#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qgf n ASN 2 N 0.00 -2.54 -0.33 0.00 0.23 -0.58 -4.83 115.26 107.20 2qgf n ASN 2 Ca 0.00 0.81 0.19 0.00 -0.53 0.00 0.00 54.58 55.05 2qgf n ASN 2 Cb 0.00 -0.93 0.44 0.00 -2.08 0.00 0.00 39.78 37.21 2qgf n ASN 2 CO 0.00 0.00 0.00 -0.65 -0.93 0.00 0.00 177.26 175.68 2qgf h PRO 3 N 0.36 0.50 -0.01 -0.53 0.11 -1.94 -1.56 132.00 128.94 2qgf h PRO 3 Ca -0.38 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2qgf h PRO 3 Cb 1.44 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2qgf h PRO 3 CO 0.47 0.33 -0.39 1.28 -0.21 0.00 0.00 178.00 179.48 2qgf n LEU 4 N -4.74 0.99 -4.66 2.35 4.77 -1.26 -4.83 117.00 109.62 2qgf n LEU 4 Ca 0.25 -0.26 -0.54 0.00 -0.03 0.00 0.00 56.01 55.43 2qgf n LEU 4 Cb 0.78 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.67 2qgf n LEU 4 CO 0.22 0.20 1.14 0.00 -1.33 0.00 0.00 177.39 177.62 2qgf n TYR 5 N -0.87 1.84 -0.97 -1.77 -0.00 -0.59 -1.24 117.16 113.56 2qgf n TYR 5 Ca 0.10 0.55 0.00 0.00 -0.00 0.00 0.00 57.90 58.54 2qgf n TYR 5 Cb 0.36 -2.42 0.00 0.00 -0.00 0.00 0.00 39.34 37.28 2qgf n TYR 5 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 2qgf n GLN 6 N 4.11 -1.71 -2.15 2.98 1.13 0.03 -4.97 117.38 116.79 2qgf n GLN 6 Ca 0.22 0.43 -0.29 0.00 -1.94 0.00 0.00 57.00 55.42 2qgf n GLN 6 Cb 0.17 -4.81 0.03 0.00 0.11 0.00 0.00 30.24 25.74 2qgf n GLN 6 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2qgf s LYS 7 N -1.78 3.13 -0.04 -1.09 1.02 -0.37 -4.78 119.74 115.83 2qgf s LYS 7 Ca 0.00 0.33 -0.09 0.00 0.02 0.00 0.00 55.97 56.24 2qgf s LYS 7 Cb 0.00 -2.16 -0.05 0.00 -0.52 0.00 0.00 37.83 35.10 2qgf s LYS 7 CO 0.00 -0.71 0.26 -1.01 -0.92 0.00 0.00 175.35 172.97 2qgf s HIS 8 N -3.12 3.62 -0.85 3.18 3.76 -1.26 -4.69 115.29 115.94 2qgf s HIS 8 Ca 0.55 0.66 -0.06 0.00 -0.15 0.00 0.00 55.06 56.06 2qgf s HIS 8 Cb -0.11 -2.05 0.21 0.00 1.11 0.00 0.00 32.58 31.75 2qgf s HIS 8 CO 0.49 0.66 0.74 0.42 -0.85 0.00 0.00 174.74 176.20 2qgf s ILE 9 N -1.15 4.70 -0.22 0.60 -1.09 -0.94 -4.90 121.20 118.20 2qgf s ILE 9 Ca 0.22 -3.29 -0.16 0.00 -2.23 0.00 0.00 60.65 55.20 2qgf s ILE 9 Cb -0.14 -3.92 -0.11 0.00 -1.58 0.00 0.00 42.46 36.71 2qgf s ILE 9 CO 0.11 -1.04 -0.20 -0.38 -1.23 0.00 0.00 174.94 172.20 2qgf n ILE 10 N 3.01 1.50 -4.17 2.92 2.08 -1.26 -0.69 119.36 122.76 2qgf n ILE 10 Ca 0.17 -0.08 -0.17 0.00 0.56 0.00 0.00 62.75 63.23 2qgf n ILE 10 Cb 0.39 -2.12 -0.12 0.00 -0.75 0.00 0.00 39.64 37.04 2qgf n ILE 10 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 2qgf s SER 11 N -6.67 1.45 0.47 4.38 0.15 -1.26 -4.64 113.70 107.58 2qgf s SER 11 Ca -0.30 -0.56 0.18 0.00 0.70 0.00 0.00 55.95 55.97 2qgf s SER 11 Cb 0.08 -0.04 1.13 0.00 -1.71 0.00 0.00 66.02 65.49 2qgf s SER 11 CO 0.45 -0.09 2.01 -0.29 1.20 0.00 0.00 173.24 176.53 2qgf h ILE 12 N 4.39 0.98 0.00 6.45 6.09 -1.95 -1.54 117.51 131.93 2qgf h ILE 12 Ca -0.39 -0.61 0.00 0.00 -1.37 0.00 0.00 64.86 62.49 2qgf h ILE 12 Cb 1.19 1.34 0.00 0.00 0.47 0.00 0.00 36.82 39.82 2qgf h ILE 12 CO 0.41 0.17 0.00 0.78 -3.07 0.00 0.00 178.15 176.44 2qgf h ASN 13 N 0.00 0.00 0.41 2.19 2.35 -1.97 -0.63 115.58 117.92 2qgf h ASN 13 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2qgf h ASN 13 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.70 2qgf h ASN 13 CO 0.02 0.00 -0.22 0.47 -1.65 0.00 0.00 177.43 176.05 2qgf n ASP 14 N -2.66 0.61 -4.61 5.81 9.92 -0.58 -4.79 116.55 120.26 2qgf n ASP 14 Ca -0.01 -0.51 -0.34 0.00 -0.53 0.00 0.00 54.79 53.39 2qgf n ASP 14 Cb 0.14 0.02 -0.10 0.00 -0.64 0.00 0.00 41.12 40.53 2qgf n ASP 14 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2qgf s LEU 15 N -2.63 3.69 0.68 0.64 1.43 -0.25 -5.07 118.68 117.18 2qgf s LEU 15 Ca 0.23 0.04 -0.06 0.00 -1.03 0.00 0.00 54.13 53.30 2qgf s LEU 15 Cb 0.19 -1.92 0.05 0.00 0.03 0.00 0.00 46.19 44.54 2qgf s LEU 15 CO 0.54 0.18 0.99 -0.94 0.23 0.00 0.00 176.35 177.34 2qgf s SER 16 N 0.35 4.97 0.39 2.29 1.04 -1.26 -4.88 113.70 116.61 2qgf s SER 16 Ca 0.01 0.50 0.11 0.00 0.48 0.00 0.00 55.95 57.05 2qgf s SER 16 Cb -0.13 -1.22 0.90 0.00 0.10 0.00 0.00 66.02 65.67 2qgf s SER 16 CO 0.01 -1.49 1.94 -0.09 0.98 0.00 0.00 173.24 174.59 2qgf h ARG 17 N -0.51 0.56 -0.39 4.02 2.43 -1.97 -0.11 114.38 118.42 2qgf h ARG 17 Ca -0.44 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 58.58 2qgf h ARG 17 Cb 1.30 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 2qgf h ARG 17 CO 0.60 0.37 -0.20 -0.44 -1.51 0.00 0.00 179.97 178.80 2qgf h ASP 18 N 0.58 0.75 -0.13 -3.80 3.32 -1.98 -2.42 116.42 112.75 2qgf h ASP 18 Ca 0.34 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 2qgf h ASP 18 Cb 0.53 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.87 2qgf h ASP 18 CO -0.12 0.94 -0.02 0.44 -1.72 0.00 0.00 179.24 178.76 2qgf h ASP 19 N 0.66 0.24 -0.29 6.45 3.45 -1.39 -1.68 116.42 123.85 2qgf h ASP 19 Ca 0.10 -0.36 0.06 0.00 0.43 0.00 0.00 57.03 57.26 2qgf h ASP 19 Cb 0.69 -0.07 -0.06 0.00 -0.56 0.00 0.00 39.33 39.34 2qgf h ASP 19 CO 0.05 0.54 -0.08 -0.07 -1.57 0.00 0.00 179.24 178.12 2qgf h LEU 20 N -0.07 -0.28 -1.06 1.55 3.38 -1.38 -0.61 115.31 116.84 2qgf h LEU 20 Ca 0.03 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2qgf h LEU 20 Cb 0.43 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 2qgf h LEU 20 CO 0.01 -0.10 0.33 0.78 0.09 0.00 0.00 178.44 179.55 2qgf h ASN 21 N -0.01 0.90 -0.31 -0.43 -0.26 -1.40 -0.75 115.58 113.33 2qgf h ASN 21 Ca 0.14 -0.10 -0.01 0.00 -0.56 0.00 0.00 56.30 55.77 2qgf h ASN 21 Cb 0.22 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.24 2qgf h ASN 21 CO -0.31 0.77 0.15 0.25 -1.06 0.00 0.00 177.43 177.23 2qgf h LEU 22 N 0.99 0.41 -0.34 1.61 5.85 -0.56 0.18 115.31 123.45 2qgf h LEU 22 Ca 0.24 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 2qgf h LEU 22 Cb 0.11 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2qgf h LEU 22 CO -0.03 0.43 0.17 0.58 -0.34 0.00 0.00 178.44 179.25 2qgf h VAL 23 N 0.36 1.16 -0.17 1.05 2.07 -0.67 -1.49 116.25 118.57 2qgf h VAL 23 Ca 0.11 -0.44 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 2qgf h VAL 23 Cb 0.13 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 2qgf h VAL 23 CO -0.01 0.16 -0.19 -0.07 0.02 0.00 0.00 177.57 177.48 2qgf h LEU 24 N 0.42 0.28 -0.23 2.57 3.38 -0.91 0.02 115.31 120.83 2qgf h LEU 24 Ca 0.12 -0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 2qgf h LEU 24 Cb 0.11 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2qgf h LEU 24 CO -0.02 0.50 -0.39 0.00 0.09 0.00 0.00 178.44 178.62 2qgf h ALA 25 N 1.53 0.36 -0.70 1.53 0.00 -0.38 -2.70 119.26 118.91 2qgf h ALA 25 Ca 0.05 -0.45 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 2qgf h ALA 25 Cb 0.50 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2qgf h ALA 25 CO 0.03 0.46 0.25 1.15 0.00 0.00 0.00 179.25 181.14 2qgf h THR 26 N 0.39 1.25 -0.43 0.00 2.02 -0.61 -2.81 112.91 112.72 2qgf h THR 26 Ca 0.02 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.38 2qgf h THR 26 Cb 0.98 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 2qgf h THR 26 CO 0.09 0.32 0.22 0.00 0.37 0.00 0.00 175.52 176.52 2qgf h ALA 27 N 1.25 0.55 -0.71 6.16 0.00 -0.96 0.23 119.26 125.78 2qgf h ALA 27 Ca 0.23 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2qgf h ALA 27 Cb 0.24 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2qgf h ALA 27 CO -0.01 0.09 0.47 0.00 0.00 0.00 0.00 179.25 179.79 2qgf h ALA 28 N 1.07 0.90 -0.19 0.00 0.00 -1.37 0.23 119.26 119.91 2qgf h ALA 28 Ca 0.15 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2qgf h ALA 28 Cb 0.08 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2qgf h ALA 28 CO -0.02 0.33 0.05 0.87 0.00 0.00 0.00 179.25 180.48 2qgf h LYS 29 N 0.97 0.30 0.00 0.00 1.57 -1.26 -1.38 116.57 116.77 2qgf h LYS 29 Ca 0.26 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.95 2qgf h LYS 29 Cb -0.10 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.17 2qgf h LYS 29 CO -0.06 0.43 -0.09 -0.07 -0.57 0.00 0.00 179.45 179.10 2qgf h LEU 30 N 0.12 0.00 -0.21 2.94 3.38 -0.62 0.56 115.31 121.48 2qgf h LEU 30 Ca 0.06 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.81 2qgf h LEU 30 Cb 0.27 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.03 2qgf h LEU 30 CO 0.00 0.09 -0.73 0.50 0.09 0.00 0.00 178.44 178.38 2qgf h LYS 31 N 0.00 0.79 0.39 1.13 3.64 -0.54 -3.24 116.57 118.73 2qgf h LYS 31 Ca -0.00 -0.61 -0.02 0.00 -1.27 0.00 0.00 60.65 58.75 2qgf h LYS 31 Cb 0.18 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2qgf h LYS 31 CO 0.01 1.23 -0.19 0.00 -2.27 0.00 0.00 179.45 178.23 2qgf h ALA 32 N 0.61 -0.52 -3.49 5.00 0.00 -0.19 -3.42 119.26 117.25 2qgf h ALA 32 Ca -0.04 -0.14 -0.65 0.00 0.00 0.00 0.00 54.91 54.08 2qgf h ALA 32 Cb 1.35 0.20 -0.40 0.00 0.00 0.00 0.00 17.79 18.94 2qgf h ALA 32 CO 0.15 -0.50 -0.68 -0.80 0.00 0.00 0.00 179.25 177.42 2qgf s ASN 33 N -4.98 4.48 0.49 0.00 0.01 0.09 -5.10 114.94 109.92 2qgf s ASN 33 Ca -0.09 -2.58 -0.24 0.00 -0.71 0.00 0.00 52.86 49.24 2qgf s ASN 33 Cb 0.01 -1.59 -0.07 0.00 0.41 0.00 0.00 41.25 40.01 2qgf s ASN 33 CO 0.29 -0.30 1.41 -2.84 -1.51 0.00 0.00 177.10 174.14 2qgf s PRO 34 N 0.32 3.46 -0.58 -0.60 0.02 -1.22 -4.46 135.00 131.94 2qgf s PRO 34 Ca 0.14 2.36 0.06 0.00 0.02 0.00 0.00 61.00 63.58 2qgf s PRO 34 Cb -0.23 -2.50 0.21 0.00 0.02 0.00 0.00 34.50 32.00 2qgf s PRO 34 CO -0.04 -0.98 0.55 1.04 -0.33 0.00 0.00 177.00 177.23 2qgf n GLN 35 N -0.53 1.56 0.00 5.54 1.13 -1.26 -5.00 117.38 118.82 2qgf n GLN 35 Ca 0.07 -4.10 0.00 0.00 -1.94 0.00 0.00 57.00 51.03 2qgf n GLN 35 Cb 0.43 -1.99 0.02 0.00 0.11 0.00 0.00 30.24 28.80 2qgf n GLN 35 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2qgf n PRO 36 N 1.70 0.02 -0.04 -1.09 -0.04 -1.22 -1.80 135.00 132.53 2qgf n PRO 36 Ca 0.25 0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 2qgf n PRO 36 Cb 0.42 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 2qgf n PRO 36 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2qgf n GLU 37 N -1.12 0.49 -0.19 0.54 1.02 -1.25 -2.36 120.64 117.78 2qgf n GLU 37 Ca 0.00 -0.72 -0.00 0.00 -0.02 0.00 0.00 57.16 56.42 2qgf n GLU 37 Cb 0.00 -0.59 0.10 0.00 -0.02 0.00 0.00 31.44 30.93 2qgf n GLU 37 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2qgf h LEU 38 N 0.00 0.04 -3.07 -4.62 5.85 -1.21 -1.81 115.31 110.49 2qgf h LEU 38 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2qgf h LEU 38 Cb 0.95 0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.11 2qgf h LEU 38 CO 0.00 0.03 0.00 0.18 -0.34 0.00 0.00 178.44 178.31 2qgf n LEU 39 N -5.10 4.75 -4.63 2.25 4.77 0.16 -4.99 117.00 114.22 2qgf n LEU 39 Ca 0.08 -2.40 -0.49 0.00 -0.03 0.00 0.00 56.01 53.17 2qgf n LEU 39 Cb 0.30 -0.59 -0.05 0.00 -2.33 0.00 0.00 43.42 40.75 2qgf n LEU 39 CO 0.19 0.78 1.05 1.17 -1.33 