#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qaj s ASN 2 N 0.00 5.79 0.16 6.12 0.02 -1.26 -1.68 114.94 124.08 2qaj s ASN 2 Ca 0.00 -0.92 0.09 0.00 -1.02 0.00 0.00 52.86 51.01 2qaj s ASN 2 Cb 0.00 -2.05 -0.04 0.00 0.02 0.00 0.00 41.25 39.18 2qaj s ASN 2 CO 0.00 -0.38 -0.21 -0.76 0.02 0.00 0.00 177.10 175.77 2qaj s LEU 3 N 1.58 2.39 -0.04 0.60 1.43 -0.32 -0.39 118.68 123.93 2qaj s LEU 3 Ca 0.03 -0.81 0.03 0.00 -1.03 0.00 0.00 54.13 52.35 2qaj s LEU 3 Cb -0.19 -0.97 0.00 0.00 0.03 0.00 0.00 46.19 45.06 2qaj s LEU 3 CO 0.07 0.05 -0.13 -0.69 0.23 0.00 0.00 176.35 175.88 2qaj s VAL 4 N -1.65 1.12 -0.16 -1.59 1.01 -0.71 -0.89 120.40 117.52 2qaj s VAL 4 Ca 0.15 -0.52 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 2qaj s VAL 4 Cb -0.08 -0.99 -0.01 0.00 0.00 0.00 0.00 36.38 35.30 2qaj s VAL 4 CO 0.07 0.34 -0.09 -0.76 0.00 0.00 0.00 175.10 174.66 2qaj s LEU 5 N 0.29 2.83 0.14 3.92 1.02 0.98 0.23 118.68 128.09 2qaj s LEU 5 Ca -0.07 -0.33 0.04 0.00 0.02 0.00 0.00 54.13 53.80 2qaj s LEU 5 Cb -0.12 -1.67 -0.04 0.00 0.02 0.00 0.00 46.19 44.38 2qaj s LEU 5 CO 0.02 0.10 -0.10 0.00 0.02 0.00 0.00 176.35 176.39 2qaj s MET 6 N 0.74 1.05 0.00 1.70 0.23 -0.32 -2.59 119.30 120.11 2qaj s MET 6 Ca -0.04 -1.43 0.00 0.00 -1.03 0.00 0.00 55.69 53.19 2qaj s MET 6 Cb -0.15 -0.63 0.00 0.00 -1.53 0.00 0.00 34.83 32.52 2qaj s MET 6 CO 0.02 0.08 0.00 0.41 -2.03 0.00 0.00 175.02 173.50 2qaj n GLY 7 N -0.13 2.51 3.75 3.16 0.00 -1.26 -1.22 105.19 112.00 2qaj n GLY 7 Ca -0.11 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 44.87 2qaj n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qaj s LEU 8 N 0.00 3.07 -0.22 0.99 1.43 -1.26 -4.82 118.68 117.86 2qaj s LEU 8 Ca 0.00 1.94 -0.41 0.00 -1.03 0.00 0.00 54.13 54.63 2qaj s LEU 8 Cb 0.00 -4.54 -0.17 0.00 0.03 0.00 0.00 46.19 41.51 2qaj s LEU 8 CO 0.00 -2.17 1.59 -2.65 0.23 0.00 0.00 176.35 173.35 2qaj n PRO 9 N -3.43 0.85 -0.67 1.29 -0.02 -1.26 -0.85 135.00 130.91 2qaj n PRO 9 Ca 0.10 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2qaj n PRO 9 Cb 0.53 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 2qaj n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qaj n GLY 10 N 3.62 0.80 0.31 -1.23 0.00 -1.26 -4.86 105.19 102.57 2qaj n GLY 10 Ca 0.25 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.47 2qaj n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qaj h ALA 11 N 0.00 1.05 0.00 4.61 0.00 -1.32 -3.46 119.26 120.15 2qaj h ALA 11 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qaj h ALA 11 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qaj h ALA 11 CO 0.00 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.68 2qaj n GLY 12 N -0.68 1.73 0.15 0.00 0.00 -1.26 -4.92 105.19 100.20 2qaj n GLY 12 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 2qaj n GLY 12 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qaj h LYS 13 N 0.00 0.26 -0.50 1.61 1.57 -1.92 -0.97 116.57 116.61 2qaj h LYS 13 Ca 0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2qaj h LYS 13 Cb 0.00 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 2qaj h LYS 13 CO 0.00 0.17 0.22 0.78 -0.57 0.00 0.00 179.45 180.05 2qaj h GLY 14 N 0.27 0.79 0.97 3.86 0.00 -1.98 0.33 103.07 107.32 2qaj h GLY 14 Ca 0.16 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2qaj h GLY 14 CO -0.16 0.39 -0.01 -0.84 0.00 0.00 0.00 176.54 175.92 2qaj h THR 15 N 0.67 0.98 -0.43 4.70 2.02 -1.89 -1.31 112.91 117.65 2qaj h THR 15 Ca 0.17 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.20 2qaj h THR 15 Cb 0.16 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2qaj h THR 15 CO -0.02 0.00 -0.31 1.56 0.37 0.00 0.00 175.52 177.12 2qaj h GLN 16 N -0.01 0.98 -0.57 6.66 1.08 -1.10 -3.10 115.11 119.04 2qaj h GLN 16 Ca 0.01 -0.47 0.03 0.00 -1.45 0.00 0.00 58.65 56.77 2qaj h GLN 16 Cb 0.02 -0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.41 2qaj h GLN 16 CO -0.01 1.14 0.38 0.78 -0.95 0.00 0.00 178.83 180.16 2qaj h GLY 17 N 0.82 0.75 1.28 3.46 0.00 -0.08 -1.59 103.07 107.70 2qaj h GLY 17 Ca 0.08 -0.26 0.02 0.00 0.00 0.00 0.00 47.33 47.17 2qaj h GLY 17 CO 0.08 0.23 0.44 -2.09 0.00 0.00 0.00 176.54 175.21 2qaj h GLU 18 N 0.66 0.83 -0.04 4.80 4.81 -1.16 -1.92 114.58 122.56 2qaj h GLU 18 Ca 0.23 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.35 2qaj h GLU 18 Cb 0.09 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.28 2qaj h GLU 18 CO -0.06 0.55 -0.19 0.00 -0.73 0.00 0.00 179.01 178.57 2qaj h ARG 19 N 0.85 0.20 -0.22 1.92 2.47 -1.37 -2.95 114.38 115.28 2qaj h ARG 19 Ca 0.26 -0.16 0.06 0.00 -1.26 0.00 0.00 59.98 58.87 2qaj h ARG 19 Cb -0.02 0.03 -0.06 0.00 -1.65 0.00 0.00 29.97 28.28 2qaj h ARG 19 CO -0.06 0.82 -0.18 0.82 0.56 0.00 0.00 179.97 181.93 2qaj h ILE 20 N -0.37 0.52 -0.06 2.04 2.04 -1.17 -0.35 117.51 120.16 2qaj h ILE 20 Ca -0.01 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 2qaj h ILE 20 Cb 0.85 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2qaj h ILE 20 CO 0.04 0.00 -0.04 -0.37 0.00 0.00 0.00 178.15 177.78 2qaj h VAL 21 N -0.18 1.07 -0.19 1.67 -1.51 -1.45 0.84 116.25 116.50 2qaj h VAL 21 Ca 0.13 -0.29 -0.11 0.00 -1.23 0.00 0.00 66.70 65.20 2qaj h VAL 21 Cb 0.37 1.07 0.00 0.00 -2.13 0.00 0.00 31.29 30.60 2qaj h VAL 21 CO -0.33 0.09 -0.33 -0.08 -1.23 0.00 0.00 177.57 175.69 2qaj h GLU 22 N 0.08 0.56 0.00 5.19 4.81 -1.02 0.22 114.58 124.42 2qaj h GLU 22 Ca 0.02 -0.35 -0.07 0.00 -0.13 0.00 0.00 59.36 58.84 2qaj h GLU 22 Cb 0.13 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 2qaj h GLU 22 CO 0.01 0.96 -0.32 -0.44 -0.73 0.00 0.00 179.01 178.48 2qaj h ASP 23 N 0.22 0.00 0.00 1.04 3.32 -0.67 -3.39 116.42 116.94 2qaj h ASP 23 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2qaj h ASP 23 Cb 0.92 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.47 2qaj h ASP 23 CO 0.07 0.32 -0.10 -1.22 -1.72 0.00 0.00 179.24 176.60 2qaj n TYR 24 N -3.18 0.00 -1.52 4.55 4.02 0.25 -5.04 117.16 116.23 2qaj n TYR 24 Ca 0.03 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.78 2qaj n TYR 24 Cb 0.66 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.93 2qaj n TYR 24 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qaj n GLY 25 N 0.98 1.21 3.86 2.72 0.00 0.77 -5.01 105.19 109.73 2qaj n GLY 25 Ca 0.00 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 2qaj n GLY 25 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qaj s ILE 26 N -2.53 4.86 0.28 -0.61 -4.36 -1.26 -5.02 121.20 112.56 2qaj s ILE 26 Ca 0.00 0.62 -0.30 0.00 -0.26 0.00 0.00 60.65 60.71 2qaj s ILE 26 Cb 0.00 -3.63 -0.11 0.00 1.25 0.00 0.00 42.46 39.97 2qaj s ILE 26 CO 0.00 -0.06 1.55 -2.84 0.24 0.00 0.00 174.94 173.84 2qaj s PRO 27 N -2.75 4.16 -0.33 0.37 0.02 -1.26 -4.64 135.00 130.57 2qaj s PRO 27 Ca 0.48 2.50 -0.19 0.00 0.02 0.00 0.00 61.00 63.81 2qaj s PRO 27 Cb -0.11 -3.05 -0.01 0.00 0.02 0.00 0.00 34.50 31.35 2qaj s PRO 27 CO 0.20 -0.58 0.58 -1.58 -0.33 0.00 0.00 177.00 175.29 2qaj s HIS 28 N 0.01 3.19 -0.43 6.54 2.46 -1.26 -0.83 115.29 124.98 2qaj s HIS 28 Ca 0.62 0.41 -0.02 0.00 0.47 0.00 0.00 55.06 56.54 2qaj s HIS 28 Cb -0.46 -2.97 0.11 0.00 -0.13 0.00 0.00 32.58 29.13 2qaj s HIS 28 CO 0.46 -0.51 0.21 0.42 -2.47 0.00 0.00 174.74 172.86 2qaj s ILE 29 N 2.53 3.17 -0.28 0.89 1.01 0.18 -4.97 121.20 123.73 2qaj s ILE 29 