#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qn0 n ASP 2 N 0.00 -9.45 -4.64 6.55 8.00 -1.26 -4.71 116.55 111.05 1qn0 n ASP 2 Ca 0.00 1.69 -0.49 0.00 0.71 0.00 0.00 54.79 56.70 1qn0 n ASP 2 Cb 0.00 -5.24 -0.05 0.00 -0.02 0.00 0.00 41.12 35.81 1qn0 n ASP 2 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1qn0 n VAL 3 N 1.92 0.49 -0.97 2.53 3.14 -1.26 -4.88 118.33 119.30 1qn0 n VAL 3 Ca 0.00 -0.16 -0.37 0.00 -2.96 0.00 0.00 64.34 60.85 1qn0 n VAL 3 Cb 0.00 -1.87 0.05 0.00 -1.06 0.00 0.00 33.84 30.96 1qn0 n VAL 3 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1qn0 n PRO 4 N 7.03 -0.11 -3.06 1.45 -0.02 -1.26 -4.91 135.00 134.12 1qn0 n PRO 4 Ca 0.26 -0.03 -0.32 0.00 -2.02 0.00 0.00 63.50 61.39 1qn0 n PRO 4 Cb 0.29 -1.10 -0.06 0.00 -0.02 0.00 0.00 33.50 32.61 1qn0 n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qn0 s ALA 5 N -2.04 3.28 0.84 3.55 0.00 -1.26 -4.71 121.76 121.42 1qn0 s ALA 5 Ca 0.41 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1qn0 s ALA 5 Cb -0.08 -2.81 0.00 0.00 0.00 0.00 0.00 23.12 20.23 1qn0 s ALA 5 CO 0.75 0.26 0.00 -0.40 0.00 0.00 0.00 175.76 176.37 1qn0 n ASP 6 N -0.52 -0.75 -1.61 0.00 5.75 -1.26 -4.47 116.55 113.70 1qn0 n ASP 6 Ca 0.04 0.00 -0.11 0.00 -0.01 0.00 0.00 54.79 54.71 1qn0 n ASP 6 Cb 0.53 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.64 1qn0 n ASP 6 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qn0 n GLY 7 N 0.00 0.08 3.38 6.12 0.00 -1.22 -4.97 105.19 108.59 1qn0 n GLY 7 Ca 0.00 -0.33 -0.45 0.00 0.00 0.00 0.00 46.02 45.24 1qn0 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qn0 s ALA 8 N -2.84 3.50 0.35 4.61 0.00 -1.01 -4.97 121.76 121.40 1qn0 s ALA 8 Ca 0.15 -2.45 -0.27 0.00 0.00 0.00 0.00 51.96 49.39 1qn0 s ALA 8 Cb -0.06 -3.60 -0.09 0.00 0.00 0.00 0.00 23.12 19.36 1qn0 s ALA 8 CO 0.18 -2.43 1.18 -1.59 0.00 0.00 0.00 175.76 173.10 1qn0 s LYS 9 N 2.36 4.28 -0.14 0.00 0.00 -1.26 -2.22 119.74 122.74 1qn0 s LYS 9 Ca 0.15 1.91 0.01 0.00 0.00 0.00 0.00 55.97 58.04 1qn0 s LYS 9 Cb -0.20 -2.89 0.02 0.00 0.00 0.00 0.00 37.83 34.76 1qn0 s LYS 9 CO 0.02 -0.15 -0.16 0.42 0.00 0.00 0.00 175.35 175.48 1qn0 s ILE 10 N -1.30 1.70 -0.39 3.79 1.01 0.89 -4.97 121.20 121.93 1qn0 s ILE 10 Ca 0.52 -0.73 0.07 0.00 0.00 0.00 0.00 60.65 60.51 1qn0 s ILE 10 Cb -0.33 -1.56 0.18 0.00 0.01 0.00 0.00 42.46 40.77 1qn0 s ILE 10 CO 0.42 0.48 0.65 -0.62 0.00 0.00 0.00 174.94 175.87 1qn0 s ASP 11 N 1.28 -1.48 -0.03 3.58 2.15 -1.26 -2.04 116.67 118.87 1qn0 s ASP 11 Ca 0.01 -0.61 0.05 0.00 0.43 0.00 0.00 52.55 52.42 1qn0 s ASP 11 Cb -0.14 1.89 -0.07 0.00 -0.30 0.00 0.00 42.92 44.31 1qn0 s ASP 11 CO -0.08 -0.18 0.06 0.49 -0.17 0.00 0.00 175.17 175.28 1qn0 n PHE 12 N 4.52 0.00 -3.24 -5.34 3.72 -1.26 -4.89 117.46 110.97 1qn0 n PHE 12 Ca 0.10 0.00 -0.46 0.00 -0.05 0.00 0.00 57.45 57.04 1qn0 n PHE 12 Cb 0.57 -0.18 -0.04 0.00 -0.94 0.00 0.00 39.48 38.89 1qn0 n PHE 12 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1qn0 s ILE 13 N -2.21 5.20 0.55 4.37 1.01 -1.26 -4.99 121.20 123.86 1qn0 s ILE 13 Ca -0.02 -1.65 -0.16 0.00 0.00 0.00 0.00 60.65 58.82 1qn0 s ILE 13 Cb 0.02 -4.44 -0.06 0.00 0.01 0.00 0.00 42.46 38.00 1qn0 s ILE 13 CO 0.20 -1.02 1.03 0.00 0.00 0.00 0.00 174.94 175.15 1qn0 s ALA 14 N 1.54 2.87 -0.20 9.38 0.00 -1.26 -4.63 121.76 129.47 1qn0 s ALA 14 Ca 0.11 0.33 -0.09 0.00 0.00 0.00 0.00 51.96 52.31 1qn0 s ALA 14 Cb -0.22 -3.19 0.07 0.00 0.00 0.00 0.00 23.12 19.79 1qn0 