#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 -2.97 116.94 108.40 1fq9 h PHE 17 Ca 0.00 0.00 -0.18 0.00 -0.20 0.00 0.00 57.97 57.59 1fq9 h PHE 17 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 36.14 1fq9 h PHE 17 CO 0.00 0.14 -1.12 0.87 -2.00 0.00 0.00 178.31 176.20 1fq9 h LYS 18 N 0.00 0.00 -7.28 6.09 1.79 -2.04 -3.47 116.57 111.67 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 0.36 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 31.09 1fq9 h LYS 18 CO 0.02 0.51 0.37 -0.51 -1.08 0.00 0.00 179.45 178.76 1fq9 s ASP 19 N -6.20 5.57 0.93 0.86 1.01 -1.12 -5.02 116.67 112.70 1fq9 s ASP 19 Ca -0.00 1.70 -0.12 0.00 0.71 0.00 0.00 52.55 54.84 1fq9 s ASP 19 Cb 0.08 -2.51 0.15 0.00 1.01 0.00 0.00 42.92 41.65 1fq9 s ASP 19 CO 0.80 -1.31 1.09 -2.84 0.21 0.00 0.00 175.17 173.12 1fq9 s PRO 20 N -4.62 0.98 0.10 8.23 0.02 -1.26 -4.82 135.00 133.63 1fq9 s PRO 20 Ca 0.60 0.70 -0.00 0.00 0.02 0.00 0.00 61.00 62.33 1fq9 s PRO 20 Cb -0.15 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 32.55 1fq9 s PRO 20 CO 0.47 -2.40 -0.00 0.15 -0.33 0.00 0.00 177.00 174.89 1fq9 s LYS 21 N -4.95 0.83 -0.01 5.54 1.02 0.67 -2.85 119.74 119.98 1fq9 s LYS 21 Ca 0.64 -1.36 0.04 0.00 0.02 0.00 0.00 55.97 55.31 1fq9 s LYS 21 Cb -0.18 0.08 -0.03 0.00 -0.52 0.00 0.00 37.83 37.18 1fq9 s LYS 21 CO 0.57 -0.15 -0.11 1.03 -0.92 0.00 0.00 175.35 175.77 1fq9 s ARG 22 N -3.95 2.46 -0.48 1.68 0.52 0.81 -0.30 118.95 119.69 1fq9 s ARG 22 Ca 0.16 -0.75 -0.07 0.00 -0.52 0.00 0.00 55.73 54.55 1fq9 s ARG 22 Cb 0.07 -2.41 0.12 0.00 0.52 0.00 0.00 34.95 33.25 1fq9 s ARG 22 CO -0.03 0.60 0.33 -0.51 0.02 0.00 0.00 175.30 175.71 1fq9 s LEU 23 N -1.19 5.56 -0.44 2.53 1.43 -1.26 -0.85 118.68 124.45 1fq9 s LEU 23 Ca 0.15 -2.07 -0.27 0.00 -1.03 0.00 0.00 54.13 50.91 1fq9 s LEU 23 Cb -0.11 -1.95 0.02 0.00 0.03 0.00 0.00 46.19 44.19 1fq9 s LEU 23 CO 0.05 -0.61 0.99 -0.47 0.23 0.00 0.00 176.35 176.53 1fq9 s TYR 24 N 1.11 2.93 -0.04 0.29 6.14 -0.67 -0.56 117.35 126.56 1fq9 s TYR 24 Ca 0.08 0.58 -0.30 0.00 0.64 0.00 0.00 57.07 58.08 1fq9 s TYR 24 Cb -0.24 -4.02 -0.02 0.00 0.42 0.00 0.00 41.96 38.10 1fq9 s TYR 24 CO -0.02 -1.08 0.98 0.00 0.64 0.00 0.00 175.55 176.07 1fq9 h LYS 26 N 6.91 0.10 -5.58 0.00 3.64 -1.27 -2.17 116.57 118.21 1fq9 h LYS 26 Ca -0.37 -0.01 -0.57 0.00 -1.27 0.00 0.00 60.65 58.43 1fq9 h LYS 26 Cb 1.19 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.93 1fq9 h LYS 26 CO 0.79 0.07 1.90 -1.71 -2.27 0.00 0.00 179.45 178.22 1fq9 n ASN 27 N -4.38 4.19 0.00 4.20 5.15 -1.21 -3.88 115.26 119.33 1fq9 n ASN 27 Ca 0.13 -2.84 0.00 0.00 -0.60 0.00 0.00 54.58 51.28 1fq9 n ASN 27 Cb 0.69 -1.72 0.00 0.00 -0.53 0.00 0.00 39.78 38.21 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 5.42 0.52 2.18 8.20 0.00 -1.26 -4.26 105.19 116.00 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 0.41 3.74 -0.02 0.00 -0.82 -4.98 105.19 101.52 1fq9 n GLY 29 Ca 0.00 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.35 3.66 0.05 1.61 0.40 -1.22 -4.43 117.98 115.71 1fq9 s PHE 30 Ca 0.00 1.27 -0.24 0.00 -0.60 0.00 0.00 56.93 57.36 1fq9 s PHE 30 Cb 0.00 -2.72 -0.06 0.00 0.51 0.00 0.00 43.02 40.75 1fq9 s PHE 30 CO 0.00 0.25 0.74 -0.06 0.70 0.00 0.00 175.22 176.85 1fq9 s PHE 31 N 0.15 3.75 0.11 0.36 0.08 0.92 -0.50 117.98 122.86 1fq9 s PHE 31 Ca 0.35 1.46 -0.31 0.00 0.12 0.00 0.00 56.93 58.54 1fq9 s PHE 31 Cb -0.19 -2.79 -0.09 0.00 -0.57 0.00 0.00 43.02 39.39 1fq9 s PHE 31 CO 0.19 0.31 1.60 -1.17 -0.10 0.00 0.00 175.22 176.06 1fq9 s LEU 32 N -0.21 4.37 -0.00 -0.37 2.96 0.27 -1.46 118.68 124.23 1fq9 s LEU 32 Ca 0.37 2.54 0.05 0.00 -0.22 0.00 0.00 54.13 56.87 1fq9 s LEU 32 Cb -0.20 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 42.89 1fq9 s LEU 32 CO 0.23 -0.85 -0.16 -0.60 -1.32 0.00 0.00 176.35 173.65 1fq9 s ARG 33 N 1.92 1.23 -0.25 1.98 3.52 0.74 -4.59 118.95 123.50 1fq9 s ARG 33 Ca 0.72 -0.59 -0.02 0.00 -0.13 0.00 0.00 55.73 55.71 1fq9 s ARG 33 Cb -0.41 -1.20 0.02 0.00 -1.56 0.00 0.00 34.95 31.79 1fq9 s ARG 33 CO 0.32 0.33 -0.05 0.42 -0.81 0.00 0.00 175.30 175.50 1fq9 s ILE 34 N -0.42 3.00 