Ca 0.22 -2.23 -0.08 0.00 0.00 0.00 0.00 60.65 58.57 2qaj s ILE 29 Cb -0.15 -3.18 -0.01 0.00 0.01 0.00 0.00 42.46 39.13 2qaj s ILE 29 CO 0.13 -0.70 0.09 -0.55 0.00 0.00 0.00 174.94 173.90 2qaj s SER 30 N 1.52 5.18 0.31 3.58 0.15 -1.26 0.74 113.70 123.92 2qaj s SER 30 Ca 0.10 -0.44 0.02 0.00 0.70 0.00 0.00 55.95 56.33 2qaj s SER 30 Cb -0.22 -1.92 0.50 0.00 -1.71 0.00 0.00 66.02 62.67 2qaj s SER 30 CO -0.05 -0.12 1.82 0.71 1.20 0.00 0.00 173.24 176.81 2qaj h THR 31 N 5.68 1.22 -0.45 6.45 1.35 -1.82 -0.93 112.91 124.41 2qaj h THR 31 Ca -0.35 -0.90 -0.00 0.00 -0.55 0.00 0.00 66.41 64.60 2qaj h THR 31 Cb 1.15 0.97 -0.02 0.00 -1.73 0.00 0.00 68.15 68.52 2qaj h THR 31 CO 0.60 0.31 0.27 1.23 -0.25 0.00 0.00 175.52 177.68 2qaj h GLY 32 N 0.90 0.65 1.03 5.82 0.00 -1.90 0.22 103.07 109.79 2qaj h GLY 32 Ca 0.11 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.11 2qaj h GLY 32 CO 0.02 0.26 0.13 -0.55 0.00 0.00 0.00 176.54 176.40 2qaj h ASP 33 N 0.60 0.95 -0.69 0.19 3.32 -1.83 -1.43 116.42 117.53 2qaj h ASP 33 Ca 0.16 -0.24 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 2qaj h ASP 33 Cb -0.01 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.26 2qaj h ASP 33 CO -0.03 0.95 0.31 0.24 -1.72 0.00 0.00 179.24 178.99 2qaj h MET 34 N 0.91 1.00 -0.32 3.56 2.86 -0.80 0.19 114.93 122.33 2qaj h MET 34 Ca 0.19 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.64 2qaj h MET 34 Cb 0.39 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 2qaj h MET 34 CO 0.01 0.81 0.06 0.74 1.06 0.00 0.00 176.91 179.58 2qaj h PHE 35 N 0.96 0.56 -0.10 -0.22 0.05 -0.77 -2.24 116.94 115.18 2qaj h PHE 35 Ca 0.23 -0.07 -0.09 0.00 3.82 0.00 0.00 57.97 61.86 2qaj h PHE 35 Cb 0.15 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 37.93 2qaj h PHE 35 CO 0.01 0.60 -0.36 0.00 -0.18 0.00 0.00 178.31 178.38 2qaj h ARG 36 N 0.37 0.21 -0.56 1.51 3.08 -1.00 -0.23 114.38 117.75 2qaj h ARG 36 Ca 0.10 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 59.98 2qaj h ARG 36 Cb 0.33 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 2qaj h ARG 36 CO 0.00 0.55 0.03 0.00 -1.07 0.00 0.00 179.97 179.48 2qaj h ALA 37 N 1.45 1.00 -0.47 0.04 0.00 -0.84 -1.26 119.26 119.18 2qaj h ALA 37 Ca 0.02 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 2qaj h ALA 37 Cb 0.73 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2qaj h ALA 37 CO 0.05 0.62 -0.17 0.00 0.00 0.00 0.00 179.25 179.76 2qaj h ALA 38 N 1.15 0.65 -0.52 0.00 0.00 -0.86 -2.69 119.26 116.99 2qaj h ALA 38 Ca 0.17 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2qaj h ALA 38 Cb 0.47 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2qaj h ALA 38 CO 0.02 0.60 0.32 0.52 0.00 0.00 0.00 179.25 180.71 2qaj h MET 39 N 0.79 0.70 -0.51 0.00 2.07 -0.67 0.96 114.93 118.29 2qaj h MET 39 Ca 0.11 -0.06 0.00 0.00 -2.07 0.00 0.00 59.70 57.69 2qaj h MET 39 Cb 0.74 -0.15 -0.02 0.00 -1.87 0.00 0.00 31.60 30.29 2qaj h MET 39 CO 0.06 0.50 0.33 0.87 1.07 0.00 0.00 176.91 179.74 2qaj h LYS 40 N 0.70 0.67 0.00 1.72 1.57 -1.15 -2.08 116.57 118.00 2qaj h LYS 40 Ca 0.19 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2qaj h LYS 40 Cb -0.03 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.13 2qaj h LYS 40 CO -0.04 0.45 0.00 0.39 -0.57 0.00 0.00 179.45 179.68 2qaj n GLU 41 N -4.73 0.24 -3.05 3.15 1.02 -1.02 -4.93 120.64 111.31 2qaj n GLU 41 Ca 0.02 0.30 -0.15 0.00 -0.02 0.00 0.00 57.16 57.31 2qaj n GLU 41 Cb 0.02 -1.83 0.04 0.00 -0.02 0.00 0.00 31.44 29.65 2qaj n GLU 41 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2qaj n GLU 42 N -2.25 -4.48 -1.58 3.49 1.02 0.28 -5.01 120.64 112.10 2qaj n GLU 42 Ca 0.04 0.56 -0.31 0.00 -0.02 0.00 0.00 57.16 57.43 2qaj n GLU 42 Cb 0.35 -4.72 0.06 0.00 -0.02 0.00 0.00 31.44 27.11 2qaj n GLU 42 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2qaj s THR 43 N -3.12 3.77 0.39 2.62 -4.23 -0.85 -4.80 115.64 109.42 2qaj s THR 43 Ca 0.32 0.57 0.10 0.00 -1.18 0.00 0.00 61.69 61.50 2qaj s THR 43 Cb -0.14 -3.33 0.32 0.00 1.34 0.00 0.00 72.50 70.69 2qaj s THR 43 CO 0.39 -0.75 1.95 -0.65 -0.54 0.00 0.00 174.62 175.02 2qaj h PRO 44 N -0.81 0.57 -0.42 3.99 0.11 -1.95 -0.32 132.00 133.18 2qaj h PRO 44 Ca -0.45 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 2qaj h PRO 44 Cb 1.23 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2qaj h PRO 44 CO 0.58 0.38 0.15 1.25 -0.21 0.00 0.00 178.00 180.15 2qaj h LEU 45 N 0.59 0.59 -0.34 2.35 5.85 -1.92 -2.32 115.31 120.11 2qaj h LEU 45 Ca 0.32 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.87 2qaj h LEU 45 Cb 0.48 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 2qaj h LEU 45 CO -0.11 0.62 0.22 1.23 -0.34 0.00 0.00 178.44 180.06 2qaj h GLY 46 N 0.53 0.48 1.13 3.75 0.00 -1.27 -0.98 103.07 106.72 2qaj h GLY 46 Ca 0.14 -0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 2qaj h GLY 46 CO -0.01 0.16 0.29 1.41 0.00 0.00 0.00 176.54 178.40 2qaj h LEU 47 N 0.45 1.02 -0.28 3.11 3.38 -1.20 0.49 115.31 122.27 2qaj h LEU 47 Ca 0.13 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2qaj h LEU 47 Cb -0.04 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 2qaj h LEU 47 CO -0.04 0.91 -0.12 -0.08 0.09 0.00 0.00 178.44 179.20 2qaj h GLU 48 N 1.08 0.59 -0.14 1.13 4.81 -1.20 -3.15 114.58 117.70 2qaj h GLU 48 Ca 0.25 -0.25 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 2qaj h GLU 48 Cb 0.21 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 2qaj h GLU 48 CO -0.02 0.82 -0.40 0.00 -0.73 0.00 0.00 179.01 178.68 2qaj h ALA 49 N 0.75 1.07 -0.64 2.92 0.00 -1.00 -3.28 119.26 119.08 2qaj h ALA 49 Ca 0.07 -0.41 0.13 0.00 0.00 0.00 0.00 54.91 54.70 2qaj h ALA 49 Cb 0.64 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.23 2qaj h ALA 49 CO 0.04 0.59 0.04 -0.22 0.00 0.00 0.00 179.25 179.71 2qaj h LYS 50 N 0.26 0.15 -0.87 0.00 3.64 -0.85 -1.13 116.57 117.77 2qaj h LYS 50 Ca 0.03 -0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.52 2qaj h LYS 50 Cb 0.82 -0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 32.52 2qaj h LYS 50 CO 0.06 0.10 0.49 1.03 -2.27 0.00 0.00 179.45 178.86 2qaj h SER 51 N 0.15 0.66 -0.00 4.20 0.87 -1.65 -0.07 113.55 117.71 2qaj h SER 51 Ca 0.34 0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.94 2qaj h SER 51 Cb 0.56 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2qaj h SER 51 CO -0.52 0.33 -0.10 1.88 -0.53 0.00 0.00 176.83 177.89 2qaj h TYR 52 N 0.75 0.10 -0.55 2.24 -1.99 -1.50 -3.27 116.97 112.75 2qaj h TYR 52 Ca 0.45 -0.05 0.05 0.00 2.00 0.00 0.00 58.73 61.17 2qaj h TYR 52 Cb 0.53 -0.01 -0.05 0.00 2.00 0.00 0.00 36.73 39.20 2qaj h TYR 52 CO -0.06 0.84 0.29 0.82 -0.00 0.00 0.00 178.16 180.04 2qaj h ILE 53 N -0.66 0.96 0.00 -2.88 2.04 -0.93 -1.27 117.51 114.77 2qaj h ILE 53 Ca -0.01 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 2qaj h ILE 53 Cb 0.86 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2qaj h ILE 53 CO 0.02 0.10 -0.05 0.44 0.00 0.00 0.00 178.15 178.66 2qaj h ASP 54 N 0.55 0.00 0.16 1.72 3.45 -1.14 -1.65 116.42 119.51 2qaj h ASP 54 Ca 0.24 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.70 2qaj h ASP 54 Cb 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.92 2qaj h ASP 54 CO -0.16 0.05 -0.54 0.29 -1.57 0.00 0.00 179.24 177.31 2qaj n LYS 55 N -3.73 0.59 -0.70 3.56 5.02 -0.64 -4.90 118.16 117.37 2qaj n LYS 55 Ca -0.02 -0.43 0.00 0.00 -2.02 0.00 0.00 58.31 55.84 2qaj n LYS 55 Cb 0.15 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 2qaj n LYS 55 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qaj n GLY 56 N 1.43 0.67 3.94 0.72 0.00 -0.62 -4.77 105.19 106.57 2qaj n GLY 56 Ca 0.08 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 2qaj n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qaj s GLU 57 N -0.30 3.22 0.25 1.61 2.02 -0.57 -3.93 118.70 121.00 2qaj s GLU 57 Ca 0.00 -0.32 -0.30 0.00 0.02 0.00 0.00 54.97 54.38 2qaj s GLU 57 Cb 0.00 -2.54 -0.09 0.00 0.10 0.00 0.00 34.13 31.60 2qaj s GLU 57 CO 0.00 -0.19 1.03 -0.51 0.02 0.00 0.00 175.26 175.61 2qaj s LEU 58 N -4.56 4.59 0.42 1.80 1.43 -1.26 -4.01 118.68 117.09 2qaj s LEU 58 Ca 0.47 2.11 -0.24 0.00 -1.03 0.00 0.00 54.13 55.44 2qaj s LEU 58 Cb -0.10 -3.62 -0.08 0.00 0.03 0.00 0.00 46.19 42.42 2qaj s LEU 58 CO 0.39 -0.02 1.11 -0.69 0.23 0.00 0.00 176.35 177.37 2qaj s VAL 59 N -1.07 3.40 0.44 -1.59 1.01 -1.26 -4.93 120.40 116.40 2qaj s VAL 59 Ca 0.43 1.09 -0.23 0.00 0.00 0.00 0.00 61.98 63.27 2qaj s VAL 59 Cb -0.29 -3.57 -0.11 0.00 0.00 0.00 0.00 36.38 32.42 2qaj s VAL 59 CO 0.37 0.02 0.80 -2.65 0.00 0.00 0.00 175.10 173.63 2qaj n PRO 60 N -0.19 0.95 0.13 2.72 -0.02 -1.26 -4.85 135.00 132.48 2qaj n PRO 60 Ca 0.06 0.34 -0.14 0.00 -2.02 0.00 0.00 63.50 61.74 2qaj n PRO 60 Cb 0.48 -1.82 -0.06 0.00 -0.02 0.00 0.00 33.50 32.08 2qaj n PRO 60 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2qaj h ASP 61 N 1.08 -1.01 -0.44 2.55 3.32 -1.99 -2.85 116.42 117.09 2qaj h ASP 61 Ca -0.43 0.11 0.08 0.00 0.02 0.00 0.00 57.03 56.82 2qaj h ASP 61 Cb 1.37 0.38 -0.10 0.00 0.22 0.00 0.00 39.33 41.20 2qaj h ASP 61 CO 0.54 -0.44 -0.32 -0.08 -1.72 0.00 0.00 179.24 177.22 2qaj h GLU 62 N -0.59 -0.22 -0.34 3.56 4.81 -1.99 0.19 114.58 120.00 2qaj h GLU 62 Ca 0.02 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.17 2qaj h GLU 62 Cb 0.61 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 2qaj h GLU 62 CO -0.19 -0.15 -0.22 -0.24 -0.73 0.00 0.00 179.01 177.48 2qaj h VAL 63 N -0.23 1.27 -0.12 0.32 3.04 -1.95 -1.31 116.25 117.26 2qaj h VAL 63 Ca 0.19 -1.28 -0.02 0.00 -1.01 0.00 0.00 66.70 64.58 2qaj h VAL 63 Cb 0.54 1.24 -0.00 0.00 -2.01 0.00 0.00 31.29 31.05 2qaj h VAL 63 CO -0.56 0.42 0.01 0.74 -1.01 0.00 0.00 177.57 177.17 2qaj h THR 64 N 0.58 1.23 -0.69 3.17 2.02 -1.09 -2.19 112.91 115.94 2qaj h THR 64 Ca 0.08 -0.73 0.03 0.00 0.77 0.00 0.00 66.41 66.56 2qaj h THR 64 Cb 0.68 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 68.54 2qaj h THR 64 CO 0.05 0.21 0.43 0.40 0.37 0.00 0.00 175.52 176.99 2qaj h ILE 65 N -0.04 1.09 -0.28 3.11 2.04 -0.62 -2.23 117.51 120.58 2qaj h ILE 65 Ca 0.04 -0.29 0.06 0.00 1.00 0.00 0.00 64.86 65.67 2qaj h ILE 65 Cb 0.32 0.17 -0.06 0.00 -0.74 0.00 0.00 36.82 36.50 2qaj h ILE 65 CO 0.00 0.16 -0.13 1.23 0.00 0.00 0.00 178.15 179.41 2qaj h GLY 66 N 0.85 0.11 2.00 5.37 0.00 -0.99 0.34 103.07 110.75 2qaj h GLY 66 Ca 0.28 0.16 -0.09 0.00 0.00 0.00 0.00 47.33 47.68 2qaj h GLY 66 CO -0.11 -0.15 -0.41 0.16 0.00 0.00 0.00 176.54 176.03 2qaj h ILE 67 N -0.09 1.05 -0.19 2.60 3.07 -1.16 -2.96 117.51 119.84 2qaj h ILE 67 Ca 0.15 -1.55 -0.19 0.00 1.55 0.00 0.00 64.86 64.81 2qaj h ILE 67 Cb 0.31 1.90 0.01 0.00 -0.27 0.00 0.00 36.82 38.76 2qaj h ILE 67 CO -0.34 0.41 -0.62 0.58 -1.05 0.00 0.00 178.15 177.13 2qaj h VAL 68 N 0.00 1.30 -0.62 0.16 2.07 -0.79 -2.46 116.25 115.92 2qaj h VAL 68 Ca -0.00 -1.83 0.06 0.00 0.82 0.00 0.00 66.70 65.74 2qaj h VAL 68 Cb 0.87 1.91 -0.06 0.00 -1.52 0.00 0.00 31.29 32.49 2qaj h VAL 68 CO 0.05 0.58 0.32 0.50 0.02 0.00 0.00 177.57 179.04 2qaj h LYS 69 N 0.47 0.57 -0.32 1.57 3.64 -0.87 -0.76 116.57 120.87 2qaj h LYS 69 Ca -0.02 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 2qaj h LYS 69 Cb 1.24 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 2qaj h LYS 69 CO 0.13 0.38 0.13 1.49 -2.27 0.00 0.00 179.45 179.30 2qaj h GLU 70 N 0.59 0.47 -0.54 1.90 4.57 -1.53 -3.13 114.58 116.90 2qaj h GLU 70 Ca 0.28 -0.09 -0.03 0.00 -1.18 0.00 0.00 59.36 58.35 2qaj h GLU 70 Cb 0.21 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 2qaj h GLU 70 CO -0.20 0.48 0.24 -0.09 -1.18 0.00 0.00 179.01 178.26 2qaj h ARG 71 N 0.36 0.79 0.00 1.92 9.65 -0.89 -2.49 114.38 123.73 2qaj h ARG 71 Ca 0.11 -0.13 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2qaj h ARG 71 Cb 0.19 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 2qaj h ARG 71 CO -0.01 0.68 0.00 1.28 2.80 0.00 0.00 179.97 184.72 2qaj n LEU 72 N -4.54 0.00 0.01 3.80 4.77 -0.35 -2.08 117.00 118.61 2qaj n LEU 72 Ca 0.03 0.46 0.12 0.00 -0.03 0.00 0.00 56.01 56.59 2qaj n LEU 72 Cb 0.14 -0.46 0.21 0.00 -2.33 0.00 0.00 43.42 40.98 2qaj n LEU 72 CO 0.38 -0.26 0.39 0.61 -1.33 0.00 0.00 177.39 177.18 2qaj n GLY 73 N -0.21 -1.28 3.71 -0.72 0.00 -0.94 -4.80 105.19 100.95 2qaj n GLY 73 Ca 0.04 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 2qaj n GLY 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qaj s LYS 74 N -3.05 1.71 0.33 1.61 -0.14 -0.88 -4.91 119.74 114.40 2qaj s LYS 74 Ca 0.09 1.65 0.02 0.00 -1.36 0.00 0.00 55.97 56.38 2qaj s LYS 74 Cb 0.16 -1.80 0.61 0.00 -1.68 0.00 0.00 37.83 35.13 2qaj s LYS 74 CO 0.71 -2.14 1.96 -0.44 -0.76 0.00 0.00 175.35 174.68 2qaj h ASP 75 N -0.96 0.79 0.02 2.83 3.32 -1.92 -2.45 116.42 118.06 2qaj h ASP 75 Ca -0.46 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 2qaj h ASP 75 Cb 1.28 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.66 2qaj h ASP 75 CO 0.47 0.53 0.00 -0.90 -1.72 0.00 0.00 179.24 177.62 2qaj n ASP 76 N -4.46 0.00 -1.17 6.45 3.85 -1.26 -1.80 116.55 118.16 2qaj n ASP 76 Ca 0.11 -0.23 0.11 0.00 -0.71 0.00 0.00 54.79 54.07 2qaj n ASP 76 Cb 0.15 -0.03 0.25 0.00 -1.35 0.00 0.00 41.12 40.14 2qaj n ASP 76 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2qaj h GLU 78 N 4.10 0.69 -0.62 0.00 4.57 -1.54 -2.00 114.58 119.78 2qaj h GLU 78 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2qaj h GLU 78 Cb 0.95 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.38 2qaj h GLU 78 CO 0.00 0.45 0.00 0.54 -1.18 0.00 0.00 179.01 178.82 2qaj n ARG 79 N -4.80 2.93 0.00 1.92 3.00 -1.26 -4.99 116.66 113.47 2qaj n ARG 79 Ca 0.13 -2.29 0.00 0.00 -0.01 0.00 0.00 57.85 55.68 2qaj n ARG 79 Cb 0.28 -1.67 0.00 0.00 0.00 0.00 0.00 32.46 31.07 2qaj n ARG 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qaj n GLY 80 N 1.18 0.88 3.72 -0.13 0.00 -0.75 -2.93 105.19 107.15 2qaj n GLY 80 Ca 0.21 -2.25 -0.08 0.00 0.00 0.00 0.00 46.02 43.89 2qaj n GLY 80 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qaj s PHE 81 N -0.97 -0.30 -0.35 1.61 -0.12 -0.68 -4.37 117.98 112.81 2qaj s PHE 81 Ca 0.00 -0.08 0.01 0.00 -0.05 0.00 0.00 56.93 56.81 2qaj s PHE 81 Cb 0.00 0.66 0.11 0.00 -0.63 0.00 0.00 43.02 43.16 2qaj s PHE 81 CO 0.00 -1.11 0.12 -1.17 -0.05 0.00 0.00 175.22 173.01 2qaj s LEU 82 N -2.87 2.90 0.08 -1.99 2.96 -0.01 -1.17 118.68 118.58 2qaj s LEU 82 Ca 0.08 -1.98 -0.30 0.00 -0.22 0.00 0.00 54.13 51.71 2qaj s LEU 82 Cb -0.04 -1.07 -0.05 0.00 0.50 0.00 0.00 46.19 45.52 2qaj s LEU 82 CO 0.01 -0.37 1.00 -0.76 -1.32 0.00 0.00 176.35 174.91 2qaj s LEU 83 N 1.17 4.45 -0.24 -0.68 1.43 -0.07 0.47 118.68 125.20 2qaj s LEU 83 