s ALA 14 CO -0.00 -0.55 0.45 0.20 0.00 0.00 0.00 175.76 175.85 1qn0 s GLY 15 N -2.81 -0.38 0.00 0.00 0.00 -1.15 -5.03 107.32 97.94 1qn0 s GLY 15 Ca 0.62 1.64 0.00 0.00 0.00 0.00 0.00 44.72 46.98 1qn0 s GLY 15 CO 0.33 2.06 0.00 0.61 0.00 0.00 0.00 173.10 176.10 1qn0 n GLY 16 N 4.71 1.21 1.34 0.20 0.00 -1.26 -0.51 105.19 110.88 1qn0 n GLY 16 Ca -0.17 -0.37 -0.01 0.00 0.00 0.00 0.00 46.02 45.47 1qn0 n GLY 16 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1qn0 n GLU 17 N 10.47 2.70 -0.70 1.61 -0.58 -1.26 -4.86 120.64 128.02 1qn0 n GLU 17 Ca 0.00 -1.64 0.00 0.00 -0.42 0.00 0.00 57.16 55.10 1qn0 n GLU 17 Cb 0.00 -1.83 0.00 0.00 -0.57 0.00 0.00 31.44 29.04 1qn0 n GLU 17 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 1qn0 n LYS 18 N 0.15 0.03 0.00 3.49 2.85 0.33 -5.18 118.16 119.84 1qn0 n LYS 18 Ca 0.19 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.45 1qn0 n LYS 18 Cb 0.84 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.22 1qn0 n LYS 18 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1qn0 n ASN 19 N -1.05 0.00 -4.65 -5.58 6.94 -1.25 -2.92 115.26 106.76 1qn0 n ASN 19 Ca 0.00 0.00 -0.43 0.00 -0.02 0.00 0.00 54.58 54.13 1qn0 n ASN 19 Cb 0.00 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.40 1qn0 n ASN 19 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1qn0 s LEU 20 N 0.00 4.05 -0.35 -4.53 1.43 -1.26 -4.99 118.68 113.04 1qn0 s LEU 20 Ca 0.00 1.52 -0.10 0.00 -1.03 0.00 0.00 54.13 54.52 1qn0 s LEU 20 Cb 0.00 -3.54 0.02 0.00 0.03 0.00 0.00 46.19 42.70 1qn0 s LEU 20 CO 0.00 -0.93 0.18 -0.89 0.23 0.00 0.00 176.35 174.94 1qn0 s THR 21 N 3.99 4.51 -0.06 5.49 2.01 -1.26 -4.72 115.64 125.60 1qn0 s THR 21 Ca 0.57 -0.71 -0.08 0.00 0.31 0.00 0.00 61.69 61.78 1qn0 s THR 21 Cb -0.20 -3.43 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 1qn0 s THR 21 CO 0.19 -0.11 0.22 -0.69 -0.69 0.00 0.00 174.62 173.55 1qn0 s VAL 22 N 1.56 5.37 -0.08 3.82 1.01 -0.87 -4.90 120.40 126.32 1qn0 s VAL 22 Ca 0.03 0.27 -0.03 0.00 0.00 0.00 0.00 61.98 62.25 1qn0 s VAL 22 Cb -0.18 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 1qn0 s VAL 22 CO 0.06 0.52 0.04 -0.69 0.00 0.00 0.00 175.10 175.03 1qn0 s VAL 23 N -1.13 4.59 0.06 2.92 1.01 -1.26 -0.07 120.40 126.51 1qn0 s VAL 23 Ca 0.21 -0.18 0.03 0.00 0.00 0.00 0.00 61.98 62.04 1qn0 s VAL 23 Cb -0.13 -2.97 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 1qn0 s VAL 23 CO 0.10 0.58 -0.10 0.12 0.00 0.00 0.00 175.10 175.79 1qn0 s PHE 24 N -0.95 0.91 0.01 5.22 5.36 -0.94 -4.95 117.98 122.63 1qn0 s PHE 24 Ca 0.15 -0.49 0.02 0.00 -0.96 0.00 0.00 56.93 55.64 1qn0 s PHE 24 Cb -0.12 -0.52 -0.01 0.00 -0.34 0.00 0.00 43.02 42.03 1qn0 s PHE 24 CO 0.04 -0.02 -0.06 1.21 -1.46 0.00 0.00 175.22 174.92 1qn0 s ASN 25 N -1.69 0.74 0.24 6.13 2.47 -1.26 -2.40 114.94 119.17 1qn0 s ASN 25 Ca -0.06 -0.21 0.21 0.00 0.42 0.00 0.00 52.86 53.22 1qn0 s ASN 25 Cb -0.10 -0.05 0.06 0.00 -1.45 0.00 0.00 41.25 39.72 1qn0 s ASN 25 CO 0.01 0.01 1.17 0.45 -3.72 0.00 0.00 177.10 175.02 1qn0 h HIS 26 N 5.63 0.00 -0.05 0.43 3.86 -1.88 -3.23 115.15 119.91 1qn0 h HIS 26 Ca -0.30 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.91 1qn0 h HIS 26 Cb 1.19 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.66 1qn0 h HIS 26 CO 0.46 0.11 0.00 0.43 0.86 0.00 0.00 177.93 179.79 1qn0 n SER 27 N -2.84 0.40 -0.12 2.45 7.64 -1.26 -2.60 113.62 117.30 1qn0 n SER 27 Ca -0.00 -1.67 -0.16 0.00 1.01 0.00 0.00 