0.49 4.11 -1.09 -0.75 -2.17 121.20 124.37 1fq9 s ILE 34 Ca 0.06 -0.94 -0.19 0.00 -2.23 0.00 0.00 60.65 57.35 1fq9 s ILE 34 Cb -0.06 -2.50 -0.08 0.00 -1.58 0.00 0.00 42.46 38.23 1fq9 s ILE 34 CO -0.00 0.22 1.00 -1.00 -1.23 0.00 0.00 174.94 173.93 1fq9 s HIS 35 N 1.35 3.22 0.54 3.97 3.76 -0.32 -4.44 115.29 123.38 1fq9 s HIS 35 Ca 0.01 1.55 0.36 0.00 -0.15 0.00 0.00 55.06 56.83 1fq9 s HIS 35 Cb -0.16 -2.91 1.96 0.00 1.11 0.00 0.00 32.58 32.58 1fq9 s HIS 35 CO -0.04 -0.53 2.24 -1.35 -0.85 0.00 0.00 174.74 174.22 1fq9 h PRO 36 N 1.30 0.00 -0.00 8.40 0.11 -1.88 -1.42 132.00 138.50 1fq9 h PRO 36 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1fq9 h PRO 36 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1fq9 h PRO 36 CO 0.60 0.02 -0.12 -0.40 -0.21 0.00 0.00 178.00 177.89 1fq9 n ASP 37 N -3.41 0.41 0.00 -2.05 5.68 -1.26 -4.93 116.55 111.00 1fq9 n ASP 37 Ca -0.02 -0.44 0.00 0.00 -0.50 0.00 0.00 54.79 53.82 1fq9 n ASP 37 Cb 0.13 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 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 1.31 1.42 3.76 6.12 0.00 -0.54 -4.98 105.19 112.29 1fq9 n GLY 38 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.72 3.33 -0.06 1.61 0.52 -1.26 -1.25 118.95 121.12 1fq9 s ARG 39 Ca 0.00 1.90 0.02 0.00 -0.52 0.00 0.00 55.73 57.13 1fq9 s ARG 39 Cb 0.00 -2.19 0.01 0.00 0.52 0.00 0.00 34.95 33.29 1fq9 s ARG 39 CO 0.00 -0.94 -0.10 0.08 0.02 0.00 0.00 175.30 174.35 1fq9 s VAL 40 N -1.51 0.98 0.00 3.52 1.01 -1.26 -1.17 120.40 121.97 1fq9 s VAL 40 Ca 0.71 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.29 1fq9 s VAL 40 Cb -0.32 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.15 1fq9 s VAL 40 CO 0.37 0.32 0.00 -0.90 0.00 0.00 0.00 175.10 174.89 1fq9 n ASP 41 N 3.82 0.00 -4.28 3.32 3.85 -0.92 -4.35 116.55 117.99 1fq9 n ASP 41 Ca -0.23 -0.05 -0.18 0.00 -0.71 0.00 0.00 54.79 53.61 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 -0.20 1.19 -0.06 6.12 0.00 0.83 -0.19 107.32 115.02 1fq9 s GLY 42 Ca 0.00 -1.40 -0.04 0.00 0.00 0.00 0.00 44.72 43.28 1fq9 s GLY 42 CO 0.00 -1.47 0.14 -1.34 0.00 0.00 0.00 173.10 170.43 1fq9 s VAL 43 N -2.35 -0.02 -0.05 1.40 -7.23 -0.54 -4.78 120.40 106.83 1fq9 s VAL 43 Ca 0.13 0.08 0.15 0.00 -1.81 0.00 0.00 61.98 60.53 1fq9 s VAL 43 Cb -0.04 -0.21 0.05 0.00 0.56 0.00 0.00 36.38 36.74 1fq9 s VAL 43 CO 0.04 0.03 1.49 0.03 -0.31 0.00 0.00 175.10 176.38 1fq9 h ARG 44 N 6.52 0.00 -6.20 4.82 3.08 -1.87 0.26 114.38 120.99 1fq9 h ARG 44 Ca -0.33 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.15 1fq9 h ARG 44 Cb 1.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.21 1fq9 h ARG 44 CO 0.43 0.54 1.30 -2.00 -1.07 0.00 0.00 179.97 179.16 1fq9 s GLU 45 N -3.08 3.44 0.55 0.04 2.56 -1.26 -4.81 118.70 116.14 1fq9 s GLU 45 Ca 0.03 1.73 0.37 0.00 0.00 0.00 0.00 54.97 57.09 1fq9 s GLU 45 Cb 0.09 -4.21 1.81 0.00 2.00 0.00 0.00 34.13 33.82 1fq9 s GLU 45 CO 0.74 -1.74 2.10 -0.22 -0.56 0.00 0.00 175.26 175.59 1fq9 h LYS 46 N 12.85 0.00 -0.01 4.30 3.64 -1.98 -1.88 116.57 133.49 1fq9 h LYS 46 Ca -0.37 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 1fq9 h LYS 46 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1fq9 h LYS 46 CO 1.00 0.00 -0.03 -1.13 -2.27 0.00 0.00 179.45 177.02 1fq9 n SER 47 N -2.91 1.43 -4.66 4.20 3.41 -1.26 -4.93 113.62 108.91 1fq9 n SER 47 Ca -0.01 -1.42 -0.45 0.00 -0.26 0.00 0.00 58.87 56.73 1fq9 n SER 47 Cb 0.16 0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.10 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 0.07 2.44 0.00 4.04 2.03 -0.71 -4.84 116.55 119.58 1fq9 n ASP 48 Ca 0.18 1.16 0.12 0.00 0.52 0.00 0.00 54.79 56.77 1fq9 n ASP 48 Cb 0.35 -1.41 0.64 0.00 -0.72 0.00 0.00 41.12 39.99 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 1.46 0.50 -0.26 -0.67 -0.04 -1.26 -3.54 135.00 131.19 1fq9 n PRO 49 Ca 0.10 0.04 0.09 0.00 -0.04 0.00 0.00 63.50 63.68 1fq9 n PRO 49 Cb 0.32 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.17 0.00 0.70 0.54 8.25 -1.26 -4.64 115.22 117.64 1fq9 n HIS 50 Ca 0.14 -1.17 0.08 0.00 -0.26 0.00 0.00 57.72 56.51 1fq9 n HIS 50 