Ca 0.12 1.80 0.00 0.00 -1.03 0.00 0.00 54.13 55.02 2qaj s LEU 83 Cb -0.19 -3.58 0.07 0.00 0.03 0.00 0.00 46.19 42.51 2qaj s LEU 83 CO -0.16 -0.18 -0.01 -0.62 0.23 0.00 0.00 176.35 175.61 2qaj s ASP 84 N 0.40 3.73 0.00 2.29 -1.08 0.23 -0.02 116.67 122.23 2qaj s ASP 84 Ca 0.50 -1.21 0.00 0.00 -0.52 0.00 0.00 52.55 51.32 2qaj s ASP 84 Cb -0.24 -1.05 0.00 0.00 -1.46 0.00 0.00 42.92 40.17 2qaj s ASP 84 CO 0.30 -0.28 0.00 0.61 0.52 0.00 0.00 175.17 176.32 2qaj n GLY 85 N 4.74 0.75 2.95 2.66 0.00 -1.07 -2.70 105.19 112.52 2qaj n GLY 85 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2qaj n GLY 85 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2qaj s PHE 86 N -2.43 -0.18 0.68 1.61 2.19 -1.26 -4.29 117.98 114.30 2qaj s PHE 86 Ca 0.00 0.50 -0.09 0.00 0.33 0.00 0.00 56.93 57.67 2qaj s PHE 86 Cb 0.00 -0.05 0.02 0.00 -1.31 0.00 0.00 43.02 41.68 2qaj s PHE 86 CO 0.00 -0.16 1.04 -1.25 1.83 0.00 0.00 175.22 176.67 2qaj s PRO 87 N 1.02 2.72 -0.00 10.12 0.04 -1.26 -4.70 135.00 142.94 2qaj s PRO 87 Ca -0.08 0.21 0.05 0.00 0.04 0.00 0.00 61.00 61.22 2qaj s PRO 87 Cb -0.10 -2.11 0.08 0.00 0.04 0.00 0.00 34.50 32.42 2qaj s PRO 87 CO -0.05 -1.00 1.03 2.89 0.04 0.00 0.00 177.00 179.91 2qaj n ARG 88 N -2.90 0.04 -3.75 4.56 1.85 -1.26 -4.96 116.66 110.25 2qaj n ARG 88 Ca 0.06 -1.22 -0.14 0.00 -1.00 0.00 0.00 57.85 55.56 2qaj n ARG 88 Cb 0.58 -0.44 -0.08 0.00 -1.05 0.00 0.00 32.46 31.47 2qaj n ARG 88 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2qaj s THR 89 N -0.08 0.05 0.29 8.89 -4.23 -1.26 -4.84 115.64 114.47 2qaj s THR 89 Ca 0.07 -0.45 -0.03 0.00 -1.18 0.00 0.00 61.69 60.10 2qaj s THR 89 Cb 0.08 -0.65 0.26 0.00 1.34 0.00 0.00 72.50 73.53 2qaj s THR 89 CO -0.03 -0.25 1.96 0.58 -0.54 0.00 0.00 174.62 176.34 2qaj h VAL 90 N 3.79 1.22 -0.99 2.29 2.07 -1.93 -1.62 116.25 121.08 2qaj h VAL 90 Ca -0.30 -0.40 0.02 0.00 0.82 0.00 0.00 66.70 66.84 2qaj h VAL 90 Cb 1.18 -0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 2qaj h VAL 90 CO 0.40 0.22 0.65 0.00 0.02 0.00 0.00 177.57 178.86 2qaj h ALA 91 N 1.46 1.32 -0.44 1.67 0.00 -1.99 0.10 119.26 121.38 2qaj h ALA 91 Ca 0.32 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.05 2qaj h ALA 91 Cb -0.13 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.26 2qaj h ALA 91 CO -0.07 0.62 -0.22 1.96 0.00 0.00 0.00 179.25 181.54 2qaj h GLN 92 N 1.31 0.88 -0.43 0.00 4.20 -1.73 -0.81 115.11 118.53 2qaj h GLN 92 Ca 0.37 -0.37 -0.05 0.00 0.06 0.00 0.00 58.65 58.66 2qaj h GLN 92 Cb -0.11 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 2qaj h GLN 92 CO -0.09 1.01 0.08 0.00 -0.67 0.00 0.00 178.83 179.16 2qaj h ALA 93 N 0.98 0.57 -0.69 3.87 0.00 -0.51 0.11 119.26 123.60 2qaj h ALA 93 Ca 0.10 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2qaj h ALA 93 Cb 0.76 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2qaj h ALA 93 CO 0.06 0.29 0.27 0.93 0.00 0.00 0.00 179.25 180.80 2qaj h GLU 94 N 0.57 1.03 -0.68 0.00 5.08 -0.70 -1.78 114.58 118.10 2qaj h GLU 94 Ca 0.13 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 2qaj h GLU 94 Cb 0.37 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2qaj h GLU 94 CO 0.01 0.86 0.17 0.00 -1.00 0.00 0.00 179.01 179.05 2qaj h ALA 95 N 1.12 0.90 -0.51 3.43 0.00 -0.82 -2.48 119.26 120.90 2qaj h ALA 95 Ca 0.23 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2qaj h ALA 95 Cb 0.22 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2qaj h ALA 95 CO -0.02 0.62 0.27 1.25 0.00 0.00 0.00 179.25 181.37 2qaj h LEU 96 N 1.02 0.62 -0.11 0.00 5.85 -0.39 -1.14 115.31 121.18 2qaj h LEU 96 Ca 0.22 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.91 2qaj h LEU 96 Cb 0.36 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 2qaj h LEU 96 CO 0.00 0.51 -0.04 -0.33 -0.34 0.00 0.00 178.44 178.25 2qaj h GLU 97 N 0.71 -0.02 0.24 1.25 4.39 -0.87 0.64 114.58 120.93 2qaj h GLU 97 Ca 0.18 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.87 2qaj h GLU 97 Cb 0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2qaj h GLU 97 CO -0.03 -0.01 -0.12 0.93 -1.16 0.00 0.00 179.01 178.62 2qaj h GLU 98 N -0.02 -0.31 -0.27 2.33 5.08 -1.27 -0.95 114.58 119.17 2qaj h GLU 98 Ca 0.06 0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.50 2qaj h GLU 98 Cb 0.10 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.35 2qaj h GLU 98 CO -0.12 -0.20 -0.24 0.82 -1.00 0.00 0.00 179.01 178.26 2qaj h ILE 99 N -0.33 0.38 0.00 3.13 2.04 -0.99 -0.81 117.51 120.93 2qaj h ILE 99 Ca -0.03 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 2qaj h ILE 99 Cb 0.26 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.71 2qaj h ILE 99 CO 0.05 0.00 -0.15 -0.07 0.00 0.00 0.00 178.15 177.98 2qaj h LEU 100 N -0.24 0.00 -0.44 1.44 3.38 -0.81 -1.86 115.31 116.79 2qaj h LEU 100 Ca 0.15 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.95 2qaj h LEU 100 Cb 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2qaj h LEU 100 CO -0.41 0.15 -0.54 -0.08 0.09 0.00 0.00 178.44 177.65 2qaj h GLU 101 N 0.00 0.68 -0.13 1.13 4.81 0.15 0.91 114.58 122.13 2qaj h GLU 101 Ca -0.00 -0.43 -0.15 0.00 -0.13 0.00 0.00 59.36 58.65 2qaj h GLU 101 Cb 0.55 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 2qaj h GLU 101 CO 0.02 1.05 -0.55 1.49 -0.73 0.00 0.00 179.01 180.29 2qaj h GLU 102 N 0.53 0.40 -0.00 1.92 4.57 -0.69 -2.98 114.58 118.33 2qaj h GLU 102 Ca 0.01 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.94 2qaj h GLU 102 Cb 1.11 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.73 2qaj h GLU 102 CO 0.11 0.85 -0.24 0.66 -1.18 0.00 0.00 179.01 179.21 2qaj n TYR 103 N -3.93 0.00 -3.24 0.92 4.01 -0.75 -4.94 117.16 109.22 2qaj n TYR 103 Ca -0.03 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.55 2qaj n TYR 103 Cb 0.59 -0.34 0.06 0.00 -0.31 0.00 0.00 39.34 39.35 2qaj n TYR 103 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qaj n GLY 104 N 1.47 -0.16 2.51 2.72 0.00 -0.04 -5.00 105.19 106.69 2qaj n GLY 104 Ca 0.07 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 2qaj n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qaj s LYS 105 N -5.70 0.66 0.55 1.61 1.02 0.11 -5.04 119.74 112.94 2qaj s LYS 105 Ca 0.31 -1.41 -0.18 0.00 0.02 0.00 0.00 55.97 54.71 2qaj s LYS 105 Cb -0.14 -1.47 -0.06 0.00 -0.52 0.00 0.00 37.83 35.65 2qaj s LYS 105 CO 0.54 -1.20 1.06 -1.25 -0.92 0.00 0.00 175.35 173.59 2qaj s PRO 106 N 0.99 3.51 0.01 -1.68 0.04 -1.26 -4.69 135.00 131.92 2qaj s PRO 106 Ca 0.18 1.32 -0.30 0.00 0.04 0.00 0.00 61.00 62.23 2qaj s PRO 106 Cb -0.23 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.21 2qaj s PRO 106 CO -0.00 -0.67 1.18 0.42 0.04 0.00 0.00 177.00 177.96 2qaj s ILE 107 N -2.18 4.20 -0.05 0.56 1.01 -1.26 -4.64 121.20 118.84 2qaj s ILE 107 Ca 0.66 1.57 -0.18 0.00 0.00 0.00 0.00 60.65 62.70 2qaj s ILE 107 Cb -0.17 -4.00 -0.31 0.00 0.01 0.00 0.00 42.46 37.98 2qaj s ILE 107 CO 0.29 0.08 0.80 0.44 0.00 0.00 0.00 174.94 176.55 2qaj h ASP 108 N 7.04 0.55 -4.22 3.58 3.32 -1.11 -3.48 116.42 122.10 2qaj h ASP 108 Ca -0.39 -0.92 -0.11 0.00 0.02 0.00 0.00 57.03 55.63 2qaj h ASP 108 Cb 1.20 -0.18 -0.22 0.00 0.22 0.00 0.00 39.33 40.34 2qaj h ASP 108 CO 0.83 1.57 -0.18 -0.31 -1.72 0.00 0.00 179.24 179.43 2qaj s TYR 109 N -2.50 -0.44 -0.31 4.55 2.02 -1.19 -4.85 117.35 114.63 2qaj s TYR 109 Ca -0.15 0.99 -0.06 0.00 -0.37 0.00 0.00 57.07 57.49 2qaj s TYR 109 Cb 0.03 0.17 0.03 0.00 -0.40 0.00 0.00 41.96 41.79 2qaj s TYR 109 CO 0.84 -0.30 0.07 0.08 -1.57 0.00 0.00 175.55 174.68 2qaj s VAL 110 N -0.22 3.72 -0.37 0.71 1.01 -0.39 -1.74 120.40 123.12 2qaj s VAL 110 Ca -0.04 -0.99 -0.15 0.00 0.00 0.00 0.00 61.98 60.81 2qaj s VAL 110 Cb -0.03 -3.02 -0.00 0.00 0.00 0.00 0.00 36.38 33.32 2qaj s VAL 110 CO 0.02 -0.05 0.34 -0.63 0.00 0.00 0.00 175.10 174.78 2qaj s ILE 111 N 1.42 5.20 -0.36 2.22 1.01 0.14 -0.51 121.20 130.31 2qaj s ILE 111 Ca -0.00 -0.23 -0.17 0.00 0.00 0.00 0.00 60.65 60.25 2qaj s ILE 111 Cb -0.18 -3.86 -0.00 0.00 0.01 0.00 0.00 42.46 38.42 2qaj s ILE 111 CO 0.02 -0.18 0.44 0.21 0.00 0.00 0.00 174.94 175.43 2qaj s ASN 112 N 1.74 6.24 -0.81 3.58 2.47 -0.16 -1.18 114.94 126.82 2qaj s ASN 112 Ca 0.09 -0.21 -0.21 0.00 0.42 0.00 0.00 52.86 52.95 2qaj s ASN 112 Cb -0.17 -2.23 0.10 0.00 -1.45 0.00 0.00 41.25 37.49 2qaj s ASN 112 CO 0.11 -0.45 1.07 -0.63 -3.72 0.00 0.00 177.10 173.49 2qaj s ILE 113 N 2.22 4.51 -0.17 -5.21 1.01 -0.35 -1.22 121.20 121.98 2qaj s ILE 113 Ca 0.15 -1.01 -0.29 0.00 0.00 0.00 0.00 60.65 59.50 2qaj s ILE 113 Cb -0.16 -4.75 -0.01 0.00 0.01 0.00 0.00 42.46 37.55 2qaj s ILE 113 CO 0.13 -1.51 1.15 -0.70 0.00 0.00 0.00 174.94 174.02 2qaj s GLU 114 N 3.40 4.27 -0.03 2.79 2.12 -0.50 -4.54 118.70 126.21 2qaj s GLU 114 Ca 0.29 1.53 -0.01 0.00 0.36 0.00 0.00 54.97 57.14 2qaj s GLU 114 Cb -0.10 -3.68 0.03 0.00 0.26 0.00 0.00 34.13 30.64 2qaj s GLU 114 CO -0.01 -0.62 0.06 0.08 -0.54 0.00 0.00 175.26 174.23 2qaj s VAL 115 N 3.13 -0.04 0.16 3.70 1.01 -1.26 -1.08 120.40 126.02 2qaj s VAL 115 Ca 0.50 0.16 -0.33 0.00 0.00 0.00 0.00 61.98 62.31 2qaj s VAL 115 Cb -0.19 -0.11 -0.13 0.00 0.00 0.00 0.00 36.38 35.94 2qaj s VAL 115 CO 0.13 0.07 1.63 -0.67 0.00 0.00 0.00 175.10 176.25 2qaj n ASP 116 N 3.95 3.31 -0.07 3.32 -0.08 -1.26 -4.85 116.55 120.87 2qaj n ASP 116 Ca -0.24 1.07 0.23 0.00 -1.51 0.00 0.00 54.79 54.34 2qaj n ASP 116 Cb 0.52 -1.46 0.70 0.00 2.34 0.00 0.00 41.12 43.23 2qaj n ASP 116 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 2qaj h LYS 117 N 6.32 0.01 0.00 -0.67 2.10 -2.00 -2.21 116.57 120.12 2qaj h LYS 117 Ca -0.45 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 2qaj h LYS 117 Cb 1.24 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 2qaj h LYS 117 CO 0.91 0.01 0.00 -0.44 -2.00 0.00 0.00 179.45 177.92 2qaj h ASP 118 N 0.01 0.00 -0.16 7.07 3.45 -2.03 -2.62 116.42 122.14 2qaj h ASP 118 Ca 0.32 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.78 2qaj h ASP 118 Cb 1.26 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.03 2qaj h ASP 118 CO -0.01 0.00 0.00 1.33 -1.57 0.00 0.00 179.24 178.99 2qaj n VAL 119 N -3.07 0.47 0.11 -1.35 0.24 -0.83 -4.58 118.33 109.32 2qaj n VAL 119 Ca -0.02 -0.74 -0.03 0.00 -2.04 0.00 0.00 64.34 61.51 2qaj n VAL 119 Cb 0.11 0.88 0.04 0.00 -1.47 0.00 0.00 33.84 33.40 2qaj n VAL 119 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2qaj h LEU 120 N 1.97 0.00 -0.47 1.34 3.38 -1.55 -2.96 115.31 117.02 2qaj h LEU 120 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2qaj h LEU 120 Cb 0.57 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2qaj h LEU 120 CO 0.00 0.76 0.21 -0.03 0.09 0.00 0.00 178.44 179.48 2qaj h MET 121 N 0.00 0.69 -0.72 1.13 4.05 -1.81 -1.92 114.93 116.35 2qaj h MET 121 Ca -0.01 -0.11 -0.04 0.00 -0.28 0.00 0.00 59.70 59.26 2qaj h MET 121 Cb 1.41 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 32.06 2qaj h MET 121 CO 0.10 0.60 0.29 1.49 0.23 0.00 0.00 176.91 179.62 2qaj h GLU 122 N 0.62 1.07 -0.78 0.39 4.57 -1.86 -1.41 114.58 117.17 2qaj h GLU 122 Ca 0.16 -0.19 -0.03 0.00 -1.18 0.00 0.00 59.36 58.12 2qaj h GLU 122 Cb 0.15 -0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 28.53 2qaj h GLU 122 CO -0.02 0.88 0.39 0.00 -1.18 0.00 0.00 179.01 179.07 2qaj h ARG 123 N 1.02 1.11 0.05 1.92 3.08 -1.32 -2.51 114.38 117.73 2qaj h ARG 123 Ca 0.24 -0.16 -0.08 0.00 0.07 0.00 0.00 59.98 60.06 2qaj h ARG 123 Cb 0.20 -0.20 0.01 0.00 0.08 0.00 0.00 29.97 30.06 2qaj h ARG 123 CO -0.02 0.85 -0.33 -0.07 -1.07 0.00 0.00 179.97 179.34 2qaj h LEU 124 N 1.09 0.21 -2.07 3.04 3.38 -1.17 -2.86 115.31 116.94 2qaj h LEU 124 Ca 0.27 -0.94 -0.02 0.00 0.09 0.00 0.00 57.88 57.28 2qaj h LEU 124 Cb 0.10 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2qaj h LEU 124 CO -0.04 1.13 -0.09 0.71 0.09 0.00 0.00 178.44 180.24 2qaj h THR 125 N -0.68 0.61 -0.20 0.22 1.35 -1.33 -1.34 112.91 111.53 2qaj h THR 125 Ca -0.05 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 2qaj h THR 125 Cb 1.22 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 2qaj h THR 125 CO 0.06 0.08 0.00 0.61 -0.25 0.00 0.00 175.52 176.03 2qaj n GLY 126 N -0.93 0.75 3.76 5.82 0.00 -0.95 -4.93 105.19 108.72 2qaj n GLY 126 Ca -0.02 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 2qaj n GLY 126 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qaj s ARG 127 N -1.76 4.75 -0.02 1.61 3.52 -0.51 -1.44 118.95 125.10 2qaj s ARG 127 Ca 0.34 1.42 0.02 0.00 -0.13 0.00 0.00 55.73 57.38 2qaj s ARG 127 Cb 0.20 -3.09 0.01 0.00 -1.56 0.00 0.00 34.95 30.50 2qaj s ARG 127 CO 0.29 0.43 -0.06 1.03 -0.81 0.00 0.00 175.30 176.18 2qaj s ARG 128 N -1.52 0.66 0.05 5.12 1.81 -0.55 -4.70 118.95 119.83 2qaj s ARG 128 Ca 0.44 -0.19 0.08 0.00 -1.72 0.00 0.00 55.73 54.35 2qaj s ARG 128 Cb -0.23 -0.66 -0.03 0.00 -0.45 0.00 0.00 34.95 33.58 2qaj s ARG 128 CO 0.29 0.06 -0.23 0.42 -0.68 0.00 0.00 175.30 175.16 2qaj s ILE 129 N 0.25 2.39 -0.08 1.52 1.01 0.46 -0.09 121.20 126.66 2qaj s ILE 129 Ca -0.03 -1.32 -0.30 0.00 0.00 0.00 0.00 60.65 59.00 2qaj s ILE 129 Cb -0.07 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 2qaj s ILE 129 CO -0.00 0.35 1.48 0.00 0.00 0.00 0.00 174.94 176.77 2qaj h SER 131 N 8.75 0.00 0.01 0.00 4.64 -1.51 -0.94 113.55 124.50 2qaj h SER 131 Ca -0.35 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.55 2qaj h SER 131 Cb 1.16 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.18 2qaj h SER 131 CO 0.95 0.00 -2.41 0.52 -0.87 0.00 0.00 176.83 175.01 2qaj n VAL 132 N -2.37 1.53 0.38 0.95 0.31 -1.26 -4.78 118.33 113.10 2qaj n VAL 132 Ca 0.01 -0.45 0.06 0.00 -0.01 0.00 0.00 64.34 63.96 2qaj n VAL 132 Cb 0.21 -1.71 -0.08 0.00 -0.91 0.00 0.00 33.84 31.34 2qaj n VAL 132 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qaj n GLY 134 N 1.46 2.91 3.74 0.00 0.00 -0.36 -4.99 105.19 107.95 2qaj n GLY 134 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2qaj n GLY 134 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2qaj s THR 135 N -1.90 2.05 0.07 2.61 -1.32 -1.26 -4.50 115.64 111.39 2qaj s THR 135 Ca 0.00 0.03 0.05 0.00 -1.21 0.00 0.00 61.69 60.56 2qaj s THR 135 Cb 0.00 -3.02 -0.04 0.00 -1.51 0.00 0.00 72.50 67.94 2qaj s THR 135 CO 0.00 -0.00 -0.04 0.42 -2.21 0.00 0.00 174.62 172.78 2qaj s THR 136 N -1.35 3.76 0.32 5.08 -4.23 -1.26 -1.08 115.64 116.89 2qaj s THR 136 Ca 0.77 -1.01 0.04 0.00 -1.18 0.00 0.00 61.69 60.31 2qaj s THR 136 Cb -0.39 -2.75 -0.06 0.00 1.34 0.00 0.00 72.50 70.63 2qaj s THR 136 CO 0.44 0.18 0.04 -0.31 -0.54 0.00 0.00 174.62 174.43 2qaj s TYR 137 N -1.21 2.00 -0.04 3.99 2.02 0.88 -4.99 117.35 120.00 2qaj s TYR 137 Ca 0.23 -0.90 0.01 0.00 -0.37 0.00 0.00 57.07 56.03 