0.00 0.00 177.39 179.24 2qgf n LYS 40 N 1.08 1.62 -0.31 3.23 4.81 -0.68 -1.19 118.16 126.71 2qgf n LYS 40 Ca 0.25 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 58.28 2qgf n LYS 40 Cb 0.90 -2.29 0.00 0.00 0.02 0.00 0.00 35.03 33.66 2qgf n LYS 40 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2qgf n HIS 41 N 3.03 0.00 -3.22 5.64 8.25 -1.26 -4.99 115.22 122.67 2qgf n HIS 41 Ca 0.18 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.35 2qgf n HIS 41 Cb 0.24 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.31 2qgf n HIS 41 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2qgf s LYS 42 N -0.57 3.66 -0.13 -0.41 -0.14 -0.34 -4.99 119.74 116.83 2qgf s LYS 42 Ca 0.00 0.11 0.00 0.00 -1.36 0.00 0.00 55.97 54.72 2qgf s LYS 42 Cb 0.00 -2.59 0.02 0.00 -1.68 0.00 0.00 37.83 33.59 2qgf s LYS 42 CO 0.00 0.15 -0.12 0.08 -0.76 0.00 0.00 175.35 174.70 2qgf s VAL 43 N -2.16 1.34 -0.09 3.17 1.01 -1.26 -1.66 120.40 120.74 2qgf s VAL 43 Ca 0.46 -0.49 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 2qgf s VAL 43 Cb -0.11 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 2qgf s VAL 43 CO 0.31 0.42 -0.06 -0.63 0.00 0.00 0.00 175.10 175.13 2qgf s ILE 44 N 1.52 3.71 -0.24 2.22 1.01 -0.42 -0.79 121.20 128.21 2qgf s ILE 44 Ca 0.04 -0.46 -0.16 0.00 0.00 0.00 0.00 60.65 60.07 2qgf s ILE 44 Cb -0.13 -2.55 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 2qgf s ILE 44 CO -0.09 0.57 0.40 0.00 0.00 0.00 0.00 174.94 175.82 2qgf s ALA 45 N -0.44 3.57 -0.79 9.38 0.00 -0.77 -1.39 121.76 131.31 2qgf s ALA 45 Ca 0.07 -0.68 -0.17 0.00 0.00 0.00 0.00 51.96 51.18 2qgf s ALA 45 Cb -0.12 -2.69 0.16 0.00 0.00 0.00 0.00 23.12 20.47 2qgf s ALA 45 CO 0.02 -0.52 0.85 0.45 0.00 0.00 0.00 175.76 176.56 2qgf s SER 46 N 1.38 6.57 -0.89 0.00 0.15 0.45 -1.27 113.70 120.10 2qgf s SER 46 Ca 0.17 -2.17 -0.11 0.00 0.70 0.00 0.00 55.95 54.54 2qgf s SER 46 Cb -0.15 -2.29 0.23 0.00 -1.71 0.00 0.00 66.02 62.10 2qgf s SER 46 CO 0.09 -0.86 0.83 0.00 1.20 0.00 0.00 173.24 174.50 2qgf s PHE 48 N -0.30 3.47 0.23 0.00 0.40 -0.95 -1.60 117.98 119.24 2qgf s PHE 48 Ca 0.22 -1.76 0.26 0.00 -0.60 0.00 0.00 56.93 55.04 2qgf s PHE 48 Cb -0.11 -4.07 1.13 0.00 0.51 0.00 0.00 43.02 40.48 2qgf s PHE 48 CO -0.08 -1.25 1.92 0.74 0.70 0.00 0.00 175.22 177.24 2qgf h PHE 49 N 8.17 0.00 -3.31 0.36 -1.00 -1.24 -3.06 116.94 116.87 2qgf h PHE 49 Ca 0.15 0.00 -0.66 0.00 2.81 0.00 0.00 57.97 60.27 2qgf h PHE 49 Cb 1.01 0.00 -0.29 0.00 3.61 0.00 0.00 35.95 40.28 2qgf h PHE 49 CO 1.09 0.18 -0.79 -2.00 -1.61 0.00 0.00 178.31 175.18 2qgf s GLU 50 N -3.83 3.29 0.27 1.51 2.12 -1.09 -3.85 118.70 117.11 2qgf s GLU 50 Ca -0.01 -0.72 -0.30 0.00 0.36 0.00 0.00 54.97 54.31 2qgf s GLU 50 Cb 0.11 -2.63 -0.09 0.00 0.26 0.00 0.00 34.13 31.78 2qgf s GLU 50 CO 0.61 0.10 1.06 0.00 -0.54 0.00 0.00 175.26 176.49 2qgf s ALA 51 N 0.63 3.39 -0.31 6.30 0.00 -1.26 -4.66 121.76 125.85 2qgf s ALA 51 Ca -0.08 0.83 0.05 0.00 0.00 0.00 0.00 51.96 52.76 2qgf s ALA 51 Cb -0.16 -3.30 0.20 0.00 0.00 0.00 0.00 23.12 19.86 2qgf s ALA 51 CO 0.03 -0.07 0.63 0.45 0.00 0.00 0.00 175.76 176.80 2qgf s SER 52 N -0.93 -1.52 0.09 0.00 0.15 -1.26 -4.98 113.70 105.25 2qgf s SER 52 Ca 0.44 0.05 -0.19 0.00 0.70 0.00 0.00 55.95 56.95 2qgf s SER 52 Cb -0.30 1.95 -0.08 0.00 -1.71 0.00 0.00 66.02 65.88 2qgf s SER 52 CO 0.39 -0.26 1.56 0.74 1.20 0.00 0.00 173.24 176.87 2qgf h THR 53 N 5.73 1.22 -0.28 6.45 2.02 -1.98 0.54 112.91 126.61 2qgf h THR 53 Ca -0.01 -0.74 0.03 0.00 0.77 0.00 0.00 66.41 66.46 2qgf h THR 53 Cb 1.19 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 68.83 2qgf h THR 53 CO 0.12 0.24 0.08 0.08 0.37 0.00 0.00 175.52 176.41 2qgf h ARG 54 N 0.20 0.19 -0.38 6.66 0.11 -1.99 0.36 114.38 119.52 2qgf h ARG 54 Ca 0.07 -0.01 -0.14 0.00 0.10 0.00 0.00 59.98 60.00 2qgf h ARG 54 Cb 0.31 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 31.34 2qgf h ARG 54 CO 0.00 0.13 -0.33 1.15 0.10 0.00 0.00 179.97 181.02 2qgf h THR 55 N 0.20 1.28 0.05 0.08 2.02 -1.99 -2.03 112.91 112.52 2qgf h THR 55 Ca 0.13 -1.49 -0.00 0.00 0.77 0.00 0.00 66.41 65.82 2qgf h THR 55 Cb 0.11 1.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2qgf h THR 55 CO -0.15 0.50 -0.02 -0.09 0.37 0.00 0.00 175.52 176.12 2qgf h ARG 56 N 0.72 -0.06 -0.95 6.66 2.43 -0.75 -1.84 114.38 120.58 2qgf h ARG 56 Ca 0.07 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.36 2qgf h ARG 56 Cb 0.89 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.38 2qgf h ARG 56 CO 0.08 0.33 0.61 -0.07 -1.51 0.00 0.00 179.97 179.41 2qgf h LEU 57 N -0.47 0.85 -0.13 3.80 3.38 -0.88 0.44 115.31 122.30 2qgf h LEU 57 Ca -0.01 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2qgf h LEU 57 Cb 0.42 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2qgf h LEU 57 CO 0.01 0.47 -0.13 -1.28 0.09 0.00 0.00 178.44 177.61 2qgf h SER 58 N 0.93 0.34 -0.01 -0.43 0.87 -1.33 0.45 113.55 114.36 2qgf h SER 58 Ca 0.45 -0.48 -0.00 0.00 -1.23 0.00 0.00 61.79 60.53 2qgf h SER 58 Cb 0.47 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2qgf h SER 58 CO -0.22 0.75 0.01 -0.26 -0.53 0.00 0.00 176.83 176.58 2qgf h PHE 59 N -0.06 0.02 -0.71 2.24 -1.00 -0.92 -0.14 116.94 116.37 2qgf h PHE 59 Ca 0.02 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.78 2qgf h PHE 59 Cb 0.66 -0.01 -0.03 0.00 3.61 0.00 0.00 35.95 40.18 2qgf h PHE 59 CO 0.09 0.13 0.37 0.93 -1.61 0.00 0.00 178.31 178.21 2qgf h GLU 60 N -0.10 0.99 -0.73 1.51 5.08 -0.93 1.00 114.58 121.40 2qgf h GLU 60 Ca 0.00 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 2qgf h GLU 60 Cb 0.12 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 2qgf h GLU 60 CO -0.00 0.74 0.24 1.15 -1.00 0.00 0.00 179.01 180.14 2qgf h THR 61 N 0.99 1.26 -0.78 1.13 2.02 -0.60 -0.61 112.91 116.32 2qgf h THR 61 Ca 0.25 -0.88 0.01 0.00 0.77 0.00 0.00 66.41 66.56 2qgf h THR 61 Cb 0.06 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 66.88 2qgf h THR 61 CO -0.04 0.35 0.51 0.28 0.37 0.00 0.00 175.52 176.99 2qgf h SER 62 N 1.07 0.88 -0.64 4.18 0.02 0.39 -0.46 113.55 118.99 2qgf h SER 62 Ca 0.24 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.15 2qgf h SER 62 Cb 0.29 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.58 2qgf h SER 62 CO -0.01 0.63 0.32 0.24 -1.14 0.00 0.00 176.83 176.87 2qgf h MET 63 N 1.03 0.91 -0.21 3.45 2.07 -0.07 -2.87 114.93 119.24 2qgf h MET 63 Ca 0.29 -0.12 -0.09 0.00 -2.07 0.00 0.00 59.70 57.71 2qgf h MET 63 Cb -0.09 -0.17 -0.01 0.00 -1.87 0.00 0.00 31.60 29.46 2qgf h MET 63 CO -0.08 0.71 -0.27 0.45 1.07 0.00 0.00 176.91 178.79 2qgf h HIS 64 N 0.87 0.44 0.00 -0.22 3.86 -0.33 -2.55 115.15 117.22 2qgf h HIS 64 Ca 0.22 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 2qgf h HIS 64 Cb 0.09 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 28.45 2qgf h HIS 64 CO -0.00 0.63 -0.06 0.00 0.86 0.00 0.00 177.93 179.36 2qgf h ARG 65 N 0.35 0.00 -0.61 2.45 2.47 -0.88 -2.08 114.38 116.08 2qgf h ARG 65 Ca 0.05 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 2qgf h ARG 65 Cb 0.67 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.99 2qgf h ARG 65 CO 0.05 0.06 0.00 1.28 0.56 0.00 0.00 179.97 181.92 2qgf n LEU 66 N -3.36 3.83 0.00 3.04 4.77 -1.08 -3.44 117.00 120.75 2qgf n LEU 66 Ca -0.01 -2.10 0.00 0.00 -0.03 0.00 0.00 56.01 53.87 2qgf n LEU 66 Cb 0.22 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 2qgf n LEU 66 CO 0.27 0.89 0.00 0.61 -1.33 0.00 0.00 177.39 177.83 2qgf n GLY 67 N 1.22 1.28 3.82 -0.72 0.00 -0.78 0.39 105.19 110.39 2qgf n GLY 67 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 2qgf n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qgf s ALA 68 N -3.49 2.74 0.38 4.61 0.00 -0.98 -4.06 121.76 120.95 2qgf s ALA 68 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.17 2qgf s ALA 68 Cb 0.00 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.90 2qgf s ALA 68 CO 0.00 -1.00 0.59 -1.12 0.00 0.00 0.00 175.76 174.23 2qgf s SER 69 N -3.38 6.17 -0.03 0.00 0.01 -0.67 -4.32 113.70 111.49 2qgf s SER 69 Ca 0.60 0.41 0.00 0.00 1.31 0.00 0.00 55.95 58.27 2qgf s SER 69 Cb -0.14 -1.89 0.03 0.00 0.21 0.00 0.00 66.02 64.22 2qgf s SER 69 CO 0.47 -0.41 0.01 -0.69 0.41 0.00 0.00 173.24 173.03 2qgf s VAL 70 N -2.39 0.09 0.11 3.43 1.01 -1.26 -1.30 120.40 120.09 2qgf s VAL 70 Ca 0.42 0.14 0.06 0.00 0.00 0.00 0.00 61.98 62.60 2qgf s VAL 70 Cb -0.10 -0.20 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 2qgf s VAL 70 CO 0.37 0.12 -0.15 0.68 0.00 0.00 0.00 175.10 176.12 2qgf s VAL 71 N 1.05 1.36 -4.10 2.92 -7.23 -0.49 -4.96 120.40 108.95 2qgf s VAL 71 Ca -0.09 -1.64 0.00 0.00 -1.81 0.00 0.00 61.98 58.43 2qgf s VAL 71 Cb -0.13 -1.47 0.00 0.00 0.56 0.00 0.00 36.38 35.33 2qgf s VAL 71 CO -0.02 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.04 2qgf n GLY 72 N 0.70 -1.09 3.71 2.32 0.00 -1.26 -0.41 105.19 109.15 2qgf n GLY 72 Ca -0.17 -1.11 -0.10 0.00 0.00 0.00 0.00 46.02 44.64 2qgf n GLY 72 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qgf s PHE 73 N -3.00 0.38 0.03 1.61 -0.12 -0.52 -4.94 117.98 111.42 2qgf s PHE 73 Ca 0.00 -0.91 0.00 0.00 -0.05 0.00 0.00 56.93 55.98 2qgf s PHE 73 Cb 0.00 0.54 -0.00 0.00 -0.63 0.00 0.00 43.02 42.93 2qgf s PHE 73 CO 0.00 -1.41 0.03 -1.13 -0.05 0.00 0.00 175.22 172.66 2qgf n SER 74 N -1.32 -0.08 0.00 1.98 3.41 -1.25 -2.24 113.62 114.13 2qgf n SER 74 Ca -0.05 -1.17 0.00 0.00 -0.26 0.00 0.00 58.87 57.39 2qgf n SER 74 Cb 0.60 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.72 2qgf n SER 74 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2qgf n ASP 75 N -2.62 0.00 -3.50 4.04 2.03 -1.16 -4.77 116.55 110.57 2qgf n ASP 75 Ca 0.00 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 54.93 2qgf n ASP 75 Cb 0.05 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.43 2qgf n ASP 75 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2qgf n SER 76 N 0.00 5.70 -4.17 1.67 7.64 -1.25 -4.86 113.62 118.35 2qgf n SER 76 Ca 0.00 -2.66 -0.34 0.00 1.01 0.00 0.00 58.87 56.88 2qgf n SER 76 Cb 0.00 -1.50 -0.06 0.00 -1.01 0.00 0.00 64.21 61.64 2qgf n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qgf n ALA 77 N 5.09 2.27 -2.17 -0.43 0.00 -1.26 -4.90 120.51 119.11 2qgf n ALA 77 Ca 0.61 -3.09 -0.41 0.00 0.00 0.00 0.00 53.44 50.55 2qgf n ALA 77 Cb 0.30 -3.55 -0.04 0.00 0.00 0.00 0.00 19.45 16.16 2qgf n ALA 77 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2qgf s ASN 78 N 6.02 7.34 -0.40 0.00 0.02 -1.26 -4.93 114.94 121.73 2qgf s ASN 78 Ca 0.65 1.97 -0.27 0.00 -1.02 0.00 0.00 52.86 54.18 2qgf s ASN 78 Cb 0.06 -2.60 -0.04 0.00 0.02 0.00 0.00 41.25 38.69 2qgf s ASN 78 CO 0.14 -0.18 2.07 0.42 0.02 0.00 0.00 177.10 179.57 2qgf s THR 79 N -0.04 3.22 -0.26 1.60 -4.23 -1.26 -3.64 115.64 111.02 2qgf s THR 79 Ca 0.49 0.19 -0.05 0.00 -1.18 0.00 0.00 61.69 61.14 2qgf s THR 79 Cb -0.27 -3.39 0.01 0.00 1.34 0.00 0.00 72.50 70.19 2qgf s THR 79 CO 0.32 -0.31 0.13 -1.20 -0.54 0.00 0.00 174.62 173.02 2qgf n SER 80 N 12.53 -7.55 -3.45 3.99 7.64 -1.26 -4.78 113.62 120.74 2qgf n SER 80 Ca 0.28 0.98 -0.38 0.00 1.01 0.00 0.00 58.87 60.75 2qgf n SER 80 Cb 0.49 -4.28 -0.02 0.00 -1.01 0.00 0.00 64.21 59.39 2qgf n SER 80 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2qgf n LEU 81 N 0.64 7.32 -0.24 -3.43 4.32 -1.24 -4.56 117.00 119.82 2qgf n LEU 81 Ca 0.01 -3.99 -0.08 0.00 -0.02 0.00 0.00 56.01 51.94 2qgf n LEU 81 Cb 0.22 -1.49 0.05 0.00 -1.62 0.00 0.00 43.42 40.58 2qgf n LEU 81 CO 0.36 1.40 0.91 1.23 -1.22 0.00 0.00 177.39 180.06 2qgf h GLY 82 N 8.63 1.20 -6.22 -0.72 0.00 -1.94 -3.40 103.07 100.61 2qgf h GLY 82 Ca 0.70 -0.79 -0.09 0.00 0.00 0.00 0.00 47.33 47.15 2qgf h GLY 82 CO 1.79 0.73 -0.41 1.25 0.00 0.00 0.00 176.54 179.91 2qgf s LYS 83 N -5.21 0.39 0.00 4.80 2.20 -1.26 -5.00 119.74 115.66 2qgf s LYS 83 Ca -0.12 0.75 0.24 0.00 -0.36 0.00 0.00 55.97 56.48 2qgf s LYS 83 Cb 0.14 -0.08 1.25 0.00 -1.51 0.00 0.00 37.83 37.63 2qgf s LYS 83 CO 0.85 -0.55 1.78 1.63 -0.36 0.00 0.00 175.35 178.70 2qgf n LYS 84 N 5.39 0.44 0.00 4.03 5.02 -1.26 -4.97 118.16 126.81 2qgf n LYS 84 Ca -0.04 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2qgf n LYS 84 Cb 0.50 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 2qgf n LYS 84 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qgf n GLY 85 N 0.66 1.17 3.72 0.72 0.00 -1.26 -5.02 105.19 105.18 2qgf n GLY 85 Ca 0.13 -0.82 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 2qgf n GLY 85 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qgf n GLU 86 N 0.00 1.76 -2.12 1.61 2.13 -1.26 -4.98 120.64 117.78 2qgf n GLU 86 Ca 0.00 0.64 -0.32 0.00 0.66 0.00 0.00 57.16 58.14 2qgf n GLU 86 Cb 0.00 -2.48 -0.01 0.00 0.27 0.00 0.00 31.44 29.22 2qgf n GLU 86 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2qgf s THR 87 N -1.27 4.45 0.39 6.31 -4.23 -1.26 -4.94 115.64 115.10 2qgf s THR 87 Ca 0.67 1.02 0.12 0.00 -1.18 0.00 0.00 61.69 62.33 2qgf s THR 87 Cb -0.45 -3.70 0.12 0.00 1.34 0.00 0.00 72.50 69.82 2qgf s THR 87 CO 0.53 -0.82 1.88 0.25 -0.54 0.00 0.00 174.62 175.91 2qgf h LEU 88 N 0.34 0.04 -0.96 4.79 5.85 -1.99 -1.66 115.31 121.72 2qgf h LEU 88 Ca -0.46 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2qgf h LEU 88 Cb 1.19 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 2qgf h LEU 88 CO 0.61 0.33 0.60 0.00 -0.34 0.00 0.00 178.44 179.64 2qgf h ALA 89 N 1.67 1.22 -0.05 1.25 0.00 -1.95 -1.94 119.26 119.46 2qgf h ALA 89 Ca 0.00 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.63 2qgf h ALA 89 Cb 0.54 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2qgf h ALA 89 CO 0.04 0.65 -0.79 -0.44 0.00 0.00 0.00 179.25 178.71 2qgf h ASP 90 N 1.32 0.48 -0.36 0.00 5.19 -1.69 -1.66 116.42 119.69 2qgf h ASP 90 Ca 0.35 -0.34 -0.08 0.00 -0.62 0.00 0.00 57.03 56.34 2qgf h ASP 90 Cb -0.10 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.26 2qgf h ASP 90 CO -0.07 1.10 -0.09 0.74 -3.12 0.00 0.00 179.24 177.80 2qgf h THR 91 N 0.25 1.28 -0.35 0.35 2.02 -1.24 -2.29 112.91 112.93 2qgf h THR 91 Ca -0.04 -1.16 -0.16 0.00 0.77 0.00 0.00 66.41 65.82 2qgf h THR 91 Cb 1.39 1.29 -0.00 0.00 -1.74 0.00 0.00 68.15 69.09 2qgf h THR 91 CO 0.14 0.38 -0.43 0.40 0.37 0.00 0.00 175.52 176.38 2qgf h ILE 92 N 0.48 1.27 -0.86 3.11 1.08 -1.34 -0.01 117.51 121.26 2qgf h ILE 92 Ca 0.09 -1.60 0.09 0.00 -0.39 0.00 0.00 64.86 63.05 2qgf h ILE 92 Cb 0.60 1.45 -0.06 0.00 -3.07 0.00 0.00 36.82 35.74 2qgf h ILE 92 CO 0.04 0.53 0.56 0.28 -0.69 0.00 0.00 178.15 178.86 2qgf h SER 93 N 0.72 0.77 0.01 1.72 0.02 -1.24 -0.37 113.55 115.19 2qgf h SER 93 Ca 0.05 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 2qgf h SER 93 Cb 1.02 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.42 2qgf h SER 93 CO 0.10 0.46 -0.09 0.58 -1.14 0.00 0.00 176.83 176.74 2qgf h VAL 94 N 0.86 1.73 0.00 2.27 2.07 -1.19 -3.36 116.25 118.62 2qgf h VAL 94 Ca 0.39 -2.26 -0.02 0.00 0.82 0.00 0.00 66.70 65.63 2qgf h VAL 94 Cb 0.38 3.26 -0.00 0.00 -1.52 0.00 0.00 31.29 33.41 2qgf h VAL 94 CO -0.16 0.59 -0.09 0.40 0.02 0.00 0.00 177.57 178.33 2qgf h ILE 95 N -0.88 1.02 0.00 4.57 2.04 -0.69 -1.90 117.51 121.67 2qgf h ILE 95 Ca -0.02 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.52 2qgf h ILE 95 Cb 1.03 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2qgf h ILE 95 CO 0.02 0.09 0.00 -1.54 0.00 0.00 0.00 178.15 176.72 2qgf n SER 96 N -4.35 0.00 -0.08 1.72 3.41 -0.18 -1.58 113.62 112.56 2qgf n SER 96 Ca -0.03 -0.02 0.12 0.00 -0.26 0.00 0.00 58.87 58.68 2qgf n SER 96 Cb 0.17 -0.27 0.19 0.00 -0.26 0.00 0.00 64.21 64.04 2qgf n SER 96 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2qgf n THR 97 N -1.27 0.00 -0.13 6.66 -2.24 -0.71 -4.46 114.28 112.13 2qgf n THR 97 Ca 0.09 -0.04 -0.24 0.00 -2.27 0.00 0.00 64.05 61.59 2qgf n THR 97 Cb 0.15 0.49 -0.10 0.00 -2.10 0.00 0.00 70.33 68.77 2qgf n THR 97 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2qgf n TYR 98 N -1.24 0.00 -3.10 4.78 4.01 -0.62 -5.08 117.16 115.92 2qgf n TYR 98 Ca 0.07 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.62 2qgf n TYR 98 Cb 0.34 -0.93 0.03 0.00 -0.31 0.00 0.00 39.34 38.48 2qgf n TYR 98 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2qgf s VAL 99 N -2.48 2.49 -0.71 -0.72 -7.23 -1.15 -4.96 120.40 105.65 2qgf s VAL 99 Ca -0.35 -1.05 0.17 0.00 -1.81 0.00 0.00 61.98 58.94 2qgf s VAL 99 Cb 0.12 -2.54 -0.19 0.00 0.56 0.00 0.00 36.38 34.33 2qgf s VAL 99 CO 0.49 0.00 0.67 0.47 -0.31 0.00 0.00 175.10 176.42 2qgf n ASP 100 N -2.02 0.81 -3.56 4.85 8.00 0.03 -4.89 116.55 119.78 2qgf n ASP 100 Ca 0.11 -0.80 -0.11 0.00 0.71 0.00 0.00 54.79 54.70 2qgf n ASP 100 Cb 0.61 1.08 -0.05 0.00 -0.02 0.00 0.00 41.12 42.74 2qgf n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qgf s ALA 101 N -2.63 -1.90 -0.08 2.24 0.00 -1.25 -4.29 121.76 113.85 2qgf s ALA 101 Ca 0.05 1.48 0.02 0.00 0.00 0.00 0.00 51.96 53.50 2qgf s ALA 101 Cb 0.12 -0.46 0.01 0.00 0.00 0.00 0.00 23.12 22.80 2qgf s ALA 101 CO 0.68 -0.37 -0.13 0.42 0.00 0.00 0.00 175.76 176.37 2qgf s ILE 102 N -1.40 1.25 -0.21 0.00 1.01 -0.40 -1.84 121.20 119.61 2qgf s ILE 102 Ca -0.02 -0.52 -0.04 0.00 0.00 0.00 0.00 60.65 60.07 2qgf s ILE 102 Cb -0.00 -1.15 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 2qgf s ILE 102 CO 0.01 0.39 -0.02 -0.69 0.00 0.00 0.00 174.94 174.63 2qgf s VAL 103 N 0.86 3.66 0.05 2.92 1.01 -0.39 -0.12 120.40 128.39 2qgf s VAL 103 Ca -0.10 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 61.51 2qgf s VAL 103 Cb -0.15 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.55 2qgf s VAL 103 CO 0.01 0.43 -0.12 0.00 0.00 0.00 0.00 175.10 175.42 2qgf s MET 104 N 1.21 0.73 -0.08 2.72 0.23 -0.67 -0.75 119.30 122.70 2qgf s MET 104 Ca 0.03 -0.78 0.03 0.00 -1.03 0.00 0.00 55.69 53.93 2qgf s MET 104 Cb -0.14 -0.66 0.01 0.00 -1.53 0.00 0.00 34.83 32.50 2qgf s MET 104 CO -0.00 0.15 -0.15 0.50 -2.03 0.00 0.00 175.02 173.49 2qgf s ARG 105 N -1.40 2.03 0.05 3.16 3.52 -0.62 -0.25 118.95 125.43 2qgf s ARG 105 Ca -0.03 -0.52 0.01 0.00 -0.13 0.00 0.00 55.73 55.06 2qgf s ARG 105 Cb -0.09 -1.64 -0.03 0.00 -1.56 0.00 0.00 34.95 31.64 2qgf s ARG 105 CO 0.01 0.05 -0.05 -1.58 -0.81 0.00 0.00 175.30 172.92 2qgf s HIS 106 N 0.63 0.58 0.24 5.12 2.46 -0.49 -0.74 115.29 123.10 2qgf s HIS 106 Ca -0.15 -0.70 0.20 0.00 0.47 0.00 0.00 55.06 54.88 2qgf s HIS 106 Cb -0.16 -0.37 0.87 0.00 -0.13 0.00 0.00 32.58 32.79 2qgf s HIS 106 CO 0.04 -0.18 1.83 -1.35 -2.47 0.00 0.00 174.74 172.61 2qgf h PRO 107 N 3.96 0.00 -5.64 2.88 0.11 -1.87 -1.90 132.00 129.54 2qgf h PRO 107 Ca -0.34 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 65.11 2qgf h PRO 107 Cb 1.18 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.19 2qgf h PRO 107 CO 0.51 0.30 -0.53 -0.65 -0.21 0.00 0.00 178.00 177.42 2qgf s GLN 108 N -3.82 3.47 0.38 1.05 -0.21 -1.26 -3.62 119.66 115.64 2qgf s GLN 108 Ca -0.01 -0.24 -0.28 0.00 0.02 0.00 0.00 55.36 54.85 2qgf s GLN 108 Cb 0.12 -3.11 -0.11 0.00 1.00 0.00 0.00 33.01 30.91 2qgf s GLN 108 CO 0.66 0.64 1.50 0.39 -2.12 0.00 0.00 175.29 176.36 2qgf n GLU 109 N 2.39 2.69 -0.78 2.91 4.71 -1.26 -2.67 120.64 128.63 2qgf n GLU 109 Ca -0.19 0.94 0.00 0.00 -0.01 0.00 0.00 57.16 57.91 2qgf n GLU 109 Cb 0.54 -2.68 0.00 0.00 -1.01 0.00 0.00 31.44 28.29 2qgf n GLU 109 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qgf n GLY 110 N 0.49 0.89 0.26 0.62 0.00 -1.26 -4.96 105.19 101.23 2qgf n GLY 110 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.97 2qgf n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qgf h ALA 111 N 0.00 0.80 0.00 4.61 0.00 -1.86 -1.57 119.26 121.23 2qgf h ALA 111 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2qgf h ALA 111 Cb 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2qgf h ALA 111 CO 0.00 0.32 -0.31 0.00 0.00 0.00 0.00 179.25 179.26 2qgf h ALA 112 N 1.16 1.33 -0.01 0.00 0.00 -1.93 -0.55 119.26 119.26 2qgf h ALA 112 Ca 0.22 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qgf h ALA 112 Cb 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2qgf h ALA 112 CO -0.03 0.39 -0.01 -0.09 0.00 0.00 0.00 179.25 179.51 2qgf h ARG 113 N 0.00 0.02 0.19 0.00 9.65 -1.82 -2.46 114.38 119.95 2qgf h ARG 113 Ca -0.00 -0.01 0.01 0.00 -1.10 0.00 0.00 59.98 58.87 2qgf h ARG 113 Cb 0.61 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.17 2qgf h ARG 113 CO 0.04 0.45 -0.20 1.25 2.80 0.00 0.00 179.97 184.31 2qgf h LEU 114 N -0.41 -0.54 -0.89 3.80 5.85 -1.06 -2.39 115.31 119.68 2qgf h LEU 114 Ca 0.00 0.05 0.21 0.00 0.84 0.00 0.00 57.88 58.98 2qgf h LEU 114 Cb 0.44 0.19 -0.16 0.00 0.37 0.00 0.00 40.66 41.50 2qgf h LEU 114 CO 0.00 -0.29 -0.06 0.00 -0.34 0.00 0.00 178.44 177.75 2qgf h ALA 115 N 0.33 0.86 -1.23 1.25 0.00 -1.06 0.38 119.26 119.80 2qgf h ALA 115 Ca 0.00 0.31 0.37 0.00 0.00 0.00 0.00 54.91 55.60 2qgf h ALA 115 Cb 0.40 0.57 -0.11 0.00 0.00 0.00 0.00 17.79 18.66 2qgf h ALA 115 CO -0.06 -0.46 0.81 1.15 0.00 0.00 0.00 179.25 180.69 2qgf h THR 116 N 0.04 0.29 -0.00 0.00 2.02 -0.93 0.35 112.91 114.67 2qgf h THR 116 Ca 0.49 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.60 2qgf h THR 116 Cb 0.89 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 2qgf h THR 116 CO -0.84 0.03 0.00 -0.62 0.37 0.00 0.00 175.52 174.46 2qgf n GLU 117 N -4.58 1.03 0.00 6.66 1.02 0.13 -3.73 120.64 121.17 2qgf n GLU 117 Ca 0.32 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 2qgf n GLU 117 Cb 1.24 -1.36 0.00 0.00 -0.02 0.00 0.00 31.44 31.29 2qgf n GLU 117 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2qgf n PHE 118 N -0.81 0.00 1.90 -0.32 3.01 0.11 -4.77 117.46 116.58 2qgf