#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 4.20 -0.16 3.17 2.96 -1.26 -4.89 118.68 122.70 2qnf s LEU 2 Ca 0.00 1.35 -0.04 0.00 -0.22 0.00 0.00 54.13 55.22 2qnf s LEU 2 Cb 0.00 -3.40 -0.13 0.00 0.50 0.00 0.00 46.19 43.16 2qnf s LEU 2 CO 0.00 -0.44 2.14 0.18 -1.32 0.00 0.00 176.35 176.91 2qnf n LEU 3 N 5.22 3.13 0.00 -0.68 4.77 -1.26 -4.86 117.00 123.32 2qnf n LEU 3 Ca 0.07 -2.08 -0.10 0.00 -0.03 0.00 0.00 56.01 53.87 2qnf n LEU 3 Cb 0.48 -0.81 0.08 0.00 -2.33 0.00 0.00 43.42 40.84 2qnf n LEU 3 CO 0.50 0.64 0.27 1.07 -1.33 0.00 0.00 177.39 178.54 2qnf n THR 4 N 3.00 0.00 -1.14 -5.08 5.66 -1.26 -4.17 114.28 111.29 2qnf n THR 4 Ca 0.26 -0.27 0.00 0.00 -3.05 0.00 0.00 64.05 60.99 2qnf n THR 4 Cb 0.42 -1.53 0.00 0.00 -1.55 0.00 0.00 70.33 67.67 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 1.19 0.92 0.00 1.09 0.00 -1.26 -2.41 105.19 104.72 2qnf n GLY 5 Ca 0.06 -0.58 0.15 0.00 0.00 0.00 0.00 46.02 45.64 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 0.57 0.46 0.00 1.61 2.85 -1.26 -3.43 118.16 118.97 2qnf n LYS 6 Ca 0.00 0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.27 2qnf n LYS 6 Cb 0.00 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 32.88 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 -1.26 0.00 0.13 -5.58 4.77 -1.01 -2.35 117.00 111.70 2qnf n LEU 7 Ca 0.15 0.44 -0.08 0.00 -0.03 0.00 0.00 56.01 56.49 2qnf n LEU 7 Cb 0.22 -0.44 -0.04 0.00 -2.33 0.00 0.00 43.42 40.83 2qnf n LEU 7 CO 0.22 -0.44 0.23 0.22 -1.33 0.00 0.00 177.39 176.29 2qnf h TYR 8 N 0.00 -0.39 -0.72 -1.77 3.20 -1.66 -2.49 116.97 113.14 2qnf h TYR 8 Ca 0.00 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.88 2qnf h TYR 8 Cb 0.09 0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.45 2qnf h TYR 8 CO 0.00 -0.16 0.47 0.87 -1.64 0.00 0.00 178.16 177.70 2qnf h LYS 9 N -1.07 0.91 -0.42 1.82 1.57 -1.75 -2.38 116.57 115.25 2qnf h LYS 9 Ca -0.04 -0.05 0.06 0.00 -1.87 0.00 0.00 60.65 58.74 2qnf h LYS 9 Cb 0.40 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.45 2qnf h LYS 9 CO 0.07 0.60 0.12 0.93 -0.57 0.00 0.00 179.45 180.60 2qnf h GLU 10 N 0.94 0.25 0.00 3.15 5.08 -1.62 -2.00 114.58 120.39 2qnf h GLU 10 Ca 0.27 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.58 2qnf h GLU 10 Cb -0.06 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2qnf h GLU 10 CO -0.08 0.17 -0.19 1.49 -1.00 0.00 0.00 179.01 179.40 2qnf h GLU 11 N 0.26 0.00 -0.48 2.33 4.57 -1.14 -1.71 114.58 118.41 2qnf h GLU 11 Ca 0.20 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.25 2qnf h GLU 11 Cb 0.22 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 2qnf h GLU 11 CO -0.24 0.19 -0.23 0.87 -1.18 0.00 0.00 179.01 178.43 2qnf h LYS 12 N 0.00 1.00 0.37 1.92 1.57 -0.86 -2.56 116.57 118.01 2qnf h LYS 12 Ca -0.00 -0.43 -0.02 0.00 -1.87 0.00 0.00 60.65 58.33 2qnf h LYS 12 Cb 0.51 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 2qnf h LYS 12 CO 0.02 1.11 -0.26 0.37 -0.57 0.00 0.00 179.45 180.13 2qnf h GLN 13 N 0.86 -0.58 -0.85 3.15 5.75 -0.96 -0.59 115.11 121.90 2qnf h GLN 13 Ca 0.11 0.04 0.12 0.00 -0.15 0.00 0.00 58.65 58.77 2qnf h GLN 13 Cb 0.81 0.13 -0.13 0.00 1.07 0.00 0.00 27.48 29.36 2qnf h GLN 13 CO 0.07 -0.38 -0.36 1.63 -2.65 0.00 0.00 178.83 177.13 2qnf n LYS 14 N -3.91 -0.23 0.25 1.69 5.02 -0.95 0.13 118.16 120.17 2qnf n LYS 14 Ca -0.07 1.30 0.11 0.00 -2.02 0.00 0.00 58.31 57.62 2qnf n LYS 14 Cb 0.25 -1.93 0.67 0.00 -0.02 0.00 0.00 35.03 34.01 2qnf n LYS 14 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 2qnf h PHE 15 N 0.00 0.00 -0.09 2.13 0.04 -1.32 -0.63 116.94 117.07 2qnf h PHE 15 Ca 0.27 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.87 2qnf h PHE 15 Cb 0.48 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.62 2qnf h PHE 15 CO -0.77 0.13 -0.67 -0.92 -0.60 0.00 0.00 178.31 175.48 2qnf h TYR 16 N 0.00 0.49 0.08 -0.55 3.20 0.28 -3.01 116.97 117.45 2qnf h TYR 16 Ca -0.00 -0.20 -0.00 0.00 3.14 0.00 0.00 58.73 61.66 2qnf h TYR 16 Cb 0.30 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.49 2qnf h TYR 16 CO 0.00 0.93 -0.04 -0.44 -1.64 0.00 0.00 178.16 176.97 2qnf h ASP 17 N 0.26 -0.09 -0.73 -2.11 3.32 -0.80 -2.07 116.42 114.20 2qnf h ASP 17 Ca -0.02 -0.16 0.21 0.00 0.02 0.00 0.00 57.03 57.08 2qnf h ASP 17 Cb 1.22 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.76 2qnf h ASP 17 CO 0.11 0.47 0.77 0.00 -1.72 0.00 0.00 179.24 178.87 2qnf h ALA 18 N -0.83 2.54 -0.62 3.45 0.00 -1.23 0.55 119.26 123.12 2qnf h ALA 18 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qnf h ALA 18 Cb 0.25 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2qnf h ALA 18 CO 0.02 -1.14 0.00 1.04 0.00 0.00 0.00 179.25 179.16 2qnf n GLN 19 N -3.60 2.81 -1.49 0.00 6.02 -1.14 -4.94 117.38 115.05 2qnf n GLN 19 Ca 0.15 -2.39 -0.17 0.00 -0.01 0.00 0.00 57.00 54.58 2qnf n GLN 19 Cb 1.02 -1.61 -0.07 0.00 1.02 0.00 0.00 30.24 30.59 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 1.25 -4.74 0.00 1.08 3.02 0.19 -2.19 115.26 113.87 2qnf n ASN 20 Ca 0.22 0.43 0.00 0.00 -0.03 0.00 0.00 54.58 55.20 2qnf n ASN 20 Cb 0.63 -4.19 0.00 0.00 -0.61 0.00 0.00 39.78 35.61 2qnf n ASN 20 