Cb 0.14 -0.19 0.03 0.00 1.12 0.00 0.00 29.99 31.09 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 -1.32 0.00 -2.64 1.59 -5.35 -1.23 -1.82 119.36 108.59 1fq9 n ILE 51 Ca 0.17 -0.40 -0.43 0.00 -0.27 0.00 0.00 62.75 61.82 1fq9 n ILE 51 Cb 0.66 1.25 -0.02 0.00 -1.74 0.00 0.00 39.64 39.78 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 -1.68 3.74 -0.01 6.28 1.02 -1.26 -4.39 119.74 123.43 1fq9 s LYS 52 Ca 0.15 0.56 0.03 0.00 0.02 0.00 0.00 55.97 56.74 1fq9 s LYS 52 Cb 0.13 -3.89 -0.03 0.00 -0.52 0.00 0.00 37.83 33.52 1fq9 s LYS 52 CO 0.32 -1.29 -0.08 -0.51 -0.92 0.00 0.00 175.35 172.88 1fq9 s LEU 53 N 4.23 3.12 -0.42 3.17 1.43 0.59 -1.16 118.68 129.64 1fq9 s LEU 53 Ca 0.46 -0.13 -0.08 0.00 -1.03 0.00 0.00 54.13 53.35 1fq9 s LEU 53 Cb -0.08 -1.76 0.09 0.00 0.03 0.00 0.00 46.19 44.47 1fq9 s LEU 53 CO 0.29 0.30 0.26 -1.58 0.23 0.00 0.00 176.35 175.85 1fq9 s GLN 54 N -1.24 2.46 -0.09 1.70 2.00 0.11 -0.24 119.66 124.35 1fq9 s GLN 54 Ca 0.16 -1.58 -0.23 0.00 -2.00 0.00 0.00 55.36 51.71 1fq9 s GLN 54 Cb -0.11 -3.75 -0.03 0.00 0.80 0.00 0.00 33.01 29.92 1fq9 s GLN 54 CO 0.06 -1.01 0.68 -0.51 -0.50 0.00 0.00 175.29 174.01 1fq9 s LEU 55 N 1.35 4.28 -0.00 3.68 1.43 -1.26 -2.05 118.68 126.12 1fq9 s LEU 55 Ca 0.04 1.12 0.06 0.00 -1.03 0.00 0.00 54.13 54.32 1fq9 s LEU 55 Cb -0.24 -3.04 -0.02 0.00 0.03 0.00 0.00 46.19 42.93 1fq9 s LEU 55 CO 0.00 -0.14 -0.20 -1.58 0.23 0.00 0.00 176.35 174.66 1fq9 s GLN 56 N 1.01 1.55 0.03 1.70 2.00 -0.95 -4.97 119.66 120.02 1fq9 s GLN 56 Ca 0.36 -0.76 -0.17 0.00 -2.00 0.00 0.00 55.36 52.79 1fq9 s GLN 56 Cb -0.17 -1.53 -0.06 0.00 0.80 0.00 0.00 33.01 32.05 1fq9 s GLN 56 CO 0.16 0.41 0.48 0.00 -0.50 0.00 0.00 175.29 175.85 1fq9 s ALA 57 N -0.54 3.64 -0.77 1.58 0.00 -1.26 -0.50 121.76 123.91 1fq9 s ALA 57 Ca 0.07 -0.10 0.19 0.00 0.00 0.00 0.00 51.96 52.12 1fq9 s ALA 57 Cb -0.08 -2.51 -0.22 0.00 0.00 0.00 0.00 23.12 20.31 1fq9 s ALA 57 CO -0.00 0.43 0.75 -1.91 0.00 0.00 0.00 175.76 175.03 1fq9 n GLU 58 N 1.85 0.69 0.00 0.00 4.07 0.73 -4.91 120.64 123.07 1fq9 n GLU 58 Ca -0.12 -0.03 0.00 0.00 -0.06 0.00 0.00 57.16 56.95 1fq9 n GLU 58 Cb 0.52 -1.41 0.00 0.00 -0.06 0.00 0.00 31.44 30.49 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 -1.56 0.00 -1.15 5.31 0.28 -1.19 -5.02 120.64 117.31 1fq9 n GLU 59 Ca 0.03 0.00 -0.46 0.00 -0.16 0.00 0.00 57.16 56.57 1fq9 n GLU 59 Cb 0.33 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 33.13 1fq9 n GLU 59 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1fq9 n ARG 60 N -0.53 0.00 -0.85 3.44 1.74 -1.26 0.18 116.66 119.38 1fq9 n ARG 60 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1fq9 n ARG 60 Cb 0.00 -1.03 0.00 0.00 -1.02 0.00 0.00 32.46 30.41 1fq9 n ARG 60 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fq9 n GLY 61 N 3.08 0.55 3.13 -0.13 0.00 -1.26 -4.99 105.19 105.57 1fq9 n GLY 61 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.59 1.71 0.23 1.61 1.01 0.13 -1.28 120.40 121.21 1fq9 s VAL 62 Ca 0.00 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.23 1fq9 s VAL 62 Cb 0.00 -1.51 -0.05 0.00 0.00 0.00 0.00 36.38 34.82 1fq9 s VAL 62 CO 0.00 0.48 -0.03 0.68 0.00 0.00 0.00 175.10 176.23 1fq9 s VAL 63 N 0.65 1.21 0.16 2.92 -7.23 0.07 -0.19 120.40 117.99 1fq9 s VAL 63 Ca -0.13 -2.06 0.07 0.00 -1.81 0.00 0.00 61.98 58.05 1fq9 s VAL 63 Cb -0.16 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.45 1fq9 s VAL 63 CO 0.04 -0.39 -0.01 -0.94 -0.31 0.00 0.00 175.10 173.48 1fq9 s SER 64 N -3.32 4.73 -0.18 4.85 1.04 0.35 -0.86 113.70 120.32 1fq9 s SER 64 Ca 0.27 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.31 1fq9 s SER 64 Cb 0.05 -1.00 0.04 0.00 0.10 0.00 0.00 66.02 65.21 1fq9 s SER 64 CO 0.08 0.10 -0.08 -0.63 0.98 0.00 0.00 173.24 173.69 1fq9 s ILE 65 N -1.67 1.39 -0.18 -1.02 1.01 -1.26 -2.24 121.20 117.23 1fq9 s ILE 65 Ca 0.27 -0.80 -0.02 0.00 0.00 0.00 0.00 60.65 60.10 1fq9 s ILE 65 Cb -0.10 -1.49 -0.01 0.00 0.01 0.00 0.00 42.46 40.88 1fq9 s ILE 65 CO 0.18 0.17 -0.11 -0.75 0.00 0.00 0.00 174.94 174.44 1fq9 s LYS 66 N 1.51 3.31 -0.16 2.79 2.20 -0.87 -0.91 119.74 127.62 