n PHE 118 Ca 0.17 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.77 2qgf n PHE 118 Cb 0.09 0.00 0.75 0.00 -0.01 0.00 0.00 39.48 40.31 2qgf n PHE 118 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2qgf n SER 119 N -0.16 0.25 0.00 4.37 3.41 -0.63 -4.07 113.62 116.79 2qgf n SER 119 Ca 0.00 -1.22 0.00 0.00 -0.26 0.00 0.00 58.87 57.39 2qgf n SER 119 Cb 0.06 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2qgf n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qgf n GLY 120 N 0.96 4.15 0.38 5.00 0.00 -1.26 -1.22 105.19 113.20 2qgf n GLY 120 Ca 0.20 0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.49 2qgf n GLY 120 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2qgf n ASN 121 N 9.16 1.38 -4.66 1.61 6.94 -1.26 -4.90 115.26 123.53 2qgf n ASN 121 Ca 0.00 -1.19 -0.43 0.00 -0.02 0.00 0.00 54.58 52.94 2qgf n ASN 121 Cb 0.00 0.13 -0.03 0.00 -2.36 0.00 0.00 39.78 37.52 2qgf n ASN 121 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2qgf s VAL 122 N -2.33 4.75 0.37 3.53 1.01 -0.35 -5.03 120.40 122.34 2qgf s VAL 122 Ca 0.28 1.91 -0.27 0.00 0.00 0.00 0.00 61.98 63.89 2qgf s VAL 122 Cb 0.20 -4.26 -0.10 0.00 0.00 0.00 0.00 36.38 32.22 2qgf s VAL 122 CO 0.46 -0.11 1.31 -2.84 0.00 0.00 0.00 175.10 173.92 2qgf s PRO 123 N 2.83 4.18 -0.13 2.72 0.02 -1.26 -4.77 135.00 138.59 2qgf s PRO 123 Ca 0.43 2.20 0.03 0.00 0.02 0.00 0.00 61.00 63.67 2qgf s PRO 123 Cb -0.16 -2.93 0.01 0.00 0.02 0.00 0.00 34.50 31.44 2qgf s PRO 123 CO 0.09 -0.33 -0.22 0.54 -0.33 0.00 0.00 177.00 176.75 2qgf s VAL 124 N -1.20 1.99 -0.17 3.83 0.11 -1.26 -1.28 120.40 122.43 2qgf s VAL 124 Ca 0.53 -0.95 -0.07 0.00 -2.93 0.00 0.00 61.98 58.56 2qgf s VAL 124 Cb -0.39 -1.75 -0.04 0.00 -1.53 0.00 0.00 36.38 32.67 2qgf s VAL 124 CO 0.51 0.54 0.07 -0.76 -3.33 0.00 0.00 175.10 172.13 2qgf s LEU 125 N 0.71 3.90 -0.41 2.54 1.02 0.83 -2.21 118.68 125.06 2qgf s LEU 125 Ca -0.10 0.15 -0.28 0.00 0.02 0.00 0.00 54.13 53.92 2qgf s LEU 125 Cb -0.16 -1.98 0.02 0.00 0.02 0.00 0.00 46.19 44.10 2qgf s LEU 125 CO 0.01 0.22 1.05 0.21 0.02 0.00 0.00 176.35 177.86 2qgf s ASN 126 N 0.07 6.70 0.00 2.29 2.47 0.13 -1.67 114.94 124.93 2qgf s ASN 126 Ca 0.06 0.58 0.19 0.00 0.42 0.00 0.00 52.86 54.11 2qgf s ASN 126 Cb -0.12 -2.52 0.53 0.00 -1.45 0.00 0.00 41.25 37.69 2qgf s ASN 126 CO 0.00 -1.05 1.44 0.00 -3.72 0.00 0.00 177.10 173.78 2qgf n ALA 127 N 7.28 2.41 0.00 1.71 0.00 0.65 -4.29 120.51 128.27 2qgf n ALA 127 Ca 0.10 -1.00 0.00 0.00 0.00 0.00 0.00 53.44 52.54 2qgf n ALA 127 Cb 0.48 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.98 2qgf n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qgf n GLY 128 N 1.44 4.14 2.54 0.00 0.00 -1.25 -4.74 105.19 107.32 2qgf n GLY 128 Ca 0.20 -0.85 -0.28 0.00 0.00 0.00 0.00 46.02 45.08 2qgf n GLY 128 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2qgf s ASP 129 N 0.00 3.34 1.13 1.61 -4.77 -0.47 -1.40 116.67 116.11 2qgf s ASP 129 Ca 0.00 -1.42 0.00 0.00 -3.30 0.00 0.00 52.55 47.83 2qgf s ASP 129 Cb 0.00 -0.31 0.00 0.00 -1.09 0.00 0.00 42.92 41.52 2qgf s ASP 129 CO 0.00 -0.41 0.00 0.61 0.70 0.00 0.00 175.17 176.07 2qgf n GLY 130 N 5.04 3.06 1.82 2.12 0.00 -0.71 -1.66 105.19 114.86 2qgf n GLY 130 Ca -0.03 -0.31 0.07 0.00 0.00 0.00 0.00 46.02 45.76 2qgf n GLY 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qgf n SER 131 N 1.57 5.59 0.00 1.61 3.41 -1.26 -4.74 113.62 119.80 2qgf n SER 131 Ca 0.00 -2.90 0.00 0.00 -0.26 0.00 0.00 58.87 55.71 2qgf n SER 131 Cb 0.00 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.28 2qgf n SER 131 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2qgf n ASN 132 N 0.62 0.00 -4.66 4.04 5.15 -0.66 -4.76 115.26 114.99 2qgf n ASN 132 Ca 0.27 0.00 -0.24 0.00 -0.60 0.00 0.00 54.58 54.02 2qgf n ASN 132 Cb 1.16 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 40.34 2qgf n ASN 132 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2qgf s GLN 133 N 0.00 2.20 -0.40 1.20 -1.52 -1.25 -4.92 119.66 114.98 2qgf s GLN 133 Ca 0.00 -1.63 0.06 0.00 -1.95 0.00 0.00 55.36 51.83 2qgf s GLN 133 Cb 0.00 -2.04 0.31 0.00 -0.22 0.00 0.00 33.01 31.06 2qgf s GLN 133 CO 0.00 0.17 1.24 1.58 -0.25 0.00 0.00 175.29 178.02 2qgf n HIS 134 N -1.00 -1.84 -0.32 0.91 -0.00 -1.26 -1.37 115.22 110.34 2qgf n HIS 134 Ca -0.04 -1.55 0.19 0.00 0.46 0.00 0.00 57.72 56.79 2qgf n HIS 134 Cb 0.61 1.45 0.46 0.00 -0.12 0.00 0.00 29.99 32.39 2qgf n HIS 134 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2qgf h PRO 135 N 2.40 0.48 -0.15 1.57 0.13 -1.82 -1.42 132.00 133.19 2qgf h PRO 135 Ca -0.24 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 64.79 2qgf h PRO 135 Cb 1.18 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 2qgf h PRO 135 CO 0.02 0.32 -0.21 1.79 -0.23 0.00 0.00 178.00 179.69 2qgf h THR 136 N 0.50 1.22 -0.11 1.56 1.35 -1.95 -1.06 112.91 114.41 2qgf h THR 136 Ca 0.57 -1.00 -0.13 0.00 -0.55 0.00 0.00 66.41 65.30 2qgf h THR 136 Cb 1.28 1.34 -0.01 0.00 -1.73 0.00 0.00 68.15 69.03 2qgf h THR 136 CO -0.31 0.31 -0.50 -0.61 -0.25 0.00 0.00 175.52 174.16 2qgf h GLN 137 N 0.23 0.29 -0.22 4.72 5.75 -1.62 -2.66 115.11 121.60 2qgf h GLN 137 Ca 0.04 -0.17 -0.19 0.00 -0.15 0.00 0.00 58.65 58.18 2qgf h GLN 137 Cb 0.50 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.07 2qgf h GLN 137 CO 0.03 0.73 -0.60 1.15 -2.65 0.00 0.00 178.83 177.49 2qgf h THR 138 N 0.23 1.29 -0.04 2.39 2.02 -1.25 -1.47 112.91 116.08 2qgf h THR 138 Ca 0.01 -1.80 0.01 0.00 0.77 0.00 0.00 66.41 65.40 2qgf h THR 138 Cb 0.96 1.80 -0.00 0.00 -1.74 0.00 0.00 68.15 69.17 2qgf h THR 138 CO 0.08 0.58 0.03 -0.07 0.37 0.00 0.00 175.52 176.51 2qgf h LEU 139 N 0.55 0.00 0.19 2.58 3.38 -1.07 0.11 115.31 121.04 2qgf h LEU 139 Ca -0.01 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.65 2qgf h LEU 139 Cb 1.22 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.99 2qgf h LEU 139 CO 0.13 0.00 -1.42 0.25 0.09 0.00 0.00 178.44 177.49 2qgf h LEU 140 N 0.00 0.62 -0.33 1.67 6.46 -1.31 -1.99 115.31 120.44 2qgf h LEU 140 Ca 0.02 -0.70 -0.12 0.00 -0.12 0.00 0.00 57.88 56.95 2qgf h LEU 140 Cb 0.08 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 39.80 2qgf h LEU 140 CO -0.00 1.56 -0.28 0.44 -0.62 0.00 0.00 178.44 179.54 2qgf h ASP 141 N 0.11 0.81 -0.44 1.25 3.32 0.04 -2.18 116.42 119.33 2qgf h ASP 141 Ca -0.22 -0.45 -0.11 0.00 0.02 0.00 0.00 57.03 56.27 2qgf h ASP 141 Cb 2.08 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 41.39 2qgf h ASP 141 CO 0.23 1.10 -0.16 -0.07 -1.72 0.00 0.00 179.24 178.62 2qgf h LEU 142 N 0.54 0.91 -1.08 1.55 3.38 -0.94 -1.31 115.31 118.35 2qgf h LEU 142 Ca 0.06 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 2qgf h LEU 142 Cb 0.85 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 2qgf h LEU 142 CO 0.07 1.08 0.36 0.15 0.09 0.00 0.00 178.44 180.19 2qgf h PHE 143 N 0.72 0.99 -0.04 1.13 -0.00 -1.36 0.78 116.94 119.17 2qgf h PHE 143 Ca 0.11 -0.03 -0.15 0.00 -0.00 0.00 0.00 57.97 57.89 2qgf h PHE 143 Cb 0.72 -0.31 -0.01 0.00 -0.00 0.00 0.00 35.95 36.34 2qgf h PHE 143 CO 0.05 0.71 -0.66 1.15 -0.00 0.00 0.00 178.31 179.56 2qgf h THR 144 N 1.00 1.42 -0.02 4.41 2.02 -1.27 -1.49 112.91 118.98 2qgf h THR 144 Ca 0.25 -2.15 -0.01 0.00 0.77 0.00 0.00 66.41 65.26 2qgf h THR 144 Cb 0.08 2.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 2qgf h THR 144 CO -0.03 0.63 -0.04 0.40 0.37 0.00 0.00 175.52 176.84 2qgf h ILE 145 N 0.12 1.45 -0.90 3.11 2.04 -0.50 -2.41 117.51 120.42 2qgf h ILE 145 Ca -0.01 -1.40 -0.01 0.00 1.00 0.00 0.00 64.86 64.44 2qgf h ILE 145 Cb 1.19 2.34 -0.04 0.00 -0.74 0.00 0.00 36.82 39.57 2qgf h ILE 145 CO 0.10 0.37 0.54 -0.61 0.00 0.00 0.00 178.15 178.55 2qgf h GLN 146 N -0.49 1.23 -0.63 2.37 4.15 -0.90 0.34 115.11 121.19 2qgf h GLN 146 Ca 0.00 -0.12 -0.06 0.00 0.77 0.00 0.00 58.65 59.24 2qgf h GLN 146 Cb 0.63 -0.26 -0.03 0.00 0.21 0.00 0.00 27.48 28.04 2qgf h GLN 146 CO 0.01 0.87 0.15 1.49 -1.93 0.00 0.00 178.83 179.42 2qgf h GLU 147 N 1.25 1.01 0.00 1.69 4.81 -1.28 0.12 114.58 122.17 2qgf h GLU 147 Ca 0.32 -0.24 -0.22 0.00 -0.13 0.00 0.00 59.36 59.09 2qgf h GLU 147 Cb -0.04 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.17 2qgf h GLU 147 CO -0.06 0.91 -1.37 1.79 -0.73 0.00 0.00 179.01 179.55 2qgf h THR 148 N 0.93 0.92 0.00 0.32 1.35 -0.99 -3.37 112.91 112.07 2qgf h THR 148 Ca 0.20 -2.61 0.00 0.00 -0.55 0.00 0.00 66.41 63.45 2qgf h THR 148 Cb 0.36 2.40 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 2qgf h THR 148 CO 0.00 0.53 -1.50 0.00 -0.25 0.00 0.00 175.52 174.30 2qgf n GLN 149 N -3.08 0.67 -0.26 4.72 1.13 0.12 -4.99 117.38 115.69 2qgf n GLN 149 Ca -0.10 -0.11 0.00 0.00 -1.94 0.00 0.00 57.00 54.85 2qgf n GLN 149 Cb 0.94 -1.43 0.00 0.00 0.11 0.00 0.00 30.24 29.86 2qgf n GLN 149 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qgf n GLY 150 N 1.42 2.35 3.55 1.08 0.00 0.40 -4.96 105.19 109.03 2qgf n GLY 150 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 2qgf n GLY 150 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qgf s ARG 151 N -0.05 1.43 -0.00 1.61 1.70 -1.24 -4.95 118.95 117.45 2qgf s ARG 151 Ca 0.00 -0.76 0.05 0.00 -0.47 0.00 0.00 55.73 54.55 2qgf s ARG 151 Cb 0.00 0.56 0.13 0.00 -0.57 0.00 0.00 34.95 35.07 2qgf s ARG 151 CO 0.00 -0.62 1.11 1.28 -1.08 0.00 0.00 175.30 175.99 2qgf n LEU 152 N -0.37 2.40 -4.41 -1.89 4.77 -1.26 -4.35 117.00 111.89 2qgf n LEU 152 Ca -0.11 -2.01 -0.27 0.00 -0.03 0.00 0.00 56.01 53.59 2qgf n LEU 152 Cb 0.63 -0.10 -0.12 0.00 -2.33 0.00 0.00 43.42 41.49 2qgf n LEU 152 CO 0.15 0.60 -0.53 -1.81 -1.33 0.00 0.00 177.39 174.47 2qgf s ASP 153 N -1.02 3.35 -1.17 -1.43 1.01 -1.26 -4.57 116.67 111.58 2qgf s ASP 153 Ca 0.10 -0.85 -0.09 0.00 0.71 0.00 0.00 52.55 52.43 2qgf s ASP 153 Cb 0.05 -0.24 -0.02 0.00 1.01 0.00 0.00 42.92 43.72 2qgf s ASP 153 CO 0.07 0.12 0.81 0.59 0.21 0.00 0.00 175.17 176.97 2qgf n ASN 154 N 0.36 -4.24 -4.39 0.27 4.13 0.42 -4.94 115.26 106.87 2qgf n ASN 154 Ca -0.13 -0.84 -0.25 0.00 1.68 0.00 0.00 54.58 55.03 2qgf n ASN 154 Cb 0.56 -4.25 -0.12 0.00 -1.54 0.00 0.00 39.78 34.43 2qgf n ASN 154 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2qgf s LEU 155 N -6.20 2.43 -0.45 3.41 1.43 -1.26 -4.95 118.68 113.10 2qgf s LEU 155 Ca 0.30 -0.86 -0.09 0.00 -1.03 0.00 0.00 54.13 52.44 2qgf s LEU 155 Cb -0.07 -1.05 0.10 0.00 0.03 0.00 0.00 46.19 45.20 2qgf s LEU 155 CO 0.80 0.07 0.31 -1.00 0.23 0.00 0.00 176.35 176.76 2qgf s HIS 156 N -1.78 3.38 -0.17 0.29 3.76 -1.26 -1.18 115.29 118.33 2qgf s HIS 156 Ca 0.19 -1.71 -0.04 0.00 -0.15 0.00 0.00 55.06 53.35 2qgf s HIS 156 Cb -0.07 -3.24 -0.02 0.00 1.11 0.00 0.00 32.58 30.35 2qgf s HIS 156 CO 0.09 -0.92 -0.03 0.08 -0.85 0.00 0.00 174.74 173.10 2qgf s VAL 157 N 1.39 3.81 -0.13 -0.90 1.01 -0.10 -0.91 120.40 124.58 2qgf s VAL 157 Ca 0.04 -0.38 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 2qgf s VAL 157 Cb -0.25 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 2qgf s VAL 157 CO 0.01 0.47 0.04 0.00 0.00 0.00 0.00 175.10 175.62 2qgf s ALA 158 N 0.65 3.40 -0.20 5.51 0.00 0.07 -1.43 121.76 129.75 2qgf s ALA 158 Ca -0.02 -0.76 0.01 0.00 0.00 0.00 0.00 51.96 51.19 2qgf s ALA 158 Cb -0.14 -1.71 0.03 0.00 0.00 0.00 0.00 23.12 21.29 2qgf s ALA 158 CO 0.02 0.42 -0.16 -1.64 0.00 0.00 0.00 175.76 174.40 2qgf s MET 159 N -0.37 2.64 0.05 0.00 -1.94 -0.01 -0.63 119.30 119.05 2qgf s MET 159 Ca 0.08 -0.92 0.07 0.00 -1.71 0.00 0.00 55.69 53.21 2qgf s MET 159 Cb -0.12 -2.58 -0.03 0.00 2.01 0.00 0.00 34.83 34.11 2qgf s MET 159 CO 0.02 -0.32 -0.15 0.08 -0.01 0.00 0.00 175.02 174.64 2qgf s VAL 160 N 1.28 2.99 0.00 -6.03 1.01 -0.43 -1.76 120.40 117.46 2qgf s VAL 160 Ca 0.01 -1.18 0.00 0.00 0.00 0.00 0.00 61.98 60.81 2qgf s VAL 160 Cb -0.15 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.93 2qgf s VAL 160 CO -0.10 0.28 0.00 0.61 0.00 0.00 0.00 175.10 175.89 2qgf n GLY 161 N 1.34 0.29 3.07 4.51 0.00 -0.86 -1.03 105.19 112.50 2qgf n GLY 161 Ca -0.16 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 2qgf n GLY 161 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2qgf n ASP 162 N 0.00 4.05 0.29 1.61 4.64 -1.26 -4.31 116.55 121.58 2qgf n ASP 162 Ca 0.00 -2.84 0.18 0.00 -1.38 0.00 0.00 54.79 50.75 2qgf n ASP 162 Cb 0.00 -1.64 0.85 0.00 -1.04 0.00 0.00 41.12 39.29 2qgf n ASP 162 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 2qgf h LEU 163 N 11.52 0.00 0.14 -2.67 3.38 -1.78 -2.31 115.31 123.60 2qgf h LEU 163 Ca 0.50 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.47 2qgf h LEU 163 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2qgf h LEU 163 CO 1.73 0.03 -0.07 0.50 0.09 0.00 0.00 178.44 180.72 2qgf h LYS 164 N 0.00 -0.18 -0.02 1.13 3.64 -1.30 -3.37 116.57 116.46 2qgf h LYS 164 Ca -0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2qgf h LYS 164 Cb 0.34 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2qgf h LYS 164 CO 0.00 0.27 -0.05 0.66 -2.27 0.00 0.00 179.45 178.07 2qgf n TYR 165 N -4.93 0.00 -2.30 1.91 4.01 -1.23 -4.72 117.16 109.90 2qgf n TYR 165 Ca -0.08 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.25 2qgf n TYR 165 Cb 0.27 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.27 2qgf n TYR 165 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2qgf s GLY 166 N -1.78 0.64 0.55 2.72 0.00 -0.87 -4.87 107.32 103.71 2qgf s GLY 166 Ca 0.23 -0.86 0.22 0.00 0.00 0.00 0.00 44.72 44.32 2qgf s GLY 166 CO 0.29 2.99 2.18 0.07 0.00 0.00 0.00 173.10 178.63 2qgf h ARG 167 N 12.19 0.00 -0.16 2.90 0.11 -1.90 -2.80 114.38 124.72 2qgf h ARG 167 Ca -0.27 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 59.64 2qgf h ARG 167 Cb 1.11 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.19 2qgf h ARG 167 CO 1.22 0.00 -0.58 1.79 0.10 0.00 0.00 179.97 182.50 2qgf h THR 168 N 0.00 1.32 0.00 0.08 1.35 -1.91 -2.57 112.91 111.17 2qgf h THR 168 Ca 0.02 -1.83 -0.06 0.00 -0.55 0.00 0.00 66.41 63.98 2qgf h THR 168 Cb 0.07 2.00 -0.01 0.00 -1.73 0.00 0.00 68.15 68.48 2qgf h THR 168 CO -0.00 0.57 -0.30 -0.37 -0.25 0.00 0.00 175.52 175.16 2qgf h VAL 169 N 0.36 1.04 -0.27 6.82 -1.51 -1.88 -0.31 116.25 120.50 2qgf h VAL 169 Ca -0.03 -1.11 -0.06 0.00 -1.23 0.00 0.00 66.70 64.28 2qgf h VAL 169 Cb 1.21 1.63 -0.01 0.00 -2.13 0.00 0.00 31.29 31.99 2qgf h VAL 169 CO 0.12 0.30 -0.05 0.45 -1.23 0.00 0.00 177.57 177.16 2qgf h HIS 170 N 0.00 0.57 -0.30 5.19 -0.00 -1.49 -2.37 115.15 116.76 2qgf h HIS 170 Ca -0.00 -0.12 -0.14 0.00 -0.00 0.00 0.00 60.37 60.11 2qgf h HIS 170 Cb 0.60 -0.14 -0.01 0.00 -0.00 0.00 0.00 27.41 27.86 2qgf h HIS 170 CO 0.00 0.71 -0.38 0.77 -0.00 0.00 0.00 177.93 179.03 2qgf h SER 171 N 0.27 0.73 -0.13 2.45 0.02 -0.93 -2.73 113.55 113.23 2qgf h SER 171 Ca 0.07 -0.32 -0.10 0.00 -0.84 0.00 0.00 61.79 60.60 2qgf h SER 171 Cb 0.52 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 2qgf h SER 171 CO 0.02 1.04 -0.24 0.25 -1.14 0.00 0.00 176.83 176.76 2qgf h LEU 172 N 0.57 0.58 -0.39 5.07 5.85 -1.10 -0.42 115.31 125.47 2qgf h LEU 172 Ca 0.05 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 2qgf h LEU 172 Cb 0.91 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 2qgf h LEU 172 CO 0.08 0.81 0.09 0.74 -0.34 0.00 0.00 178.44 179.82 2qgf h THR 173 N 0.51 1.23 -0.53 1.05 2.02 -1.26 -1.52 112.91 114.40 2qgf h THR 173 Ca 0.07 -0.80 -0.09 0.00 0.77 0.00 0.00 66.41 66.37 2qgf h THR 173 Cb 0.68 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 2qgf h THR 173 CO 0.05 0.27 -0.01 1.56 0.37 0.00 0.00 175.52 177.77 2qgf h GLN 174 N 0.49 0.95 0.14 6.66 4.20 -1.14 -1.37 115.11 125.03 2qgf h GLN 174 Ca 0.12 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.52 2qgf h GLN 174 Cb 0.32 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2qgf h GLN 174 CO 0.00 0.96 -0.07 0.00 -0.67 0.00 0.00 178.83 179.06 2qgf h ALA 175 N 0.95 -0.19 0.00 3.87 0.00 -1.02 -2.90 119.26 119.97 2qgf h ALA 175 Ca 0.15 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2qgf h ALA 175 Cb 0.54 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2qgf h ALA 175 CO 0.03 -0.50 -0.00 -0.07 0.00 0.00 0.00 179.25 178.70 2qgf h LEU 176 N -0.39 0.00 0.00 0.00 3.38 -1.24 -1.46 115.31 115.59 2qgf h LEU 176 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2qgf h LEU 176 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2qgf h LEU 176 CO 0.03 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.57 2qgf n ALA 177 N -2.09 2.53 0.22 1.53 0.00 -0.52 -2.33 120.51 119.85 2qgf n ALA 177 Ca -0.01 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.46 2qgf n ALA 177 Cb 0.24 -1.21 -0.08 0.00 0.00 0.00 0.00 19.45 18.39 2qgf n ALA 177 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qgf n LYS 178 N -0.72 0.51 -3.21 0.00 5.02 -0.55 -4.94 118.16 114.28 2qgf n LYS 178 Ca 0.10 -0.06 -0.18 0.00 -2.02 0.00 0.00 58.31 56.15 2qgf n LYS 178 Cb 0.05 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 2qgf n LYS 178 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2qgf s PHE 179 N -3.37 2.95 0.08 2.13 0.08 -0.99 -4.86 117.98 114.00 2qgf s PHE 179 Ca -0.02 -0.30 -0.01 0.00 0.12 0.00 0.00 56.93 56.72 2qgf s PHE 179 Cb 0.13 -2.21 -0.04 0.00 -0.57 0.00 0.00 43.02 40.32 2qgf s PHE 179 CO 0.85 -0.25 0.24 -0.51 -0.10 0.00 0.00 175.22 175.46 2qgf s ASP 180 N -4.27 6.38 -1.47 1.36 1.11 -1.26 -4.61 116.67 113.91 2qgf s ASP 180 Ca 0.50 0.33 0.00 0.00 0.18 0.00 0.00 52.55 53.56 2qgf s ASP 180 Cb -0.10 -1.98 0.00 0.00 1.07 0.00 0.00 42.92 41.91 2qgf s ASP 180 CO 0.32 0.14 0.00 0.61 1.18 0.00 0.00 175.17 177.43 2qgf n GLY 181 N 0.23 1.07 3.78 0.21 0.00 -1.26 -0.44 105.19 108.79 2qgf n GLY 181 Ca -0.05 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.26 2qgf n GLY 181 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qgf s ASN 182 N -2.72 7.36 -0.12 1.61 0.01 -1.26 -3.77 114.94 116.04 2qgf s ASN 182 Ca 0.00 1.63 0.01 0.00 -0.71 0.00 0.00 52.86 53.79 2qgf s ASN 182 Cb 0.00 -2.50 -0.01 0.00 0.41 0.00 0.00 41.25 39.15 2qgf s ASN 182 CO 0.00 0.18 -0.15 -0.60 -1.51 0.00 0.00 177.10 175.02 2qgf s ARG 183 N -1.28 3.31 -0.08 -0.60 6.06 -0.32 -4.07 118.95 121.97 2qgf s ARG 183 Ca 0.37 -0.73 -0.01 0.00 -2.50 0.00 0.00 55.73 52.86 2qgf s ARG 183 Cb -0.22 -2.56 -0.03 0.00 0.06 0.00 0.00 34.95 32.19 2qgf s ARG 183 CO 0.26 0.20 -0.02 -0.06 -2.50 0.00 0.00 175.30 173.18 2qgf s PHE 184 N 0.36 3.11 -0.18 5.12 0.40 -0.36 -0.92 117.98 125.51 2qgf s PHE 184 Ca -0.13 0.15 0.01 0.00 -0.60 0.00 0.00 56.93 56.37 2qgf s PHE 184 Cb -0.16 -1.77 0.03 0.00 0.51 0.00 0.00 43.02 41.63 2qgf s PHE 184 CO 0.06 0.44 -0.15 0.71 0.70 0.00 0.00 175.22 176.98 2qgf s TYR 185 N -0.87 2.52 -0.45 0.36 1.51 -0.52 -0.79 117.35 119.11 2qgf s TYR 185 Ca 0.13 -1.54 -0.13 0.00 -1.01 0.00 0.00 57.07 54.52 2qgf s TYR 185 Cb -0.11 -1.74 0.08 0.00 -0.11 0.00 0.00 41.96 40.08 2qgf s TYR 185 CO 0.02 -0.75 0.34 -0.06 -1.11 0.00 0.00 175.55 173.99 2qgf s PHE 186 N 1.37 3.29 -0.44 2.71 0.08 0.55 -0.83 117.98 124.71 2qgf s PHE 186 Ca 0.02 -1.19 -0.09 0.00 0.12 0.00 0.00 56.93 55.78 2qgf s PHE 186 Cb -0.14 -3.09 0.09 0.00 -0.57 0.00 0.00 43.02 39.31 2qgf s PHE 186 CO -0.10 -0.82 0.30 0.42 -0.10 0.00 0.00 175.22 174.91 2qgf s ILE 187 N 1.55 4.26 0.05 0.64 1.01 -0.72 -1.24 121.20 126.75 2qgf s ILE 187 Ca 0.04 -1.53 -0.13 0.00 0.00 0.00 0.00 60.65 59.03 2qgf s ILE 187 Cb -0.24 -3.68 0.02 0.00 0.01 0.00 0.00 42.46 38.57 2qgf s ILE 187 CO 0.05 -0.61 0.28 0.00 0.00 0.00 0.00 174.94 174.66 2qgf s ALA 188 N 1.41 -0.59 0.48 9.38 0.00 -1.25 -2.03 121.76 129.16 2qgf s ALA 188 Ca 0.04 -0.10 -0.23 0.00 0.00 0.00 0.00 51.96 51.67 2qgf s ALA 188 Cb -0.24 0.34 -0.07 0.00 0.00 0.00 0.00 23.12 23.16 2qgf s ALA 188 CO 0.01 -0.42 1.22 -2.14 0.00 0.00 0.00 175.76 174.43 2qgf s PRO 189 N -2.72 3.58 0.30 0.00 0.02 -1.26 -4.86 135.00 130.06 2qgf s PRO 189 Ca -0.04 1.90 0.05 0.00 0.02 0.00 0.00 61.00 62.94 2qgf s PRO 189 Cb -0.00 -2.36 0.81 0.00 0.02 0.00 0.00 34.50 32.96 2qgf s PRO 189 CO -0.04 -0.73 1.65 0.22 -0.33 0.00 0.00 177.00 177.77 2qgf h ASP 190 N 1.88 0.16 0.90 2.53 -0.00 -1.99 0.34 116.42 120.24 2qgf h ASP 190 Ca -0.50 0.19 0.00 0.00 -0.00 0.00 0.00 57.03 56.72 2qgf h ASP 190 Cb 1.26 0.22 0.00 0.00 -0.00 0.00 0.00 39.33 40.82 2qgf h ASP 190 CO 0.59 -0.14 0.00 0.00 -0.00 0.00 0.00 179.24 179.70 2qgf n ALA 191 N -2.59 1.97 -2.43 -0.78 0.00 -1.26 -3.67 120.51 111.76 2qgf n ALA 191 Ca 0.24 -0.02 -0.22 0.00 0.00 0.00 0.00 53.44 53.44 2qgf n ALA 191 Cb 0.75 -1.39 0.01 0.00 0.00 0.00 0.00 19.45 18.83 2qgf n ALA 191 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qgf n LEU 192 N -1.86 4.04 -4.85 0.00 4.77 0.12 -4.96 117.00 114.26 2qgf n LEU 192 Ca 0.04 -4.73 -0.31 0.00 -0.03 0.00 0.00 56.01 50.99 2qgf n LEU 192 Cb 0.29 -0.23 0.03 0.00 -2.33 0.00 0.00 43.42 41.18 2qgf n LEU 192 CO 0.22 2.02 0.72 0.00 -1.33 0.00 0.00 177.39 179.03 2qgf s ALA 193 N -3.51 2.88 0.29 -1.18 0.00 -1.13 -2.32 121.76 116.80 2qgf s ALA 193 Ca 0.44 -0.09 -0.30 0.00 0.00 0.00 0.00 51.96 52.01 2qgf s ALA 193 Cb 0.41 -3.10 -0.11 0.00 0.00 0.00 0.00 23.12 20.31 2qgf s ALA 193 CO -0.09 -0.99 1.61 1.41 0.00 0.00 0.00 175.76 177.70 2qgf s MET 194 N -5.17 4.11 0.54 0.00 1.75 -1.26 -2.83 119.30 116.44 2qgf s MET 194 Ca 0.57 2.59 -0.21 0.00 -1.25 0.00 0.00 55.69 57.39 2qgf s MET 194 Cb -0.12 -3.02 -0.06 0.00 2.84 0.00 0.00 34.83 34.47 2qgf s MET 194 CO 0.54 -0.65 1.22 -2.30 -0.65 0.00 0.00 175.02 173.18 2qgf n PRO 195 N 2.30 1.46 -0.22 4.11 -0.02 -1.26 -4.88 135.00 136.49 2qgf n PRO 195 Ca 0.09 0.54 -0.02 0.00 -2.02 0.00 0.00 63.50 62.09 2qgf n PRO 195 Cb 0.37 -2.41 0.09 0.00 -0.02 0.00 0.00 33.50 31.53 2qgf n PRO 195 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2qgf