2qaj s TYR 137 Cb -0.11 -1.30 0.03 0.00 -0.40 0.00 0.00 41.96 40.17 2qaj s TYR 137 CO 0.15 0.08 -0.01 -1.58 -1.57 0.00 0.00 175.55 172.61 2qaj s HIS 138 N -3.22 0.47 0.47 2.71 5.65 0.51 -1.48 115.29 120.40 2qaj s HIS 138 Ca 0.35 -0.07 0.29 0.00 0.25 0.00 0.00 55.06 55.88 2qaj s HIS 138 Cb 0.08 -0.51 1.36 0.00 -1.18 0.00 0.00 32.58 32.34 2qaj s HIS 138 CO 0.15 -0.16 1.75 -0.07 -0.65 0.00 0.00 174.74 175.76 2qaj h LEU 139 N 7.27 0.22 0.00 8.88 3.38 -1.52 -0.24 115.31 133.30 2qaj h LEU 139 Ca -0.40 0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.49 2qaj h LEU 139 Cb 1.14 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 2qaj h LEU 139 CO 0.46 0.00 -1.22 0.52 0.09 0.00 0.00 178.44 178.30 2qaj n VAL 140 N -4.43 1.11 0.15 1.22 0.31 -1.26 -4.55 118.33 110.89 2qaj n VAL 140 Ca 0.28 0.02 0.02 0.00 -0.01 0.00 0.00 64.34 64.65 2qaj n VAL 140 Cb 1.17 -1.86 0.19 0.00 -0.91 0.00 0.00 33.84 32.43 2qaj n VAL 140 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2qaj h PHE 141 N -0.55 0.00 -0.49 3.52 0.04 -1.96 -3.39 116.94 114.10 2qaj h PHE 141 Ca -0.20 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.27 2qaj h PHE 141 Cb 0.95 0.00 -0.20 0.00 2.20 0.00 0.00 35.95 38.90 2qaj h PHE 141 CO -0.14 0.52 -0.64 -1.71 -0.60 0.00 0.00 178.31 175.74 2qaj n ASN 142 N -3.51 -2.01 -4.81 2.17 5.15 -0.96 -4.94 115.26 106.36 2qaj n ASN 142 Ca 0.00 -3.25 -0.33 0.00 -0.60 0.00 0.00 54.58 50.40 2qaj n ASN 142 Cb 0.62 1.25 -0.02 0.00 -0.53 0.00 0.00 39.78 41.10 2qaj n ASN 142 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2qaj s PRO 143 N 0.08 3.64 0.52 1.20 0.04 -0.14 -0.36 135.00 139.97 2qaj s PRO 143 Ca 0.31 1.24 -0.19 0.00 0.04 0.00 0.00 61.00 62.41 2qaj s PRO 143 Cb 0.24 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.63 2qaj s PRO 143 CO -0.18 -0.55 1.04 -1.25 0.04 0.00 0.00 177.00 176.10 2qaj s PRO 144 N -3.68 3.68 0.25 0.56 0.04 -1.26 -4.92 135.00 129.68 2qaj s PRO 144 Ca 0.65 1.26 -0.04 0.00 0.04 0.00 0.00 61.00 62.91 2qaj s PRO 144 Cb -0.15 -2.08 0.37 0.00 0.04 0.00 0.00 34.50 32.68 2qaj s PRO 144 CO 0.28 -0.52 1.87 0.87 0.04 0.00 0.00 177.00 179.54 2qaj h LYS 145 N 1.16 1.07 -4.95 4.56 1.57 -1.96 -3.36 116.57 114.67 2qaj h LYS 145 Ca -0.48 -0.06 -0.67 0.00 -1.87 0.00 0.00 60.65 57.56 2qaj h LYS 145 Cb 1.22 -0.24 -0.34 0.00 0.08 0.00 0.00 32.23 32.95 2qaj h LYS 145 CO 0.59 0.71 -0.79 0.99 -0.57 0.00 0.00 179.45 180.37 2qaj s THR 146 N -6.05 2.47 0.26 -0.16 2.01 -1.26 -5.09 115.64 107.82 2qaj s THR 146 Ca -0.13 -1.13 -0.29 0.00 0.31 0.00 0.00 61.69 60.45 2qaj s THR 146 Cb 0.19 -2.24 -0.14 0.00 0.01 0.00 0.00 72.50 70.32 2qaj s THR 146 CO 0.80 0.26 1.09 -0.81 -0.69 0.00 0.00 174.62 175.27 2qaj n PRO 147 N 4.60 1.38 -0.54 4.92 -0.04 -1.26 -2.03 135.00 142.03 2qaj n PRO 147 Ca -0.17 0.49 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 2qaj n PRO 147 Cb 0.47 -1.92 0.00 0.00 -0.04 0.00 0.00 33.50 32.01 2qaj n PRO 147 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qaj n GLY 148 N 1.50 1.63 3.01 0.55 0.00 -1.26 -5.01 105.19 105.60 2qaj n GLY 148 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 2qaj n GLY 148 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qaj s ILE 149 N -3.43 0.37 0.24 -0.61 -4.36 -0.86 -1.09 121.20 111.46 2qaj s ILE 149 Ca 0.00 -0.80 -0.30 0.00 -0.26 0.00 0.00 60.65 59.30 2qaj s ILE 149 Cb 0.00 -0.43 -0.09 0.00 1.25 0.00 0.00 42.46 43.19 2qaj s ILE 149 CO 0.00 -0.29 1.22 0.00 0.24 0.00 0.00 174.94 176.11 2qaj h ASP 151 N 4.60 0.39 0.00 0.00 5.19 -1.92 -1.78 116.42 122.91 2qaj h ASP 151 Ca -0.46 -0.06 -0.00 0.00 -0.62 0.00 0.00 57.03 55.89 2qaj h ASP 151 Cb 1.22 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.62 2qaj h ASP 151 CO 0.72 0.45 -0.00 0.11 -3.12 0.00 0.00 179.24 177.40 2qaj h LYS 152 N 0.42 -0.00 -0.00 3.56 1.57 -1.98 -3.42 116.57 116.71 2qaj h LYS 152 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2qaj h LYS 152 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2qaj h LYS 152 CO 0.01 0.96 -0.00 -0.40 -0.57 0.00 0.00 179.45 179.44 2qaj n ASP 153 N -4.63 0.97 0.00 0.86 5.68 -1.25 -5.01 116.55 113.18 2qaj n ASP 153 Ca -0.10 -0.98 0.00 0.00 -0.50 0.00 0.00 54.79 53.21 2qaj n ASP 153 Cb 0.46 0.06 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 2qaj n ASP 153 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qaj n GLY 154 N 0.08 0.53 3.78 6.12 0.00 -0.67 -4.98 105.19 110.05 2qaj n GLY 154 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2qaj n GLY 154 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qaj s GLY 155 N -2.00 2.25 0.31 -0.02 0.00 -1.26 -4.55 107.32 102.05 2qaj s GLY 155 Ca 0.00 0.55 -0.28 0.00 0.00 0.00 0.00 44.72 44.98 2qaj s GLY 155 CO 0.00 0.89 1.16 -0.54 0.00 0.00 0.00 173.10 174.61 2qaj s GLU 156 N -3.90 4.47 0.15 2.90 2.02 -1.26 -0.35 118.70 122.73 2qaj s GLU 156 Ca 0.67 1.91 -0.09 0.00 0.02 0.00 0.00 54.97 57.47 2qaj s GLU 156 Cb -0.19 -3.07 -0.06 0.00 0.10 0.00 0.00 34.13 30.90 2qaj s GLU 156 CO 0.36 0.03 0.46 -0.51 0.02 0.00 0.00 175.26 175.62 2qaj s LEU 157 N -1.72 4.27 0.31 1.80 1.43 -0.25 -1.35 118.68 123.18 2qaj s LEU 157 Ca 0.48 0.82 0.03 0.00 -1.03 0.00 0.00 54.13 54.43 2qaj s LEU 157 Cb -0.33 -3.32 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 2qaj s LEU 157 CO 0.43 0.06 0.15 -0.72 0.23 0.00 0.00 176.35 176.50 2qaj s TYR 158 N -1.60 1.63 -0.19 0.29 1.13 0.54 -4.86 117.35 114.29 2qaj s TYR 158 Ca 0.40 -1.33 -0.02 0.00 -1.41 0.00 0.00 57.07 54.71 2qaj s TYR 158 Cb -0.13 -0.90 -0.00 0.00 -1.10 0.00 0.00 41.96 39.83 2qaj s TYR 158 CO 0.21 -0.47 -0.10 -1.14 -2.51 0.00 0.00 175.55 171.54 2qaj s GLN 159 N -3.83 3.29 0.32 -3.49 0.74 -1.26 -0.40 119.66 115.02 2qaj s GLN 159 Ca 0.35 -0.69 -0.29 0.00 0.05 0.00 0.00 55.36 54.78 2qaj s GLN 159 Cb 0.05 -2.82 -0.12 0.00 1.10 0.00 0.00 33.01 31.22 2qaj s GLN 159 CO 0.17 -0.10 1.40 -2.13 -0.55 0.00 0.00 175.29 174.08 2qaj n ARG 160 N 4.45 2.30 0.09 1.67 0.63 -1.26 -4.86 116.66 119.69 2qaj n ARG 160 Ca -0.19 0.81 0.19 0.00 -0.92 0.00 0.00 57.85 57.74 2qaj n ARG 160 Cb 0.51 -2.47 0.74 0.00 0.45 0.00 0.00 32.46 31.69 2qaj n ARG 160 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2qaj h ALA 161 N 3.36 2.20 -0.24 5.13 0.00 -2.01 0.36 119.26 128.07 2qaj h ALA 161 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2qaj h ALA 161 Cb 1.