1fq9 s LYS 66 Ca 0.00 -0.69 -0.29 0.00 -0.36 0.00 0.00 55.97 54.63 1fq9 s LYS 66 Cb -0.15 -2.78 -0.02 0.00 -1.51 0.00 0.00 37.83 33.36 1fq9 s LYS 66 CO -0.08 -0.04 1.41 0.20 -0.36 0.00 0.00 175.35 176.48 1fq9 s GLY 67 N 1.00 1.53 0.10 5.54 0.00 -0.23 0.04 107.32 115.30 1fq9 s GLY 67 Ca -0.01 0.54 -0.24 0.00 0.00 0.00 0.00 44.72 45.01 1fq9 s GLY 67 CO -0.01 2.71 1.71 -2.08 0.00 0.00 0.00 173.10 175.42 1fq9 h VAL 68 N 5.65 0.83 -0.08 1.40 2.07 -1.45 0.44 116.25 125.11 1fq9 h VAL 68 Ca -0.30 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 1fq9 h VAL 68 Cb 1.13 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 1fq9 h VAL 68 CO 0.98 0.00 -0.12 0.77 0.02 0.00 0.00 177.57 179.22 1fq9 h SER 69 N -0.16 0.23 0.66 0.57 4.64 -1.83 -3.10 113.55 114.56 1fq9 h SER 69 Ca 0.01 -0.53 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 1fq9 h SER 69 Cb 0.16 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1fq9 h SER 69 CO -0.03 0.72 0.00 0.00 -0.87 0.00 0.00 176.83 176.65 1fq9 h ALA 70 N 0.52 1.00 -6.54 5.18 0.00 -1.77 -3.47 119.26 114.18 1fq9 h ALA 70 Ca 0.01 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.41 1fq9 h ALA 70 Cb 0.67 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1fq9 h ALA 70 CO 0.03 0.00 -0.93 -1.71 0.00 0.00 0.00 179.25 176.64 1fq9 n ASN 71 N -2.64 -1.98 -4.12 0.00 5.15 0.14 -4.76 115.26 107.06 1fq9 n ASN 71 Ca 0.01 -1.07 -0.10 0.00 -0.60 0.00 0.00 54.58 52.81 1fq9 n ASN 71 Cb 0.21 -2.83 -0.09 0.00 -0.53 0.00 0.00 39.78 36.54 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 -6.59 1.00 -0.10 1.20 0.52 -1.20 -4.73 118.95 109.04 1fq9 s ARG 72 Ca 0.19 -1.40 0.01 0.00 -0.52 0.00 0.00 55.73 54.00 1fq9 s ARG 72 Cb -0.08 0.27 -0.02 0.00 0.52 0.00 0.00 34.95 35.64 1fq9 s ARG 72 CO 0.90 -0.30 -0.12 0.71 0.02 0.00 0.00 175.30 176.51 1fq9 s TYR 73 N -4.04 2.81 -0.17 -0.53 1.51 0.21 -1.06 117.35 116.07 1fq9 s TYR 73 Ca 0.24 -0.39 -0.29 0.00 -1.01 0.00 0.00 57.07 55.62 1fq9 s TYR 73 Cb 0.07 -1.77 -0.03 0.00 -0.11 0.00 0.00 41.96 40.12 1fq9 s TYR 73 CO 0.02 -0.01 1.56 -1.17 -1.11 0.00 0.00 175.55 174.84 1fq9 s LEU 74 N -0.12 4.05 0.01 -1.29 2.96 -0.08 -0.49 118.68 123.72 1fq9 s LEU 74 Ca -0.01 1.78 0.05 0.00 -0.22 0.00 0.00 54.13 55.73 1fq9 s LEU 74 Cb -0.14 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.01 1fq9 s LEU 74 CO 0.03 -1.09 -0.15 0.00 -1.32 0.00 0.00 176.35 173.82 1fq9 s ALA 75 N 4.60 1.28 -0.25 5.97 0.00 0.95 -4.42 121.76 129.89 1fq9 s ALA 75 Ca 0.69 -0.73 -0.06 0.00 0.00 0.00 0.00 51.96 51.85 1fq9 s ALA 75 Cb -0.26 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.56 1fq9 s ALA 75 CO 0.27 0.29 0.04 1.41 0.00 0.00 0.00 175.76 177.77 1fq9 s MET 76 N -0.63 3.45 0.90 0.00 1.75 -0.97 -2.06 119.30 121.74 1fq9 s MET 76 Ca 0.05 -0.61 -0.12 0.00 -1.25 0.00 0.00 55.69 53.76 1fq9 s MET 76 Cb -0.07 -3.25 0.13 0.00 2.84 0.00 0.00 34.83 34.49 1fq9 s MET 76 CO 0.00 -0.25 1.15 0.15 -0.65 0.00 0.00 175.02 175.42 1fq9 s LYS 77 N 1.55 1.23 0.39 4.11 -0.14 -0.44 -4.89 119.74 121.55 1fq9 s LYS 77 Ca 0.05 0.24 0.11 0.00 -1.36 0.00 0.00 55.97 55.01 1fq9 s LYS 77 Cb -0.15 -1.85 0.90 0.00 -1.68 0.00 0.00 37.83 35.04 1fq9 s LYS 77 CO 0.01 -2.13 1.93 1.05 -0.76 0.00 0.00 175.35 175.46 1fq9 h GLU 78 N -1.45 0.57 0.00 1.68 4.11 -1.99 0.62 114.58 118.12 1fq9 h GLU 78 Ca -0.50 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.90 1fq9 h GLU 78 Cb 1.33 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1fq9 h GLU 78 CO 0.62 0.37 0.00 -0.40 0.07 0.00 0.00 179.01 179.67 1fq9 n ASP 79 N -4.50 0.26 0.00 3.06 3.85 -1.26 -4.87 116.55 113.09 1fq9 n ASP 79 Ca 0.13 0.55 0.00 0.00 -0.71 0.00 0.00 54.79 54.76 1fq9 n ASP 79 Cb 0.39 -0.61 0.00 0.00 -1.35 0.00 0.00 41.12 39.55 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 0.40 1.04 3.88 6.12 0.00 0.21 -4.35 105.19 112.49 1fq9 n GLY 80 Ca 0.04 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.11 3.30 0.29 1.61 1.70 -1.25 0.14 118.95 123.62 1fq9 s ARG 81 Ca 0.00 -0.48 0.02 0.00 -0.47 0.00 0.00 55.73 54.80 1fq9 s ARG 81 Cb 0.00 -2.97 -0.03 0.00 -0.57 0.00 0.00 34.95 31.38 1fq9 s ARG 81 CO 