58.87 58.05 1qn0 n SER 27 Cb 0.59 -0.03 -0.11 0.00 -1.01 0.00 0.00 64.21 63.65 1qn0 n SER 27 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1qn0 n THR 28 N -0.44 1.33 -1.06 0.44 -1.04 -1.22 -4.41 114.28 107.89 1qn0 n THR 28 Ca 0.10 -0.52 -0.03 0.00 -2.04 0.00 0.00 64.05 61.56 1qn0 n THR 28 Cb 0.11 -1.28 0.30 0.00 -1.82 0.00 0.00 70.33 67.64 1qn0 n THR 28 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1qn0 n HIS 29 N -3.16 2.13 0.29 -1.42 8.25 -1.21 -4.48 115.22 115.62 1qn0 n HIS 29 Ca -0.41 -1.14 0.17 0.00 -0.26 0.00 0.00 57.72 56.08 1qn0 n HIS 29 Cb 0.95 -0.61 0.89 0.00 1.12 0.00 0.00 29.99 32.34 1qn0 n HIS 29 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 1qn0 h LYS 30 N 2.58 0.00 -0.01 -0.41 2.10 -1.71 1.67 116.57 120.79 1qn0 h LYS 30 Ca 0.20 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.85 1qn0 h LYS 30 Cb 2.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.47 1qn0 h LYS 30 CO 0.62 0.00 -0.02 -3.47 -2.00 0.00 0.00 179.45 174.59 1qn0 n ASP 31 N -2.78 1.20 -4.42 7.07 -0.08 -1.26 -4.78 116.55 111.50 1qn0 n ASP 31 Ca -0.02 -1.36 -0.33 0.00 -1.51 0.00 0.00 54.79 51.57 1qn0 n ASP 31 Cb 0.21 0.01 -0.14 0.00 2.34 0.00 0.00 41.12 43.54 1qn0 n ASP 31 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1qn0 s VAL 32 N -2.04 3.29 0.97 5.18 1.01 0.57 -5.10 120.40 124.28 1qn0 s VAL 32 Ca 0.39 -0.58 -0.14 0.00 0.00 0.00 0.00 61.98 61.65 1qn0 s VAL 32 Cb 0.21 -2.40 0.03 0.00 0.00 0.00 0.00 36.38 34.23 1qn0 s VAL 32 CO 0.36 0.52 0.29 0.29 0.00 0.00 0.00 175.10 176.56 1qn0 n LYS 33 N 3.42 -0.40 0.03 2.72 5.02 -1.26 -4.88 118.16 122.81 1qn0 n LYS 33 Ca -0.18 -0.08 -0.20 0.00 -2.02 0.00 0.00 58.31 55.83 1qn0 n LYS 33 Cb 0.53 -1.79 -0.10 0.00 -0.02 0.00 0.00 35.03 33.65 1qn0 n LYS 33 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qn0 n ASP 35 N -3.90 0.00 0.24 0.00 5.68 -1.26 -0.37 116.55 116.94 1qn0 n ASP 35 Ca -0.11 0.33 0.17 0.00 -0.50 0.00 0.00 54.79 54.68 1qn0 n ASP 35 Cb 0.85 -0.41 0.76 0.00 -1.14 0.00 0.00 41.12 41.18 1qn0 n ASP 35 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 1qn0 h ASP 36 N 0.00 0.00 0.00 -1.12 1.82 -1.83 -3.33 116.42 111.96 1qn0 h ASP 36 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1qn0 h ASP 36 Cb 0.17 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.18 1qn0 h ASP 36 CO 0.00 0.00 -0.42 0.00 -1.61 0.00 0.00 179.24 177.21 1qn0 n HIS 38 N -2.62 2.91 -1.06 0.00 8.25 0.50 -4.78 115.22 118.43 1qn0 n HIS 38 Ca 0.00 -2.70 -0.28 0.00 -0.26 0.00 0.00 57.72 54.47 1qn0 n HIS 38 Cb 0.21 -2.33 -0.05 0.00 1.12 0.00 0.00 29.99 28.94 1qn0 n HIS 38 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1qn0 n HIS 39 N 5.91 1.64 -4.18 4.41 -0.00 -1.25 -4.41 115.22 117.34 1qn0 n HIS 39 Ca 0.55 -2.42 -0.17 0.00 -0.00 0.00 0.00 57.72 55.68 1qn0 n HIS 39 Cb 0.36 -2.05 -0.12 0.00 -0.00 0.00 0.00 29.99 28.18 1qn0 n HIS 39 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 1qn0 s GLN 40 N 2.35 0.84 0.72 -1.40 -1.52 -1.26 -5.13 119.66 114.25 1qn0 s GLN 40 Ca 0.59 -1.03 -0.16 0.00 -1.95 0.00 0.00 55.36 52.81 1qn0 s GLN 40 Cb 0.18 -0.75 0.02 0.00 -0.22 0.00 0.00 33.01 32.23 1qn0 s GLN 40 CO -0.04 0.15 1.14 -0.35 -0.25 0.00 0.00 175.29 175.95 1qn0 n PRO 41 N 1.02 0.65 -0.53 2.91 -0.04 -1.26 -4.39 135.00 133.36 1qn0 n PRO 41 Ca -0.19 0.28 -0.15 0.00 -0.04 0.00 0.00 63.50 63.40 1qn0 n PRO 41 Cb 0.55 -2.39 0.13 0.00 -0.04 0.00 0.00 33.50 31.76 1qn0 n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qn0 