#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qnf s LEU 2 N 0.00 4.12 -0.28 4.03 2.96 -1.26 -4.93 118.68 123.32 2qnf s LEU 2 Ca 0.00 0.87 -0.04 0.00 -0.22 0.00 0.00 54.13 54.74 2qnf s LEU 2 Cb 0.00 -2.97 -0.13 0.00 0.50 0.00 0.00 46.19 43.60 2qnf s LEU 2 CO 0.00 -0.35 2.27 0.18 -1.32 0.00 0.00 176.35 177.13 2qnf n LEU 3 N 5.38 3.65 0.00 -0.68 4.77 -1.26 -4.87 117.00 123.99 2qnf n LEU 3 Ca 0.01 -2.32 -0.14 0.00 -0.03 0.00 0.00 56.01 53.53 2qnf n LEU 3 Cb 0.49 -0.91 0.11 0.00 -2.33 0.00 0.00 43.42 40.78 2qnf n LEU 3 CO 0.45 0.75 0.30 1.07 -1.33 0.00 0.00 177.39 178.63 2qnf n THR 4 N 3.14 0.00 0.00 -5.08 5.66 -1.26 -4.05 114.28 112.69 2qnf n THR 4 Ca 0.31 -0.26 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 2qnf n THR 4 Cb 0.42 -1.22 0.00 0.00 -1.55 0.00 0.00 70.33 67.98 2qnf n THR 4 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2qnf n GLY 5 N -0.51 0.82 0.08 1.09 0.00 -1.26 -2.07 105.19 103.34 2qnf n GLY 5 Ca 0.07 -0.29 0.11 0.00 0.00 0.00 0.00 46.02 45.91 2qnf n GLY 5 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2qnf n LYS 6 N 7.14 0.13 0.00 1.61 2.85 -1.26 -3.13 118.16 125.50 2qnf n LYS 6 Ca 0.00 0.31 0.00 0.00 -1.05 0.00 0.00 58.31 57.57 2qnf n LYS 6 Cb 0.00 -1.73 0.00 0.00 -0.65 0.00 0.00 35.03 32.65 2qnf n LYS 6 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2qnf n LEU 7 N -1.97 0.00 0.05 -5.58 4.77 -0.88 -2.80 117.00 110.59 2qnf n LEU 7 Ca 0.03 0.41 -0.03 0.00 -0.03 0.00 0.00 56.01 56.40 2qnf n LEU 7 Cb 0.25 -0.41 -0.01 0.00 -2.33 0.00 0.00 43.42 40.92 2qnf n LEU 7 CO 0.20 -0.41 0.12 0.22 -1.33 0.00 0.00 177.39 176.19 2qnf h TYR 8 N 0.00 -0.16 -0.85 -1.77 3.20 -1.59 -2.85 116.97 112.96 2qnf h TYR 8 Ca 0.00 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.00 2qnf h TYR 8 Cb 0.07 0.05 -0.09 0.00 1.54 0.00 0.00 36.73 38.31 2qnf h TYR 8 CO 0.00 -0.10 0.45 0.87 -1.64 0.00 0.00 178.16 177.75 2qnf h LYS 9 N -0.59 0.66 0.68 1.82 1.57 -1.80 -2.23 116.57 116.68 2qnf h LYS 9 Ca -0.02 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 2qnf h LYS 9 Cb 0.13 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.29 2qnf h LYS 9 CO 0.03 0.43 -0.38 0.93 -0.57 0.00 0.00 179.45 179.89 2qnf h GLU 10 N 0.68 -0.95 -1.37 3.15 5.08 -1.70 -2.45 114.58 117.02 2qnf h GLU 10 Ca 0.45 0.06 0.40 0.00 -1.00 0.00 0.00 59.36 59.27 2qnf h GLU 10 Cb 0.58 0.22 -0.05 0.00 0.50 0.00 0.00 28.75 29.99 2qnf h GLU 10 CO -0.33 -0.63 1.11 1.49 -1.00 0.00 0.00 179.01 179.65 2qnf h GLU 11 N -0.98 0.00 0.57 2.33 4.57 -1.16 0.33 114.58 120.24 2qnf h GLU 11 Ca -0.09 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.06 2qnf h GLU 11 Cb 0.77 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.37 2qnf h GLU 11 CO 0.12 0.00 -0.27 0.87 -1.18 0.00 0.00 179.01 178.55 2qnf h LYS 12 N 0.00 -0.74 -0.69 1.92 1.57 -0.97 -2.75 116.57 114.91 2qnf h LYS 12 Ca 0.65 0.05 0.12 0.00 -1.87 0.00 0.00 60.65 59.60 2qnf h LYS 12 Cb 2.86 0.17 -0.13 0.00 0.08 0.00 0.00 32.23 35.22 2qnf h LYS 12 CO -0.01 -0.49 -0.35 0.37 -0.57 0.00 0.00 179.45 178.40 2qnf h GLN 13 N -1.20 -0.12 -0.66 3.15 5.75 -0.09 0.35 115.11 122.29 2qnf h GLN 13 Ca -0.08 0.01 0.10 0.00 -0.15 0.00 0.00 58.65 58.53 2qnf h GLN 13 Cb 0.59 0.03 -0.12 0.00 1.07 0.00 0.00 27.48 29.05 2qnf h GLN 13 CO 0.13 -0.08 -0.42 0.87 -2.65 0.00 0.00 178.83 176.68 2qnf h LYS 14 N -0.12 -0.17 0.00 1.69 1.57 -1.38 0.28 116.57 118.43 2qnf h LYS 14 Ca 0.26 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.03 2qnf h LYS 14 Cb 0.56 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 2qnf h LYS 14 CO -0.76 -0.11 -0.11 0.74 -0.57 0.00 0.00 179.45 178.64 2qnf h PHE 15 N -0.17 0.00 -0.19 -1.35 0.04 -0.69 -1.87 116.94 112.71 2qnf h PHE 15 Ca 0.21 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.84 2qnf h PHE 15 Cb 0.56 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 2qnf h PHE 15 CO -0.74 0.11 -0.48 -0.92 -0.60 0.00 0.00 178.31 175.68 2qnf h TYR 16 N 0.00 0.62 0.32 -0.55 5.03 0.10 -2.68 116.97 119.81 2qnf h TYR 16 Ca -0.00 -0.20 -0.02 0.00 2.58 0.00 0.00 58.73 61.10 2qnf h TYR 16 Cb 0.25 -0.12 0.00 0.00 1.55 0.00 0.00 36.73 38.40 2qnf h TYR 16 CO 0.00 0.89 -0.15 -0.44 -1.32 0.00 0.00 178.16 177.14 2qnf h ASP 17 N 0.40 -0.36 -0.37 -2.11 3.32 -0.77 -2.20 116.42 114.33 2qnf h ASP 17 Ca 0.02 0.01 0.11 0.00 0.02 0.00 0.00 57.03 57.19 2qnf h ASP 17 Cb 0.99 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 2qnf h ASP 17 CO 0.09 0.05 0.62 0.00 -1.72 0.00 0.00 179.24 178.28 2qnf h ALA 18 N -1.19 2.05 -0.29 3.45 0.00 -1.43 0.27 119.26 122.12 2qnf h ALA 18 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qnf h ALA 18 Cb 0.33 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2qnf h ALA 18 CO 0.07 -0.81 0.00 1.04 0.00 0.00 0.00 179.25 179.55 2qnf n GLN 19 N -3.27 2.29 -2.40 0.00 6.02 -1.01 -4.96 117.38 114.06 2qnf n GLN 19 Ca 0.07 -1.94 -0.20 0.00 -0.01 0.00 0.00 57.00 54.91 2qnf n GLN 19 Cb 0.77 -1.48 -0.01 0.00 1.02 0.00 0.00 30.24 30.54 2qnf n GLN 19 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2qnf n ASN 20 N 1.18 -5.81 -0.96 1.08 5.03 0.94 -2.21 115.26 114.50 2qnf n ASN 20 Ca 0.18 -0.00 -0.10 0.00 0.87 0.00 0.00 54.58 55.53 2qnf n ASN 20 Cb 0.54 -4.84 -0.02 0.00 -1.02 0.00 0.00 39.78 34.43 2qnf n ASN 20 