 1fq9 h ILE 137 N 0.17 0.00 -3.08 0.00 3.07 -1.79 -2.84 117.51 113.05 1fq9 h ILE 137 Ca 0.04 -0.81 -0.54 0.00 1.55 0.00 0.00 64.86 65.09 1fq9 h ILE 137 Cb 0.19 1.67 -0.01 0.00 -0.27 0.00 0.00 36.82 38.40 1fq9 h ILE 137 CO 0.01 0.00 0.68 -0.76 -1.05 0.00 0.00 178.15 177.03 1fq9 s LEU 138 N -5.42 4.32 0.05 0.16 1.43 -1.12 -4.44 118.68 113.66 1fq9 s LEU 138 Ca 0.06 1.98 0.05 0.00 -1.03 0.00 0.00 54.13 55.20 1fq9 s LEU 138 Cb 0.09 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.71 1fq9 s LEU 138 CO 0.68 -0.58 -0.15 -0.36 0.23 0.00 0.00 176.35 176.17 1fq9 s PHE 139 N 1.80 1.34 -0.27 0.29 0.40 0.98 -0.92 117.98 121.61 1fq9 s PHE 139 Ca 0.59 -0.38 -0.00 0.00 -0.60 0.00 0.00 56.93 56.54 1fq9 s PHE 139 Cb -0.28 -0.78 0.05 0.00 0.51 0.00 0.00 43.02 42.51 1fq9 s PHE 139 CO 0.26 0.06 -0.06 -1.17 0.70 0.00 0.00 175.22 175.01 1fq9 s LEU 140 N -1.34 3.55 0.24 -0.37 2.96 0.90 0.17 118.68 124.79 1fq9 s LEU 140 Ca 0.02 -1.22 -0.30 0.00 -0.22 0.00 0.00 54.13 52.42 1fq9 s LEU 140 Cb -0.09 -1.64 -0.09 0.00 0.50 0.00 0.00 46.19 44.87 1fq9 s LEU 140 CO 0.02 -0.20 1.23 -2.16 -1.32 0.00 0.00 176.35 173.91 1fq9 s PRO 141 N 1.22 4.47 -0.01 0.98 0.04 -1.26 -1.72 135.00 138.72 1fq9 s PRO 141 Ca -0.05 1.97 0.03 0.00 0.04 0.00 0.00 61.00 62.99 1fq9 s PRO 141 Cb -0.19 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.16 1fq9 s PRO 141 CO -0.03 -0.08 -0.10 -1.64 0.04 0.00 0.00 177.00 175.19 1fq9 s MET 142 N -0.80 0.77 0.96 4.56 -1.94 0.11 -4.95 119.30 118.01 1fq9 s MET 142 Ca 0.51 -0.35 -0.12 0.00 -1.71 0.00 0.00 55.69 54.02 1fq9 s MET 142 Cb -0.35 -0.75 0.11 0.00 2.01 0.00 0.00 34.83 35.85 1fq9 s MET 142 CO 0.41 0.20 0.76 -1.13 -0.01 0.00 0.00 175.02 175.25 1fq9 n SER 143 N 2.81 -0.99 0.00 3.03 3.41 -1.26 -0.22 113.62 120.40 1fq9 n SER 143 Ca -0.14 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 1fq9 n SER 143 Cb 0.57 -1.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.20 1fq9 n SER 143 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88