n GLY 42 N 0.90 -2.33 5.00 0.55 0.00 -1.26 -0.20 105.19 107.85 1qn0 n GLY 42 Ca 0.14 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1qn0 n GLY 42 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1qn0 n ASP 43 N -0.85 0.00 -1.34 1.61 -0.08 -1.26 -3.35 116.55 111.28 1qn0 n ASP 43 Ca 0.06 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.37 1qn0 n ASP 43 Cb 0.29 0.00 0.28 0.00 2.34 0.00 0.00 41.12 44.03 1qn0 n ASP 43 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1qn0 n LYS 44 N 0.00 3.21 -0.35 -0.67 3.00 -1.22 -4.64 118.16 117.50 1qn0 n LYS 44 Ca 0.00 -3.00 0.23 0.00 -0.00 0.00 0.00 58.31 55.54 1qn0 n LYS 44 Cb 0.00 -1.99 0.47 0.00 0.00 0.00 0.00 35.03 33.51 1qn0 n LYS 44 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.40 177.77 1qn0 h GLN 45 N 2.17 0.38 -3.82 1.64 4.15 -0.58 -3.11 115.11 115.94 1qn0 h GLN 45 Ca 0.10 -0.02 -0.77 0.00 0.77 0.00 0.00 58.65 58.73 1qn0 h GLN 45 Cb 1.77 -0.09 -0.28 0.00 0.21 0.00 0.00 27.48 29.10 1qn0 h GLN 45 CO 0.41 0.25 -0.04 0.71 -1.93 0.00 0.00 178.83 178.24 1qn0 s TYR 46 N -5.63 3.64 0.36 3.99 2.02 -1.26 -4.19 117.35 116.27 1qn0 s TYR 46 Ca -0.10 -2.08 0.04 0.00 -0.37 0.00 0.00 57.07 54.56 1qn0 s TYR 46 Cb 0.28 -3.68 -0.03 0.00 -0.40 0.00 0.00 41.96 38.13 1qn0 s TYR 46 CO 0.80 -0.96 0.14 0.00 -1.57 0.00 0.00 175.55 173.95 1qn0 s ALA 47 N 0.27 2.45 0.33 3.71 0.00 -1.18 -5.13 121.76 122.21 1qn0 s ALA 47 Ca 0.16 -1.57 -0.29 0.00 0.00 0.00 0.00 51.96 50.26 1qn0 s ALA 47 Cb -0.14 0.92 -0.10 0.00 0.00 0.00 0.00 23.12 23.80 1qn0 s ALA 47 CO -0.07 -0.41 1.31 0.20 0.00 0.00 0.00 175.76 176.79 1qn0 s GLY 48 N -3.49 2.97 0.22 0.00 0.00 -1.26 -4.91 107.32 100.85 1qn0 s GLY 48 Ca 0.31 1.26 0.10 0.00 0.00 0.00 0.00 44.72 46.39 1qn0 s GLY 48 CO 0.16 1.92 1.50 0.00 0.00 0.00 0.00 173.10 176.68 1qn0 n THR 50 N -3.60 1.82 -1.89 0.00 -2.24 -1.26 -1.64 114.28 105.47 1qn0 n THR 50 Ca -0.01 -0.91 -0.33 0.00 -2.27 0.00 0.00 64.05 60.54 1qn0 n THR 50 Cb 0.73 -0.47 0.03 0.00 -2.10 0.00 0.00 70.33 68.52 1qn0 n THR 50 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1qn0 s THR 51 N -1.99 3.53 0.72 4.28 2.01 -1.07 -4.08 115.64 119.03 1qn0 s THR 51 Ca 0.32 0.71 -0.16 0.00 0.31 0.00 0.00 61.69 62.87 1qn0 s THR 51 Cb 0.25 -3.24 -0.01 0.00 0.01 0.00 0.00 72.50 69.52 1qn0 s THR 51 CO 0.08 -0.44 0.82 -0.67 -0.69 0.00 0.00 174.62 173.73 1qn0 n ASP 52 N -2.25 -0.07 -2.00 3.53 2.03 -1.26 -1.60 116.55 114.93 1qn0 n ASP 52 Ca 0.10 0.64 -0.17 0.00 0.52 0.00 0.00 54.79 55.88 1qn0 n ASP 52 Cb 0.52 -1.34 -0.04 0.00 -0.72 0.00 0.00 41.12 39.54 1qn0 n ASP 52 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1qn0 n GLY 53 N 1.27 0.48 0.00 0.27 0.00 -1.26 -4.83 105.19 101.12 1qn0 n GLY 53 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1qn0 n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qn0 n HIS 55 N 0.00 2.12 -1.98 0.00 8.25 -0.65 -4.53 115.22 118.42 1qn0 n HIS 55 Ca 0.00 -2.08 -0.41 0.00 -0.26 0.00 0.00 57.72 54.97 1qn0 n HIS 55 Cb 0.00 -1.31 -0.01 0.00 1.12 0.00 0.00 29.99 29.80 1qn0 n HIS 55 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1qn0 n ASN 56 N 0.34 7.20 -3.82 0.41 2.85 -1.22 -3.98 115.26 117.03 1qn0 n ASN 56 Ca 0.51 -3.05 -0.27 0.00 -0.11 0.00 0.00 54.58 51.66 1qn0 n ASN 56 Cb 0.43 -1.43 -0.17 0.00 1.24 0.00 0.00 39.78 39.85 1qn0 n ASN 56 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1qn0 s ILE 57 N -0.15 0.75 -0.97 -1.44 -1.09 -1.21 -5.03 