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qnf n GLY 21 N -0.28 0.40 3.29 7.41 0.00 -0.78 -5.04 105.19 110.19 2qnf n GLY 21 Ca -0.17 -0.99 -0.27 0.00 0.00 0.00 0.00 46.02 44.58 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 -2.72 1.53 0.04 1.61 1.02 -0.93 -2.15 119.74 118.13 2qnf s LYS 22 Ca 0.00 -1.03 -0.30 0.00 0.02 0.00 0.00 55.97 54.65 2qnf s LYS 22 Cb 0.00 -1.69 -0.06 0.00 -0.52 0.00 0.00 37.83 35.57 2qnf s LYS 22 CO 0.00 0.43 1.27 0.00 -0.92 0.00 0.00 175.35 176.13 2qnf n LEU 24 N 4.45 0.07 0.00 0.00 4.77 -1.26 -0.72 117.00 124.31 2qnf n LEU 24 Ca 0.11 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2qnf n LEU 24 Cb 0.45 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 2qnf n LEU 24 CO 0.57 0.02 0.00 -0.38 -1.33 0.00 0.00 177.39 176.26 2qnf n ILE 25 N -0.25 0.00 0.45 -0.08 5.41 -1.26 -4.83 119.36 118.80 2qnf n ILE 25 Ca 0.00 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.86 2qnf n ILE 25 Cb 0.02 -0.38 0.46 0.00 -0.71 0.00 0.00 39.64 39.02 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 -2.12 -1.46 -1.10 0.00 1.13 0.10 -4.97 117.38 108.96 2qnf n GLN 27 Ca 0.03 0.48 -0.12 0.00 -1.94 0.00 0.00 57.00 55.45 2qnf n GLN 27 Cb 0.24 -4.63 0.07 0.00 0.11 0.00 0.00 30.24 26.04 2qnf n GLN 27 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2qnf n ARG 28 N -0.34 -0.21 -3.16 -1.09 1.74 -1.26 -4.54 116.66 107.79 2qnf n ARG 28 Ca -0.02 -1.03 -0.39 0.00 -0.77 0.00 0.00 57.85 55.63 2qnf n ARG 28 Cb 0.40 -0.47 -0.06 0.00 -1.02 0.00 0.00 32.46 31.31 2qnf n ARG 28 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2qnf s GLU 29 N -3.99 4.27 0.46 5.56 2.12 -1.26 -1.31 118.70 124.55 2qnf s GLU 29 Ca 0.32 0.60 -0.24 0.00 0.36 0.00 0.00 54.97 56.00 2qnf s GLU 29 Cb -0.01 -3.52 -0.07 0.00 0.26 0.00 0.00 34.13 30.78 2qnf s GLU 29 CO 0.22 -0.09 1.34 -0.51 -0.54 0.00 0.00 175.26 175.68 2qnf s LEU 30 N 1.42 4.06 0.25 2.70 1.43 -0.91 -4.90 118.68 122.72 2qnf s LEU 30 Ca 0.29 2.73 -0.29 0.00 -1.03 0.00 0.00 54.13 55.83 2qnf s LEU 30 Cb -0.16 -4.05 -0.15 0.00 0.03 0.00 0.00 46.19 41.86 2qnf s LEU 30 CO 0.11 -1.16 0.95 -3.20 0.23 0.00 0.00 176.35 173.29 2qnf n ASN 31 N -0.36 0.83 0.14 2.29 2.85 -1.26 -4.81 115.26 114.94 2qnf n ASN 31 Ca 0.06 1.16 0.08 0.00 -0.11 0.00 0.00 54.58 55.77 2qnf n ASN 31 Cb 0.44 -1.21 0.57 0.00 1.24 0.00 0.00 39.78 40.82 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 2.10 0.19 -5.75 1.20 0.13 -1.98 -3.33 132.00 124.56 2qnf h PRO 32 Ca -0.38 -0.01 -0.32 0.00 -0.87 0.00 0.00 66.00 64.41 2qnf h PRO 32 Cb 1.36 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 32.40 2qnf h PRO 32 CO 0.62 0.13 0.81 0.34 -0.23 0.00 0.00 178.00 179.67 2qnf s ASP 33 N -6.83 5.18 0.14 1.44 -1.08 -1.26 -4.85 116.67 109.41 2qnf s ASP 33 Ca -0.06 -0.58 -0.31 0.00 -0.52 0.00 0.00 52.55 51.08 2qnf s ASP 33 Cb 0.17 -2.56 -0.09 0.00 -1.46 0.00 0.00 42.92 38.99 2qnf s ASP 33 CO 0.70 -2.68 1.52 0.58 0.52 0.00 0.00 175.17 175.81 2qnf h VAL 34 N 7.21 0.00 0.00 1.11 2.07 -1.96 -1.92 116.25 122.77 2qnf h VAL 34 Ca 0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.58 2qnf h VAL 34 Cb 1.02 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2qnf h VAL 34 CO 1.21 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.80 2qnf n GLN 35 N -5.23 0.25 -0.14 1.57 1.13 -1.26 -2.30 117.38 111.40 2qnf n GLN 35 Ca -0.01 0.05 0.11 0.00 -1.94 0.00 0.00 57.00 55.21 2qnf n GLN 35 Cb 0.30 -1.50 0.28 0.00 0.11 0.00 0.00 30.24 29.43 2qnf n GLN 35 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2qnf n ALA 36 N -1.08 2.46 -2.82 -1.58 0.00 -0.72 -4.89 120.51 111.89 2qnf n ALA 36 Ca 0.06 -0.78 -0.33 0.00 0.00 0.00 0.00 53.44 52.40 2qnf n ALA 36 Cb 0.04 -0.96 -0.05 0.00 0.00 0.00 0.00 19.45 18.48 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 -1.54 6.43 -0.00 0.00 0.01 -0.97 -4.80 114.94 114.07 2qnf s ASN 37 Ca 0.35 0.44 -0.30 0.00 -0.71 0.00 0.00 52.86 52.64 2qnf s ASN 37 Cb 0.20 -2.03 -0.03 0.00 0.41 0.00 0.00 41.25 39.79 2qnf s ASN 37 CO 0.29 0.19 1.04 -1.00 -1.51 0.00 0.00 177.10 176.11 2qnf s HIS 38 N -1.44 3.57 -1.01 2.20 3.76 -1.02 -4.90 115.29 116.45 2qnf s HIS 38 Ca 0.32 1.58 -0.15 0.00 -0.15 0.00 0.00 55.06 56.66 2qnf s HIS 38 Cb -0.13 -3.21 0.18 0.00 1.11 0.00 0.00 32.58 30.54 2qnf s HIS 38 CO 0.22 -0.37 1.13 -1.17 -0.85 0.00 0.00 174.74 173.70 2qnf s LEU 39 N 1.20 5.58 0.98 0.89 2.96 -1.26 -0.54 118.68 128.50 2qnf s LEU 39 Ca 0.53 -2.64 -0.13 0.00 -0.22 0.00 0.00 54.13 51.67 2qnf s LEU 39 Cb -0.23 -2.34 0.10 0.00 0.50 0.00 0.00 46.19 44.23 2qnf s LEU 39 CO 0.27 -0.77 0.64 -0.67 -1.32 0.00 0.00 176.35 174.50 2qnf n ASP 40 N 5.26 -1.35 -3.59 3.68 2.03 -1.17 -4.91 116.55 116.50 2qnf n ASP 40 Ca 0.25 0.25 -0.10 0.00 0.52 0.00 0.00 54.79 55.71 2qnf n ASP 40 Cb 0.46 -1.26 -0.06 0.00 -0.72 0.00 0.00 41.12 39.54 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 -2.45 -0.39 0.10 -0.67 -3.43 -1.26 -2.50 115.29 104.69 2qnf s HIS 41 Ca 0.61 0.73 -0.31 0.00 -0.80 0.00 0.00 55.06 55.29 2qnf s HIS 41 Cb -0.21 0.43 -0.07 0.00 -1.43 0.00 0.00 32.58 31.30 2qnf s HIS 41 CO 0.64 -0.32 1.37 0.34 -2.00 0.00 0.00 174.74 174.77 2qnf s ASP 42 N -0.83 6.86 0.00 7.38 -1.08 -0.38 -4.91 116.67 123.71 2qnf s ASP 