0.00 0.61 0.46 -0.51 -1.08 0.00 0.00 175.30 174.79 1fq9 s LEU 82 N -2.36 4.14 0.00 -1.89 1.43 -1.26 -1.33 118.68 117.41 1fq9 s LEU 82 Ca 0.32 0.33 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 1fq9 s LEU 82 Cb -0.13 -3.15 0.00 0.00 0.03 0.00 0.00 46.19 42.94 1fq9 s LEU 82 CO 0.25 -0.18 0.00 0.00 0.23 0.00 0.00 176.35 176.64 1fq9 n LEU 83 N -1.47 0.00 -4.11 1.79 -0.00 -0.87 -4.65 117.00 107.68 1fq9 n LEU 83 Ca -0.06 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.62 1fq9 n LEU 83 Cb 0.56 0.00 -0.15 0.00 -0.00 0.00 0.00 43.42 43.83 1fq9 n LEU 83 CO 0.47 0.00 -0.48 0.00 -0.00 0.00 0.00 177.39 177.39 1fq9 s ALA 84 N -2.00 2.50 0.63 1.47 0.00 -0.38 -0.03 121.76 123.94 1fq9 s ALA 84 Ca 0.00 -1.51 -0.14 0.00 0.00 0.00 0.00 51.96 50.31 1fq9 s ALA 84 Cb 0.00 -1.45 -0.02 0.00 0.00 0.00 0.00 23.12 21.65 1fq9 s ALA 84 CO 0.00 -0.81 1.06 0.45 0.00 0.00 0.00 175.76 176.46 1fq9 s SER 85 N 1.21 5.63 0.13 0.00 0.15 0.36 -4.50 113.70 116.67 1fq9 s SER 85 Ca -0.02 1.77 0.09 0.00 0.70 0.00 0.00 55.95 58.49 1fq9 s SER 85 Cb -0.17 -2.52 -0.16 0.00 -1.71 0.00 0.00 66.02 61.46 1fq9 s SER 85 CO -0.08 -1.27 1.24 0.50 1.20 0.00 0.00 173.24 174.83 1fq9 h LYS 86 N 0.10 0.00 -5.77 5.44 1.63 -1.89 0.60 116.57 116.68 1fq9 h LYS 86 Ca -0.46 0.00 -0.49 0.00 -0.85 0.00 0.00 60.65 58.85 1fq9 h LYS 86 Cb 1.22 0.00 -0.19 0.00 -0.60 0.00 0.00 32.23 32.66 1fq9 h LYS 86 CO 0.57 0.85 -0.78 -1.54 -3.45 0.00 0.00 179.45 175.10 1fq9 s SER 87 N -6.59 2.36 0.48 4.20 1.04 -1.26 -4.77 113.70 109.16 1fq9 s SER 87 Ca 0.01 -0.79 -0.22 0.00 0.48 0.00 0.00 55.95 55.42 1fq9 s SER 87 Cb 0.09 -0.12 -0.07 0.00 0.10 0.00 0.00 66.02 66.03 1fq9 s SER 87 CO 0.81 -0.06 1.18 -0.69 0.98 0.00 0.00 173.24 175.46 1fq9 s VAL 88 N -1.85 3.01 0.14 5.02 1.01 -1.26 -4.86 120.40 121.60 1fq9 s VAL 88 Ca 0.10 0.74 -0.06 0.00 0.00 0.00 0.00 61.98 62.77 1fq9 s VAL 88 Cb -0.07 -3.37 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 1fq9 s VAL 88 CO 0.05 -0.03 0.17 0.42 0.00 0.00 0.00 175.10 175.71 1fq9 s THR 89 N -1.55 0.09 -1.70 3.92 -4.23 -1.26 -5.02 115.64 105.90 1fq9 s THR 89 Ca 0.66 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 1fq9 s THR 89 Cb -0.29 -1.86 0.00 0.00 1.34 0.00 0.00 72.50 71.69 1fq9 s THR 89 CO 0.35 -0.43 0.65 -0.90 -0.54 0.00 0.00 174.62 173.76 1fq9 n ASP 90 N -0.14 0.00 -1.23 3.99 5.68 -1.26 -0.87 116.55 122.72 1fq9 n ASP 90 Ca -0.08 0.15 0.12 0.00 -0.50 0.00 0.00 54.79 54.48 1fq9 n ASP 90 Cb 0.63 -0.15 0.26 0.00 -1.14 0.00 0.00 41.12 40.72 1fq9 n ASP 90 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1fq9 n GLU 91 N -1.15 2.60 -0.54 0.11 1.02 -1.26 -4.18 120.64 117.25 1fq9 n GLU 91 Ca 0.00 -2.45 0.08 0.00 -0.02 0.00 0.00 57.16 54.77 1fq9 n GLU 91 Cb 0.00 -1.53 0.30 0.00 -0.02 0.00 0.00 31.44 30.19 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 -2.14 2.80 0.10 0.00 0.08 -1.26 -4.09 117.98 113.46 1fq9 s PHE 93 Ca 0.44 -0.52 0.04 0.00 0.12 0.00 0.00 56.93 57.01 1fq9 s PHE 93 Cb 0.31 -1.80 -0.04 0.00 -0.57 0.00 0.00 43.02 40.92 1fq9 s PHE 93 CO 0.17 -0.12 -0.11 -0.06 -0.10 0.00 0.00 175.22 175.01 1fq9 s PHE 94 N 0.12 1.10 -0.51 0.36 0.08 -0.04 -1.68 117.98 117.41 1fq9 s PHE 94 Ca -0.06 -0.64 -0.24 0.00 0.12 0.00 0.00 56.93 56.10 1fq9 s PHE 94 Cb -0.15 -0.60 0.03 0.00 -0.57 0.00 0.00 43.02 41.74 1fq9 s PHE 94 CO 0.05 0.02 0.91 -0.06 -0.10 0.00 0.00 175.22 176.04 1fq9 s PHE 95 N -2.40 2.86 -0.13 0.36 2.99 0.16 -0.75 117.98 121.08 1fq9 s PHE 95 Ca 0.06 0.15 -0.26 0.00 0.00 0.00 0.00 56.93 56.87 1fq9 s PHE 95 Cb -0.03 -3.98 -0.02 0.00 0.00 0.00 0.00 43.02 38.99 1fq9 s PHE 95 CO 0.00 -1.22 0.85 -2.00 -0.00 0.00 0.00 175.22 172.86 1fq9 s GLU 96 N 3.79 4.36 -0.05 0.44 2.12 -0.41 -2.51 118.70 126.44 1fq9 s GLU 96 Ca 0.33 1.08 0.00 0.00 0.36 0.00 0.00 54.97 56.74 1fq9 s GLU 96 Cb -0.12 -3.54 0.02 0.00 0.26 0.00 0.00 34.13 30.76 1fq9 s GLU 96 CO 0.22 -0.24 -0.03 0.50 -0.54 0.00 0.00 175.26 175.17 1fq9 s ARG 97 N 1.82 0.75 -0.75 4.30 3.52 -0.80 -4.81 118.95 122.98 1fq9 s ARG 97 Ca 0.41 -0.03 -0.24 0.00 -0.13 0.00 0.00 55.73 55.74 1fq9 s ARG 97 Cb -0.17 -0.89 0.06 0.00 -1.56 0.00 0.00 34.95 