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qnf n GLY 21 N -1.00 0.58 3.53 7.41 0.00 -0.84 -4.99 105.19 109.87 2qnf n GLY 21 Ca -0.24 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 2qnf n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qnf s LYS 22 N -3.65 2.20 -0.05 1.61 -0.14 -0.94 -0.48 119.74 118.29 2qnf s LYS 22 Ca 0.00 -0.93 -0.28 0.00 -1.36 0.00 0.00 55.97 53.40 2qnf s LYS 22 Cb 0.00 -2.30 -0.03 0.00 -1.68 0.00 0.00 37.83 33.82 2qnf s LYS 22 CO 0.00 0.55 0.90 0.00 -0.76 0.00 0.00 175.35 176.03 2qnf n LEU 24 N 4.19 0.19 0.03 0.00 4.77 -1.26 -0.27 117.00 124.64 2qnf n LEU 24 Ca 0.04 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 2qnf n LEU 24 Cb 0.50 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 2qnf n LEU 24 CO 0.50 0.05 0.00 -0.38 -1.33 0.00 0.00 177.39 176.23 2qnf n ILE 25 N -0.09 0.06 0.57 -0.08 5.41 -1.26 -4.82 119.36 119.15 2qnf n ILE 25 Ca 0.00 0.02 0.10 0.00 1.00 0.00 0.00 62.75 63.87 2qnf n ILE 25 Cb 0.05 -0.32 0.43 0.00 -0.71 0.00 0.00 39.64 39.09 2qnf n ILE 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qnf n GLN 27 N -1.79 -1.54 -2.19 0.00 1.13 0.62 -4.94 117.38 108.68 2qnf n GLN 27 Ca 0.04 1.04 -0.27 0.00 -1.94 0.00 0.00 57.00 55.87 2qnf n GLN 27 Cb 0.24 -5.42 0.14 0.00 0.11 0.00 0.00 30.24 25.32 2qnf n GLN 27 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2qnf s ARG 28 N -3.35 1.24 -0.36 -1.09 0.52 -1.26 -4.56 118.95 110.08 2qnf s ARG 28 Ca 0.00 -0.61 -0.29 0.00 -0.52 0.00 0.00 55.73 54.31 2qnf s ARG 28 Cb 0.00 -2.06 0.01 0.00 0.52 0.00 0.00 34.95 33.42 2qnf s ARG 28 CO 0.00 -1.90 1.24 -1.21 0.02 0.00 0.00 175.30 173.45 2qnf s GLU 29 N -5.54 3.84 0.60 3.54 8.01 -1.26 -1.60 118.70 126.28 2qnf s GLU 29 Ca 0.69 1.00 -0.19 0.00 0.01 0.00 0.00 54.97 56.48 2qnf s GLU 29 Cb -0.05 -3.89 -0.04 0.00 -4.31 0.00 0.00 34.13 25.84 2qnf s GLU 29 CO 0.49 -1.22 1.18 1.28 0.01 0.00 0.00 175.26 176.99 2qnf n LEU 30 N 7.76 4.95 -4.53 1.80 4.77 0.36 -4.88 117.00 127.24 2qnf n LEU 30 Ca 0.14 0.86 -0.40 0.00 -0.03 0.00 0.00 56.01 56.58 2qnf n LEU 30 Cb 0.47 -1.49 0.02 0.00 -2.33 0.00 0.00 43.42 40.09 2qnf n LEU 30 CO 0.66 -1.23 0.30 -3.20 -1.33 0.00 0.00 177.39 172.59 2qnf n ASN 31 N -1.19 -0.01 0.14 -1.43 2.85 -1.26 -4.87 115.26 109.50 2qnf n ASN 31 Ca 0.14 0.90 -0.14 0.00 -0.11 0.00 0.00 54.58 55.37 2qnf n ASN 31 Cb 0.47 -1.24 -0.08 0.00 1.24 0.00 0.00 39.78 40.17 2qnf n ASN 31 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2qnf h PRO 32 N 0.87 -0.27 -5.97 1.20 0.13 -1.99 -3.38 132.00 122.59 2qnf h PRO 32 Ca -0.44 0.02 -0.61 0.00 -0.87 0.00 0.00 66.00 64.10 2qnf h PRO 32 Cb 1.37 0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.56 2qnf h PRO 32 CO 0.52 -0.17 1.48 -3.47 -0.23 0.00 0.00 178.00 176.13 2qnf n ASP 33 N -5.21 2.88 0.53 1.44 -0.08 -1.26 -4.86 116.55 110.00 2qnf n ASP 33 Ca -0.09 0.25 -0.21 0.00 -1.51 0.00 0.00 54.79 53.23 2qnf n ASP 33 Cb 0.14 -1.47 -0.10 0.00 2.34 0.00 0.00 41.12 42.03 2qnf n ASP 33 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 2qnf h VAL 34 N 7.16 0.00 -0.27 5.18 2.07 -1.98 -3.18 116.25 125.23 2qnf h VAL 34 Ca -0.36 -0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.24 2qnf h VAL 34 Cb 1.27 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2qnf h VAL 34 CO 0.98 0.00 0.51 1.56 0.02 0.00 0.00 177.57 180.64 2qnf h GLN 35 N -1.35 0.00 -0.00 1.57 1.08 -1.93 -1.80 115.11 112.68 2qnf h GLN 35 Ca -0.14 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.06 2qnf h GLN 35 Cb 1.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.46 2qnf h GLN 35 CO 0.23 0.00 -0.03 0.00 -0.95 0.00 0.00 178.83 178.07 2qnf n ALA 36 N -2.09 2.67 -2.23 3.87 0.00 -1.20 -4.84 120.51 116.68 2qnf n ALA 36 Ca 0.04 -0.26 -0.31 0.00 0.00 0.00 0.00 53.44 52.92 2qnf n ALA 36 Cb 0.63 -1.39 -0.04 0.00 0.00 0.00 0.00 19.45 18.65 2qnf n ALA 36 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2qnf s ASN 37 N -2.19 6.57 -0.15 0.00 0.01 -0.68 -4.81 114.94 113.69 2qnf s ASN 37 Ca 0.39 1.09 -0.24 0.00 -0.71 0.00 0.00 52.86 53.39 2qnf s ASN 37 Cb 0.21 -2.30 -0.02 0.00 0.41 0.00 0.00 41.25 39.55 2qnf s ASN 37 CO 0.40 -0.32 0.77 -1.00 -1.51 0.00 0.00 177.10 175.45 2qnf s HIS 38 N -2.22 3.45 -1.03 2.20 3.76 -0.11 -4.88 115.29 116.46 2qnf s HIS 38 Ca 0.51 1.21 -0.20 0.00 -0.15 0.00 0.00 55.06 56.43 2qnf s HIS 38 Cb -0.10 -2.94 0.10 0.00 1.11 0.00 0.00 32.58 30.75 2qnf s HIS 38 CO 0.28 -0.15 1.34 -1.17 -0.85 0.00 0.00 174.74 174.19 2qnf s LEU 39 N 1.80 4.34 1.02 0.89 2.96 -1.26 0.41 118.68 128.83 2qnf s LEU 39 Ca 0.37 -1.96 -0.11 0.00 -0.22 0.00 0.00 54.13 52.20 2qnf s LEU 39 Cb -0.17 -2.48 0.20 0.00 0.50 0.00 0.00 46.19 44.24 2qnf s LEU 39 CO 0.14 -1.21 1.09 -0.67 -1.32 0.00 0.00 176.35 174.37 2qnf n ASP 40 N 7.52 -0.49 -3.53 3.68 2.03 -1.25 -4.94 116.55 119.58 2qnf n ASP 40 Ca 0.31 0.19 -0.09 0.00 0.52 0.00 0.00 54.79 55.73 2qnf n ASP 40 Cb 0.49 -1.39 -0.03 0.00 -0.72 0.00 0.00 41.12 39.47 2qnf n ASP 40 CO 0.00 0.00 0.00 -1.38 -1.92 0.00 0.00 177.20 173.90 2qnf s HIS 41 N -2.55 -0.36 -0.24 -0.67 -3.43 -1.26 -2.78 115.29 104.01 2qnf s HIS 41 Ca 0.67 0.36 -0.29 0.00 -0.80 0.00 0.00 55.06 55.00 2qnf s HIS 41 Cb -0.24 0.51 0.00 0.00 -1.43 0.00 0.00 32.58 31.42 2qnf s HIS 41 CO 0.61 -0.48 1.15 0.34 -2.00 0.00 0.00 