42 Ca -0.01 2.27 0.19 0.00 -0.52 0.00 0.00 52.55 54.49 2qnf s ASP 42 Cb -0.01 -2.58 0.18 0.00 -1.46 0.00 0.00 42.92 39.04 2qnf s ASP 42 CO -0.00 -0.63 1.14 -0.46 0.52 0.00 0.00 175.17 175.73 2qnf n ASN 43 N 4.04 2.68 -4.68 -0.34 0.23 -1.26 -1.79 115.26 114.14 2qnf n ASN 43 Ca 0.11 -1.82 -0.31 0.00 -0.53 0.00 0.00 54.58 52.03 2qnf n ASN 43 Cb 0.43 -0.03 0.16 0.00 -2.08 0.00 0.00 39.78 38.26 2qnf n ASN 43 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2qnf s GLU 44 N -1.55 1.10 0.00 -3.83 2.02 -1.26 -4.79 118.70 110.39 2qnf s GLU 44 Ca 0.24 1.61 0.16 0.00 0.02 0.00 0.00 54.97 57.00 2qnf s GLU 44 Cb 0.16 -1.73 -0.18 0.00 0.10 0.00 0.00 34.13 32.48 2qnf s GLU 44 CO 0.24 -2.58 0.70 1.28 0.02 0.00 0.00 175.26 174.93 2qnf n LEU 45 N -4.07 0.79 -4.41 1.80 4.77 -1.26 -3.64 117.00 110.98 2qnf n LEU 45 Ca 0.12 -0.50 -0.20 0.00 -0.03 0.00 0.00 56.01 55.40 2qnf n LEU 45 Cb 0.52 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 2qnf n LEU 45 CO 0.49 0.20 -0.35 0.20 -1.33 0.00 0.00 177.39 176.60 2qnf s ASN 46 N -2.56 2.51 0.00 -1.43 0.01 -1.26 -4.96 114.94 107.25 2qnf s ASN 46 Ca 0.06 -1.21 0.00 0.00 -0.71 0.00 0.00 52.86 51.00 2qnf s ASN 46 Cb 0.12 -0.12 0.00 0.00 0.41 0.00 0.00 41.25 41.67 2qnf s ASN 46 CO 0.68 -0.40 0.00 0.61 -1.51 0.00 0.00 177.10 176.47 2qnf n GLY 47 N -0.55 -0.52 0.18 0.66 0.00 -1.26 -4.34 105.19 99.37 2qnf n GLY 47 Ca -0.05 -1.69 0.04 0.00 0.00 0.00 0.00 46.02 44.32 2qnf n GLY 47 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qnf h PRO 48 N 0.00 0.00 0.00 1.61 0.13 -2.01 -2.89 132.00 128.85 2qnf h PRO 48 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2qnf h PRO 48 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2qnf h PRO 48 CO 0.00 0.40 0.00 1.63 -0.23 0.00 0.00 178.00 179.80 2qnf n LYS 49 N -3.70 0.87 -2.12 0.86 5.02 -1.26 -4.83 118.16 113.00 2qnf n LYS 49 Ca -0.01 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.85 2qnf n LYS 49 Cb 0.49 -1.07 -0.02 0.00 -0.02 0.00 0.00 35.03 34.40 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 -2.00 2.92 0.00 7.82 0.00 -1.09 -3.62 121.76 125.79 2qnf s ALA 50 Ca 0.06 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.12 2qnf s ALA 50 Cb 0.03 -3.99 0.00 0.00 0.00 0.00 0.00 23.12 19.15 2qnf s ALA 50 CO 0.04 -2.57 0.00 0.41 0.00 0.00 0.00 175.76 173.65 2qnf n GLY 51 N 5.31 0.32 3.77 0.00 0.00 -0.74 -5.01 105.19 108.84 2qnf n GLY 51 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.74 4.65 0.67 1.61 -0.14 -1.24 -4.73 119.74 119.82 2qnf s LYS 52 Ca 0.00 1.26 -0.15 0.00 -1.36 0.00 0.00 55.97 55.72 2qnf s LYS 52 Cb 0.00 -3.21 0.01 0.00 -1.68 0.00 0.00 37.83 32.94 2qnf s LYS 52 CO 0.00 0.52 1.13 0.14 -0.76 0.00 0.00 175.35 176.38 2qnf s VAL 53 N -1.21 3.07 0.00 3.17 -7.23 -1.26 -1.26 120.40 115.68 2qnf s VAL 53 Ca 0.39 0.51 0.00 0.00 -1.81 0.00 0.00 61.98 61.06 2qnf s VAL 53 Cb -0.23 -3.03 0.00 0.00 0.56 0.00 0.00 36.38 33.67 2qnf s VAL 53 CO 0.28 -0.30 0.20 0.54 -0.31 0.00 0.00 175.10 175.50 2qnf n ARG 54 N -2.45 3.57 0.00 4.82 1.74 -1.04 -4.82 116.66 118.47 2qnf n ARG 54 Ca 0.11 -0.20 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 2qnf n ARG 54 Cb 0.52 -0.69 0.00 0.00 -1.02 0.00 0.00 32.46 31.27 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 0.57 4.04 3.65 -0.13 0.00 -1.26 -5.03 105.19 107.03 2qnf n GLY 55 Ca 0.00 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.09 2qnf n GLY 55 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qnf s LEU 56 N 0.00 4.08 0.31 0.99 2.96 -1.26 -3.06 118.68 122.69 2qnf s LEU 56 Ca 0.00 1.49 0.08 0.00 -0.22 0.00 0.00 54.13 55.48 2qnf s LEU 56 Cb 0.00 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.11 2qnf s LEU 56 CO 0.00 -0.84 0.11 -0.76 -1.32 0.00 0.00 176.35 173.54 2qnf s LEU 57 N 3.70 3.32 0.59 -0.68 1.43 0.30 -4.39 118.68 122.95 2qnf s LEU 57 Ca 0.53 -0.66 -0.17 0.00 -1.03 0.00 0.00 54.13 52.81 2qnf s LEU 57 Cb -0.19 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 2qnf s LEU 57 CO 0.16 -0.18 1.08 0.00 0.23 0.00 0.00 176.35 177.64 2qnf h ASN 59 N 0.59 -1.61 -0.98 0.00 -1.07 -1.91 -0.20 115.58 110.41 2qnf h ASN 59 Ca -0.48 0.24 0.15 0.00 0.07 0.00 0.00 56.30 56.28 2qnf h ASN 59 Cb 1.23 0.71 -0.15 0.00 -2.07 0.00 0.00 38.32 38.04 2qnf h ASN 59 CO 0.57 -0.18 -0.41 -0.07 0.07 0.00 0.00 177.43 177.41 2qnf h LEU 60 N -0.02 -1.50 -0.88 6.14 3.38 -2.00 -0.46 115.31 119.98 2qnf h LEU 60 Ca 0.12 0.31 -0.12 0.00 0.09 0.00 0.00 57.88 58.28 2qnf h LEU 60 Cb 0.32 0.77 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2qnf h LEU 60 CO -0.69 -0.28 -0.47 0.00 0.09 0.00 0.00 178.44 177.09 2qnf h ASN 62 N 0.17 0.00 -0.47 0.00 -1.24 0.01 -2.30 115.58 111.75 2qnf h ASN 62 Ca 0.01 0.00 -0.13 0.00 0.71 0.00 0.00 56.30 56.89 2qnf h ASN 62 Cb 0.90 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.93 2qnf h ASN 62 CO 0.07 0.39 -0.22 0.00 -1.29 0.00 0.00 177.43 176.39 2qnf h ALA 63 N 1.61 0.66 -0.14 1.57 0.00 -1.05 -3.07 119.26 118.84 2qnf h ALA 63 Ca -0.00 -0.39 -0.17 0.00 0.00 0.00 0.00 54.91 54.34 2qnf h ALA 63 Cb 0.97 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2qnf h ALA 63 CO 0.05 0.65 -0.64 0.00 0.00 0.00 0.00 179.25 179.32 2qnf h ALA 64 N 