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2qaj h ALA 161 CO 0.68 -0.51 0.00 -0.40 0.00 0.00 0.00 179.25 179.02 2qaj n ASP 162 N -4.10 2.45 -2.15 0.00 5.75 -1.26 -4.49 116.55 112.74 2qaj n ASP 162 Ca 0.06 -1.83 -0.22 0.00 -0.01 0.00 0.00 54.79 52.79 2qaj n ASP 162 Cb 0.50 -0.15 0.01 0.00 -1.03 0.00 0.00 41.12 40.44 2qaj n ASP 162 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2qaj n ASP 163 N 0.84 6.58 -4.51 -1.12 8.00 0.12 -3.73 116.55 122.73 2qaj n ASP 163 Ca 0.17 -3.18 -0.27 0.00 0.71 0.00 0.00 54.79 52.23 2qaj n ASP 163 Cb 0.46 -1.12 -0.10 0.00 -0.02 0.00 0.00 41.12 40.34 2qaj n ASP 163 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2qaj s ASN 164 N 0.08 3.91 0.16 -2.24 4.22 -1.26 -4.22 114.94 115.59 2qaj s ASN 164 Ca 0.44 -0.70 -0.17 0.00 -2.14 0.00 0.00 52.86 50.29 2qaj s ASN 164 Cb 0.32 -0.53 0.11 0.00 1.28 0.00 0.00 41.25 42.43 2qaj s ASN 164 CO -0.09 0.11 1.20 1.21 -2.04 0.00 0.00 177.10 177.49 2qaj n GLU 165 N 0.13 -0.23 0.15 3.55 2.13 -1.26 -0.53 120.64 124.58 2qaj n GLU 165 Ca -0.11 1.18 -0.14 0.00 0.66 0.00 0.00 57.16 58.75 2qaj n GLU 165 Cb 0.56 -1.75 -0.08 0.00 0.27 0.00 0.00 31.44 30.44 2qaj n GLU 165 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2qaj h GLU 166 N 0.00 -0.32 -0.28 5.31 4.81 -1.97 -0.62 114.58 121.52 2qaj h GLU 166 Ca 0.22 0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.36 2qaj h GLU 166 Cb 0.41 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 2qaj h GLU 166 CO -0.75 -0.16 -0.31 1.15 -0.73 0.00 0.00 179.01 178.20 2qaj h THR 167 N -0.40 1.28 -0.55 0.32 2.02 -1.71 -1.62 112.91 112.26 2qaj h THR 167 Ca -0.03 -1.42 -0.02 0.00 0.77 0.00 0.00 66.41 65.71 2qaj h THR 167 Cb 0.30 1.41 -0.03 0.00 -1.74 0.00 0.00 68.15 68.10 2qaj h THR 167 CO 0.06 0.45 0.27 0.58 0.37 0.00 0.00 175.52 177.25 2qaj h VAL 168 N 0.50 1.20 -0.43 3.16 2.07 -0.75 0.71 116.25 122.70 2qaj h VAL 168 Ca 0.06 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 67.04 2qaj h VAL 168 Cb 0.79 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 2qaj h VAL 168 CO 0.06 0.22 0.27 -1.28 0.02 0.00 0.00 177.57 176.86 2qaj h SER 169 N 0.73 0.51 -0.55 0.57 0.87 -0.75 -0.22 113.55 114.71 2qaj h SER 169 Ca 0.19 -0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2qaj h SER 169 Cb 0.10 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 2qaj h SER 169 CO -0.03 0.40 0.33 0.50 -0.53 0.00 0.00 176.83 177.50 2qaj h LYS 170 N 0.58 0.75 -0.95 2.24 1.63 -0.93 -0.64 116.57 119.25 2qaj h LYS 170 Ca 0.16 -0.07 0.04 0.00 -0.85 0.00 0.00 60.65 59.93 2qaj h LYS 170 Cb -0.03 -0.16 -0.06 0.00 -0.60 0.00 0.00 32.23 31.39 2qaj h LYS 170 CO -0.03 0.55 0.62 0.00 -3.45 0.00 0.00 179.45 177.13 2qaj h ARG 171 N 0.74 1.15 -0.38 1.90 3.08 -0.27 0.16 114.38 120.77 2qaj h ARG 171 Ca 0.20 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.10 2qaj h ARG 171 Cb -0.01 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.77 2qaj h ARG 171 CO -0.04 0.76 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.49 2qaj h LEU 172 N 1.19 0.71 0.16 3.04 3.38 -0.56 -1.55 115.31 121.68 2qaj h LEU 172 Ca 0.38 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2qaj h LEU 172 Cb 0.02 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2qaj h LEU 172 CO -0.13 0.89 -0.08 -0.08 0.09 0.00 0.00 178.44 179.14 2qaj h GLU 173 N 0.52 -0.20 -0.37 1.13 4.81 -0.40 0.11 114.58 120.18 2qaj h GLU 173 Ca 0.10 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2qaj h GLU 173 Cb 0.56 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 2qaj h GLU 173 CO 0.03 -0.13 0.24 0.28 -0.73 0.00 0.00 179.01 178.70 2qaj h VAL 174 N -0.22 1.10 0.00 0.32 2.07 -0.67 -3.11 116.25 115.74 2qaj h VAL 174 Ca -0.02 -0.19 -0.16 0.00 0.82 0.00 0.00 66.70 67.15 2qaj h VAL 174 Cb 0.17 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2qaj h VAL 174 CO 0.04 0.10 -0.78 0.78 0.02 0.00 0.00 177.57 177.72 2qaj h ASN 175 N 0.50 0.00 -0.61 0.57 4.21 -1.22 -3.28 115.58 115.74 2qaj h ASN 175 Ca 0.13 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.62 2qaj h ASN 175 Cb -0.05 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.12 2qaj h ASN 175 CO -0.03 0.78 0.29 0.24 -1.29 0.00 0.00 177.43 177.42 2qaj h MET 176 N 0.00 0.91 0.00 0.81 2.86 -0.72 -1.52 114.93 117.28 2qaj h MET 176 Ca -0.01 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 2qaj h MET 176 Cb 1.56 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 33.06 2qaj h MET 176 CO 0.10 0.72 0.00 0.36 1.06 0.00 0.00 176.91 179.15 2qaj n LYS 177 N -4.34 0.73 -0.00 1.72 2.85 -1.18 -2.46 118.16 115.47 2qaj n LYS 177 Ca 0.06 0.01 0.05 0.00 -1.05 0.00 0.00 58.31 57.37 2qaj n LYS 177 Cb 0.14 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 32.95 2qaj n LYS 177 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 2qaj n GLN 178 N -1.02 0.98 0.15 -1.58 1.13 -0.65 -4.82 117.38 111.57 2qaj n GLN 178 Ca 0.18 -0.07 -0.08 0.00 -1.94 0.00 0.00 57.00 55.08 2qaj n GLN 178 Cb 0.09 -1.19 -0.04 0.00 0.11 0.00 0.00 30.24 29.21 2qaj n GLN 178 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 2qaj h THR 179 N 0.00 0.00 -0.98 5.09 2.02 -1.02 -2.93 112.91 115.09 2qaj h THR 179 Ca 0.00 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.28 2qaj h THR 179 Cb 0.42 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.75 2qaj h THR 179 CO 0.00 0.00 0.62 -0.61 0.37 0.00 0.00 175.52 175.90 2qaj h GLN 180 N -0.47 1.02 -0.61 6.66 5.75 -1.88 -1.38 115.11 124.20 2qaj h GLN 180 Ca -0.03 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.37 2qaj h GLN 180 Cb 0.39 -0.23 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 2qaj h GLN 180 CO -0.00 0.67 0.26 -1.00 -2.65 0.00 0.00 178.83 176.11 2qaj h PRO 181 N 1.05 0.87 -0.35 -2.39 0.13 -1.88 0.21 132.00 129.64 2qaj h PRO 181 Ca 0.46 -0.13 -0.07 0.00 -0.87 0.00 0.00 66.00 65.39 2qaj h PRO 181 Cb 0.34 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.31 2qaj h PRO 181 CO -0.23 0.70 -0.05 -0.07 -0.23 0.00 0.00 178.00 178.13 2qaj h LEU 182 N 0.86 0.65 -0.40 1.56 3.38 -1.16 0.24 115.31 120.45 2qaj h LEU 182 Ca 0.21 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2qaj h LEU 182 Cb 0.15 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2qaj h LEU 182 CO -0.02 0.85 0.25 -0.07 0.09 0.00 0.00 178.44 179.53 2qaj h LEU 183 N 0.45 0.48 -0.76 1.67 3.38 -0.78 -1.12 115.31 118.63 2qaj h LEU 183 Ca 0.09 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 2qaj h LEU 183 Cb 0.54 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 2qaj h LEU 183 CO 0.03 0.39 0.21 0.44 0.09 0.00 0.00 178.44 179.59 2qaj h ASP 184 N 0.53 1.07 0.19 -0.43 3.32 -0.43 0.24 116.42 120.92 2qaj h ASP 184 Ca 0.15 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2qaj h ASP 184 Cb -0.01 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 2qaj h ASP 184 CO -0.03 1.00 -0.17 0.15 -1.72 0.00 0.00 179.24 178.48 2qaj h PHE 185 N 1.09 -0.45 0.00 4.55 3.04 0.04 -1.62 116.94 123.59 2qaj h PHE 185 Ca 0.23 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.18 2qaj h PHE 185 Cb 0.33 0.17 -0.00 0.00 2.56 0.00 0.00 35.95 39.01 2qaj h PHE 185 CO 0.03 -0.26 -0.01 1.88 -2.02 0.00 0.00 178.31 177.93 2qaj h TYR 186 N -0.38 0.00 -0.35 0.41 0.05 -1.11 -2.42 116.97 113.17 2qaj h TYR 186 Ca -0.00 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.64 2qaj h TYR 186 Cb 0.35 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.08 2qaj h TYR 186 CO -0.13 0.01 -0.34 1.03 -1.05 0.00 0.00 178.16 177.68 2qaj h SER 187 N 0.00 0.82 -0.29 3.88 0.87 -0.28 -1.76 113.55 116.78 2qaj h SER 187 Ca -0.00 -0.35 -0.16 0.00 -1.23 0.00 0.00 61.79 60.06 2qaj h SER 187 Cb 0.91 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 2qaj h SER 187 CO 0.00 1.08 -0.41 -0.08 -0.53 0.00 0.00 176.83 176.90 2qaj h GLU 188 N 0.65 0.85 -0.60 2.24 4.22 -1.16 -2.90 114.58 117.88 2qaj h GLU 188 Ca 0.07 -0.45 0.00 0.00 0.08 0.00 0.00 59.36 59.05 2qaj h GLU 188 Cb 0.88 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 2qaj h GLU 188 CO 0.08 1.09 0.37 0.87 -2.18 0.00 0.00 179.01 179.24 2qaj h LYS 189 N 0.69 0.80 0.00 1.92 1.79 -1.19 -3.47 116.57 117.11 2qaj h LYS 189 Ca 0.05 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2qaj h LYS 189 Cb 0.98 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.46 2qaj h LYS 189 