h GLN 196 N 1.23 0.59 -1.00 -0.52 5.75 -2.00 -2.40 115.11 116.75 2qgf h GLN 196 Ca -0.49 -0.04 0.21 0.00 -0.15 0.00 0.00 58.65 58.18 2qgf h GLN 196 Cb 1.32 -0.13 -0.11 0.00 1.07 0.00 0.00 27.48 29.63 2qgf h GLN 196 CO 0.56 0.39 0.61 0.10 -2.65 0.00 0.00 178.83 177.83 2qgf h TYR 197 N 0.61 1.05 -0.43 3.99 -0.00 -1.99 0.22 116.97 120.41 2qgf h TYR 197 Ca 0.29 0.03 -0.11 0.00 -0.00 0.00 0.00 58.73 58.94 2qgf h TYR 197 Cb 0.22 -0.31 -0.01 0.00 -0.00 0.00 0.00 36.73 36.62 2qgf h TYR 197 CO -0.10 0.18 -0.18 0.82 -0.00 0.00 0.00 178.16 178.89 2qgf h ILE 198 N 0.70 1.28 -0.38 -0.90 2.04 -1.79 -1.66 117.51 116.80 2qgf h ILE 198 Ca 0.60 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.13 2qgf h ILE 198 Cb 1.01 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 2qgf h ILE 198 CO -0.41 0.45 0.21 -0.07 0.00 0.00 0.00 178.15 178.33 2qgf h LEU 199 N 0.71 0.47 -0.06 1.44 3.38 -0.82 -1.11 115.31 119.31 2qgf h LEU 199 Ca 0.10 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2qgf h LEU 199 Cb 0.74 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.32 2qgf h LEU 199 CO 0.06 0.42 -0.31 0.44 0.09 0.00 0.00 178.44 179.14 2qgf h ASP 200 N 0.48 -0.94 -0.86 -0.43 3.32 -0.42 -0.46 116.42 117.12 2qgf h ASP 200 Ca 0.13 0.13 0.08 0.00 0.02 0.00 0.00 57.03 57.39 2qgf h ASP 200 Cb 0.05 0.39 -0.07 0.00 0.22 0.00 0.00 39.33 39.92 2qgf h ASP 200 CO -0.02 -0.36 0.52 -0.03 -1.72 0.00 0.00 179.24 177.63 2qgf h MET 201 N -0.42 0.88 -0.54 3.56 4.05 -1.01 -1.86 114.93 119.59 2qgf h MET 201 Ca 0.08 -0.05 0.01 0.00 -0.28 0.00 0.00 59.70 59.45 2qgf h MET 201 Cb 0.54 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 31.11 2qgf h MET 201 CO -0.30 0.58 0.35 -0.07 0.23 0.00 0.00 176.91 177.71 2qgf h LEU 202 N 0.91 0.61 -1.14 3.39 3.38 0.00 -2.69 115.31 119.77 2qgf h LEU 202 Ca 0.40 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.32 2qgf h LEU 202 Cb 0.28 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 2qgf h LEU 202 CO -0.21 0.44 0.24 0.44 0.09 0.00 0.00 178.44 179.44 2qgf h ASP 203 N 0.72 0.77 -0.69 -0.43 3.32 -0.33 -1.88 116.42 117.90 2qgf h ASP 203 Ca 0.20 -0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.16 2qgf h ASP 203 Cb -0.07 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.24 2qgf h ASP 203 CO -0.05 0.69 0.45 -0.33 -1.72 0.00 0.00 179.24 178.28 2qgf h GLU 204 N 0.83 0.91 0.00 3.56 5.08 -1.11 -0.44 114.58 123.41 2qgf h GLU 204 Ca 0.20 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 2qgf h GLU 204 Cb 0.16 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 2qgf h GLU 204 CO -0.02 0.61 -0.02 0.87 -1.00 0.00 0.00 179.01 179.44 2qgf h LYS 205 N 0.93 0.00 -0.78 2.33 1.79 -1.17 -3.46 116.57 116.22 2qgf h LYS 205 Ca 0.25 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.71 2qgf h LYS 205 Cb -0.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.55 2qgf h LYS 205 CO -0.05 0.02 -0.01 0.41 -1.08 0.00 0.00 179.45 178.74 2qgf n GLY 206 N -0.01 0.74 3.89 3.86 0.00 -0.17 -5.04 105.19 108.45 2qgf n GLY 206 Ca 0.00 -0.73 -0.34 0.00 0.00 0.00 0.00 46.02 44.96 2qgf n GLY 206 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qgf s ILE 207 N -2.69 5.24 0.08 -0.61 1.01 -0.81 -5.03 121.20 118.39 2qgf s ILE 207 Ca 0.01 0.16 -0.12 0.00 0.00 0.00 0.00 60.65 60.70 2qgf s ILE 207 Cb -0.00 -3.60 -0.06 0.00 0.01 0.00 0.00 42.46 38.81 2qgf s ILE 207 CO 0.01 0.28 0.44 0.00 0.00 0.00 0.00 174.94 175.67 2qgf s ALA 208 N -1.40 3.68 -0.12 9.38 0.00 -1.26 -4.52 121.76 127.53 2qgf s ALA 208 Ca 0.31 -0.28 -0.19 0.00 0.00 0.00 0.00 51.96 51.80 2qgf s ALA 208 Cb -0.13 -2.36 0.05 0.00 0.00 0.00 0.00 23.12 20.67 2qgf s ALA 208 CO 0.19 0.52 0.48 1.67 0.00 0.00 0.00 175.76 178.62 2qgf s TRP 209 N -1.36 -0.47 0.07 0.00 1.48 -1.26 -1.22 118.94 116.18 2qgf s TRP 209 Ca 0.33 1.01 0.02 0.00 -1.06 0.00 0.00 56.10 56.41 2qgf s TRP 209 Cb -0.15 0.20 -0.03 0.00 -1.16 0.00 0.00 33.47 32.34 2qgf s TRP 209 CO 0.18 -0.36 -0.08 -1.54 -4.06 0.00 0.00 176.95 171.09 2qgf s SER 210 N -0.42 1.05 -0.19 -2.66 1.04 0.03 -4.96 113.70 107.59 2qgf s SER 210 Ca -0.06 -0.72 -0.07 0.00 0.48 0.00 0.00 55.95 55.59 2qgf s SER 210 Cb -0.03 0.05 -0.04 0.00 0.10 0.00 0.00 66.02 66.09 2qgf s SER 210 CO 0.03 -0.28 0.06 -0.76 0.98 0.00 0.00 173.24 173.28 2qgf s LEU 211 N -2.11 3.73 0.17 2.42 1.43 -1.26 -0.33 118.68 122.72 2qgf s LEU 211 Ca -0.01 0.02 0.11 0.00 -1.03 0.00 0.00 54.13 53.21 2qgf s LEU 211 Cb -0.05 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 2qgf s LEU 211 CO -0.01 0.13 -0.24 -1.00 0.23 0.00 0.00 176.35 175.46 2qgf s HIS 212 N 0.61 2.23 -0.11 0.29 3.76 -0.37 -4.92 115.29 116.79 2qgf s HIS 212 Ca 0.03 -0.38 0.20 0.00 -0.15 0.00 0.00 55.06 54.77 2qgf s HIS 212 Cb -0.13 -1.13 -0.25 0.00 1.11 0.00 0.00 32.58 32.18 2qgf s HIS 212 CO 0.01 0.43 0.50 -1.13 -0.85 0.00 0.00 174.74 173.71 2qgf n SER 213 N 0.46 0.23 -4.32 1.40 3.41 -1.26 -3.76 113.62 109.78 2qgf n SER 213 Ca -0.14 0.09 -0.23 0.00 -0.26 0.00 0.00 58.87 58.33 2qgf n SER 213 Cb 0.55 1.32 -0.12 0.00 -0.26 0.00 0.00 64.21 65.71 2qgf n SER 213 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2qgf s SER 214 N -5.02 2.68 -0.05 4.04 0.15 -1.26 -4.80 113.70 109.44 2qgf s SER 214 Ca -0.07 -0.77 -0.25 0.00 0.70 0.00 0.00 55.95 55.56 2qgf s SER 214 Cb 0.11 -0.16 -0.22 0.00 -1.71 0.00 0.00 66.02 64.04 2qgf s SER 214 CO 0.86 0.03 1.08 0.40 1.20 0.00 0.00 173.24 176.81 2qgf h ILE 215 N 3.69 1.53 0.00 6.45 2.04 -1.93 -3.22 117.51 126.06 2qgf h ILE 215 Ca -0.45 -1.77 0.00 0.00 1.00 0.00 0.00 64.86 63.64 2qgf h ILE 215 Cb 1.19 2.63 0.00 0.00 -0.74 0.00 0.00 36.82 39.91 2qgf h ILE 215 CO 0.44 0.48 0.00 1.05 0.00 0.00 0.00 178.15 180.12 2qgf h GLU 216 N -0.51 0.00 0.00 2.37 4.11 -1.94 0.85 114.58 119.45 2qgf h GLU 216 Ca -0.01 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.40 2qgf h GLU 216 Cb 0.87 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 2qgf h GLU 216 CO 0.03 0.00 -0.09 1.49 0.07 0.00 0.00 179.01 180.52 2qgf h GLU 217 N 0.00 0.00 0.00 1.06 4.81 -1.98 -3.09 114.58 115.38 2qgf h GLU 217 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2qgf h GLU 217 Cb 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.41 2qgf h GLU 217 CO 0.00 0.09 0.00 1.55 -0.73 0.00 0.00 179.01 179.92 2qgf n VAL 218 N -3.29 0.00 -0.34 0.32 3.14 0.09 -4.87 118.33 113.38 2qgf n VAL 218 Ca -0.01 -0.25 -0.01 0.00 -2.96 0.00 0.00 64.34 61.11 2qgf n VAL 218 Cb 0.29 1.48 0.04 0.00 -1.06 0.00 0.00 33.84 34.59 2qgf n VAL 218 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 2qgf n MET 219 N -0.02 -0.20 0.26 1.45 0.00 -0.06 -1.24 117.12 117.31 2qgf n MET 219 Ca 0.00 1.36 0.11 0.00 0.00 0.00 0.00 57.70 59.16 2qgf n MET 219 Cb 0.12 -2.01 0.72 0.00 0.00 0.00 0.00 33.22 32.04 2qgf n MET 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2qgf h ALA 220 N 1.22 1.65 -0.24 -5.12 0.00 -1.80 -3.02 119.26 111.95 2qgf h ALA 220 Ca 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2qgf h ALA 220 Cb 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2qgf h ALA 220 CO -0.87 0.08 0.00 -0.85 0.00 0.00 0.00 179.25 177.60 2qgf n GLU 221 N -4.11 2.83 -3.97 0.00 0.28 -0.38 -4.50 120.64 110.80 2qgf n GLU 221 Ca -0.03 -2.07 -0.32 0.00 -0.16 0.00 0.00 57.16 54.58 2qgf n GLU 221 Cb 0.15 -1.30 -0.05 0.00 1.43 0.00 0.00 31.44 31.66 2qgf n GLU 221 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 2qgf s VAL 222 N -1.36 5.14 -0.23 3.84 -7.23 -1.14 -4.72 120.40 114.70 2qgf s VAL 222 Ca 0.21 -0.37 -0.05 0.00 -1.81 0.00 0.00 61.98 59.97 2qgf s VAL 222 Cb 0.13 -3.43 -0.18 0.00 0.56 0.00 0.00 36.38 33.46 2qgf s VAL 222 CO 0.11 0.25 -0.09 0.47 -0.31 0.00 0.00 175.10 175.53 2qgf n ASP 223 N 0.74 2.00 -4.23 4.85 8.00 -0.08 -4.46 116.55 123.37 2qgf n ASP 223 Ca -0.09 0.06 -0.32 0.00 0.71 0.00 0.00 54.79 55.15 2qgf n ASP 223 Cb 0.52 -0.63 -0.17 0.00 -0.02 0.00 0.00 41.12 40.83 2qgf n ASP 223 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qgf s ILE 224 N -2.52 2.04 -0.33 0.53 -1.09 -1.18 -1.24 121.20 117.41 2qgf s ILE 224 Ca -0.32 -1.02 0.02 0.00 -2.23 0.00 0.00 60.65 57.09 2qgf s ILE 224 Cb 0.09 -1.75 0.09 0.00 -1.58 0.00 0.00 42.46 39.31 2qgf s ILE 224 CO 0.62 0.56 0.04 -0.22 -1.23 0.00 0.00 174.94 174.71 2qgf s LEU 225 N 0.21 4.52 -0.64 2.97 2.96 -0.37 -0.75 118.68 127.59 2qgf s LEU 225 Ca -0.15 -1.90 -0.15 0.00 -0.22 0.00 0.00 54.13 51.71 2qgf s LEU 225 Cb -0.17 -1.66 0.16 0.00 0.50 0.00 0.00 46.19 45.02 2qgf s LEU 225 CO 0.08 -0.36 0.58 -0.47 -1.32 0.00 0.00 176.35 174.85 2qgf s TYR 226 N 1.02 3.44 0.27 5.38 6.14 0.19 -1.12 117.35 132.67 2qgf s TYR 226 Ca 0.05 -1.61 -0.20 0.00 0.64 0.00 0.00 57.07 55.95 2qgf s TYR 226 Cb -0.20 -3.77 -0.09 0.00 0.42 0.00 0.00 41.96 38.32 2qgf s TYR 226 CO -0.06 -1.00 0.78 -1.64 0.64 0.00 0.00 175.55 174.27 2qgf s MET 227 N 1.05 4.28 0.22 4.97 -1.94 -0.29 -1.31 119.30 126.27 2qgf s MET 227 Ca 0.09 0.95 0.04 0.00 -1.71 0.00 0.00 55.69 55.05 2qgf s MET 227 Cb -0.23 -2.75 -0.05 0.00 2.01 0.00 0.00 34.83 33.82 2qgf s MET 227 CO -0.02 0.31 -0.02 0.95 -0.01 0.00 0.00 175.02 176.23 2qgf s THR 228 N -1.66 1.04 -0.25 2.05 -4.23 -0.20 -4.08 115.64 108.32 2qgf s THR 228 Ca 0.47 -2.04 -0.24 0.00 -1.18 0.00 0.00 61.69 58.71 2qgf s THR 228 Cb -0.16 -2.26 -0.01 0.00 1.34 0.00 0.00 72.50 71.41 2qgf s THR 228 CO 0.20 -0.39 0.80 -0.60 -0.54 0.00 0.00 174.62 174.09 2qgf s ARG 229 N -3.85 4.16 -0.42 3.99 3.52 -1.26 -4.44 118.95 120.65 2qgf s ARG 229 Ca 0.27 0.87 -0.28 0.00 -0.13 0.00 0.00 55.73 56.46 2qgf s ARG 229 Cb 0.05 -3.65 0.02 0.00 -1.56 0.00 0.00 34.95 29.82 2qgf s ARG 229 CO 0.07 -0.51 1.05 0.08 -0.81 0.00 0.00 175.30 175.18 2qgf s VAL 230 N 2.80 4.39 -0.21 7.11 1.01 -1.26 -4.41 120.40 129.83 2qgf s VAL 230 Ca 0.34 1.24 -0.26 0.00 0.00 0.00 0.00 61.98 63.29 2qgf s VAL 230 Cb -0.15 -4.49 -0.01 0.00 0.00 0.00 0.00 36.38 31.73 2qgf s VAL 230 CO 0.08 -0.78 0.86 -1.10 0.00 0.00 0.00 175.10 174.16 2qgf s GLN 231 N 3.98 4.25 0.49 2.72 -0.21 -1.26 -4.94 119.66 124.70 2qgf s GLN 231 Ca 0.44 1.05 0.19 0.00 0.02 0.00 0.00 55.36 57.05 2qgf s GLN 231 Cb -0.10 -3.61 1.23 0.00 1.00 0.00 0.00 33.01 31.53 2qgf s GLN 231 CO 0.25 -0.45 2.01 -0.22 -2.12 0.00 0.00 175.29 174.76 2qgf h LYS 232 N 7.48 0.16 -0.66 2.91 3.64 -1.94 -2.10 116.57 126.06 2qgf h LYS 232 Ca -0.25 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.15 2qgf h LYS 232 Cb 1.11 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.85 2qgf h LYS 232 CO 0.87 0.11 0.44 0.93 -2.27 0.00 0.00 179.45 179.53 2qgf h GLU 233 N 0.17 0.78 0.00 1.90 3.07 -1.96 0.19 114.58 118.73 2qgf h GLU 233 Ca 0.23 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 2qgf h GLU 233 Cb 0.69 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 2qgf h GLU 233 CO -0.04 0.52 0.00 0.54 -1.40 0.00 0.00 179.01 178.63 2qgf