174.74 174.36 2qnf s ASP 42 N -2.04 6.95 -0.02 7.38 -1.08 -0.74 -4.88 116.67 122.23 2qnf s ASP 42 Ca 0.03 1.37 0.13 0.00 -0.52 0.00 0.00 52.55 53.56 2qnf s ASP 42 Cb -0.01 -2.54 0.40 0.00 -1.46 0.00 0.00 42.92 39.32 2qnf s ASP 42 CO -0.05 -0.80 1.31 -0.46 0.52 0.00 0.00 175.17 175.68 2qnf n ASN 43 N 6.72 2.58 -4.58 -0.34 6.94 -1.26 -1.08 115.26 124.24 2qnf n ASN 43 Ca 0.13 -2.09 -0.30 0.00 -0.02 0.00 0.00 54.58 52.30 2qnf n ASN 43 Cb 0.46 -0.34 0.20 0.00 -2.36 0.00 0.00 39.78 37.74 2qnf n ASN 43 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2qnf n GLU 44 N 0.72 -1.25 -0.01 -3.83 -0.58 -1.26 -4.85 120.64 109.58 2qnf n GLU 44 Ca 0.15 -0.31 0.02 0.00 -0.42 0.00 0.00 57.16 56.60 2qnf n GLU 44 Cb 0.44 -2.28 -0.07 0.00 -0.57 0.00 0.00 31.44 28.97 2qnf n GLU 44 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2qnf n LEU 45 N -4.41 0.00 -4.53 -4.62 4.77 -1.26 -3.67 117.00 103.28 2qnf n LEU 45 Ca 0.08 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.81 2qnf n LEU 45 Cb 0.53 0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.56 2qnf n LEU 45 CO 0.52 0.05 -0.39 0.20 -1.33 0.00 0.00 177.39 176.44 2qnf s ASN 46 N -3.24 3.64 0.00 -1.43 0.01 -1.26 -4.92 114.94 107.75 2qnf s ASN 46 Ca -0.03 -1.19 0.00 0.00 -0.71 0.00 0.00 52.86 50.93 2qnf s ASN 46 Cb 0.05 -0.33 0.00 0.00 0.41 0.00 0.00 41.25 41.38 2qnf s ASN 46 CO 0.36 -0.20 0.00 0.61 -1.51 0.00 0.00 177.10 176.36 2qnf n GLY 47 N -0.76 -0.80 0.07 0.66 0.00 -1.26 -4.23 105.19 98.86 2qnf n GLY 47 Ca -0.05 -1.67 0.13 0.00 0.00 0.00 0.00 46.02 44.43 2qnf n GLY 47 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qnf n PRO 48 N -0.87 0.15 0.00 1.61 -0.04 -1.26 -2.73 135.00 131.86 2qnf n PRO 48 Ca 0.00 0.18 0.15 0.00 -0.04 0.00 0.00 63.50 63.79 2qnf n PRO 48 Cb 0.00 -1.69 0.88 0.00 -0.04 0.00 0.00 33.50 32.64 2qnf n PRO 48 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2qnf n LYS 49 N -1.96 0.88 -1.69 0.54 5.02 -1.26 -4.83 118.16 114.85 2qnf n LYS 49 Ca 0.05 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.92 2qnf n LYS 49 Cb 0.36 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.84 2qnf n LYS 49 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qnf s ALA 50 N -2.08 3.08 -1.32 7.82 0.00 -1.11 -3.37 121.76 124.79 2qnf s ALA 50 Ca 0.43 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.32 2qnf s ALA 50 Cb 0.21 -3.97 0.00 0.00 0.00 0.00 0.00 23.12 19.35 2qnf s ALA 50 CO 0.36 -2.28 0.00 0.41 0.00 0.00 0.00 175.76 174.25 2qnf n GLY 51 N 5.22 1.19 3.72 0.00 0.00 -0.24 -4.97 105.19 110.10 2qnf n GLY 51 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 2qnf n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qnf s LYS 52 N -3.05 4.49 0.58 1.61 -0.14 -1.22 -4.69 119.74 117.32 2qnf s LYS 52 Ca 0.00 1.10 -0.20 0.00 -1.36 0.00 0.00 55.97 55.51 2qnf s LYS 52 Cb 0.00 -3.45 -0.03 0.00 -1.68 0.00 0.00 37.83 32.67 2qnf s LYS 52 CO 0.00 0.04 1.34 0.08 -0.76 0.00 0.00 175.35 176.04 2qnf s VAL 53 N 0.82 2.05 -0.10 3.17 1.01 -1.26 -1.79 120.40 124.29 2qnf s VAL 53 Ca 0.43 0.04 0.08 0.00 0.00 0.00 0.00 61.98 62.52 2qnf s VAL 53 Cb -0.19 -3.02 -0.11 0.00 0.00 0.00 0.00 36.38 33.06 2qnf s VAL 53 CO 0.22 -0.00 0.21 0.54 0.00 0.00 0.00 175.10 176.07 2qnf n ARG 54 N -1.35 1.40 0.00 2.72 1.74 -1.12 -4.85 116.66 115.20 2qnf n ARG 54 Ca 0.12 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.15 2qnf n ARG 54 Cb 0.46 -1.09 0.00 0.00 -1.02 0.00 0.00 32.46 30.81 2qnf n ARG 54 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qnf n GLY 55 N 1.83 4.29 3.68 -0.13 0.00 -1.26 -5.04 105.19 108.56 2qnf n GLY 55 Ca -0.01 -1.11 -0.50 0.00 0.00 0.00 0.00 46.02 44.41 2qnf n GLY 55 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2qnf n LEU 56 N 0.00 3.10 -4.43 0.99 7.94 -1.26 -3.74 117.00 119.59 2qnf n LEU 56 Ca 0.00 1.02 -0.22 0.00 -1.11 0.00 0.00 56.01 55.70 2qnf n LEU 56 Cb 0.00 -1.33 -0.10 0.00 0.53 0.00 0.00 43.42 42.52 2qnf n LEU 56 CO 0.00 -0.22 -0.46 -0.76 -1.11 0.00 0.00 177.39 174.84 2qnf s LEU 57 N 3.24 2.58 0.56 -1.96 1.43 0.16 -4.41 118.68 120.29 2qnf s LEU 57 Ca 0.91 -1.03 -0.20 0.00 -1.03 0.00 0.00 54.13 52.77 2qnf s LEU 57 Cb -0.77 -0.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 2qnf s LEU 57 CO 0.52 -0.04 1.27 0.00 0.23 0.00 0.00 176.35 178.32 2qnf h ASN 59 N 1.21 -1.38 -0.34 0.00 -1.07 -1.92 -1.17 115.58 110.91 2qnf h ASN 59 Ca -0.51 0.25 0.05 0.00 0.07 0.00 0.00 56.30 56.17 2qnf h ASN 59 Cb 1.30 0.66 -0.08 0.00 -2.07 0.00 0.00 38.32 38.13 2qnf h ASN 59 CO 0.56 -0.31 -0.50 -0.07 0.07 0.00 0.00 177.43 177.17 2qnf h LEU 60 N -0.17 -1.66 -0.68 6.14 3.38 -2.00 -2.39 115.31 117.94 2qnf h LEU 60 Ca 0.22 0.22 -0.11 0.00 0.09 0.00 0.00 57.88 58.30 2qnf h LEU 60 Cb 0.56 0.69 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 2qnf h LEU 60 CO -0.73 -0.41 -0.17 0.00 0.09 0.00 0.00 178.44 177.21 2qnf h ASN 62 N 0.75 0.78 -0.12 0.00 -1.24 -0.74 -1.39 115.58 113.62 2qnf h ASN 62 Ca 0.11 -0.12 -0.07 0.00 0.71 0.00 0.00 56.30 56.93 2qnf h ASN 62 Cb 0.69 -0.20 -0.00 0.00 0.73 0.00 0.00 38.32 39.54 2qnf h ASN 62 CO 0.05 0.74 -0.19 0.00 -1.29 0.00 0.00 177.43 176.75 2qnf h ALA 63 N 1.37 0.19 -0.43 1.57 0.00 -1.40 -2.61 119.26 117.93 2qnf h ALA 63 Ca 0.19 -0.36 0.04 0.00 0.00 0.00 0.00 54.91 54.78 2qnf h