0.86 0.64 0.17 0.00 0.00 -1.29 -2.63 119.26 117.01 2qnf h ALA 64 Ca 0.11 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2qnf h ALA 64 Cb 0.80 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2qnf h ALA 64 CO 0.07 0.72 -0.34 1.49 0.00 0.00 0.00 179.25 181.18 2qnf h GLU 65 N 0.37 -0.53 -0.44 0.00 4.22 -1.33 -0.64 114.58 116.22 2qnf h GLU 65 Ca -0.01 0.04 0.09 0.00 0.08 0.00 0.00 59.36 59.55 2qnf h GLU 65 Cb 1.19 0.12 -0.09 0.00 0.50 0.00 0.00 28.75 30.47 2qnf h GLU 65 CO 0.12 -0.35 -0.24 0.78 -2.18 0.00 0.00 179.01 177.13 2qnf h GLY 66 N -0.55 0.02 -0.26 1.92 0.00 -1.59 -1.54 103.07 101.07 2qnf h GLY 66 Ca -0.02 0.31 0.07 0.00 0.00 0.00 0.00 47.33 47.69 2qnf h GLY 66 CO -0.13 -0.21 -0.40 1.46 0.00 0.00 0.00 176.54 177.25 2qnf h GLN 67 N -0.15 -0.30 -0.20 4.80 1.08 -1.15 0.37 115.11 119.55 2qnf h GLN 67 Ca 0.21 0.02 0.05 0.00 -1.45 0.00 0.00 58.65 57.48 2qnf h GLN 67 Cb 0.48 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 27.92 2qnf h GLN 67 CO -0.53 -0.20 -0.13 0.52 -0.95 0.00 0.00 178.83 177.54 2qnf h MET 68 N -0.31 -0.12 0.40 1.46 2.86 -0.31 0.11 114.93 119.02 2qnf h MET 68 Ca 0.15 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 2qnf h MET 68 Cb 0.58 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 2qnf h MET 68 CO -0.56 -0.08 -0.26 -0.22 1.06 0.00 0.00 176.91 176.85 2qnf h LYS 69 N -0.12 -0.61 -0.03 1.72 3.64 -0.44 -0.46 116.57 120.26 2qnf h LYS 69 Ca 0.12 0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.56 2qnf h LYS 69 Cb 0.30 0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 32.20 2qnf h LYS 69 CO -0.28 -0.41 -0.51 1.25 -2.27 0.00 0.00 179.45 177.24 2qnf h HIS 70 N -0.64 -1.49 -0.80 1.91 2.76 -0.02 0.50 115.15 117.38 2qnf h HIS 70 Ca -0.04 0.05 0.23 0.00 -2.20 0.00 0.00 60.37 58.41 2qnf h HIS 70 Cb 0.53 0.65 -0.03 0.00 1.55 0.00 0.00 27.41 30.11 2qnf h HIS 70 CO -0.10 -0.55 0.63 0.87 -1.30 0.00 0.00 177.93 177.47 2qnf h LYS 71 N -0.63 0.00 0.14 5.26 1.79 -0.61 -0.03 116.57 122.49 2qnf h LYS 71 Ca 0.03 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.49 2qnf h LYS 71 Cb 0.70 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 2qnf h LYS 71 CO -0.37 0.00 -0.07 0.35 -1.08 0.00 0.00 179.45 178.28 2qnf h PHE 72 N 0.00 -0.17 -0.19 -1.35 3.57 0.15 -1.91 116.94 117.04 2qnf h PHE 72 Ca 0.38 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.93 2qnf h PHE 72 Cb 1.64 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.43 2qnf h PHE 72 CO 0.00 0.29 0.31 -0.91 -2.23 0.00 0.00 178.31 175.77 2qnf h ASN 73 N -0.83 0.00 0.44 0.41 2.35 0.13 -0.60 115.58 117.47 2qnf h ASN 73 Ca -0.02 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.62 2qnf h ASN 73 Cb 0.54 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.89 2qnf h ASN 73 CO 0.03 0.00 -1.66 0.54 -1.65 0.00 0.00 177.43 174.69 2qnf n ARG 74 N -3.44 0.64 0.06 0.81 5.12 -0.56 -4.05 116.66 115.24 2qnf n ARG 74 Ca 0.02 0.03 0.04 0.00 -1.93 0.00 0.00 57.85 56.01 2qnf n ARG 74 Cb 0.42 -1.68 0.20 0.00 -1.16 0.00 0.00 32.46 30.24 2qnf n ARG 74 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2qnf n SER 75 N -2.62 0.19 0.00 0.55 3.41 -0.23 -4.79 113.62 110.13 2qnf n SER 75 Ca -0.09 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 2qnf n SER 75 Cb 0.74 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 2qnf n SER 75 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qnf n GLY 76 N -1.41 2.77 0.33 5.00 0.00 -1.25 -4.85 105.19 105.78 2qnf n GLY 76 Ca -0.00 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.24 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 0.42 -1.15 0.99 3.38 -1.87 0.55 115.31 117.64 2qnf h LEU 77 Ca 0.00 0.20 0.08 0.00 0.09 0.00 0.00 57.88 58.24 2qnf h LEU 77 Cb 0.00 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 2qnf h LEU 77 CO 0.00 -0.16 0.59 0.50 0.09 0.00 0.00 178.44 179.46 2qnf h LYS 78 N 0.29 0.96 0.00 1.13 3.64 -1.78 0.71 116.57 121.52 2qnf h LYS 78 Ca 0.72 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 60.04 2qnf h LYS 78 Cb 1.62 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 33.23 2qnf h LYS 78 CO -0.63 0.63 0.00 0.41 -2.27 0.00 0.00 179.45 177.60 2qnf n GLY 79 N -1.40 -1.28 2.17 5.01 0.00 0.19 -2.31 105.19 107.57 2qnf n GLY 79 Ca 0.14 0.04 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 2qnf n GLY 79 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qnf n GLN 80 N -2.07 2.48 -1.66 1.61 1.13 0.22 -4.90 117.38 114.19 2qnf n GLN 80 Ca 0.03 -2.95 -0.18 0.00 -1.94 0.00 0.00 57.00 51.95 2qnf n GLN 80 Cb 0.25 -2.16 -0.07 0.00 0.11 0.00 0.00 30.24 28.37 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 -0.94 1.47 3.89 1.08 0.00 -0.98 -5.00 105.19 104.73 2qnf n GLY 81 Ca 0.55 -0.13 -0.32 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.72 5.15 -0.08 1.61 1.01 -1.04 -5.04 120.40 119.29 2qnf s VAL 82 Ca 0.00 0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.07 2qnf s VAL 82 Cb 0.00 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 2qnf s VAL 82 CO 0.00 0.06 0.03 -0.62 0.00 0.00 0.00 175.10 174.57 2qnf s ASP 83 N -2.34 5.43 0.00 3.32 2.15 -1.26 -4.35 116.67 119.62 2qnf s ASP 83 Ca 0.40 0.18 0.00 0.00 0.43 0.00 0.00 52.55 53.56 2qnf s ASP 83 Cb -0.12 -1.