n ARG 234 N -4.46 0.03 -4.33 2.33 5.12 -0.79 -4.73 116.66 109.83 2qgf n ARG 234 Ca 0.08 0.34 -0.18 0.00 -1.93 0.00 0.00 57.85 56.15 2qgf n ARG 234 Cb 0.12 -1.50 -0.09 0.00 -1.16 0.00 0.00 32.46 29.83 2qgf n ARG 234 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2qgf s LEU 235 N -2.86 1.66 0.16 0.55 1.43 0.65 -5.10 118.68 115.17 2qgf s LEU 235 Ca 0.04 -1.55 -0.18 0.00 -1.03 0.00 0.00 54.13 51.41 2qgf s LEU 235 Cb 0.04 0.20 -0.07 0.00 0.03 0.00 0.00 46.19 46.39 2qgf s LEU 235 CO 0.11 -0.88 0.63 -0.62 0.23 0.00 0.00 176.35 175.82 2qgf s ASP 236 N -3.37 6.99 0.59 2.29 2.15 -1.26 -4.93 116.67 119.13 2qgf s ASP 236 Ca 0.36 1.27 0.39 0.00 0.43 0.00 0.00 52.55 54.99 2qgf s ASP 236 Cb 0.05 -2.36 1.88 0.00 -0.30 0.00 0.00 42.92 42.19 2qgf s ASP 236 CO 0.17 0.12 2.16 1.55 -0.17 0.00 0.00 175.17 179.00 2qgf h PRO 237 N 3.73 0.00 0.03 4.34 0.13 -1.98 0.44 132.00 138.70 2qgf h PRO 237 Ca -0.48 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.52 2qgf h PRO 237 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2qgf h PRO 237 CO 0.65 0.00 -0.64 0.77 -0.23 0.00 0.00 178.00 178.55 2qgf h SER 238 N 0.00 0.11 0.00 1.44 0.02 -1.98 -2.42 113.55 110.73 2qgf h SER 238 Ca 0.00 -0.84 -0.08 0.00 -0.84 0.00 0.00 61.79 60.03 2qgf h SER 238 Cb 0.24 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2qgf h SER 238 CO 0.00 1.27 -0.21 1.05 -1.14 0.00 0.00 176.83 177.79 2qgf h GLU 239 N -0.82 0.37 0.85 3.45 4.11 -1.92 0.26 114.58 120.88 2qgf h GLU 239 Ca -0.15 -0.12 -0.04 0.00 0.07 0.00 0.00 59.36 59.12 2qgf h GLU 239 Cb 1.27 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2qgf h GLU 239 CO -0.03 0.57 -0.44 -0.92 0.07 0.00 0.00 179.01 178.26 2qgf h TYR 240 N 0.33 -1.16 -0.91 2.06 5.03 -0.23 -0.95 116.97 121.14 2qgf h TYR 240 Ca 0.06 -0.02 0.17 0.00 2.58 0.00 0.00 58.73 61.51 2qgf h TYR 240 Cb 0.57 0.39 -0.08 0.00 1.55 0.00 0.00 36.73 39.17 2qgf h TYR 240 CO 0.01 -0.70 0.59 0.00 -1.32 0.00 0.00 178.16 176.75 2qgf h ALA 241 N -1.37 1.92 -0.17 1.82 0.00 -1.14 0.28 119.26 120.60 2qgf h ALA 241 Ca -0.12 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2qgf h ALA 241 Cb 0.92 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2qgf h ALA 241 CO 0.17 -0.20 -0.06 -0.91 0.00 0.00 0.00 179.25 178.26 2qgf h ASN 242 N 0.62 0.24 0.00 0.00 2.35 0.25 -3.16 115.58 115.87 2qgf h ASN 242 Ca 0.48 -0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 56.11 2qgf h ASN 242 Cb 0.89 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 39.18 2qgf h ASN 242 CO -0.23 0.33 -1.95 1.33 -1.65 0.00 0.00 177.43 175.27 2qgf n VAL 243 N -4.33 0.31 -0.15 2.81 0.24 -0.07 -4.71 118.33 112.43 2qgf n VAL 243 Ca -0.00 -0.51 -0.04 0.00 -2.04 0.00 0.00 64.34 61.74 2qgf n VAL 243 Cb 0.22 -0.09 -0.04 0.00 -1.47 0.00 0.00 33.84 32.46 2qgf n VAL 243 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2qgf n LYS 244 N -2.28 -0.16 -0.15 7.34 0.00 0.79 -0.45 118.16 123.25 2qgf n LYS 244 Ca -0.10 1.09 0.27 0.00 0.00 0.00 0.00 58.31 59.58 2qgf n LYS 244 Cb 0.64 -1.62 0.55 0.00 0.00 0.00 0.00 35.03 34.60 2qgf n LYS 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2qgf h ALA 245 N -0.36 2.76 0.00 3.14 0.00 -1.84 0.13 119.26 123.09 2qgf h ALA 245 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2qgf h ALA 245 Cb 0.15 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2qgf h ALA 245 CO -0.34 -1.46 -0.08 1.96 0.00 0.00 0.00 179.25 179.33 2qgf h GLN 246 N 0.00 0.00 -0.35 0.00 1.08 -1.08 -3.37 115.11 111.39 2qgf h GLN 246 Ca 0.43 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 57.36 2qgf h GLN 246 Cb 2.41 0.00 -0.37 0.00 -0.05 0.00 0.00 27.48 29.47 2qgf h GLN 246 CO -0.00 0.00 -0.99 1.19 -0.95 0.00 0.00 178.83 178.08 2qgf n PHE 247 N -2.29 1.13 -4.69 2.96 3.72 0.47 -4.42 117.46 114.33 2qgf n PHE 247 Ca 0.05 -1.71 -0.33 0.00 -0.05 0.00 0.00 57.45 55.41 2qgf n PHE 247 Cb 0.44 -0.23 -0.16 0.00 -0.94 0.00 0.00 39.48 38.59 2qgf n PHE 247 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 2qgf s VAL 248 N -3.01 2.49 -0.13 -4.37 -7.23 -1.24 -4.81 120.40 102.10 2qgf s VAL 248 Ca 0.34 -0.84 -0.23 0.00 -1.81 0.00 0.00 61.98 59.44 2qgf s VAL 248 Cb 0.36 -2.03 -0.03 0.00 0.56 0.00 0.00 36.38 35.24 2qgf s VAL 248 CO -0.06 0.53 0.72 -0.22 -0.31 0.00 0.00 175.10 175.76 2qgf s LEU 249 N 0.69 4.23 0.19 1.32 2.96 0.23 -4.98 118.68 123.33 2qgf s LEU 249 Ca -0.08 1.10 0.11 0.00 -0.22 0.00 0.00 54.13 55.03 2qgf s LEU 249 Cb -0.16 -3.08 -0.04 0.00 0.50 0.00 0.00 46.19 43.41 2qgf s LEU 249 CO 0.02 -0.23 -0.22 -0.13 -1.32 0.00 0.00 176.35 174.47 2qgf s ARG 250 N 1.45 1.46 0.38 1.98 0.52 -1.26 -1.62 118.95 121.86 2qgf s ARG 250 Ca 0.36 -1.52 0.14 0.00 -0.52 0.00 0.00 55.73 54.19 2qgf s ARG 250 Cb -0.17 -1.67 0.98 0.00 0.52 0.00 0.00 34.95 34.61 2qgf s ARG 250 CO 0.15 0.35 1.82 0.00 0.02 0.00 0.00 175.30 177.63 2qgf h ALA 251 N 3.10 2.05 -0.73 2.13 0.00 -1.90 -1.67 119.26 122.25 2qgf h ALA 251 Ca -0.44 0.04 0.11 0.00 0.00 0.00 0.00 54.91 54.62 2qgf h ALA 251 Cb 1.21 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 2qgf h ALA 251 CO 0.50 -0.38 0.34 0.77 0.00 0.00 0.00 179.25 180.48 2qgf h SER 252 N 0.52 0.39 0.16 0.00 0.02 -1.97 -0.41 113.55 112.26 2qgf h SER 252 Ca 0.52 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.56 2qgf h SER 252 Cb 1.14 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2qgf h SER 252 CO -0.26 0.20 0.00 0.47 -1.14 0.00 0.00 176.83 176.10 2qgf n ASP 253 N -4.92 0.56 -0.16 3.07 8.00 -0.63 -1.62 116.55 120.86 2qgf n ASP 253 Ca 0.12 0.73 0.12 0.00 0.71 0.00 0.00 54.79 56.48 2qgf n ASP 253 Cb 0.33 -0.82 0.22 0.00 -0.02 0.00 0.00 41.12 40.83 2qgf n ASP 253 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2qgf n LEU 254 N -2.23 0.96 0.33 0.64 4.77 -0.16 -4.40 117.00 116.91 2qgf n LEU 254 Ca -0.01 -0.26 0.19 0.00 -0.03 0.00 0.00 56.01 55.90 2qgf n LEU 254 Cb 0.07 -0.14 1.02 0.00 -2.33 0.00 0.00 43.42 42.05 2qgf n LEU 254 CO 0.11 0.20 1.16 1.12 -1.33 0.00 0.00 177.39 178.65 2qgf h HIS 255 N 0.77 0.00 -0.01 -1.77 2.07 -1.35 -1.18 115.15 113.67 2qgf h HIS 255 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2qgf h HIS 255 Cb 0.53 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.51 2qgf h HIS 255 CO 0.00 0.00 -0.23 0.27 -3.07 0.00 0.00 177.93 174.90 2qgf n ASN 256 N -3.04 1.81 -4.73 3.10 6.94 -1.26 -5.02 115.26 113.05 2qgf n ASN 256 Ca -0.02 -1.41 -0.31 0.00 -0.02 0.00 0.00 54.58 52.82 2qgf n ASN 256 Cb 0.23 0.34 0.12 0.00 -2.36 0.00 0.00 39.78 38.10 2qgf n ASN 256 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2qgf s ALA 257 N -1.72 1.92 0.62 -2.53 0.00 -0.45 -4.28 121.76 115.32 2qgf s ALA 257 Ca 0.15 0.30 -0.11 0.00 0.00 0.00 0.00 51.96 52.29 2qgf s ALA 257 Cb 0.13 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 2qgf s ALA 257 CO 0.34 -2.13 1.03 0.15 0.00 0.00 0.00 175.76 175.15 2qgf s LYS 258 N -4.84 3.57 0.32 0.00 1.02 -1.26 -4.97 119.74 113.58 2qgf s LYS 258 Ca 0.63 0.78 0.01 0.00 0.02 0.00 0.00 55.97 57.42 2qgf s LYS 258 Cb -0.19 -2.08 0.56 0.00 -0.52 0.00 0.00 37.83 35.61 2qgf s LYS 258 CO 0.57 -0.60 1.94 0.00 -0.92 0.00 0.00 175.35 176.34 2qgf h ALA 259 N -0.27 1.54 0.00 5.17 0.00 -1.96 -2.31 119.26 121.44 2qgf h ALA 259 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2qgf h ALA 259 Cb 1.19 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2qgf h ALA 259 CO 0.62 0.35 -0.20 0.27 0.00 0.00 0.00 179.25 180.29 2qgf n ASN 260 N -4.47 0.68 -4.73 0.00 6.94 -1.26 -4.93 115.26 107.49 2qgf n ASN 260 Ca 0.12 0.40 -0.42 0.00 -0.02 0.00 0.00 54.58 54.67 2qgf n ASN 260 Cb 0.17 -0.45 -0.03 0.00 -2.36 0.00 0.00 39.78 37.11 2qgf n ASN 260 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 2qgf s MET 261 N -3.10 4.25 0.09 -3.83 1.75 -0.87 -4.88 119.30 112.70 2qgf s MET 261 Ca 0.10 2.31 0.07 0.00 -1.25 0.00 0.00 55.69 56.92 2qgf s MET 261 Cb 0.14 -3.14 -0.03 0.00 2.84 0.00 0.00 34.83 34.63 2qgf s MET 261 CO 0.63 -0.51 -0.19 0.15 -0.65 0.00 0.00 175.02 174.44 2qgf s LYS 262 N 0.50 1.09 -0.24 4.11 -0.14 -0.37 -4.50 119.74 120.18 2qgf s LYS 262 Ca 0.65 -1.08 -0.07 0.00 -1.36 0.00 0.00 55.97 54.10 2qgf s LYS 262 Cb -0.42 -1.29 -0.03 0.00 -1.68 0.00 0.00 37.83 34.41 2qgf s LYS 262 CO 0.36 0.30 0.07 0.08 -0.76 0.00 0.00 175.35 175.41 2qgf s VAL 263 N -1.13 4.42 0.19 3.17 1.01 0.11 -1.23 120.40 126.95 2qgf s VAL 263 Ca 0.05 -0.14 0.09 0.00 0.00 0.00 0.00 61.98 61.98 2qgf s VAL 263 Cb -0.10 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 2qgf s VAL 263 CO 0.03 0.35 -0.07 -0.76 0.00 0.00 0.00 175.10 174.66 2qgf s LEU 264 N 1.45 3.06 -0.29 3.92 1.43 -0.28 -2.14 118.68 125.83 2qgf s LEU 264 Ca 0.06 -0.56 -0.13 0.00 -1.03 0.00 0.00 54.13 52.46 2qgf s LEU 264 Cb -0.15 -1.71 0.10 0.00 0.03 0.00 0.00 46.19 44.46 2qgf s LEU 264 CO 0.04 0.08 0.67 -2.28 0.23 0.00 0.00 176.35 175.09 2qgf s HIS 265 N -1.82 -1.20 -0.09 0.29 2.46 -1.26 -1.14 115.29 112.54 2qgf s HIS 265 Ca 0.26 2.22 0.22 0.00 0.47 0.00 0.00 55.06 58.24 2qgf s HIS 265 Cb -0.08 0.72 1.22 0.00 -0.13 0.00 0.00 32.58 34.30 2qgf s HIS 265 CO 0.17 -0.59 1.67 -1.00 -2.47 0.00 0.00 174.74 172.52 2qgf h PRO 266 N 7.47 0.00 -1.73 2.88 0.13 -1.96 -3.46 132.00 135.33 2qgf h PRO 266 Ca -0.24 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.91 2qgf h PRO 266 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2qgf h PRO 266 CO 0.13 0.00 -0.48 1.28 -0.23 0.00 0.00 178.00 178.71 2qgf n LEU 267 N -2.31 -0.74 -4.76 1.56 4.77 -1.26 -5.01 117.00 109.25 2qgf n LEU 267 Ca -0.01 1.30 -0.40 0.00 -0.03 0.00 0.00 56.01 56.87 2qgf n LEU 267 Cb 0.08 -1.01 -0.06 0.00 -2.33 0.00 0.00 43.42 40.10 2qgf n LEU 267 CO 0.10 -0.48 0.54 -2.16 -1.33 0.00 0.00 177.39 174.07 2qgf s PRO 268 N -4.51 4.66 0.65 3.23 0.04 -1.26 -5.06 135.00 132.75 2qgf s PRO 268 Ca 0.00 1.27 -0.04 0.00 0.04 0.00 0.00 61.00 62.26 2qgf s PRO 268 Cb 0.00 -3.28 0.05 0.00 0.04 0.00 0.00 34.50 31.30 2qgf s PRO 268 CO 0.00 0.50 0.94 -0.98 0.04 0.00 0.00 177.00 177.50 2qgf s ARG 269 N -0.97 2.36 0.37 4.56 1.04 -1.26 -4.78 118.95 120.27 2qgf s ARG 269 Ca 0.38 -0.38 0.00 0.00 -1.04 0.00 0.00 55.73 54.70 2qgf s ARG 269 Cb -0.24 -2.27 0.00 0.00 -2.04 0.00 0.00 34.95 30.41 2qgf s ARG 269 CO 0.28 -1.04 0.00 1.55 -0.04 0.00 0.00 175.30 176.05 2qgf n VAL 270 N -2.73 0.00 -0.11 4.99 3.14 -1.26 -4.99 118.33 117.37 2qgf n VAL 270 Ca 0.08 0.00 -0.18 0.00 -2.96 0.00 0.00 64.34 61.27 2qgf n VAL 270 Cb 0.60 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 33.32 2qgf n VAL 270 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2qgf n ASP 271 N -3.32 1.94 -0.33 6.55 -0.08 -1.26 -4.67 116.55 115.39 2qgf n ASP 271 Ca 0.00 0.35 0.24 0.00 -1.51 0.00 0.00 54.79 53.87 2qgf n ASP 271 Cb 0.00 -0.79 0.45 0.00 2.34 0.00 0.00 41.12 43.12 2qgf n ASP 271 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 2qgf h GLU 