121.20 112.06 1qn0 s ILE 57 Ca 0.52 -0.39 -0.03 0.00 -2.23 0.00 0.00 60.65 58.51 1qn0 s ILE 57 Cb 0.16 -1.00 0.26 0.00 -1.58 0.00 0.00 42.46 40.30 1qn0 s ILE 57 CO -0.06 0.08 1.03 0.18 -1.23 0.00 0.00 174.94 174.94 1qn0 n LEU 58 N 5.00 5.01 -3.60 2.97 4.77 -1.26 -3.70 117.00 126.19 1qn0 n LEU 58 Ca -0.10 -5.16 -0.02 0.00 -0.03 0.00 0.00 56.01 50.70 1qn0 n LEU 58 Cb 0.48 -1.20 -0.05 0.00 -2.33 0.00 0.00 43.42 40.32 1qn0 n LEU 58 CO 0.14 1.59 0.41 -0.62 -1.33 0.00 0.00 177.39 177.57 1qn0 s ASP 59 N -0.37 -0.90 -0.29 -1.43 2.15 -1.26 -5.02 116.67 109.55 1qn0 s ASP 59 Ca 0.31 1.32 -0.03 0.00 0.43 0.00 0.00 52.55 54.57 1qn0 s ASP 59 Cb -0.03 1.78 0.04 0.00 -0.30 0.00 0.00 42.92 44.41 1qn0 s ASP 59 CO -0.05 -0.19 2.65 0.29 -0.17 0.00 0.00 175.17 177.69 1qn0 n LYS 60 N 4.80 2.03 0.00 4.34 5.02 -1.26 -3.90 118.16 129.19 1qn0 n LYS 60 Ca -0.15 -1.66 0.00 0.00 -2.02 0.00 0.00 58.31 54.48 1qn0 n LYS 60 Cb 0.54 -1.86 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 1qn0 n LYS 60 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qn0 n ALA 61 N 1.08 0.00 -2.57 7.82 0.00 -1.26 -5.15 120.51 120.43 1qn0 n ALA 61 Ca 0.38 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.53 1qn0 n ALA 61 Cb 0.62 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.02 1qn0 n ALA 61 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1qn0 s ASP 62 N 0.00 4.34 -0.47 0.00 2.15 -1.25 -5.11 116.67 116.33 1qn0 s ASP 62 Ca 0.00 -1.41 0.03 0.00 0.43 0.00 0.00 52.55 51.60 1qn0 s ASP 62 Cb 0.00 0.28 0.16 0.00 -0.30 0.00 0.00 42.92 43.06 1qn0 s ASP 62 CO 0.00 -0.87 0.32 -0.75 -0.17 0.00 0.00 175.17 173.70 1qn0 s LYS 63 N -4.01 1.27 -0.15 4.34 2.20 -1.26 -5.07 119.74 117.04 1qn0 s LYS 63 Ca 0.23 -2.21 -0.34 0.00 -0.36 0.00 0.00 55.97 53.29 1qn0 s LYS 63 Cb 0.01 -2.05 0.14 0.00 -1.51 0.00 0.00 37.83 34.41 1qn0 s LYS 63 CO 0.13 -1.28 1.24 -1.54 -0.36 0.00 0.00 175.35 173.54 1qn0 s SER 64 N -0.01 -0.11 0.00 1.43 1.04 -1.26 -4.99 113.70 109.80 1qn0 s SER 64 Ca 0.25 -0.03 0.07 0.00 0.48 0.00 0.00 55.95 56.72 1qn0 s SER 64 Cb -0.10 0.14 0.24 0.00 0.10 0.00 0.00 66.02 66.40 1qn0 s SER 64 CO -0.10 -0.24 1.19 0.55 0.98 0.00 0.00 173.24 175.61 1qn0 n VAL 65 N -0.18 0.24 -0.58 5.02 3.14 -1.26 -3.10 118.33 121.62 1qn0 n VAL 65 Ca -0.01 -0.25 0.09 0.00 -2.96 0.00 0.00 64.34 61.20 1qn0 n VAL 65 Cb 0.59 0.12 0.30 0.00 -1.06 0.00 0.00 33.84 33.79 1qn0 n VAL 65 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1qn0 n ASN 66 N 0.04 4.20 -4.72 6.55 4.13 -1.26 -4.84 115.26 119.35 1qn0 n ASN 66 Ca 0.07 -2.42 -0.41 0.00 1.68 0.00 0.00 54.58 53.50 1qn0 n ASN 66 Cb 0.17 -0.50 -0.04 0.00 -1.54 0.00 0.00 39.78 37.87 1qn0 n ASN 66 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1qn0 s SER 67 N -1.10 7.35 -0.08 6.41 1.04 -1.18 -3.30 113.70 122.84 1qn0 s SER 67 Ca 0.44 1.87 0.14 0.00 0.48 0.00 0.00 55.95 58.88 1qn0 s SER 67 Cb 0.28 -2.59 0.53 0.00 0.10 0.00 0.00 66.02 64.35 1qn0 s SER 67 CO 0.21 -0.21 1.40 1.87 0.98 0.00 0.00 173.24 177.49 1qn0 n TRP 68 N 3.09 1.07 -0.18 5.02 -0.00 -1.24 -3.52 117.44 121.67 1qn0 n TRP 68 Ca 0.04 -0.43 0.00 0.00 -0.00 0.00 0.00 57.50 57.11 1qn0 n TRP 68 Cb 0.48 -0.18 0.00 0.00 -0.00 0.00 0.00 31.31 31.62 1qn0 n TRP 68 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 177.69 178.67 1qn0 n TYR 69 N 0.80 0.00 -0.07 5.87 4.19 -1.26 -4.61 117.16 122.07 1qn0 n TYR 69 Ca 0.19 0.00 -0.10 0.00 3.31 0.00 0.00 57.90 61.30 1qn0 n TYR 69 Cb 0.67 