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.94 2qnf s ASP 83 CO 0.23 0.37 0.90 0.00 -0.17 0.00 0.00 175.17 176.50 2qnf n TYR 84 N 1.97 0.00 -0.25 -5.34 9.36 -1.26 -0.19 117.16 121.45 2qnf n TYR 84 Ca -0.18 0.00 0.01 0.00 3.32 0.00 0.00 57.90 61.05 2qnf n TYR 84 Cb 0.54 -0.40 0.08 0.00 -0.63 0.00 0.00 39.34 38.93 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 -0.68 -0.62 2.98 3.38 -2.00 0.28 115.31 118.66 2qnf h LEU 85 Ca 0.00 0.22 0.06 0.00 0.09 0.00 0.00 57.88 58.25 2qnf h LEU 85 Cb 0.00 0.45 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 2qnf h LEU 85 CO 0.00 -0.24 0.33 -0.33 0.09 0.00 0.00 178.44 178.29 2qnf h GLU 86 N -0.00 0.60 0.88 1.13 5.08 -1.92 -2.49 114.58 117.87 2qnf h GLU 86 Ca 0.35 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.63 2qnf h GLU 86 Cb 0.53 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2qnf h GLU 86 CO -0.75 0.39 -0.46 2.35 -1.00 0.00 0.00 179.01 179.54 2qnf h TRP 87 N 0.61 -1.22 -0.80 4.33 7.01 0.28 -2.55 115.95 123.62 2qnf h TRP 87 Ca 0.28 -0.02 0.19 0.00 2.11 0.00 0.00 58.89 61.45 2qnf h TRP 87 Cb 0.19 0.41 -0.13 0.00 -2.10 0.00 0.00 29.16 27.54 2qnf h TRP 87 CO -0.09 -0.73 0.17 -0.07 -2.79 0.00 0.00 178.44 174.93 2qnf h LEU 88 N -1.24 -0.05 0.20 0.65 3.38 -0.91 -0.74 115.31 116.60 2qnf h LEU 88 Ca -0.12 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2qnf h LEU 88 Cb 0.96 0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2qnf h LEU 88 CO 0.17 -0.10 -0.10 -0.08 0.09 0.00 0.00 178.44 178.42 2qnf h GLU 89 N 0.22 -0.26 -0.00 1.13 4.81 -1.34 0.38 114.58 119.52 2qnf h GLU 89 Ca 0.47 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.72 2qnf h GLU 89 Cb 0.87 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.30 2qnf h GLU 89 CO -0.59 -0.10 0.02 -0.91 -0.73 0.00 0.00 179.01 176.70 2qnf h ASN 90 N -0.36 0.00 0.13 1.04 2.35 -0.91 -2.06 115.58 115.77 2qnf h ASN 90 Ca -0.03 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 2qnf h ASN 90 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 2qnf h ASN 90 CO 0.04 0.00 -0.06 0.25 -1.65 0.00 0.00 177.43 176.01 2qnf h LEU 91 N 0.00 -0.15 -0.35 1.61 5.85 0.36 -2.94 115.31 119.69 2qnf h LEU 91 Ca 0.00 -0.39 0.04 0.00 0.84 0.00 0.00 57.88 58.37 2qnf h LEU 91 Cb 0.05 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.04 2qnf h LEU 91 CO -0.00 0.43 -0.50 -0.07 -0.34 0.00 0.00 178.44 177.97 2qnf h LEU 92 N -0.87 -1.65 -0.95 2.25 3.38 -0.29 0.83 115.31 118.00 2qnf h LEU 92 Ca -0.02 0.21 0.29 0.00 0.09 0.00 0.00 57.88 58.46 2qnf h LEU 92 Cb 0.53 0.67 -0.15 0.00 0.09 0.00 0.00 40.66 41.81 2qnf h LEU 92 CO 0.03 -0.36 0.41 0.74 0.09 0.00 0.00 178.44 179.34 2qnf h THR 93 N -0.37 0.27 -0.14 0.22 2.02 -1.62 0.74 112.91 114.03 2qnf h THR 93 Ca 0.06 -0.08 -0.04 0.00 0.77 0.00 0.00 66.41 67.12 2qnf h THR 93 Cb 0.53 0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2qnf h THR 93 CO -0.52 0.04 -0.05 0.22 0.37 0.00 0.00 175.52 175.59 2qnf h TYR 94 N 0.24 0.32 0.00 3.16 3.20 -0.78 -2.90 116.97 120.21 2qnf h TYR 94 Ca 0.66 -0.07 -0.09 0.00 3.14 0.00 0.00 58.73 62.37 2qnf h TYR 94 Cb 1.47 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.65 2qnf h TYR 94 CO -0.14 0.59 -0.45 -0.07 -1.64 0.00 0.00 178.16 176.45 2qnf h LEU 95 N -0.03 0.00 0.00 2.82 3.38 0.12 -3.06 115.31 118.54 2qnf h LEU 95 Ca 0.03 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 2qnf h LEU 95 Cb 0.49 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2qnf h LEU 95 CO 0.02 0.45 -0.57 0.11 0.09 0.00 0.00 178.44 178.54 2qnf h LYS 96 N 0.00 0.00 -6.24 1.13 1.57 -1.06 -3.47 116.57 108.50 2qnf h LYS 96 Ca -0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 2qnf h LYS 96 Cb 1.08 0.00 0.17 0.00 0.08 0.00 0.00 32.23 33.56 2qnf h LYS 96 CO 0.06 0.56 -0.71 0.43 -0.57 0.00 0.00 179.45 179.22 2qnf n SER 97 N -3.24 -2.09 -4.66 0.86 7.64 -1.10 -4.88 113.62 106.16 2qnf n SER 97 Ca 0.02 0.75 -0.40 0.00 1.01 0.00 0.00 58.87 60.25 2qnf n SER 97 Cb 0.76 -1.02 -0.06 0.00 -1.01 0.00 0.00 64.21 62.88 2qnf n SER 97 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qnf s ASP 98 N -1.05 6.70 0.00 6.43 -1.08 -1.26 -4.87 116.67 121.54 2qnf s ASP 98 Ca 0.63 0.85 0.00 0.00 -0.52 0.00 0.00 52.55 53.51 2qnf s ASP 98 Cb -0.52 -2.35 0.00 0.00 -1.46 0.00 0.00 42.92 38.59 2qnf s ASP 98 CO 0.60 -0.28 0.52 0.00 0.52 0.00 0.00 175.17 176.53 2qnf n TYR 99 N 5.05 0.00 0.07 -5.34 0.18 -1.26 -4.80 117.16 111.06 2qnf n TYR 99 Ca -0.01 -0.10 0.02 0.00 1.88 0.00 0.00 57.90 59.68 2qnf n TYR 99 Cb 0.50 -0.01 0.11 0.00 -0.38 0.00 0.00 39.34 39.55 2qnf n TYR 99 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 2qnf n THR 100 N -0.10 0.64 0.64 -3.48 -2.24 -1.26 0.98 114.28 109.46 2qnf n THR 100 Ca 0.00 0.61 0.09 0.00 -2.27 0.00 0.00 64.05 62.47 2qnf n THR 100 Cb 0.12 -1.61 -0.11 0.00 -2.10 0.00 0.00 70.33 66.64 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 -1.53 0.92 -0.48 -0.78 1.13 -1.26 -5.01 117.38 110.38 2qnf n GLN 101 Ca -0.00 -0.04 -0.20 0.00 -1.94 0.00 0.00 57.00 54.82 2qnf n GLN 101 Cb 0.37 -1.37 0.18 0.00 0.11 0.00 0.00 30.24 29.52 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 -1.60 -2.40 -4.85 1.08 3.02 0.28 -5.02 115.26 105.76 2qnf n ASN 102 Ca 0.02 -0.80 -0.34 0.00 -0.03 0.00 0.00 54.58 53.43 2qnf n ASN 102 Cb 0.33 -0.66 -0.06 0.00 -0.61 0.00 0.00 39.78 38.78 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 -3.18 6.76 -0.11 6.41 0.01 -1.26 -5.07 114.94 118.49 2qnf s ASN 103 Ca 0.46 1.08 -0.24 0.00 -0.71 0.00 0.00 52.86 53.46 2qnf s ASN 103 Cb -0.06 -2.29 -0.03 0.00 0.41 0.00 0.00 41.25 39.28 2qnf s ASN 103 CO 0.37 -0.02 0.74 -0.63 -1.51 0.00 0.00 177.10 176.04 2qnf s ILE 104 N -1.68 4.99 0.47 0.60 1.01 -1.26 -5.05 121.20 120.27 2qnf s ILE 104 Ca 0.44 1.48 -0.24 0.00 0.00 0.00 0.00 60.65 62.33 2qnf s ILE 104 Cb -0.13 -4.06 -0.07 0.00 0.01 0.00 0.00 42.46 38.20 2qnf s ILE 104 CO 0.20 0.16 1.38 -2.28 0.00 0.00 0.00 174.94 174.40 2qnf s HIS 105 N 1.35 2.49 0.40 3.97 5.65 -1.26 -4.95 115.29 122.94 2qnf s HIS 105 Ca 0.37 1.33 0.07 0.00 0.25 0.00 0.00 55.06 57.08 2qnf s HIS 105 Cb -0.17 -3.83 0.85 0.00 -1.18 0.00 0.00 32.58 28.25 2qnf s HIS 105 CO 0.16 -2.73 2.04 -1.00 -0.65 0.00 0.00 174.74 172.56 2qnf h PRO 106 N 2.14 0.57 0.00 2.88 0.13 -2.04 -1.93 132.00 133.75 2qnf h PRO 106 Ca -0.51 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.58 2qnf h PRO 106 Cb 1.27 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 2qnf h PRO 106 CO 0.60 0.37 -0.04 -0.91 -0.23 0.00 0.00 178.00 177.79 2qnf h ASN 107 N 0.58 0.00 -0.99 1.44 2.35 -2.00 -2.80 115.58 114.16 2qnf h ASN 107 Ca 0.18 0.00 0.19 0.00 -0.55 0.00 0.00 56.30 56.12 2qnf h ASN 107 Cb -0.00 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.26 2qnf h ASN 107 CO -0.04 0.04 0.60 0.15 -1.65 0.00 0.00 177.43 176.53 2qnf h PHE 108 N 0.00 1.04 0.02 1.19 3.57 -1.72 0.27 116.94 121.32 2qnf h PHE 108 Ca -0.00 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 2qnf h PHE 108 Cb 0.10 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 38.53 2qnf h PHE 108 CO 0.00 0.22 -0.01 0.28 -2.23 0.00 0.00 178.31 176.56 2qnf h VAL 109 N 0.74 0.00 -0.99 1.41 2.07 -1.69 -0.60 116.25 117.19 2qnf h VAL 109 Ca 0.58 0.00 0.36 0.00 0.82 0.00 0.00 66.70 68.46 2qnf h VAL 109 Cb 0.91 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.51 2qnf h VAL 109 CO -0.39 0.00 0.44 1.23 0.02 0.00 0.00 177.57 178.87 2qnf h GLY 110 N -0.03 2.00 1.12 2.17 0.00 -1.45 0.37 103.07 107.25 2qnf h GLY 110 Ca -0.00 -0.11 -0.17 0.00 0.00 0.00 0.00 47.33 47.05 2qnf h GLY 110 CO 0.00 -0.66 -0.46 -0.55 0.00 0.00 0.00 176.54 174.88 2qnf h ASP 111 N 0.09 0.96 1.16 0.19 5.19 -0.39 -2.72 116.42 120.91 2qnf h ASP 111 Ca 0.76 -0.50 -0.04 0.00 -0.62 0.00 0.00 57.03 56.63 2qnf h ASP 111 Cb 1.87 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 41.10 2qnf h ASP 111 CO -0.75 1.28 -0.19 0.50 -3.12 0.00 0.00 179.24 176.96 2qnf h LYS 112 N 0.67 0.00 0.00 3.56 1.63 0.13 -2.76 116.57 119.80 2qnf h LYS 112 Ca 0.03 0.00 -0.17 0.00 -0.85 0.00 0.00 60.65 59.67 2qnf h LYS 112 Cb 1.06 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.67 2qnf h LYS 112 CO 0.11 0.19 -0.80 0.77 -3.45 0.00 0.00 179.45 176.27 2qnf h SER 113 N 0.00 0.00 0.24 4.20 0.02 -0.75 -2.66 113.55 114.60 2qnf h SER 113 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2qnf h SER 113 Cb 0.82 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.36 2qnf h SER 113 CO 0.02 0.80 -0.11 0.11 -1.14 0.00 0.00 176.83 176.51 2qnf h LYS 114 N 0.00 -0.31 -1.06 3.45 1.57 -1.21 -1.51 116.57 117.51 2qnf h LYS 114 Ca -0.01 0.02 0.28 0.00 -1.87 0.00 0.00 60.65 59.07 2qnf h LYS 114 Cb 1.45 0.07 -0.10 0.00 0.08 0.00 0.00 32.23 33.73 2qnf h LYS 114 CO 0.10 0.06 0.67 1.49 -0.57 0.00 0.00 179.45 181.21 2qnf h GLU 115 N -0.78 0.37 -0.10 3.15 4.81 -1.55 1.13 114.58 121.60 2qnf h GLU 115 Ca -0.03 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.01 2qnf h GLU 115 Cb 0.51 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 2qnf h GLU 115 CO 0.05 0.25 -0.64 0.35 -0.73 0.00 0.00 179.01 178.29 2qnf h PHE 116 N 0.39 0.51 -0.50 0.92 3.57 -1.33 -3.13 116.94 117.36 2qnf h PHE 116 Ca 0.62 -0.20 -0.06 0.00 3.53 0.00 0.00 57.97 61.85 2qnf h PHE 116 Cb 1.56 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 40.19 2qnf h PHE 116 CO -0.00 0.92 0.06 0.66 -2.23 0.00 0.00 178.31 177.71 2qnf h SER 117 N 0.28 0.76 0.00 0.41 4.64 0.24 -1.79 113.55 118.09 2qnf h SER 117 Ca -0.01 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2qnf h SER 117 Cb 1.18 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 2qnf h SER 117 CO 0.11 0.79 0.00 0.54 -0.87 0.00 0.00 176.83 177.40 2qnf n ARG 118 N -4.24 0.20 -3.41 4.77 1.74 -0.68 -4.72 116.66 110.31 2qnf n ARG 118 Ca 0.03 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.92 2qnf n ARG 118 Cb 0.27 -1.07 -0.01 0.00 -1.02 0.00 0.00 32.46 30.63 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 -1.14 3.80 0.19 0.55 1.43 -0.67 -5.11 118.68 117.72 2qnf s LEU 119 Ca 0.01 -0.33 -0.07 0.00 -1.03 0.00 0.00 54.13 52.71 2qnf s LEU 119 Cb 0.01 -2.60 -0.06 0.00 0.03 0.00 0.00 46.19 43.56 2qnf s LEU 119 CO 0.01 -0.52 0.46 -0.83 0.23 0.00 0.00 176.35 175.70 2qnf s GLY 120 N -4.19 2.22 0.33 -3.19 0.00 -1.26 -4.91 107.32 96.32 2qnf s GLY 120 Ca 0.47 -0.44 0.11 0.00 0.00 0.00 0.00 44.72 44.86 2qnf s GLY 120 