272 N -1.00 0.03 -5.08 -0.67 9.09 -1.94 -3.38 114.58 111.63 2qgf h GLU 272 Ca -0.32 -0.00 -0.67 0.00 0.05 0.00 0.00 59.36 58.42 2qgf h GLU 272 Cb 1.26 -0.01 -0.35 0.00 -1.65 0.00 0.00 28.75 28.01 2qgf h GLU 272 CO -0.20 0.02 -0.86 0.42 0.05 0.00 0.00 179.01 178.44 2qgf s ILE 273 N -5.74 2.07 0.49 -1.06 1.01 -1.26 0.75 121.20 117.46 2qgf s ILE 273 Ca -0.11 -0.94 -0.21 0.00 0.00 0.00 0.00 60.65 59.39 2qgf s ILE 273 Cb 0.32 -1.86 -0.08 0.00 0.01 0.00 0.00 42.46 40.85 2qgf s ILE 273 CO 0.78 0.54 1.08 0.00 0.00 0.00 0.00 174.94 177.34 2qgf s ALA 274 N 1.22 2.85 0.49 9.38 0.00 -0.64 -4.68 121.76 130.38 2qgf s ALA 274 Ca 0.03 0.72 0.31 0.00 0.00 0.00 0.00 51.96 53.02 2qgf s ALA 274 Cb -0.13 -3.30 1.71 0.00 0.00 0.00 0.00 23.12 21.39 2qgf s ALA 274 CO -0.11 -0.48 2.17 1.79 0.00 0.00 0.00 175.76 179.13 2qgf h THR 275 N 1.54 0.45 -0.00 0.00 1.35 -1.95 -1.75 112.91 112.54 2qgf h THR 275 Ca -0.50 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 2qgf h THR 275 Cb 1.24 1.19 -0.00 0.00 -1.73 0.00 0.00 68.15 68.85 2qgf h THR 275 CO 0.59 0.06 0.01 -2.24 -0.25 0.00 0.00 175.52 173.68 2qgf h ASP 276 N 0.00 0.00 1.11 5.36 -0.00 -1.95 0.97 116.42 121.91 2qgf h ASP 276 Ca -0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.03 56.91 2qgf h ASP 276 Cb 0.19 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 39.50 2qgf h ASP 276 CO 0.01 0.00 -0.55 0.58 -0.00 0.00 0.00 179.24 179.28 2qgf h VAL 277 N 0.00 1.05 -0.78 4.15 2.07 -1.66 -3.18 116.25 117.91 2qgf h VAL 277 Ca 0.00 -2.16 0.12 0.00 0.82 0.00 0.00 66.70 65.48 2qgf h VAL 277 Cb 0.01 2.29 -0.05 0.00 -1.52 0.00 0.00 31.29 32.02 2qgf h VAL 277 CO -0.00 0.54 0.51 0.44 0.02 0.00 0.00 177.57 179.08 2qgf h ASP 278 N 0.00 0.55 0.67 0.57 3.45 -0.93 -1.62 116.42 119.12 2qgf h ASP 278 Ca -0.01 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.48 2qgf h ASP 278 Cb 1.25 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.93 2qgf h ASP 278 CO 0.07 0.31 0.00 0.29 -1.57 0.00 0.00 179.24 178.34 2qgf n LYS 279 N -4.51 0.21 -3.36 3.56 4.01 -1.20 -4.77 118.16 112.10 2qgf n LYS 279 Ca 0.14 0.05 -0.27 0.00 -0.51 0.00 0.00 58.31 57.72 2qgf n LYS 279 Cb 0.42 -1.50 -0.02 0.00 -0.51 0.00 0.00 35.03 33.41 2qgf n LYS 279 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 2qgf s THR 280 N -2.76 5.07 -1.46 -0.18 -4.23 -0.61 -4.97 115.64 106.49 2qgf s THR 280 Ca 0.19 -0.16 0.14 0.00 -1.18 0.00 0.00 61.69 60.68 2qgf s THR 280 Cb 0.17 -3.78 0.25 0.00 1.34 0.00 0.00 72.50 70.48 2qgf s THR 280 CO 0.43 -0.41 1.36 -0.81 -0.54 0.00 0.00 174.62 174.65 2qgf n PRO 281 N -1.25 0.21 0.09 3.99 -0.04 -1.26 -2.42 135.00 134.32 2qgf n PRO 281 Ca -0.03 0.15 0.12 0.00 -0.04 0.00 0.00 63.50 63.70 2qgf n PRO 281 Cb 0.55 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.62 2qgf n PRO 281 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2qgf h HIS 282 N 0.00 0.00 -2.81 0.54 3.86 -1.88 -3.46 115.15 111.40 2qgf h HIS 282 Ca 0.00 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.67 2qgf h HIS 282 Cb 0.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.59 2qgf h HIS 282 CO 0.00 0.00 0.91 0.00 0.86 0.00 0.00 177.93 179.70 2qgf s ALA 283 N -3.25 3.62 0.00 2.45 0.00 -1.02 0.09 121.76 123.65 2qgf s ALA 283 Ca 0.04 0.96 0.00 0.00 0.00 0.00 0.00 51.96 52.96 2qgf s ALA 283 Cb 0.11 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2qgf s ALA 283 CO 0.74 -1.04 0.74 1.87 0.00 0.00 0.00 175.76 178.08 2qgf n TRP 284 N 5.71 0.00 0.04 0.00 -0.00 -0.91 -4.88 117.44 117.41 2qgf n TRP 284 Ca 0.14 0.00 -0.11 0.00 -0.00 0.00 0.00 57.50 57.54 2qgf n TRP 284 Cb 0.43 0.02 0.02 0.00 -0.00 0.00 0.00 31.31 31.78 2qgf n TRP 284 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 177.69 177.79 2qgf h TYR 285 N 0.00 0.61 -0.07 5.87 -0.00 -1.88 0.15 116.97 121.65 2qgf h TYR 285 Ca 0.00 -0.27 -0.22 0.00 0.00 0.00 0.00 58.73 58.24 2qgf h TYR 285 Cb 1.22 -0.09 0.01 0.00 0.00 0.00 0.00 36.73 37.86 2qgf h TYR 285 CO 0.01 1.03 -0.85 0.74 -0.00 0.00 0.00 178.16 179.09 2qgf h PHE 286 N 0.31 0.81 -0.56 0.10 0.04 -1.92 -0.66 116.94 115.06 2qgf h PHE 286 Ca -0.03 -0.39 -0.10 0.00 2.80 0.00 0.00 57.97 60.24 2qgf h PHE 286 Cb 1.30 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 39.32 2qgf h PHE 286 CO 0.05 1.20 -0.05 1.96 -0.60 0.00 0.00 178.31 180.87 2qgf h GLN 287 N 0.37 1.02 -0.97 1.51 7.50 -1.89 -1.81 115.11 120.85 2qgf h GLN 287 Ca -0.07 -0.35 0.03 0.00 0.50 0.00 0.00 58.65 58.76 2qgf h GLN 287 Cb 1.47 -0.08 -0.05 0.00 0.05 0.00 0.00 27.48 28.86 2qgf h GLN 287 CO 0.16 1.03 0.64 0.37 -1.50 0.00 0.00 178.83 179.53 2qgf h GLN 288 N 0.92 1.22 -0.16 1.46 4.15 -0.57 -1.71 115.11 120.43 2qgf h GLN 288 Ca 0.16 -0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.42 2qgf h GLN 288 Cb 0.61 -0.28 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 2qgf h GLN 288 CO 0.04 0.81 -0.26 0.00 -1.93 0.00 0.00 178.83 177.49 2qgf h ALA 289 N 1.42 1.27 -0.15 3.38 0.00 -0.42 -2.67 119.26 122.09 2qgf h ALA 289 Ca 0.37 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2qgf h ALA 289 Cb -0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2qgf h ALA 289 CO -0.10 0.49 -0.49 0.78 0.00 0.00 0.00 179.25 179.93 2qgf h GLY 290 N 0.99 0.44 1.78 0.00 0.00 -0.54 -2.95 103.07 102.80 2qgf h GLY 290 Ca 0.04 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.90 2qgf h GLY 290 CO 0.04 0.43 0.00 0.70 0.00 0.00 0.00 176.54 177.71 2qgf n ASN 291 N -3.97 0.00 0.09 0.19 3.02 -0.80 -1.92 115.26 111.86 2qgf n ASN 291 Ca -0.02 0.30 -0.02 0.00 -0.03 0.00 0.00 54.58 54.81 2qgf n ASN 291 Cb 0.55 -0.39 0.24 0.00 -0.61 0.00 0.00 39.78 39.57 2qgf n ASN 291 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2qgf h GLY 292 N 2.01 0.29 0.99 7.41 0.00 -1.54 -1.03 103.07 111.21 2qgf h GLY 292 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 2qgf h GLY 292 CO 0.00 0.24 0.31 -2.22 0.00 0.00 0.00 176.54 174.87 2qgf h ILE 293 N 0.23 1.17 0.07 2.60 1.08 -1.58 0.18 117.51 121.26 2qgf h ILE 293 Ca 0.03 -0.39 -0.25 0.00 -0.39 0.00 0.00 64.86 63.85 2qgf h ILE 293 Cb 0.76 0.48 0.01 0.00 -3.07 0.00 0.00 36.82 34.99 2qgf h ILE 293 CO 0.06 0.17 -1.09 -0.26 -0.69 0.00 0.00 178.15 176.34 2qgf h PHE 294 N 0.70 0.59 -0.51 1.37 0.04 -1.65 0.11 116.94 117.59 2qgf h PHE 294 Ca 0.19 -0.37 -0.08 0.00 2.80 0.00 0.00 57.97 60.51 2qgf h PHE 294 Cb 0.01 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.09 2qgf h PHE 294 CO -0.02 1.23 0.01 0.00 -0.60 0.00 0.00 178.31 178.93 2qgf h ALA 295 N 0.64 1.07 0.04 2.45 0.00 -1.04 -0.83 119.26 121.59 2qgf h ALA 295 Ca -0.11 -0.27 -0.26 0.00 0.00 0.00 0.00 54.91 54.27 2qgf h ALA 295 Cb 1.77 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 19.37 2qgf h ALA 295 CO 0.19 0.59 -1.08 0.00 0.00 0.00 0.00 179.25 178.94 2qgf h ARG 296 N 0.79 0.56 -0.27 0.00 3.08 -0.54 -2.80 114.38 115.19 2qgf h ARG 296 Ca 0.15 -0.66 0.00 0.00 0.07 0.00 0.00 59.98 59.55 2qgf h ARG 296 Cb 0.46 0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 2qgf h ARG 296 CO 0.02 1.27 0.18 1.96 -1.07 0.00 0.00 179.97 182.33 2qgf h GLN 297 N 0.29 0.36 -0.20 0.04 4.20 -0.62 -2.38 115.11 116.80 2qgf h GLN 297 Ca -0.13 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.61 2qgf h GLN 297 Cb 1.74 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 29.38 2qgf h GLN 297 CO 0.20 0.24 -0.17 0.00 -0.67 0.00 0.00 178.83 178.43 2qgf h ALA 298 N 1.10 -0.05 -0.35 3.87 0.00 -1.18 0.18 119.26 122.83 2qgf h ALA 298 Ca 0.10 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.11 2qgf h ALA 298 Cb -0.04 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2qgf h ALA 298 CO -0.02 -0.60 0.17 1.25 0.00 0.00 0.00 179.25 180.04 2qgf h LEU 299 N -0.19 0.24 -0.71 0.00 5.85 -1.40 -1.11 115.31 117.99 2qgf h LEU 299 Ca 0.12 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.76 2qgf h LEU 299 Cb 0.37 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2qgf h LEU 299 CO -0.31 0.18 -0.09 -0.07 -0.34 0.00 0.00 178.44 177.81 2qgf h LEU 300 N 0.34 0.89 -0.13 2.25 3.38 -0.95 -2.58 115.31 118.51 2qgf h LEU 300 Ca 0.15 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2qgf h LEU 300 Cb 0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2qgf h LEU 300 CO -0.11 1.00 0.06 0.00 0.09 0.00 0.00 178.44 179.48 2qgf h ALA 301 N 1.08 0.17 -1.00 1.53 0.00 -0.55 -1.61 119.26 118.88 2qgf h ALA 301 Ca 0.13 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.97 2qgf h ALA 301 Cb 0.61 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2qgf h ALA 301 CO 0.04 -0.25 0.66 -0.07 0.00 0.00 0.00 179.25 179.63 2qgf h LEU 302 N 0.07 1.13 0.08 0.00 3.38 -1.16 0.43 115.31 119.25 2qgf h LEU 302 Ca 0.05 -0.02 -0.29 0.00 0.09 0.00 0.00 57.88 57.71 2qgf h LEU 302 Cb 0.15 -0.28 0.03 0.00 0.09 0.00 0.00 40.66 40.65 2qgf h LEU 302 CO -0.00 0.81 -1.17 0.58 0.09 0.00 0.00 178.44 178.75 2qgf h VAL 303 N 1.33 1.28 -0.02 1.22 2.07 -1.39 -3.06 116.25 117.69 2qgf h VAL 303 Ca 0.38 -2.38 0.00 0.00 0.82 0.00 0.00 66.70 65.52 2qgf h VAL 303 Cb -0.11 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 2qgf h VAL 303 CO -0.09 0.73 -0.10 0.18 0.02 0.00 0.00 177.57 178.31 2qgf n LEU 304 N -3.83 1.94 -3.86 2.57 4.77 -0.61 -0.79 117.00 117.18 2qgf n LEU 304 Ca -0.13 -0.64 -0.29 0.00 -0.03 0.00 0.00 56.01 54.92 2qgf n LEU 304 Cb 0.95 -0.02 -0.16 0.00 -2.33 0.00 0.00 43.42 41.85 2qgf n LEU 304 CO 0.57 0.33 -0.40 0.20 -1.33 0.00 0.00 177.39 176.76 2qgf s ASN 305 N -2.14 3.27 0.15 -1.43 0.01 0.13 -5.04 114.94 109.90 2qgf s ASN 305 Ca 0.31 -0.92 -0.07 0.00 -0.71 0.00 0.00 52.86 51.46 2qgf s ASN 305 Cb 0.20 -0.91 0.21 0.00 0.41 0.00 0.00 41.25 41.16 2qgf s ASN 305 CO 0.38 -0.25 0.90 -1.14 -1.51 0.00 0.00 177.10 175.49 2qgf n ARG 306 N 4.85 -0.09 -3.79 -0.60 0.63 -1.26 -4.31 116.66 112.10 2qgf n ARG 306 Ca -0.11 0.90 -0.13 0.00 -0.92 0.00 0.00 57.85 57.59 2qgf n ARG 306 Cb 0.46 -1.34 -0.14 0.00 0.45 0.00 0.00 32.46 31.89 2qgf n ARG 306 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2qgf s ASP 307 N -5.18 -0.11 -0.37 6.15 3.68 -1.26 -1.53 116.67 118.05 2qgf s ASP 307 Ca -0.08 0.26 -0.22 0.00 2.13 0.00 0.00 52.55 54.64 2qgf s ASP 307 Cb 0.14 0.20 0.01 0.00 -1.45 0.00 0.00 42.92 41.82 2qgf s ASP 307 CO 0.44 -0.10 0.71 -0.22 0.13 0.00 0.00 175.17 176.13 2qgf s LEU 308 N 0.67 4.22 -0.58 -1.34 1.98 -1.26 -5.01 118.68 117.37 2qgf s LEU 308 Ca -0.05 0.18 -0.19 0.00 -2.89 0.00 0.00 54.13 51.18 2qgf s LEU 308 Cb -0.07 -2.90 0.09 0.00 0.66 0.00 0.00 46.19 43.97 2qgf s LEU 308 CO -0.03 -0.70 0.69 -0.69 -1.89 0.00 0.00 176.35 173.73 2qgf s VAL 309 N 2.94 4.82 0.00 1.68 1.01 -1.26 -5.16 120.40 124.44 2qgf s VAL 309 Ca 0.28 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.38 2qgf s VAL 309 Cb -0.14 -4.46 0.00 0.00 0.00 0.00 0.00 36.38 31.79 2qgf s VAL 309 CO 0.17 -1.07 0.04 0.18 0.00 0.00 0.00 175.10 174.42