0.00 -0.08 0.00 0.49 0.00 0.00 39.34 40.42 1qn0 n TYR 69 CO 0.00 0.00 0.00 1.17 0.91 0.00 0.00 176.86 178.94 1qn0 n LYS 70 N -0.10 0.86 0.00 2.98 4.81 -1.23 -3.66 118.16 121.82 1qn0 n LYS 70 Ca 0.00 0.06 0.11 0.00 -0.87 0.00 0.00 58.31 57.61 1qn0 n LYS 70 Cb 0.05 -1.32 0.60 0.00 0.02 0.00 0.00 35.03 34.38 1qn0 n LYS 70 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1qn0 n VAL 71 N -2.82 0.14 -0.08 3.15 0.24 -1.23 -0.06 118.33 117.68 1qn0 n VAL 71 Ca -0.26 0.04 -0.15 0.00 -2.04 0.00 0.00 64.34 61.93 1qn0 n VAL 71 Cb 0.83 -0.69 -0.05 0.00 -1.47 0.00 0.00 33.84 32.46 1qn0 n VAL 71 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1qn0 n VAL 72 N -1.11 1.26 -0.32 3.34 0.31 -1.26 -4.37 118.33 116.17 1qn0 n VAL 72 Ca 0.14 -0.06 -0.04 0.00 -0.01 0.00 0.00 64.34 64.37 1qn0 n VAL 72 Cb 0.11 -1.95 0.20 0.00 -0.91 0.00 0.00 33.84 31.30 1qn0 n VAL 72 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1qn0 n HIS 73 N -4.05 1.63 -2.30 3.52 8.25 -1.21 -3.48 115.22 117.59 1qn0 n HIS 73 Ca -0.26 -0.85 -0.40 0.00 -0.26 0.00 0.00 57.72 55.94 1qn0 n HIS 73 Cb 0.60 -0.51 -0.03 0.00 1.12 0.00 0.00 29.99 31.16 1qn0 n HIS 73 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1qn0 s ASP 74 N -0.50 6.97 -0.07 0.41 2.15 0.92 -4.93 116.67 121.62 1qn0 s ASP 74 Ca 0.36 2.45 0.11 0.00 0.43 0.00 0.00 52.55 55.90 1qn0 s ASP 74 Cb 0.29 -2.63 0.16 0.00 -0.30 0.00 0.00 42.92 40.44 1qn0 s ASP 74 CO 0.09 -0.37 1.08 0.00 -0.17 0.00 0.00 175.17 175.80 1qn0 n ALA 75 N 0.88 2.15 -2.48 3.66 0.00 -1.26 -3.90 120.51 119.56 1qn0 n ALA 75 Ca 0.00 -1.92 -0.22 0.00 0.00 0.00 0.00 53.44 51.30 1qn0 n ALA 75 Cb 0.44 -0.43 -0.12 0.00 0.00 0.00 0.00 19.45 19.34 1qn0 n ALA 75 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1qn0 s LYS 76 N -1.63 1.23 0.27 0.00 2.20 -1.26 -5.01 119.74 115.53 1qn0 s LYS 76 Ca 0.18 -1.34 0.02 0.00 -0.36 0.00 0.00 55.97 54.47 1qn0 s LYS 76 Cb 0.16 -1.33 0.02 0.00 -1.51 0.00 0.00 37.83 35.17 1qn0 s LYS 76 CO 0.02 0.28 0.17 0.41 -0.36 0.00 0.00 175.35 175.87 1qn0 n GLY 77 N 0.50 3.04 0.00 5.54 0.00 -1.26 -4.88 105.19 108.14 1qn0 n GLY 77 Ca -0.15 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.63 1qn0 n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qn0 n GLY 78 N 1.74 0.71 0.00 -0.02 0.00 -1.26 -4.94 105.19 101.42 1qn0 n GLY 78 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1qn0 n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qn0 n ALA 79 N 0.00 0.00 -3.50 4.61 0.00 -1.26 -5.13 120.51 115.24 1qn0 n ALA 79 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1qn0 n ALA 79 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1qn0 n ALA 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1qn0 s LYS 80 N 0.00 0.88 0.17 0.00 -2.85 -1.26 -5.18 119.74 111.50 1qn0 s LYS 80 Ca 0.00 -0.28 -0.03 0.00 -1.00 0.00 0.00 55.97 54.66 1qn0 s LYS 80 Cb 0.00 0.40 0.04 0.00 -2.06 0.00 0.00 37.83 36.22 1qn0 s LYS 80 CO 0.00 -0.37 0.21 -0.35 0.10 0.00 0.00 175.35 174.94 1qn0 n PRO 81 N -0.16 -0.51 -1.30 1.78 -0.04 -1.26 -4.75 135.00 128.75 1qn0 n PRO 81 Ca -0.10 -0.33 0.00 0.00 -0.04 0.00 0.00 63.50 63.03 1qn0 n PRO 81 Cb 0.62 -0.24 0.00 0.00 -0.04 0.00 0.00 33.50 33.84 1qn0 n PRO 81 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1qn0 n THR 82 N -2.46 0.00 1.35 0.52 -2.24 -1.26 -4.94 114.28 105.25 1qn0 n THR 82 Ca 0.03 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.93 1qn0 n THR 82 Cb 0.10 0.00 0.69 0.00 -2.10 0.00 