ALA 63 Cb 0.25 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2qnf h ALA 63 CO -0.01 0.12 0.29 0.00 0.00 0.00 0.00 179.25 179.65 2qnf h ALA 64 N 0.56 1.88 0.24 0.00 0.00 -1.16 0.16 119.26 120.94 2qnf h ALA 64 Ca 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2qnf h ALA 64 Cb 0.75 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2qnf h ALA 64 CO 0.04 0.05 -0.11 1.49 0.00 0.00 0.00 179.25 180.72 2qnf h GLU 65 N 0.42 -0.31 -1.17 0.00 4.22 -1.19 -1.96 114.58 114.59 2qnf h GLU 65 Ca 0.18 0.02 0.33 0.00 0.08 0.00 0.00 59.36 59.98 2qnf h GLU 65 Cb 0.20 0.07 -0.09 0.00 0.50 0.00 0.00 28.75 29.44 2qnf h GLU 65 CO -0.04 -0.20 0.79 0.78 -2.18 0.00 0.00 179.01 178.15 2qnf h GLY 66 N -0.47 0.82 1.00 1.92 0.00 -1.36 0.42 103.07 105.40 2qnf h GLY 66 Ca -0.03 -0.12 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 2qnf h GLY 66 CO 0.05 -0.14 0.19 -1.61 0.00 0.00 0.00 176.54 175.03 2qnf h GLN 67 N 0.20 0.92 -0.16 4.80 5.75 -0.85 -1.71 115.11 124.06 2qnf h GLN 67 Ca 0.64 -0.20 -0.01 0.00 -0.15 0.00 0.00 58.65 58.93 2qnf h GLN 67 Cb 2.02 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 30.43 2qnf h GLN 67 CO -0.22 0.82 0.05 0.52 -2.65 0.00 0.00 178.83 177.35 2qnf h MET 68 N 0.84 0.24 -0.37 1.69 2.86 0.62 -1.94 114.93 118.87 2qnf h MET 68 Ca 0.19 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.82 2qnf h MET 68 Cb 0.28 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.86 2qnf h MET 68 CO -0.01 0.35 0.14 -0.22 1.06 0.00 0.00 176.91 178.23 2qnf h LYS 69 N 0.08 0.30 0.36 1.72 3.64 -1.34 -0.59 116.57 120.74 2qnf h LYS 69 Ca 0.05 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2qnf h LYS 69 Cb 0.20 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 2qnf h LYS 69 CO -0.00 0.20 -0.39 1.25 -2.27 0.00 0.00 179.45 178.24 2qnf h HIS 70 N 0.30 -1.05 -0.35 1.91 2.76 -1.20 0.21 115.15 117.74 2qnf h HIS 70 Ca 0.16 0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.44 2qnf h HIS 70 Cb 0.12 0.41 -0.01 0.00 1.55 0.00 0.00 27.41 29.48 2qnf h HIS 70 CO -0.13 -0.53 0.31 0.87 -1.30 0.00 0.00 177.93 177.14 2qnf h LYS 71 N -0.77 0.00 0.36 5.26 1.79 -1.08 -1.39 116.57 120.73 2qnf h LYS 71 Ca -0.02 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.43 2qnf h LYS 71 Cb 0.70 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.36 2qnf h LYS 71 CO -0.08 0.00 -0.17 0.35 -1.08 0.00 0.00 179.45 178.47 2qnf h PHE 72 N 0.00 -0.44 -0.10 -1.35 3.57 0.37 -2.02 116.94 116.96 2qnf h PHE 72 Ca 0.17 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.68 2qnf h PHE 72 Cb 0.78 0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.66 2qnf h PHE 72 CO 0.00 -0.27 0.45 -0.91 -2.23 0.00 0.00 178.31 175.35 2qnf h ASN 73 N -1.12 0.00 0.24 0.41 2.35 -0.09 0.14 115.58 117.50 2qnf h ASN 73 Ca -0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 2qnf h ASN 73 Cb 0.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.75 2qnf h ASN 73 CO 0.08 0.00 -1.65 0.54 -1.65 0.00 0.00 177.43 174.75 2qnf n ARG 74 N -3.00 0.58 -0.01 0.81 5.12 -0.58 -4.39 116.66 115.20 2qnf n ARG 74 Ca 0.00 -0.10 -0.10 0.00 -1.93 0.00 0.00 57.85 55.72 2qnf n ARG 74 Cb 0.52 -1.59 -0.04 0.00 -1.16 0.00 0.00 32.46 30.19 2qnf n ARG 74 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2qnf h SER 75 N 0.00 -0.18 0.00 0.55 4.64 0.06 -3.47 113.55 115.15 2qnf h SER 75 Ca 0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2qnf h SER 75 Cb 0.95 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2qnf h SER 75 CO 0.00 -0.07 0.00 0.61 -0.87 0.00 0.00 176.83 176.50 2qnf n GLY 76 N -1.19 1.70 0.38 -0.77 0.00 -1.24 -4.95 105.19 99.12 2qnf n GLY 76 Ca -0.04 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.18 2qnf n GLY 76 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qnf h LEU 77 N 0.00 0.00 -0.56 0.99 3.38 -1.90 0.19 115.31 117.41 2qnf h LEU 77 Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 2qnf h LEU 77 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2qnf h LEU 77 CO 0.00 0.00 -0.37 0.50 0.09 0.00 0.00 178.44 178.66 2qnf h LYS 78 N 0.00 0.74 0.00 1.13 3.64 -1.80 -2.04 116.57 118.24 2qnf h LYS 78 Ca 0.19 -0.37 -0.01 0.00 -1.27 0.00 0.00 60.65 59.19 2qnf h LYS 78 Cb 1.04 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.86 2qnf h LYS 78 CO -0.00 0.99 -0.05 0.78 -2.27 0.00 0.00 179.45 178.90 2qnf h GLY 79 N 0.94 0.00 -3.57 5.01 0.00 -0.96 -1.11 103.07 103.37 2qnf h GLY 79 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.96 2qnf h GLY 79 CO 0.08 0.00 0.55 -1.06 0.00 0.00 0.00 176.54 176.11 2qnf n GLN 80 N -3.28 2.04 -3.50 4.80 1.13 -0.94 -4.89 117.38 112.73 2qnf n GLN 80 Ca -0.01 -2.28 -0.24 0.00 -1.94 0.00 0.00 57.00 52.53 2qnf n GLN 80 Cb 0.23 -1.89 -0.02 0.00 0.11 0.00 0.00 30.24 28.66 2qnf n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qnf n GLY 81 N -0.52 -0.47 3.88 1.08 0.00 -0.42 -4.95 105.19 103.80 2qnf n GLY 81 Ca 0.45 0.07 -0.36 0.00 0.00 0.00 0.00 46.02 46.18 2qnf n GLY 81 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qnf s VAL 82 N -2.87 5.45 -0.05 1.61 1.01 -0.81 -5.03 120.40 119.71 2qnf s VAL 82 Ca 0.44 0.19 -0.13 0.00 0.00 0.00 0.00 61.98 62.48 2qnf s VAL 82 Cb -0.24 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 2qnf s VAL 82 CO 0.54 0.55 0.35 -0.62 