32.39 1fq9 s ARG 97 CO 0.15 -0.16 1.15 -1.17 -0.81 0.00 0.00 175.30 174.46 1fq9 s LEU 98 N 1.29 3.85 1.09 -0.88 2.96 -1.26 -1.40 118.68 124.33 1fq9 s LEU 98 Ca -0.05 -0.90 -0.12 0.00 -0.22 0.00 0.00 54.13 52.84 1fq9 s LEU 98 Cb -0.14 -2.49 0.24 0.00 0.50 0.00 0.00 46.19 44.31 1fq9 s LEU 98 CO -0.02 -1.58 1.06 -1.61 -1.32 0.00 0.00 176.35 172.87 1fq9 s GLU 99 N 4.73 -0.31 0.10 1.98 0.41 -0.18 -4.87 118.70 120.55 1fq9 s GLU 99 Ca 0.30 0.79 0.16 0.00 -0.41 0.00 0.00 54.97 55.82 1fq9 s GLU 99 Cb -0.11 -1.63 0.71 0.00 -1.78 0.00 0.00 34.13 31.32 1fq9 s GLU 99 CO 0.09 -3.30 1.51 -1.13 -0.49 0.00 0.00 175.26 171.94 1fq9 n SER 100 N -4.61 0.24 -0.68 -0.19 3.41 -1.26 -1.63 113.62 108.89 1fq9 n SER 100 Ca 0.04 0.56 0.13 0.00 -0.26 0.00 0.00 58.87 59.35 1fq9 n SER 100 Cb 0.55 -0.61 0.35 0.00 -0.26 0.00 0.00 64.21 64.23 1fq9 n SER 100 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1fq9 n ASN 101 N -1.77 2.13 -0.06 4.04 0.23 -1.26 -4.94 115.26 113.64 1fq9 n ASN 101 Ca 0.03 -1.71 -0.01 0.00 -0.53 0.00 0.00 54.58 52.36 1fq9 n ASN 101 Cb 0.17 -0.01 -0.00 0.00 -2.08 0.00 0.00 39.78 37.86 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 0.67 -3.11 -4.79 0.53 3.02 -0.65 -5.04 115.26 105.88 1fq9 n ASN 102 Ca 0.17 0.02 -0.22 0.00 -0.03 0.00 0.00 54.58 54.52 1fq9 n ASN 102 Cb 0.46 -0.68 -0.05 0.00 -0.61 0.00 0.00 39.78 38.90 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 -2.02 2.89 0.15 3.10 2.02 -1.26 -4.90 117.35 117.33 1fq9 s TYR 103 Ca 0.00 -0.26 0.05 0.00 -0.37 0.00 0.00 57.07 56.49 1fq9 s TYR 103 Cb 0.00 -1.58 -0.04 0.00 -0.40 0.00 0.00 41.96 39.94 1fq9 s TYR 103 CO 0.00 0.36 0.08 -0.80 -1.57 0.00 0.00 175.55 173.62 1fq9 s ASN 104 N -3.88 5.30 -0.04 2.29 -0.87 0.40 -1.01 114.94 117.12 1fq9 s ASN 104 Ca 0.37 -0.18 0.02 0.00 -1.57 0.00 0.00 52.86 51.50 1fq9 s ASN 104 Cb -0.06 -1.33 0.01 0.00 -0.02 0.00 0.00 41.25 39.86 1fq9 s ASN 104 CO 0.24 0.10 -0.08 0.42 -2.57 0.00 0.00 177.10 175.22 1fq9 s THR 105 N -1.64 0.76 -0.60 1.60 -4.23 -0.49 0.03 115.64 111.07 1fq9 s THR 105 Ca 0.29 -0.29 -0.06 0.00 -1.18 0.00 0.00 61.69 60.46 1fq9 s THR 105 Cb -0.10 -0.72 0.16 0.00 1.34 0.00 0.00 72.50 73.17 1fq9 s THR 105 CO 0.22 0.26 0.45 -0.31 -0.54 0.00 0.00 174.62 174.70 1fq9 s TYR 106 N 0.62 3.49 -0.17 3.99 2.02 -1.26 -1.90 117.35 124.15 1fq9 s TYR 106 Ca -0.10 -2.40 -0.19 0.00 -0.37 0.00 0.00 57.07 54.01 1fq9 s TYR 106 Cb -0.13 -3.36 -0.03 0.00 -0.40 0.00 0.00 41.96 38.03 1fq9 s TYR 106 CO 0.01 -0.91 0.55 0.50 -1.57 0.00 0.00 175.55 174.13 1fq9 s ARG 107 N 0.40 4.24 0.05 -0.62 3.52 -1.04 -0.87 118.95 124.63 1fq9 s ARG 107 Ca 0.14 0.51 -0.32 0.00 -0.13 0.00 0.00 55.73 55.93 1fq9 s ARG 107 Cb -0.20 -3.53 -0.11 0.00 -1.56 0.00 0.00 34.95 29.55 1fq9 s ARG 107 CO -0.04 -0.10 1.87 0.45 -0.81 0.00 0.00 175.30 176.67 1fq9 n SER 108 N 4.58 3.86 0.25 -2.12 2.88 -0.14 0.41 113.62 123.33 1fq9 n SER 108 Ca -0.04 0.96 0.12 0.00 -1.33 0.00 0.00 58.87 58.58 1fq9 n SER 108 Cb 0.50 -1.49 0.65 0.00 -0.75 0.00 0.00 64.21 63.13 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 9.14 0.00 0.01 -1.46 2.43 -1.65 -2.12 114.38 120.74 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 1.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1fq9 h ARG 109 CO 0.94 0.15 -0.01 -0.22 -1.51 0.00 0.00 179.97 179.33 1fq9 h LYS 110 N 0.00 -0.01 -2.63 0.20 1.63 -1.82 -3.36 116.57 110.58 1fq9 h LYS 110 Ca -0.00 0.00 -0.78 0.00 -0.85 0.00 0.00 60.65 59.02 1fq9 h LYS 110 Cb 0.47 0.00 -0.20 0.00 -0.60 0.00 0.00 32.23 31.90 1fq9 h LYS 110 CO 0.02 -0.01 1.65 0.66 -3.45 0.00 0.00 179.45 178.32 1fq9 n TYR 111 N -3.41 2.65 0.00 1.91 4.01 -1.23 -4.88 117.16 116.21 1fq9 n TYR 111 Ca -0.00 -2.69 0.00 0.00 -0.16 0.00 0.00 57.90 55.05 1fq9 n TYR 111 Cb 0.01 -1.54 0.00 0.00 -0.31 0.00 0.00 39.34 37.50 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 1.22 0.00 0.13 -0.72 -2.24 -0.80 -0.81 114.28 111.06 1fq9 n THR 112 Ca 0.49 0.17 0.03 0.00 -2.27 0.00 0.00 64.05 62.47 1fq9 n THR 112 Cb 0.28 -0.70 0.05 0.00 -2.10 0.00 0.00 70.33 67.86 1fq9 n THR 112 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1fq9 n