0.00 70.33 69.02 1qn0 n THR 82 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qn0 n ILE 84 N -1.19 0.58 0.19 0.00 2.08 -1.23 -4.07 119.36 115.72 1qn0 n ILE 84 Ca 0.15 -0.19 -0.14 0.00 0.56 0.00 0.00 62.75 63.12 1qn0 n ILE 84 Cb 0.17 -1.16 -0.08 0.00 -0.75 0.00 0.00 39.64 37.81 1qn0 n ILE 84 CO 0.00 0.00 0.00 -1.28 0.56 0.00 0.00 176.55 175.83 1qn0 h SER 85 N -0.15 -1.16 0.76 4.38 0.87 -1.67 1.83 113.55 118.41 1qn0 h SER 85 Ca -0.24 0.10 -0.04 0.00 -1.23 0.00 0.00 61.79 60.38 1qn0 h SER 85 Cb 1.31 0.40 0.01 0.00 -0.44 0.00 0.00 62.40 63.67 1qn0 h SER 85 CO -0.09 -0.51 -0.38 0.00 -0.53 0.00 0.00 176.83 175.33 1qn0 h HIS 87 N -1.04 0.88 -0.18 0.00 -0.00 -1.68 0.64 115.15 113.77 1qn0 h HIS 87 Ca -0.10 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.30 1qn0 h HIS 87 Cb 0.80 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.96 1qn0 h HIS 87 CO -0.03 -0.04 0.12 0.87 -0.00 0.00 0.00 177.93 178.85 1qn0 h LYS 88 N 0.42 0.24 -0.99 2.45 1.57 0.36 0.66 116.57 121.28 1qn0 h LYS 88 Ca 0.68 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.53 1qn0 h LYS 88 Cb 1.54 -0.05 -0.07 0.00 0.08 0.00 0.00 32.23 33.73 1qn0 h LYS 88 CO -0.48 0.16 0.64 0.22 -0.57 0.00 0.00 179.45 179.42 1qn0 h ASP 89 N 0.25 0.99 -0.48 0.86 1.82 0.13 0.39 116.42 120.37 1qn0 h ASP 89 Ca 0.07 0.02 -0.03 0.00 -0.39 0.00 0.00 57.03 56.69 1qn0 h ASP 89 Cb -0.03 -0.19 -0.02 0.00 0.68 0.00 0.00 39.33 39.77 1qn0 h ASP 89 CO -0.01 0.60 0.17 0.11 -1.61 0.00 0.00 179.24 178.49 1qn0 h LYS 90 N 1.11 0.73 -0.89 0.28 1.79 -0.29 -1.66 116.57 117.63 1qn0 h LYS 90 Ca 0.45 -0.15 -0.19 0.00 -2.18 0.00 0.00 60.65 58.57 1qn0 h LYS 90 Cb 0.27 -0.11 -0.12 0.00 -1.58 0.00 0.00 32.23 30.69 1qn0 h LYS 90 CO -0.20 0.68 0.25 0.00 -1.08 0.00 0.00 179.45 179.10 1qn0 n ALA 91 N -2.35 4.02 -2.46 3.86 0.00 0.15 -4.76 120.51 118.97 1qn0 n ALA 91 Ca 0.01 -1.57 -0.43 0.00 0.00 0.00 0.00 53.44 51.45 1qn0 n ALA 91 Cb 0.18 -1.20 -0.02 0.00 0.00 0.00 0.00 19.45 18.40 1qn0 n ALA 91 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1qn0 s GLY 92 N -0.46 1.13 0.00 0.00 0.00 0.12 -2.82 107.32 105.29 1qn0 s GLY 92 Ca 0.35 -0.39 0.00 0.00 0.00 0.00 0.00 44.72 44.68 1qn0 s GLY 92 CO 0.08 2.64 0.00 1.34 0.00 0.00 0.00 173.10 177.16 1qn0 n ASP 93 N 8.59 0.00 -4.52 1.64 2.03 -1.26 -4.98 116.55 118.04 1qn0 n ASP 93 Ca 0.14 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 55.03 1qn0 n ASP 93 Cb 0.49 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.80 1qn0 n ASP 93 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1qn0 s ASP 94 N -1.20 6.24 0.10 1.67 -1.08 -1.13 -4.92 116.67 116.36 1qn0 s ASP 94 Ca 0.00 -0.36 -0.09 0.00 -0.52 0.00 0.00 52.55 51.58 1qn0 s ASP 94 Cb 0.00 -2.24 -0.18 0.00 -1.46 0.00 0.00 42.92 39.03 1qn0 s ASP 94 CO 0.00 -0.53 1.22 0.50 0.52 0.00 0.00 175.17 176.88 1qn0 h LYS 95 N 8.62 0.53 -0.49 4.34 3.64 -1.94 -2.00 116.57 129.27 1qn0 h LYS 95 Ca -0.27 -0.61 -0.08 0.00 -1.27 0.00 0.00 60.65 58.42 1qn0 h LYS 95 Cb 1.12 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 1qn0 h LYS 95 CO 0.78 1.23 -0.00 1.49 -2.27 0.00 0.00 179.45 180.68 1qn0 h GLU 96 N 0.28 0.82 0.00 1.90 4.81 -1.94 -1.52 114.58 118.92 1qn0 h GLU 96 Ca -0.12 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 1qn0 h GLU 96 Cb 1.71 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.99 1qn0 h GLU 96 CO 0.19 0.82 0.00 1.25 -0.73 0.00 0.00 179.01 180.54 1qn0 h LEU 97 N 0.76 0.00 -2.15 1.64 7.12 -1.90 -3.02 115.31 117.76 1qn0 h LEU 97 Ca 0.15 0.00 -0.07 0.00 0.13 0.00 0.00 57.88 58.09 1qn0 h LEU 97 Cb 0.46 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 40.55 1qn0 h LEU 97 CO 0.02 0.00 0.08 1.17 -0.13 0.00 0.00 178.44 179.59 1qn0 n LYS 98 N -2.42 1.90 -2.70 1.25 4.81 -0.57 -3.46 118.16 116.96 1qn0 n LYS 98 Ca 0.05 -0.98 -0.06 0.00 -0.87 0.00 0.00 58.31 56.44 1qn0 n LYS 98 Cb 0.42 -1.59 0.05 0.00 0.02 0.00 0.00 35.03 33.93 1qn0 n LYS 98 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1qn0 n LYS 99 N 0.11 1.28 0.00 1.64 4.76 -1.14 -4.07 118.16 120.74 1qn0 n LYS 99 Ca 0.13 -2.99 0.00 0.00 -2.87 0.00 0.00 58.31 52.58 1qn0 n LYS 99 Cb 0.68 -1.06 0.00 0.00 -1.84 0.00 0.00 35.03 32.82 1qn0 n LYS 99 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1qn0 n LYS 100 N -0.33 0.00 -0.03 1.97 2.85 -1.24 -4.70 118.16 116.69 1qn0 n LYS 100 Ca 0.05 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.20 1qn0 n LYS 100 Cb 0.82 0.00 -0.14 0.00 -0.65 0.00 0.00 35.03 35.06 1qn0 n LYS 100 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1qn0 n LEU 101 N -1.73 1.12 0.00 -5.58 4.77 -1.23 -0.70 117.00 113.66 1qn0 n LEU 101 Ca 0.00 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 1qn0 n LEU 101 Cb 0.00 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1qn0 n LEU 101 CO 0.00 0.49 0.35 0.35 -1.33 0.00 0.00 177.39 177.25 1qn0 n THR 102 N -3.09 0.46 -1.72 -5.08 -2.24 -1.26 -4.88 114.28 96.47 1qn0 n THR 102 Ca -0.22 -0.67 -0.42 0.00 -2.27 0.00 0.00 64.05 60.47 1qn0 n THR 102 Cb 1.06 0.83 -0.03 0.00 -2.10 0.00 0.00 70.33 70.09 1qn0 n THR 102 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1qn0 s GLY 103 N -0.46 1.13 0.09 3.38 0.00 -1.26 -4.87 107.32 105.34 1qn0 s GLY 103 Ca 0.00 1.03 -0.23 0.00 0.00 0.00 0.00 44.72 45.52 1qn0 s GLY 103 CO 0.00 3.50 1.73 0.00 0.00 0.00 0.00 173.10 178.33 1qn0 s LYS 105 N -6.19 2.12 -0.32 0.00 -0.14 -1.26 -4.72 119.74 109.23 1qn0 s LYS 105 Ca -0.13 -0.75 -0.02 0.00 -1.36 0.00 0.00 55.97 53.72 1qn0 s LYS 105 Cb 0.06 -1.83 0.00 0.00 -1.68 0.00 0.00 37.83 34.39 1qn0 s LYS 105 CO 0.66 0.32 0.27 0.41 -0.76 0.00 0.00 175.35 176.25 1qn0 n GLY 106 N 3.03 0.49 3.79 -3.33 0.00 -0.65 -4.98 105.19 103.53 1qn0 n GLY 106 Ca -0.18 -0.42 -0.28 0.00 0.00 0.00 0.00 46.02 45.15 1qn0 n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qn0 s SER 107 N -3.15 4.39 0.00 1.61 1.04 -0.64 -4.64 113.70 112.30 1qn0 s SER 107 Ca 0.10 -1.30 0.16 0.00 0.48 0.00 0.00 55.95 55.39 1qn0 s SER 107 Cb -0.04 0.09 0.78 0.00 0.10 0.00 0.00 66.02 66.94 1qn0 s SER 107 CO 0.18 -0.80 1.49 0.00 0.98 0.00 0.00 173.24 175.08 1qn0 n ALA 108 N -1.40 1.84 -0.12 5.32 0.00 0.13 -2.47 120.51 123.80 1qn0 n ALA 108 Ca -0.06 -0.07 -0.24 0.00 0.00 0.00 0.00 53.44 53.07 1qn0 n ALA 108 Cb 0.65 -1.26 -0.10 0.00 0.00 0.00 0.00 19.45 18.74 1qn0 n ALA 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qn0 s HIS 110 N -2.47 3.52 -1.23 0.00 4.02 -1.10 -4.46 115.29 113.58 1qn0 s HIS 110 Ca -0.34 -3.19 -0.09 0.00 1.02 0.00 0.00 55.06 52.46 1qn0 s HIS 110 Cb 0.12 -2.88 0.20 0.00 -1.02 0.00 0.00 32.58 29.00 1qn0 s HIS 110 CO 0.47 -0.65 1.72 -0.35 1.02 0.00 0.00 174.74 176.96 1qn0 n PRO 111 N 2.44 3.75 0.00 8.40 -0.04 -1.03 -1.62 135.00 146.90 1qn0 n PRO 111 Ca 0.15 -3.79 0.00 0.00 -0.04 0.00 0.00 63.50 59.82 1qn0 n PRO 111 Cb 0.35 -2.85 0.00 0.00 -0.04 0.00 0.00 33.50 30.96 1qn0 n PRO 111 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91