0.00 0.00 0.00 175.10 175.92 2qnf s ASP 83 N -1.23 6.68 0.00 3.32 2.15 -1.26 -4.40 116.67 121.93 2qnf s ASP 83 Ca 0.18 0.81 0.00 0.00 0.43 0.00 0.00 52.55 53.98 2qnf s ASP 83 Cb -0.13 -2.21 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 2qnf s ASP 83 CO 0.08 0.30 0.78 0.00 -0.17 0.00 0.00 175.17 176.15 2qnf n TYR 84 N 2.16 0.00 -0.33 -5.34 9.36 -1.26 0.84 117.16 122.60 2qnf n TYR 84 Ca -0.14 0.00 0.26 0.00 3.32 0.00 0.00 57.90 61.34 2qnf n TYR 84 Cb 0.53 -0.28 0.50 0.00 -0.63 0.00 0.00 39.34 39.46 2qnf n TYR 84 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 2qnf h LEU 85 N 0.00 0.29 0.69 2.98 3.38 -1.99 0.13 115.31 120.79 2qnf h LEU 85 Ca 0.00 0.23 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 2qnf h LEU 85 Cb 0.00 0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.00 2qnf h LEU 85 CO 0.00 -0.31 -0.33 -0.08 0.09 0.00 0.00 178.44 177.81 2qnf h GLU 86 N 0.13 -0.89 -0.40 1.13 4.81 -1.81 -2.59 114.58 114.96 2qnf h GLU 86 Ca 0.77 0.06 0.08 0.00 -0.13 0.00 0.00 59.36 60.14 2qnf h GLU 86 Cb 1.88 0.20 -0.08 0.00 0.63 0.00 0.00 28.75 31.39 2qnf h GLU 86 CO -0.72 -0.56 -0.13 2.35 -0.73 0.00 0.00 179.01 179.22 2qnf h TRP 87 N -1.15 -0.29 -0.16 0.92 7.01 0.29 -2.02 115.95 120.56 2qnf h TRP 87 Ca -0.09 0.04 0.05 0.00 2.11 0.00 0.00 58.89 60.99 2qnf h TRP 87 Cb 0.74 0.19 -0.05 0.00 -2.10 0.00 0.00 29.16 27.93 2qnf h TRP 87 CO 0.00 -0.20 -0.19 1.25 -2.79 0.00 0.00 178.44 176.51 2qnf h LEU 88 N -0.04 -0.59 -0.39 0.65 6.46 -0.93 -1.11 115.31 119.37 2qnf h LEU 88 Ca 0.20 0.11 0.07 0.00 -0.12 0.00 0.00 57.88 58.13 2qnf h LEU 88 Cb 0.33 0.28 -0.06 0.00 -0.73 0.00 0.00 40.66 40.48 2qnf h LEU 88 CO -0.43 -0.23 0.04 -0.08 -0.62 0.00 0.00 178.44 177.12 2qnf h GLU 89 N -0.22 0.15 -0.58 1.25 4.81 -1.01 0.11 114.58 119.09 2qnf h GLU 89 Ca 0.11 -0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.43 2qnf h GLU 89 Cb 0.38 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 2qnf h GLU 89 CO -0.29 0.10 0.39 -0.91 -0.73 0.00 0.00 179.01 177.57 2qnf h ASN 90 N 0.16 0.33 0.17 1.04 2.35 -0.66 -1.44 115.58 117.54 2qnf h ASN 90 Ca 0.19 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.94 2qnf h ASN 90 Cb 0.25 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.56 2qnf h ASN 90 CO -0.28 0.20 -0.08 0.25 -1.65 0.00 0.00 177.43 175.87 2qnf h LEU 91 N 0.37 -0.20 -0.49 1.61 5.85 0.33 -2.74 115.31 120.04 2qnf h LEU 91 Ca 0.27 -0.32 0.10 0.00 0.84 0.00 0.00 57.88 58.77 2qnf h LEU 91 Cb 0.56 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.55 2qnf h LEU 91 CO -0.07 0.26 -0.15 0.25 -0.34 0.00 0.00 178.44 178.39 2qnf h LEU 92 N -0.72 -0.54 -2.06 2.25 5.85 -0.33 0.47 115.31 120.24 2qnf h LEU 92 Ca -0.02 0.16 0.09 0.00 0.84 0.00 0.00 57.88 58.94 2qnf h LEU 92 Cb 0.50 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 2qnf h LEU 92 CO 0.04 -0.19 0.24 0.74 -0.34 0.00 0.00 178.44 178.93 2qnf h THR 93 N -0.03 0.73 0.03 1.05 2.02 -1.33 -1.50 112.91 113.89 2qnf h THR 93 Ca 0.23 0.00 -0.25 0.00 0.77 0.00 0.00 66.41 67.17 2qnf h THR 93 Cb 0.39 0.83 0.01 0.00 -1.74 0.00 0.00 68.15 67.64 2qnf h THR 93 CO -0.52 0.00 -1.04 0.22 0.37 0.00 0.00 175.52 174.55 2qnf h TYR 94 N 0.00 0.71 0.00 3.16 3.20 0.18 -3.30 116.97 120.92 2qnf h TYR 94 Ca 0.15 -0.41 -0.09 0.00 3.14 0.00 0.00 58.73 61.52 2qnf h TYR 94 Cb 0.63 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 2qnf h TYR 94 CO 0.00 1.25 -0.78 -0.07 -1.64 0.00 0.00 178.16 176.92 2qnf h LEU 95 N 0.24 0.00 -0.04 2.82 3.38 -0.13 -3.26 115.31 118.32 2qnf h LEU 95 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2qnf h LEU 95 Cb 1.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.44 2qnf h LEU 95 CO 0.18 0.37 0.00 0.29 0.09 0.00 0.00 178.44 179.37 2qnf n LYS 96 N -3.02 0.26 -0.62 1.13 5.02 -0.80 -4.86 118.16 115.26 2qnf n LYS 96 Ca -0.01 0.23 -0.30 0.00 -2.02 0.00 0.00 58.31 56.20 2qnf n LYS 96 Cb 0.70 -1.81 0.19 0.00 -0.02 0.00 0.00 35.03 34.10 2qnf n LYS 96 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2qnf s SER 97 N -4.50 2.29 -0.12 4.39 1.04 -1.23 -5.00 113.70 110.58 2qnf s SER 97 Ca 0.10 2.04 -0.04 0.00 0.48 0.00 0.00 55.95 58.53 2qnf s SER 97 Cb 0.12 -2.51 -0.03 0.00 0.10 0.00 0.00 66.02 63.69 2qnf s SER 97 CO 0.58 -3.47 0.02 -0.62 0.98 0.00 0.00 173.24 170.73 2qnf s ASP 98 N -2.58 5.38 0.00 7.02 -1.08 -1.26 -4.92 116.67 119.23 2qnf s ASP 98 Ca 0.67 0.13 0.00 0.00 -0.52 0.00 0.00 52.55 52.83 2qnf s ASP 98 Cb -0.24 -1.68 0.00 0.00 -1.46 0.00 0.00 42.92 39.54 2qnf s ASP 98 CO 0.60 0.31 0.35 0.00 0.52 0.00 0.00 175.17 176.95 2qnf n TYR 99 N 2.60 0.00 0.00 -5.34 4.11 -1.26 -4.84 117.16 112.43 2qnf n TYR 99 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.72 2qnf n TYR 99 Cb 0.53 0.01 0.00 0.00 -0.00 0.00 0.00 39.34 39.88 2qnf n TYR 99 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 2qnf n THR 100 N 0.00 0.65 0.28 -3.48 -2.24 -1.26 0.19 114.28 108.43 2qnf n THR 100 Ca 0.00 0.38 0.10 0.00 -2.27 0.00 0.00 64.05 62.26 2qnf n THR 100 Cb 0.44 -1.38 -0.15 0.00 -2.10 0.00 0.00 70.33 67.15 2qnf n THR 100 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qnf n GLN 101 N -1.09 0.55 -0.56 -0.78 1.13 -1.26 -5.00 117.38 110.36 2qnf n GLN 101 Ca 0.00 -0.13 -0.25 0.00 -1.94 0.00 0.00 57.00 54.67 2qnf n GLN 101 Cb 