CO 0.31 -0.34 1.62 1.70 0.00 0.00 0.00 173.10 176.40 2qnf h LYS 121 N 2.60 0.16 -0.26 2.90 3.64 -1.98 -0.29 116.57 123.35 2qnf h LYS 121 Ca -0.46 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 58.80 2qnf h LYS 121 Cb 1.17 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2qnf h LYS 121 CO 0.71 0.11 -0.25 0.93 -2.27 0.00 0.00 179.45 178.68 2qnf h GLU 122 N 0.17 0.62 -0.15 1.90 4.39 -2.00 -2.54 114.58 116.96 2qnf h GLU 122 Ca 0.69 -0.33 -0.06 0.00 0.34 0.00 0.00 59.36 60.00 2qnf h GLU 122 Cb 1.59 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.24 2qnf h GLU 122 CO -0.71 0.92 -0.18 0.93 -1.16 0.00 0.00 179.01 178.81 2qnf h GLU 123 N 0.34 0.25 0.56 2.33 5.08 -1.50 -2.24 114.58 119.40 2qnf h GLU 123 Ca 0.04 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2qnf h GLU 123 Cb 0.81 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.03 2qnf h GLU 123 CO 0.06 0.44 -0.27 0.52 -1.00 0.00 0.00 179.01 178.76 2qnf h MET 124 N 0.24 -0.73 -0.70 2.33 2.86 -1.06 -2.04 114.93 115.83 2qnf h MET 124 Ca 0.04 0.05 0.11 0.00 -2.06 0.00 0.00 59.70 57.84 2qnf h MET 124 Cb 0.47 0.17 -0.05 0.00 0.06 0.00 0.00 31.60 32.25 2qnf h MET 124 CO 0.03 -0.44 0.47 0.52 1.06 0.00 0.00 176.91 178.55 2qnf h MET 125 N -0.90 0.50 -0.18 1.72 2.86 -1.34 -1.75 114.93 115.83 2qnf h MET 125 Ca -0.08 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 2qnf h MET 125 Cb 0.63 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 2qnf h MET 125 CO 0.13 0.33 0.07 0.00 1.06 0.00 0.00 176.91 178.50 2qnf h ALA 126 N 1.65 0.24 -0.78 6.32 0.00 -1.16 -2.76 119.26 122.77 2qnf h ALA 126 Ca 0.33 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 2qnf h ALA 126 Cb 0.60 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2qnf h ALA 126 CO -0.11 -0.18 0.35 1.49 0.00 0.00 0.00 179.25 180.80 2qnf h GLU 127 N 0.14 1.13 0.00 0.00 4.57 -0.61 -2.21 114.58 117.61 2qnf h GLU 127 Ca 0.06 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.05 2qnf h GLU 127 Cb 0.17 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.56 2qnf h GLU 127 CO -0.01 0.89 -0.06 0.52 -1.18 0.00 0.00 179.01 179.17 2qnf h MET 128 N 1.12 0.00 0.06 1.92 2.86 -1.24 -2.26 114.93 117.38 2qnf h MET 128 Ca 0.27 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.66 2qnf h MET 128 Cb 0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.81 2qnf h MET 128 CO -0.03 0.06 -1.06 -0.07 1.06 0.00 0.00 176.91 176.87 2qnf h LEU 129 N 0.00 0.45 -0.05 1.22 3.38 -1.12 0.45 115.31 119.64 2qnf h LEU 129 Ca -0.00 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2qnf h LEU 129 Cb 0.39 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2qnf h LEU 129 CO 0.01 1.25 -0.09 0.00 0.09 0.00 0.00 178.44 179.70 2qnf n GLN 130 N -3.64 0.27 0.00 1.13 6.02 -0.92 -2.93 117.38 117.31 2qnf n GLN 130 Ca -0.07 -0.05 0.07 0.00 -0.01 0.00 0.00 57.00 56.94 2qnf n GLN 130 Cb 0.91 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 30.72 2qnf n GLN 130 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2qnf n ARG 131 N -1.32 1.25 -3.03 -1.09 1.74 -0.90 -4.99 116.66 108.33 2qnf n ARG 131 Ca 0.10 -1.16 -0.12 0.00 -0.77 0.00 0.00 57.85 55.90 2qnf n ARG 131 Cb 0.30 -1.25 0.06 0.00 -1.02 0.00 0.00 32.46 30.55 2qnf n ARG 131 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qnf n GLY 132 N 0.88 -0.14 3.55 -0.13 0.00 -0.96 -5.03 105.19 103.36 2qnf n GLY 132 Ca 0.08 -0.06 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.26 2.77 -0.21 1.61 0.08 0.16 -5.03 117.98 114.09 2qnf s PHE 133 Ca 0.00 -0.12 -0.20 0.00 0.12 0.00 0.00 56.93 56.73 2qnf s PHE 133 Cb -0.00 -1.55 -0.03 0.00 -0.57 0.00 0.00 43.02 40.88 2qnf s PHE 133 CO 0.52 0.34 0.58 -1.21 -0.10 0.00 0.00 175.22 175.35 2qnf s GLU 134 N -1.50 4.19 0.32 0.44 2.02 -1.26 -4.59 118.70 118.32 2qnf s GLU 134 Ca 0.17 0.52 0.04 0.00 0.02 0.00 0.00 54.97 55.72 2qnf s GLU 134 Cb -0.11 -3.58 -0.02 0.00 0.10 0.00 0.00 34.13 30.52 2qnf s GLU 134 CO 0.07 -0.23 0.15 2.48 0.02 0.00 0.00 175.26 177.76 2qnf n TYR 135 N 5.05 -0.11 -4.36 1.61 0.18 -1.26 -5.05 117.16 113.23 2qnf n TYR 135 Ca -0.03 -2.22 -0.19 0.00 1.88 0.00 0.00 57.90 57.35 2qnf n TYR 135 Cb 0.50 0.07 -0.10 0.00 -0.38 0.00 0.00 39.34 39.42 2qnf n TYR 135 CO 0.00 0.00 0.00 -0.80 -2.08 0.00 0.00 176.86 173.98 2qnf s ASN 136 N -3.04 2.51 -0.12 9.48 0.02 -1.26 -5.06 114.94 117.47 2qnf s ASN 136 Ca 0.22 -1.08 -0.26 0.00 -1.02 0.00 0.00 52.86 50.72 2qnf s ASN 136 Cb 0.01 -0.12 -0.27 0.00 0.02 0.00 0.00 41.25 40.89 2qnf s ASN 136 CO 0.15 -0.26 0.73 -0.33 0.02 0.00 0.00 177.10 177.42 2qnf h GLU 137 N 2.49 0.09 0.00 -0.60 4.39 -2.02 -3.26 114.58 115.67 2qnf h GLU 137 Ca -0.38 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.17 2qnf h GLU 137 Cb 1.22 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 2qnf h GLU 137 CO 0.64 1.07 0.00 -1.13 -1.16 0.00 0.00 179.01 178.43 2qnf n SER 138 N -4.43 0.21 -4.77 1.42 3.41 -1.26 -4.69 113.62 103.51 2qnf n SER 138 Ca -0.14 0.58 -0.41 0.00 -0.26 0.00 0.00 58.87 58.64 2qnf n SER 138 Cb 0.61 -0.61 -0.01 0.00 -0.26 0.00 0.00 64.21 63.93 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 -3.38 6.59 0.78 4.04 1.01 -1.23 -5.01 116.67 119.48 2qnf s ASP 139 Ca 0.02 