CO 0.09 0.55 0.00 0.41 -1.08 0.00 0.00 179.45 179.43 2qaj n GLY 190 N -1.38 1.12 1.87 3.86 0.00 -0.68 -5.00 105.19 104.97 2qaj n GLY 190 Ca 0.06 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.09 2qaj n GLY 190 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2qaj n TYR 191 N -1.52 0.54 -3.09 1.61 4.11 -1.16 -5.06 117.16 112.59 2qaj n TYR 191 Ca 0.00 -1.19 -0.39 0.00 -0.00 0.00 0.00 57.90 56.31 2qaj n TYR 191 Cb 0.00 -0.19 -0.05 0.00 -0.00 0.00 0.00 39.34 39.10 2qaj n TYR 191 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.86 175.69 2qaj s LEU 192 N -1.67 4.39 -0.15 -3.48 2.96 -1.21 -1.26 118.68 118.25 2qaj s LEU 192 Ca 0.33 1.24 0.00 0.00 -0.22 0.00 0.00 54.13 55.48 2qaj s LEU 192 Cb 0.37 -3.06 0.03 0.00 0.50 0.00 0.00 46.19 44.03 2qaj s LEU 192 CO -0.11 -0.00 -0.10 0.00 -1.32 0.00 0.00 176.35 174.82 2qaj s ALA 193 N 0.23 1.64 -0.05 5.97 0.00 0.33 -4.92 121.76 124.96 2qaj s ALA 193 Ca 0.35 -0.82 -0.20 0.00 0.00 0.00 0.00 51.96 51.29 2qaj s ALA 193 Cb -0.19 -1.06 -0.05 0.00 0.00 0.00 0.00 23.12 21.83 2qaj s ALA 193 CO 0.19 -0.54 0.55 -0.80 0.00 0.00 0.00 175.76 175.16 2qaj s ASN 194 N 1.57 6.86 -0.04 0.00 0.01 -1.26 -0.98 114.94 121.09 2qaj s ASN 194 Ca 0.03 1.03 0.04 0.00 -0.71 0.00 0.00 52.86 53.25 2qaj s ASN 194 Cb -0.14 -2.33 -0.00 0.00 0.41 0.00 0.00 41.25 39.19 2qaj s ASN 194 CO -0.09 0.06 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.70 2qaj s VAL 195 N 0.15 1.38 -0.40 1.60 1.01 -0.36 -4.95 120.40 118.84 2qaj s VAL 195 Ca 0.29 -0.69 -0.29 0.00 0.00 0.00 0.00 61.98 61.30 2qaj s VAL 195 Cb -0.17 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 35.03 2qaj s VAL 195 CO 0.15 0.40 1.46 0.21 0.00 0.00 0.00 175.10 177.32 2qaj s ASN 196 N 0.07 6.28 0.00 3.32 2.47 -1.26 -1.42 114.94 124.40 2qaj s ASN 196 Ca -0.04 0.90 0.27 0.00 0.42 0.00 0.00 52.86 54.40 2qaj s ASN 196 Cb -0.11 -2.54 1.00 0.00 -1.45 0.00 0.00 41.25 38.14 2qaj s ASN 196 CO 0.02 -1.47 1.71 0.61 -3.72 0.00 0.00 177.10 174.25 2qaj n GLY 197 N 5.12 0.06 3.11 1.21 0.00 -0.24 -4.57 105.19 109.89 2qaj n GLY 197 Ca 0.17 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 2qaj n GLY 197 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qaj n GLN 198 N 0.21 3.72 -2.40 1.61 6.02 -1.25 -4.92 117.38 120.37 2qaj n GLN 198 Ca 0.19 -4.52 -0.02 0.00 -0.01 0.00 0.00 57.00 52.64 2qaj n GLN 198 Cb 0.35 -2.49 0.01 0.00 1.02 0.00 0.00 30.24 29.13 2qaj n GLN 198 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2qaj n ARG 199 N 1.96 0.37 -1.96 -1.09 1.74 -1.26 -5.13 116.66 111.29 2qaj n ARG 199 Ca 0.25 -0.78 -0.40 0.00 -0.77 0.00 0.00 57.85 56.14 2qaj n ARG 199 Cb 0.36 1.02 -0.00 0.00 -1.02 0.00 0.00 32.46 32.83 2qaj n ARG 199 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2qaj s ASP 200 N -2.02 6.29 0.24 0.55 1.01 -1.26 -4.80 116.67 116.68 2qaj s ASP 200 Ca 0.09 2.79 -0.09 0.00 0.71 0.00 0.00 52.55 56.05 2qaj s ASP 200 Cb -0.02 -2.65 0.37 0.00 1.01 0.00 0.00 42.92 41.64 2qaj s ASP 200 CO 0.04 -0.88 1.62 0.40 0.21 0.00 0.00 175.17 176.55 2qaj h ILE 201 N 2.61 0.28 0.00 0.77 2.04 -1.97 0.42 117.51 121.66 2qaj h ILE 201 Ca -0.50 -0.01 -0.08 0.00 1.00 0.00 0.00 64.86 65.27 2qaj h ILE 201 Cb 1.25 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 2qaj h ILE 201 CO 0.63 0.01 -0.37 1.56 0.00 0.00 0.00 178.15 179.98 2qaj h GLN 202 N 0.04 0.00 0.00 2.37 1.08 -1.99 -2.26 115.11 114.34 2qaj h GLN 202 Ca 0.39 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.47 2qaj h GLN 202 Cb 0.64 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.06 2qaj h GLN 202 CO -0.73 0.37 -0.54 -0.44 -0.95 0.00 0.00 178.83 176.53 2qaj h ASP 203 N 0.00 0.00 -0.04 1.46 3.32 -1.33 -1.94 116.42 117.89 2qaj h ASP 203 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2qaj h ASP 203 Cb 0.73 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.28 2qaj h ASP 203 CO 0.05 0.54 -0.05 0.58 -1.72 0.00 0.00 179.24 178.64 2qaj h VAL 204 N 0.00 1.40 -0.46 -1.35 2.07 -0.81 -3.18 116.25 113.92 2qaj h VAL 204 Ca -0.01 -1.27 0.03 0.00 0.82 0.00 0.00 66.70 66.27 2qaj h VAL 204 Cb 1.20 2.17 -0.02 0.00 -1.52 0.00 0.00 31.29 33.11 2qaj h VAL 204 CO 0.07 0.34 0.31 0.22 0.02 0.00 0.00 177.57 178.53 2qaj h TYR 205 N -0.38 0.49 -0.90 1.57 3.20 -1.34 -1.84 116.97 117.77 2qaj h TYR 205 Ca 0.00 0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.96 2qaj h TYR 205 Cb 0.58 -0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.62 2qaj h TYR 205 CO 0.10 0.29 0.56 0.00 -1.64 0.00 0.00 178.16 177.47 2qaj h ALA 206 N 1.73 1.26 -0.07 1.82 0.00 -1.33 0.57 119.26 123.24 2qaj h ALA 206 Ca 0.18 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 2qaj h ALA 206 Cb 0.10 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2qaj h ALA 206 CO -0.05 0.29 -0.40 -0.44 0.00 0.00 0.00 179.25 178.65 2qaj h ASP 207 N 0.99 0.17 -0.12 0.00 3.45 -1.39 -2.33 116.42 117.20 2qaj h ASP 207 Ca 0.40 -0.07 -0.17 0.00 0.43 0.00 0.00 57.03 57.63 2qaj h ASP 207 Cb 0.22 -0.05 0.01 0.00 -0.56 0.00 0.00 39.33 38.96 2qaj h ASP 207 CO -0.19 0.56 -0.58 0.58 -1.57 0.00 0.00 179.24 178.04 2qaj h VAL 208 N 0.14 1.34 -0.33 -1.35 2.07 -0.67 -3.23 116.25 114.22 2qaj h VAL 208 Ca 0.01 -1.87 -0.02 0.00 0.82 0.00 0.00 66.70 65.65 2qaj h VAL 208 Cb 0.78 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 32.67 2qaj h VAL 208 CO 0.06 0.57 0.13 0.50 0.02 0.00 0.00 177.57 178.85 2qaj h LYS 209 N 0.24 0.46 -0.80 1.57 3.64 0.25 -2.47 116.57 119.45 2qaj h LYS 209 Ca -0.04 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.34 2qaj h LYS 209 Cb 1.22 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.90 2qaj h LYS 209 CO 0.12 0.39 0.53 -0.44 -2.27 0.00 0.00 179.45 177.78 2qaj h ASP 210 N 0.47 0.79 0.04 4.20 3.45 -1.44 -1.12 116.42 122.81 2qaj h ASP 210 Ca 0.12 0.00 -0.21 0.00 0.43 0.00 0.00 57.03 57.36 2qaj h ASP 210 Cb 0.10 -0.17 0.02 0.00 -0.56 0.00 0.00 39.33 38.72 2qaj h ASP 210 CO -0.01 0.52 -0.87 -0.07 -1.57 0.00 0.00 179.24 177.24 2qaj h LEU 211 N 0.90 0.69 -1.41 1.55 3.38 -1.56 -3.33 115.31 115.53 2qaj h LEU 211 Ca 0.34 -0.79 -0.06 0.00 0.09 0.00 0.00 57.88 57.46 2qaj h LEU 211 Cb 0.19 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2qaj h LEU 211 CO -0.12 1.40 -0.26 -0.07 0.09 0.00 0.00 178.44 179.49 2qaj h LEU 212 N 0.06 0.06 -1.10 1.67 4.07 -1.10 -2.79 115.31 116.18 2qaj h LEU 212 Ca -0.12 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.82 2qaj h LEU 212 Cb 1.57 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 43.29 2qaj h LEU 212 CO 0.17 0.32 0.00 -0.62 -1.08 0.00 0.00 178.44 177.23 2qaj n GLU 213 N -4.21 0.14 -0.95 1.13 1.02 -0.46 -1.06 120.64 116.24 2qaj n GLU 213 Ca -0.02 0.56 -0.05 0.00 -0.02 0.00 0.00 57.16 57.64 2qaj n GLU 213 Cb 0.32 -1.89 0.29 0.00 -0.02 0.00 0.00 31.44 30.15 2qaj n GLU 213 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qaj n GLY 214 N -0.96 3.44 2.42 0.62 0.00 -1.05 -4.63 105.19 105.03 2qaj n GLY 214 Ca -0.00 -0.91 -0.28 0.00 0.00 0.00 0.00 46.02 44.83 2qaj n GLY 214 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qaj s LEU 215 N -2.74 1.19 0.00 0.99 1.43 -0.22 -5.15 118.68 114.18 2qaj s LEU 215 Ca 0.51 -2.67 0.07 0.00 -1.03 0.00 0.00 54.13 51.01 2qaj s LEU 215 Cb 0.41 -0.40 0.06 0.00 0.03 0.00 0.00 46.19 46.28 2qaj s LEU 215 CO 0.13 -0.23 0.73 0.29 0.23 0.00 0.00 176.35 177.49