0.22 -1.48 0.23 0.00 0.11 0.00 0.00 30.24 29.32 2qnf n GLN 101 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2qnf n ASN 102 N -1.99 -2.82 -4.88 1.08 3.02 0.52 -5.03 115.26 105.16 2qnf n ASN 102 Ca -0.01 -0.91 -0.30 0.00 -0.03 0.00 0.00 54.58 53.32 2qnf n ASN 102 Cb 0.47 -0.84 -0.04 0.00 -0.61 0.00 0.00 39.78 38.76 2qnf n ASN 102 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2qnf s ASN 103 N -3.50 6.54 -0.09 6.41 -0.87 -1.26 -5.08 114.94 117.10 2qnf s ASN 103 Ca 0.58 1.04 -0.18 0.00 -1.57 0.00 0.00 52.86 52.73 2qnf s ASN 103 Cb -0.08 -2.28 -0.05 0.00 -0.02 0.00 0.00 41.25 38.83 2qnf s ASN 103 CO 0.47 -0.30 0.47 -0.63 -2.57 0.00 0.00 177.10 174.53 2qnf s ILE 104 N -2.22 5.13 0.57 0.60 1.01 -1.26 -5.07 121.20 119.96 2qnf s ILE 104 Ca 0.50 0.95 -0.19 0.00 0.00 0.00 0.00 60.65 61.91 2qnf s ILE 104 Cb -0.10 -3.81 -0.05 0.00 0.01 0.00 0.00 42.46 38.51 2qnf s ILE 104 CO 0.28 0.38 1.18 -2.28 0.00 0.00 0.00 174.94 174.51 2qnf s HIS 105 N 0.24 2.50 0.08 3.97 5.65 -1.26 -4.98 115.29 121.49 2qnf s HIS 105 Ca 0.26 1.52 -0.28 0.00 0.25 0.00 0.00 55.06 56.81 2qnf s HIS 105 Cb -0.16 -3.42 -0.17 0.00 -1.18 0.00 0.00 32.58 27.66 2qnf s HIS 105 CO 0.11 -1.97 1.69 -1.35 -0.65 0.00 0.00 174.74 172.57 2qnf h PRO 106 N 1.05 -0.42 0.00 2.88 0.11 -2.03 -2.19 132.00 131.40 2qnf h PRO 106 Ca -0.50 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2qnf h PRO 106 Cb 1.28 0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.49 2qnf h PRO 106 CO 0.56 -0.28 0.18 0.09 -0.21 0.00 0.00 178.00 178.34 2qnf n ASN 107 N -5.28 0.20 -0.14 -2.05 3.02 -1.26 -1.15 115.26 108.60 2qnf n ASN 107 Ca -0.10 0.48 -0.07 0.00 -0.03 0.00 0.00 54.58 54.85 2qnf n ASN 107 Cb 0.19 -0.47 0.08 0.00 -0.61 0.00 0.00 39.78 38.97 2qnf n ASN 107 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2qnf h PHE 108 N 0.00 0.99 0.69 3.10 3.57 -1.77 -0.02 116.94 123.50 2qnf h PHE 108 Ca 0.00 -0.18 -0.03 0.00 3.53 0.00 0.00 57.97 61.28 2qnf h PHE 108 Cb 0.36 -0.25 0.01 0.00 2.79 0.00 0.00 35.95 38.85 2qnf h PHE 108 CO 0.00 0.93 -0.33 0.28 -2.23 0.00 0.00 178.31 176.96 2qnf h VAL 109 N 0.81 0.00 -0.92 1.41 2.07 -1.31 -1.95 116.25 116.37 2qnf h VAL 109 Ca 0.14 -0.03 0.21 0.00 0.82 0.00 0.00 66.70 67.84 2qnf h VAL 109 Cb 0.60 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.19 2qnf h VAL 109 CO 0.04 0.00 -0.12 1.23 0.02 0.00 0.00 177.57 178.74 2qnf h GLY 110 N -0.96 0.87 1.30 2.17 0.00 -1.62 0.25 103.07 105.08 2qnf h GLY 110 Ca -0.10 0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.41 2qnf h GLY 110 CO 0.16 -0.39 0.09 -0.55 0.00 0.00 0.00 176.54 175.84 2qnf h ASP 111 N 0.02 0.82 -0.18 0.19 5.19 -0.97 -1.13 116.42 120.35 2qnf h ASP 111 Ca 0.49 -0.17 -0.21 0.00 -0.62 0.00 0.00 57.03 56.52 2qnf h ASP 111 Cb 0.85 -0.22 0.01 0.00 0.18 0.00 0.00 39.33 40.15 2qnf h ASP 111 CO -0.90 0.83 -0.69 0.50 -3.12 0.00 0.00 179.24 175.86 2qnf h LYS 112 N 0.82 0.79 -0.37 3.56 1.63 0.20 -2.38 116.57 120.82 2qnf h LYS 112 Ca 0.17 -0.60 -0.08 0.00 -0.85 0.00 0.00 60.65 59.29 2qnf h LYS 112 Cb 0.36 0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.09 2qnf h LYS 112 CO 0.01 1.22 -0.10 0.77 -3.45 0.00 0.00 179.45 177.89 2qnf h SER 113 N 0.53 0.62 -0.26 4.20 0.02 -0.84 -1.39 113.55 116.43 2qnf h SER 113 Ca -0.03 -0.17 -0.06 0.00 -0.84 0.00 0.00 61.79 60.68 2qnf h SER 113 Cb 1.31 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.67 2qnf h SER 113 CO 0.14 0.76 -0.04 0.50 -1.14 0.00 0.00 176.83 177.06 2qnf h LYS 114 N 0.59 0.60 0.00 3.45 3.64 -1.11 -1.31 116.57 122.43 2qnf h LYS 114 Ca 0.11 -0.15 -0.11 0.00 -1.27 0.00 0.00 60.65 59.22 2qnf h LYS 114 Cb 0.52 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 2qnf h LYS 114 CO 0.03 0.65 -0.52 1.49 -2.27 0.00 0.00 179.45 178.83 2qnf h GLU 115 N 0.57 0.00 0.00 1.90 4.81 -1.08 -3.15 114.58 117.63 2qnf h GLU 115 Ca 0.11 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.19 2qnf h GLU 115 Cb 0.42 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 2qnf h GLU 115 CO 0.02 0.52 -0.71 0.35 -0.73 0.00 0.00 179.01 178.46 2qnf h PHE 116 N 0.00 0.00 -0.14 0.92 3.57 -0.82 -3.20 116.94 117.27 2qnf h PHE 116 Ca -0.01 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 2qnf h PHE 116 Cb 1.39 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.12 2qnf h PHE 116 CO 0.00 0.71 -0.16 0.66 -2.23 0.00 0.00 178.31 177.29 2qnf h SER 117 N 0.00 0.22 0.00 0.41 4.64 -1.21 -2.63 113.55 114.98 2qnf h SER 117 Ca -0.01 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 2qnf h SER 117 Cb 1.33 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2qnf h SER 117 CO 0.09 0.40 0.00 0.54 -0.87 0.00 0.00 176.83 176.99 2qnf n ARG 118 N -4.25 0.64 -3.99 4.77 1.74 -1.21 -4.82 116.66 109.54 2qnf n ARG 118 Ca -0.01 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.84 2qnf n ARG 118 Cb 0.29 -1.32 -0.06 0.00 -1.02 0.00 0.00 32.46 30.35 2qnf n ARG 118 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2qnf s LEU 119 N 0.00 3.31 0.25 0.55 1.43 -0.99 -5.12 118.68 118.11 2qnf s LEU 119 Ca 0.00 -0.78 -0.16 0.00 -1.03 0.00 0.00 54.13 52.16 2qnf s LEU 119 Cb 0.00 -1.80 -0.08 0.00 0.03 0.00 0.00 46.19 44.33 2qnf s LEU 119 CO 0.00 -0.39 0.69 -0.83 0.23 0.00 0.00 176.35 176.04 2qnf s GLY 120 N -3.91 2.44 0.31 -3.19 0.00 -1.26 -4.87 107.32 96.84 2qnf s GLY 120 Ca 0.40 0.03 0.02 0.00 0.00 0.00 0.00 44.72 45.17 2qnf s GLY 120 CO 0.24 0.29 1.57 1.70 0.00 0.00 0.00 173.10 176.90 2qnf h LYS 121 N 2.87 0.01 -0.52 2.90 3.64 -1.99 0.22 116.57 123.70 2qnf h LYS 121 Ca -0.48 -0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 58.81 2qnf h LYS 121 Cb 1.18 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 2qnf h LYS 121 CO 0.66 0.01 -0.01 0.93 -2.27 0.00 0.00 179.45 178.77 2qnf h GLU 122 N 0.01 0.93 0.00 1.90 4.39 -2.00 -2.28 114.58 117.53 2qnf h GLU 122 Ca 0.60 -0.30 -0.00 0.00 0.34 0.00 0.00 59.36 59.99 2qnf h GLU 122 Cb 1.23 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.80 2qnf h GLU 122 CO -0.92 0.95 -0.02 0.93 -1.16 0.00 0.00 179.01 178.79 2qnf h GLU 123 N 0.80 0.00 0.08 2.33 5.08 -1.03 -0.63 114.58 121.22 2qnf h GLU 123 Ca 0.15 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2qnf h GLU 123 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2qnf h GLU 123 CO 0.03 0.02 -0.04 0.52 -1.00 0.00 0.00 179.01 178.54 2qnf h MET 124 N 0.00 -0.11 -0.71 2.33 2.86 -0.62 -2.37 114.93 116.32 2qnf h MET 124 Ca -0.00 0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.72 2qnf h MET 124 Cb 0.53 0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.15 2qnf h MET 124 CO 0.00 0.40 0.39 0.52 1.06 0.00 0.00 176.91 179.28 2qnf h MET 125 N -0.91 0.67 -0.34 1.72 2.86 -1.34 -1.96 114.93 115.63 2qnf h MET 125 Ca -0.01 -0.04 0.07 0.00 -2.06 0.00 0.00 59.70 57.65 2qnf h MET 125 Cb 0.56 -0.15 -0.06 0.00 0.06 0.00 0.00 31.60 32.01 2qnf h MET 125 CO 0.02 0.44 -0.07 0.00 1.06 0.00 0.00 176.91 178.36 2qnf h ALA 126 N 1.39 0.24 0.00 6.32 0.00 -1.17 -1.49 119.26 124.55 2qnf h ALA 126 Ca 0.33 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.30 2qnf h ALA 126 Cb 0.25 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2qnf h ALA 126 CO -0.21 -0.45 -0.30 1.49 0.00 0.00 0.00 179.25 179.78 2qnf h GLU 127 N 0.01 0.00 0.00 0.00 4.57 -0.88 -2.82 114.58 115.47 2qnf h GLU 127 Ca 0.16 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.27 2qnf h GLU 127 Cb 0.24 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 2qnf h GLU 127 CO -0.34 0.30 -0.36 0.52 -1.18 0.00 0.00 179.01 177.95 2qnf h MET 128 N 0.00 0.00 -0.12 1.92 2.86 -0.55 -3.10 114.93 115.94 2qnf h MET 128 Ca -0.00 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.41 2qnf h MET 128 Cb 0.56 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.23 2qnf h MET 128 CO 0.04 0.36 -0.81 -0.07 1.06 0.00 0.00 176.91 177.49 2qnf h LEU 129 N 0.00 0.85 0.00 1.22 3.38 -1.17 -0.70 115.31 118.90 2qnf h LEU 129 Ca -0.00 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.39 2qnf h LEU 129 Cb 1.06 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2qnf h LEU 129 CO 0.05 1.37 0.00 1.67 0.09 0.00 0.00 178.44 181.62 2qnf n GLN 130 N -3.90 0.82 -0.00 1.13 7.27 -1.16 -2.85 117.38 118.68 2qnf n GLN 130 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.00 2qnf n GLN 130 Cb 0.76 -1.05 -0.01 0.00 2.41 0.00 0.00 30.24 32.34 2qnf n GLN 130 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2qnf n ARG 131 N -0.55 1.64 -1.65 3.69 5.12 -0.91 -5.03 116.66 118.96 2qnf n ARG 131 Ca 0.02 -0.01 0.00 0.00 -1.93 0.00 0.00 57.85 55.93 2qnf n ARG 131 Cb 0.01 -1.04 0.00 0.00 -1.16 0.00 0.00 32.46 30.27 2qnf n ARG 131 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qnf n GLY 132 N 2.62 0.94 3.66 -0.13 0.00 -0.40 -5.07 105.19 106.80 2qnf n GLY 132 Ca -0.01 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 2qnf n GLY 132 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qnf s PHE 133 N -2.50 3.04 -0.06 1.61 0.08 -0.42 -5.05 117.98 114.68 2qnf s PHE 133 Ca 0.00 0.07 -0.17 0.00 0.12 0.00 0.00 56.93 56.95 2qnf s PHE 133 Cb 0.00 -1.68 -0.05 0.00 -0.57 0.00 0.00 43.02 40.72 2qnf s PHE 133 CO 0.00 0.44 0.47 -1.21 -0.10 0.00 0.00 175.22 174.82 2qnf s GLU 134 N -1.38 4.21 0.25 0.44 2.02 -1.26 -4.64 118.70 118.33 2qnf s GLU 134 Ca 0.18 0.48 -0.11 0.00 0.02 0.00 0.00 54.97 55.54 2qnf s GLU 134 Cb -0.11 -3.35 -0.01 0.00 0.10 0.00 0.00 34.13 30.76 2qnf s GLU 134 CO 0.08 0.37 0.45 1.52 0.02 0.00 0.00 175.26 177.70 2qnf s TYR 135 N -0.08 0.48 -0.02 1.61 -0.85 -1.26 -5.00 117.35 112.23 2qnf s TYR 135 Ca 0.26 -0.82 0.01 0.00 -0.52 0.00 0.00 57.07 56.00 2qnf s TYR 135 Cb -0.16 0.11 -0.03 0.00 0.38 0.00 0.00 41.96 42.26 2qnf s TYR 135 CO 0.12 -0.98 -0.03 -0.80 -1.52 0.00 0.00 175.55 172.34 2qnf s ASN 136 N -3.05 4.91 0.45 -0.18 0.01 -1.26 -5.00 114.94 110.82 2qnf s ASN 136 Ca 0.24 -0.03 0.25 0.00 -0.71 0.00 0.00 52.86 52.62 2qnf s ASN 136 Cb -0.00 -1.25 0.69 0.00 0.41 0.00 0.00 41.25 41.10 2qnf s ASN 136 CO 0.10 0.31 1.73 -0.08 -1.51 0.00 0.00 177.10 177.65 2qnf h GLU 137 N 4.67 0.00 0.00 -0.60 4.81 -2.02 -2.77 114.58 118.66 2qnf h GLU 137 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2qnf h GLU 137 Cb 1.