2.81 -0.04 0.00 0.71 0.00 0.00 52.55 56.04 2qnf s ASP 139 Cb 0.05 -2.65 0.14 0.00 1.01 0.00 0.00 42.92 41.47 2qnf s ASP 139 CO 0.15 -0.69 0.94 0.35 0.21 0.00 0.00 175.17 176.13 2qnf n THR 140 N 1.07 0.00 0.03 -1.27 -2.24 -1.26 -4.88 114.28 105.72 2qnf n THR 140 Ca 0.02 -1.19 -0.12 0.00 -2.27 0.00 0.00 64.05 60.48 2qnf n THR 140 Cb 0.40 -1.15 -0.08 0.00 -2.10 0.00 0.00 70.33 67.40 2qnf n THR 140 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2qnf h LYS 141 N 0.00 -0.02 -0.45 -0.78 1.57 -1.98 -2.16 116.57 112.75 2qnf h LYS 141 Ca -0.31 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.56 2qnf h LYS 141 Cb 1.04 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.26 2qnf h LYS 141 CO 0.29 0.17 -0.15 1.15 -0.57 0.00 0.00 179.45 180.34 2qnf h THR 142 N -0.20 0.47 0.00 -0.16 2.02 -2.00 -1.23 112.91 111.81 2qnf h THR 142 Ca -0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 2qnf h THR 142 Cb 0.20 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 2qnf h THR 142 CO 0.00 0.00 -0.18 1.56 0.37 0.00 0.00 175.52 177.28 2qnf h GLN 143 N -0.05 0.00 0.20 6.66 4.20 -1.92 -2.72 115.11 121.48 2qnf h GLN 143 Ca 0.22 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.61 2qnf h GLN 143 Cb 0.38 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.20 2qnf h GLN 143 CO -0.49 0.18 -1.38 -0.07 -0.67 0.00 0.00 178.83 176.39 2qnf h LEU 144 N 0.00 0.79 0.04 1.46 3.38 -0.58 -2.74 115.31 117.66 2qnf h LEU 144 Ca -0.00 -0.81 -0.00 0.00 0.09 0.00 0.00 57.88 57.16 2qnf h LEU 144 Cb 0.40 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2qnf h LEU 144 CO 0.02 1.62 -0.02 0.40 0.09 0.00 0.00 178.44 180.56 2qnf h ILE 145 N 0.17 1.04 -0.20 1.22 2.04 -1.15 0.13 117.51 120.76 2qnf h ILE 145 Ca -0.22 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2qnf h ILE 145 Cb 2.07 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 39.37 2qnf h ILE 145 CO 0.26 0.07 0.13 0.00 0.00 0.00 0.00 178.15 178.60 2qnf h ALA 146 N 0.78 0.26 -0.40 1.87 0.00 -1.61 -0.95 119.26 119.22 2qnf h ALA 146 Ca -0.01 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2qnf h ALA 146 Cb 0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2qnf h ALA 146 CO 0.01 -0.25 0.26 1.03 0.00 0.00 0.00 179.25 180.30 2qnf h SER 147 N 0.26 0.41 -0.38 0.00 0.87 -1.37 -1.72 113.55 111.62 2qnf h SER 147 Ca 0.07 -0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 60.49 2qnf h SER 147 Cb -0.01 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 2qnf h SER 147 CO -0.01 0.29 -0.28 0.15 -0.53 0.00 0.00 176.83 176.45 2qnf h PHE 148 N 0.48 1.05 -0.41 2.24 3.04 0.10 -2.01 116.94 121.44 2qnf h PHE 148 Ca 0.15 -0.27 -0.01 0.00 3.98 0.00 0.00 57.97 61.82 2qnf h PHE 148 Cb 0.02 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 38.27 2qnf h PHE 148 CO -0.00 1.07 0.21 -0.22 -2.02 0.00 0.00 178.31 177.35 2qnf h LYS 149 N 0.77 0.57 0.69 1.11 3.64 -0.36 -0.44 116.57 122.55 2qnf h LYS 149 Ca 0.09 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2qnf h LYS 149 Cb 0.84 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 2qnf h LYS 149 CO 0.07 0.48 -0.46 -0.22 -2.27 0.00 0.00 179.45 177.06 2qnf h LYS 150 N 0.52 -1.05 0.00 1.90 3.64 -1.25 -2.43 116.57 117.91 2qnf h LYS 150 Ca 0.14 0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 2qnf h LYS 150 Cb 0.08 0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2qnf h LYS 150 CO -0.02 -0.70 -0.14 1.96 -2.27 0.00 0.00 179.45 178.28 2qnf h GLN 151 N -1.09 0.00 -0.30 1.90 4.20 -1.36 -2.49 115.11 115.98 2qnf h GLN 151 Ca -0.09 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.46 2qnf h GLN 151 Cb 0.89 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.66 2qnf h GLN 151 CO 0.07 0.14 -0.45 1.25 -0.67 0.00 0.00 178.83 179.17 2qnf h LEU 152 N 0.00 0.83 0.35 1.46 5.85 -0.90 -2.72 115.31 120.19 2qnf h LEU 152 Ca -0.00 -0.40 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 2qnf h LEU 152 Cb 0.30 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 2qnf h LEU 152 CO 0.02 1.15 -0.24 0.03 -0.34 0.00 0.00 178.44 179.06 2qnf h ARG 153 N 0.62 -0.54 -0.76 1.25 3.08 -0.96 -3.04 114.38 114.02 2qnf h ARG 153 Ca 0.04 0.04 0.17 0.00 0.07 0.00 0.00 59.98 60.30 2qnf h ARG 153 Cb 1.01 0.12 -0.13 0.00 0.08 0.00 0.00 29.97 31.05 2qnf h ARG 153 CO 0.10 -0.36 -0.01 -0.22 -1.07 0.00 0.00 179.97 178.41 2qnf h LYS 154 N -0.56 0.09 0.00 0.04 3.64 -1.62 0.23 116.57 118.38 2qnf h LYS 154 Ca -0.05 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2qnf h LYS 154 Cb 0.45 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2qnf h LYS 154 CO 0.03 0.06 0.00 -1.13 -2.27 0.00 0.00 179.45 176.14 2qnf n SER 155 N -5.37 0.06 0.00 4.20 3.41 -1.02 -2.30 113.62 112.60 2qnf n SER 155 Ca 0.14 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.27 2qnf n SER 155 Cb 0.47 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 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 -1.59 0.60 0.00 1.04 4.77 0.73 -5.09 117.00 117.46 2qnf n LEU 156 Ca 0.00 -0.75 0.00 0.00 -0.03 0.00 0.00 56.01 55.23 2qnf n LEU 156 Cb 0.02 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2qnf n LEU 156 CO 0.03 0.15 0.22 1.17 -1.33 0.00 0.00 177.39 177.63