SER 113 N -0.43 1.97 -4.55 3.42 7.64 -1.26 -4.87 113.62 115.53 1fq9 n SER 113 Ca 0.00 -1.57 -0.29 0.00 1.01 0.00 0.00 58.87 58.01 1fq9 n SER 113 Cb 0.17 -0.06 -0.10 0.00 -1.01 0.00 0.00 64.21 63.21 1fq9 n SER 113 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1fq9 s TRP 114 N -0.74 2.67 0.39 1.43 0.51 0.01 -4.81 118.94 118.40 1fq9 s TRP 114 Ca 0.10 -0.19 0.08 0.00 -2.12 0.00 0.00 56.10 53.97 1fq9 s TRP 114 Cb 0.06 -1.40 -0.07 0.00 -0.81 0.00 0.00 33.47 31.26 1fq9 s TRP 114 CO 0.09 0.42 0.01 0.71 -0.51 0.00 0.00 176.95 177.67 1fq9 s TYR 115 N -1.24 2.51 0.00 -1.98 1.51 -1.26 -0.97 117.35 115.93 1fq9 s TYR 115 Ca 0.21 -0.61 -0.22 0.00 -1.01 0.00 0.00 57.07 55.43 1fq9 s TYR 115 Cb -0.11 -1.71 -0.05 0.00 -0.11 0.00 0.00 41.96 39.98 1fq9 s TYR 115 CO 0.13 0.44 0.67 0.08 -1.11 0.00 0.00 175.55 175.76 1fq9 s VAL 116 N -2.67 4.87 0.14 0.71 1.01 -0.04 -4.45 120.40 119.98 1fq9 s VAL 116 Ca 0.35 1.40 -0.21 0.00 0.00 0.00 0.00 61.98 63.53 1fq9 s VAL 116 Cb 0.07 -4.01 0.06 0.00 0.00 0.00 0.00 36.38 32.50 1fq9 s VAL 116 CO 0.18 0.38 0.53 0.00 0.00 0.00 0.00 175.10 176.19 1fq9 s ALA 117 N 0.00 -1.35 0.04 5.51 0.00 -1.26 -4.46 121.76 120.24 1fq9 s ALA 117 Ca 0.34 0.30 0.08 0.00 0.00 0.00 0.00 51.96 52.68 1fq9 s ALA 117 Cb -0.19 0.81 -0.03 0.00 0.00 0.00 0.00 23.12 23.71 1fq9 s ALA 117 CO 0.19 -0.72 -0.22 -0.51 0.00 0.00 0.00 175.76 174.51 1fq9 s LEU 118 N -2.75 2.17 0.71 0.00 1.43 -1.04 -1.46 118.68 117.74 1fq9 s LEU 118 Ca 0.02 -0.53 -0.11 0.00 -1.03 0.00 0.00 54.13 52.47 1fq9 s LEU 118 Cb 0.00 -1.02 0.02 0.00 0.03 0.00 0.00 46.19 45.22 1fq9 s LEU 118 CO -0.12 0.18 1.09 -0.54 0.23 0.00 0.00 176.35 177.18 1fq9 s LYS 119 N -1.19 2.72 0.00 1.70 1.02 0.31 -4.51 119.74 119.80 1fq9 s LYS 119 Ca 0.08 0.35 0.06 0.00 0.02 0.00 0.00 55.97 56.49 1fq9 s LYS 119 Cb -0.09 -2.04 0.36 0.00 -0.52 0.00 0.00 37.83 35.54 1fq9 s LYS 119 CO 0.02 -1.09 0.90 2.89 -0.92 0.00 0.00 175.35 177.14 1fq9 n ARG 120 N -3.01 0.60 -0.07 1.68 1.85 -1.26 -2.15 116.66 114.30 1fq9 n ARG 120 Ca 0.07 0.00 0.05 0.00 -1.00 0.00 0.00 57.85 56.97 1fq9 n ARG 120 Cb 0.58 -1.16 0.09 0.00 -1.05 0.00 0.00 32.46 30.92 1fq9 n ARG 120 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1fq9 n THR 121 N -0.66 0.45 -0.58 8.89 -2.24 -1.26 -4.89 114.28 113.99 1fq9 n THR 121 Ca 0.05 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 1fq9 n THR 121 Cb 0.02 0.89 0.00 0.00 -2.10 0.00 0.00 70.33 69.14 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 0.51 0.74 3.55 3.38 0.00 -0.91 -5.01 105.19 107.44 1fq9 n GLY 122 Ca 0.08 0.00 -0.27 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 -0.42 2.01 1.32 1.61 -1.52 -1.26 -0.12 119.66 121.28 1fq9 s GLN 123 Ca 0.00 -1.24 -0.22 0.00 -1.95 0.00 0.00 55.36 51.95 1fq9 s GLN 123 Cb 0.00 -2.15 0.33 0.00 -0.22 0.00 0.00 33.01 30.97 1fq9 s GLN 123 CO 0.00 0.45 1.05 2.48 -0.25 0.00 0.00 175.29 179.01 1fq9 n TYR 124 N 0.22 -3.90 -4.51 0.91 0.18 -1.26 0.12 117.16 108.92 1fq9 n TYR 124 Ca -0.12 -0.96 -0.25 0.00 1.88 0.00 0.00 57.90 58.46 1fq9 n TYR 124 Cb 0.55 -1.19 -0.17 0.00 -0.38 0.00 0.00 39.34 38.15 1fq9 n TYR 124 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 1fq9 s LYS 125 N -5.41 1.65 0.02 -3.48 2.20 -0.53 -4.20 119.74 109.99 1fq9 s LYS 125 Ca 0.71 -0.39 -0.36 0.00 -0.36 0.00 0.00 55.97 55.58 1fq9 s LYS 125 Cb -0.08 -1.39 -0.14 0.00 -1.51 0.00 0.00 37.83 34.70 1fq9 s LYS 125 CO 0.56 -0.00 1.62 1.28 -0.36 0.00 0.00 175.35 178.44 1fq9 n LEU 126 N 3.91 2.72 -0.34 5.43 4.77 -1.26 -4.50 117.00 127.74 1fq9 n LEU 126 Ca -0.22 1.06 0.17 0.00 -0.03 0.00 0.00 56.01 56.99 1fq9 n LEU 126 Cb 0.52 -1.31 0.37 0.00 -2.33 0.00 0.00 43.42 40.67 1fq9 n LEU 126 CO 0.25 -0.44 1.15 1.23 -1.33 0.00 0.00 177.39 178.24 1fq9 h GLY 127 N 6.57 1.86 1.50 -0.72 0.00 0.95 1.37 103.07 114.60 1fq9 h GLY 127 Ca -0.47 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 46.57 1fq9 h GLY 127 CO 0.89 -0.25 0.17 -1.14 0.00 0.00 0.00 176.54 176.21 1fq9 n SER 128 N -4.91 0.32 -0.35 0.19 3.41 -1.26 0.15 113.62 111.17 1fq9 n SER 128 Ca 0.26 0.57 0.04 0.00 -0.26 0.00 0.00 58.87 59.48 1fq9 n SER 128 Cb 0.73 -0.57 0.05 0.00 -0.26 0.00 0.00 64.21 64.17 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 -1.94 0.75 -3.17 4.33 5.02 0.47 -5.03 118.16 118.59 1fq9 n LYS 129 Ca -0.01 -1.19 -0.32 0.00 -2.02 0.00 0.00 58.31 54.77 1fq9 n LYS 129 Cb 0.19 -1.16 -0.06 0.00 -0.02 0.00 0.00 35.03 33.98 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 -0.75 4.72 -0.04 -0.18 -4.23 0.12 -4.96 115.64 110.32 1fq9 s THR 130 Ca 0.11 0.86 -0.30 0.00 -1.18 0.00 0.00 61.69 61.17 1fq9 s THR 130 Cb 0.07 -3.61 0.07 0.00 1.34 0.00 0.00 72.50 70.37 1fq9 s THR 130 CO 0.10 -0.18 0.67 -0.83 -0.54 0.00 0.00 174.62 173.84 1fq9 s GLY 131 N -2.32 -0.57 0.34 3.99 0.00 -1.26 -4.79 107.32 102.70 1fq9 s GLY 131 Ca 0.53 1.28 0.13 0.00 0.00 0.00 0.00 44.72 46.66 1fq9 s GLY 131 CO 0.18 0.92 1.60 -0.56 0.00 0.00 0.00 173.10 175.24 1fq9 h PRO 132 N 2.98 0.08 -0.00 2.90 0.13 -1.98 0.11 132.00 136.21 1fq9 h PRO 132 Ca -0.27 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1fq9 h PRO 132 Cb 1.15 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1fq9 h PRO 132 CO 0.39 0.05 -0.02 0.41 -0.23 0.00 0.00 178.00 178.60 1fq9 n GLY 133 N -1.33 -1.24 3.80 1.56 0.00 -1.26 -4.92 105.19 101.81 1fq9 n GLY 133 Ca 0.32 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.56 3.89 0.20 1.61 -0.21 0.37 -4.98 119.66 117.99 1fq9 s GLN 134 Ca 0.29 1.32 0.17 0.00 0.02 0.00 0.00 55.36 57.16 1fq9 s GLN 134 Cb 0.20 -2.13 0.00 0.00 1.00 0.00 0.00 33.01 32.09 1fq9 s GLN 134 CO 0.46 -0.35 1.19 -0.22 -2.12 0.00 0.00 175.29 174.26 1fq9 h LYS 135 N 1.66 0.00 0.00 2.91 3.64 -1.91 -3.33 116.57 119.54 1fq9 h LYS 135 Ca -0.49 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.85 1fq9 h LYS 135 Cb 1.21 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 1fq9 h LYS 135 CO 0.59 0.35 -0.19 0.00 -2.27 0.00 0.00 179.45 177.93 1fq9 h ALA 136 N 1.55 1.42 0.00 5.00 0.00 -1.94 -2.98 119.26 122.31 1fq9 h ALA 136 Ca -0.06 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1fq9 h ALA 136 Cb 1.40 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1fq9 h ALA 136 CO 0.05 0.24 -0.32 -0.84 0.00 0.00 0.00 179.25 178.37 1fq9 h ILE 137 N 0.00 0.57 -3.12 0.00 3.07 -1.78 -2.77 117.51 113.48 1fq9 h ILE 137 Ca -0.00 -1.73 -0.54 0.00 1.55 0.00 0.00 64.86 64.13 1fq9 h ILE 137 Cb 0.40 2.22 -0.01 0.00 -0.27 0.00 0.00 36.82 39.17 1fq9 h ILE 137 CO 0.02 0.32 0.64 -0.76 -1.05 0.00 0.00 178.15 177.32 1fq9 s LEU 138 N -6.42 4.33 0.06 0.16 1.43 -1.13 -4.46 118.68 112.66 1fq9 s LEU 138 Ca 0.04 1.94 0.05 0.00 -1.03 0.00 0.00 54.13 55.14 1fq9 s LEU 138 Cb 0.07 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.69 1fq9 s LEU 138 CO 0.71 -0.54 -0.15 -0.36 0.23 0.00 0.00 176.35 176.25 1fq9 s PHE 139 N 1.64 1.27 -0.26 0.29 0.40 0.10 -0.99 117.98 120.44 1fq9 s PHE 139 Ca 0.58 -0.43 0.01 0.00 -0.60 0.00 0.00 56.93 56.49 1fq9 s PHE 139 Cb -0.28 -0.72 0.04 0.00 0.51 0.00 0.00 43.02 42.58 1fq9 s PHE 139 CO 0.26 0.06 -0.09 -1.17 0.70 0.00 0.00 175.22 174.99 1fq9 s LEU 140 N -1.58 3.31 0.23 -0.37 2.96 0.12 0.15 118.68 123.50 1fq9 s LEU 140 Ca -0.00 -1.15 -0.30 0.00 -0.22 0.00 0.00 54.13 52.46 1fq9 s LEU 140 Cb -0.09 -1.60 -0.09 0.00 0.50 0.00 0.00 46.19 44.90 1fq9 s LEU 140 CO 0.02 -0.17 1.24 -2.16 -1.32 0.00 0.00 176.35 173.97 1fq9 s PRO 141 N 1.21 4.45 -0.01 0.98 0.04 -1.26 -1.66 135.00 138.75 1fq9 s PRO 141 Ca -0.04 1.99 0.03 0.00 0.04 0.00 0.00 61.00 63.02 1fq9 s PRO 141 Cb -0.18 -3.19 -0.01 0.00 0.04 0.00 0.00 34.50 31.17 1fq9 s PRO 141 CO -0.05 -0.12 -0.10 -1.64 0.04 0.00 0.00 177.00 175.13 1fq9 s MET 142 N -0.64 0.84 0.95 4.56 -1.94 -0.03 -4.95 119.30 118.09 1fq9 s MET 142 Ca 0.52 -0.35 -0.11 0.00 -1.71 0.00 0.00 55.69 54.05 1fq9 s MET 142 Cb -0.35 -0.80 0.14 0.00 2.01 0.00 0.00 34.83 35.82 1fq9 s MET 142 CO 0.41 0.20 0.97 -1.13 -0.01 0.00 0.00 175.02 175.46 1fq9 n SER 143 N 2.91 -0.35 0.00 3.03 3.41 -1.26 -0.13 113.62 121.23 1fq9 n SER 143 Ca -0.14 0.35 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 1fq9 n SER 143 Cb 0.56 -1.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 1fq9 n SER 143 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88