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2qnf h GLU 137 CO 0.55 0.11 0.00 -1.13 -0.73 0.00 0.00 179.01 177.81 2qnf n SER 138 N -3.17 0.31 -4.75 1.04 3.41 -1.26 -4.82 113.62 104.39 2qnf n SER 138 Ca 0.02 0.54 -0.38 0.00 -0.26 0.00 0.00 58.87 58.80 2qnf n SER 138 Cb 0.48 -0.62 0.04 0.00 -0.26 0.00 0.00 64.21 63.85 2qnf n SER 138 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2qnf s ASP 139 N -3.58 5.17 0.63 4.04 1.01 -1.05 -5.01 116.67 117.88 2qnf s ASP 139 Ca 0.10 2.64 -0.04 0.00 0.71 0.00 0.00 52.55 55.97 2qnf s ASP 139 Cb 0.14 -2.62 0.04 0.00 1.01 0.00 0.00 42.92 41.49 2qnf s ASP 139 CO 0.48 -1.63 0.91 0.42 0.21 0.00 0.00 175.17 175.56 2qnf s THR 140 N -1.38 2.65 0.12 -1.27 -4.23 -1.26 -4.83 115.64 105.44 2qnf s THR 140 Ca 0.74 -0.37 -0.28 0.00 -1.18 0.00 0.00 61.69 60.60 2qnf s THR 140 Cb -0.37 -3.08 -0.07 0.00 1.34 0.00 0.00 72.50 70.32 2qnf s THR 140 CO 0.43 -0.07 1.61 0.11 -0.54 0.00 0.00 174.62 176.15 2qnf h LYS 141 N -0.29 -0.50 -0.58 3.99 1.57 -1.99 0.20 116.57 118.98 2qnf h LYS 141 Ca -0.44 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 58.49 2qnf h LYS 141 Cb 1.30 0.11 -0.11 0.00 0.08 0.00 0.00 32.23 33.61 2qnf h LYS 141 CO 0.58 -0.33 -0.21 1.15 -0.57 0.00 0.00 179.45 180.06 2qnf h THR 142 N -0.52 0.32 -0.44 -0.16 2.02 -1.99 -0.00 112.91 112.14 2qnf h THR 142 Ca 0.05 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.19 2qnf h THR 142 Cb 0.59 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 2qnf h THR 142 CO -0.26 0.00 0.09 1.56 0.37 0.00 0.00 175.52 177.28 2qnf h GLN 143 N -0.07 0.66 -0.39 6.66 4.20 -1.77 -2.77 115.11 121.64 2qnf h GLN 143 Ca 0.27 -0.13 -0.13 0.00 0.06 0.00 0.00 58.65 58.72 2qnf h GLN 143 Cb 0.49 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2qnf h GLN 143 CO -0.63 0.62 -0.28 -0.07 -0.67 0.00 0.00 178.83 177.80 2qnf h LEU 144 N 0.64 0.85 0.23 1.46 3.38 0.11 -2.71 115.31 119.27 2qnf h LEU 144 Ca 0.14 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2qnf h LEU 144 Cb 0.27 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2qnf h LEU 144 CO -0.00 1.07 -0.11 0.40 0.09 0.00 0.00 178.44 179.89 2qnf h ILE 145 N 0.70 0.82 0.33 1.22 2.04 -0.83 -1.85 117.51 119.94 2qnf h ILE 145 Ca 0.08 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 2qnf h ILE 145 Cb 0.81 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 2qnf h ILE 145 CO 0.07 0.05 -0.16 0.00 0.00 0.00 0.00 178.15 178.11 2qnf h ALA 146 N 0.33 -0.45 -1.05 1.87 0.00 -1.55 -1.60 119.26 116.81 2qnf h ALA 146 Ca -0.03 -0.11 0.27 0.00 0.00 0.00 0.00 54.91 55.04 2qnf h ALA 146 Cb 0.32 0.17 -0.10 0.00 0.00 0.00 0.00 17.79 18.18 2qnf h ALA 146 CO 0.05 -0.74 0.67 1.03 0.00 0.00 0.00 179.25 180.26 2qnf h SER 147 N -0.47 0.45 -0.28 0.00 0.87 -1.49 -0.09 113.55 112.54 2qnf h SER 147 Ca -0.05 0.09 -0.07 0.00 -1.23 0.00 0.00 61.79 60.53 2qnf h SER 147 Cb 0.36 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 2qnf h SER 147 CO 0.08 0.08 -0.11 0.15 -0.53 0.00 0.00 176.83 176.49 2qnf h PHE 148 N 0.39 0.65 -0.65 2.24 3.04 -0.59 -2.44 116.94 119.59 2qnf h PHE 148 Ca 0.60 -0.15 0.03 0.00 3.98 0.00 0.00 57.97 62.42 2qnf h PHE 148 Cb 1.52 -0.15 -0.04 0.00 2.56 0.00 0.00 35.95 39.84 2qnf h PHE 148 CO -0.00 0.80 0.41 -0.22 -2.02 0.00 0.00 178.31 177.27 2qnf h LYS 149 N 0.32 0.78 0.75 1.11 3.64 -0.13 -0.97 116.57 122.08 2qnf h LYS 149 Ca 0.07 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2qnf h LYS 149 Cb 0.61 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2qnf h LYS 149 CO 0.04 0.51 -0.45 -0.22 -2.27 0.00 0.00 179.45 177.06 2qnf h LYS 150 N 0.80 -1.09 -0.78 1.90 3.64 -1.25 -1.53 116.57 118.26 2qnf h LYS 150 Ca 0.26 0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.75 2qnf h LYS 150 Cb 0.00 0.25 -0.05 0.00 -0.41 0.00 0.00 32.23 32.03 2qnf h LYS 150 CO -0.10 -0.72 0.51 1.96 -2.27 0.00 0.00 179.45 178.83 2qnf h GLN 151 N -1.13 0.90 -0.41 1.90 4.20 -1.39 -1.87 115.11 117.32 2qnf h GLN 151 Ca -0.10 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.51 2qnf h GLN 151 Cb 0.90 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 2qnf h GLN 151 CO 0.11 0.60 0.08 1.25 -0.67 0.00 0.00 178.83 180.19 2qnf h LEU 152 N 0.93 0.64 -0.74 1.46 5.85 -1.06 -0.79 115.31 121.60 2qnf h LEU 152 Ca 0.31 -0.25 0.03 0.00 0.84 0.00 0.00 57.88 58.81 2qnf h LEU 152 Cb 0.09 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 2qnf h LEU 152 CO -0.10 0.73 0.47 -0.09 -0.34 0.00 0.00 178.44 179.11 2qnf h ARG 153 N 0.52 0.89 -0.26 1.25 2.43 -0.64 -2.85 114.38 115.73 2qnf h ARG 153 Ca 0.13 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 2qnf h ARG 153 Cb 0.35 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 2qnf h ARG 153 CO 0.01 0.59 -0.08 -0.22 -1.51 0.00 0.00 179.97 178.76 2qnf h LYS 154 N 0.92 0.51 0.00 0.20 3.64 -1.19 -3.05 116.57 117.60 2qnf h LYS 154 Ca 0.29 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2qnf h LYS 154 Cb 0.01 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2qnf h LYS 154 CO -0.11 0.74 0.00 -1.13 -2.27 0.00 0.00 179.45 176.68 2qnf n SER 155 N -4.52 0.00 0.00 4.20 3.41 -0.32 -2.52 113.62 113.88 2qnf n SER 155 Ca -0.04 -0.49 0.00 0.00 -0.26 0.00 0.00 58.87 58.08 2qnf n SER 155 Cb 0.31 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2qnf n SER 155 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2qnf n LEU 156 N -0.89 0.95 0.00 1.04 4.77 -1.16 -5.07 117.00 116.65 2qnf n LEU 156 Ca 0.07 -0.95 0.00 0.00 -0.03 0.00 0.00 56.01 55.10 2qnf n LEU 156 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2qnf n LEU 156 CO 0.06 0.24 0.10 0.29 -1.33 0.00 0.00 177.39 176.74