#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qan n ARG 2 N 0.00 -2.85 -3.64 0.54 3.00 -1.26 -5.06 116.66 107.39 2qan n ARG 2 Ca 0.00 2.23 -0.20 0.00 -0.01 0.00 0.00 57.85 59.87 2qan n ARG 2 Cb 0.00 -2.18 -0.17 0.00 0.00 0.00 0.00 32.46 30.11 2qan n ARG 2 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2qan s SER 3 N -0.46 1.31 0.00 0.55 0.01 -1.26 -4.94 113.70 108.90 2qan s SER 3 Ca 0.00 -0.02 0.06 0.00 1.31 0.00 0.00 55.95 57.30 2qan s SER 3 Cb 0.00 -0.00 0.10 0.00 0.21 0.00 0.00 66.02 66.33 2qan s SER 3 CO 0.00 -0.28 0.93 -0.11 0.41 0.00 0.00 173.24 174.19 2qan n LEU 4 N 5.30 0.11 0.00 2.44 0.00 -1.26 -5.09 117.00 118.51 2qan n LEU 4 Ca -0.04 -1.36 0.00 0.00 0.00 0.00 0.00 56.01 54.60 2qan n LEU 4 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.92 2qan n LEU 4 CO 0.07 0.64 0.00 0.29 0.00 0.00 0.00 177.39 178.38 2qan n LYS 5 N 0.12 0.00 -3.92 1.96 4.01 -1.26 -3.89 118.16 115.17 2qan n LYS 5 Ca -0.02 0.00 -0.30 0.00 -0.51 0.00 0.00 58.31 57.48 2qan n LYS 5 Cb 0.76 0.00 -0.16 0.00 -0.51 0.00 0.00 35.03 35.12 2qan n LYS 5 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2qan s LYS 6 N 0.00 1.56 0.00 1.97 -0.14 -1.26 -4.99 119.74 116.88 2qan s LYS 6 Ca 0.00 -0.86 0.00 0.00 -1.36 0.00 0.00 55.97 53.75 2qan s LYS 6 Cb 0.00 -2.45 0.00 0.00 -1.68 0.00 0.00 37.83 33.70 2qan s LYS 6 CO 0.00 -0.56 0.00 0.41 -0.76 0.00 0.00 175.35 174.44 2qan n GLY 7 N 4.73 1.15 3.55 -3.33 0.00 -1.25 -5.04 105.19 104.99 2qan n GLY 7 Ca -0.12 -0.30 -0.37 0.00 0.00 0.00 0.00 46.02 45.23 2qan n GLY 7 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qan n PRO 8 N 0.00 0.97 -2.91 1.61 -0.02 -1.26 -4.92 135.00 128.46 2qan n PRO 8 Ca 0.00 0.02 -0.35 0.00 -2.02 0.00 0.00 63.50 61.15 2qan n PRO 8 Cb 0.00 -3.24 -0.07 0.00 -0.02 0.00 0.00 33.50 30.18 2qan n PRO 8 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2qan s PHE 9 N 11.73 3.49 0.29 6.00 2.19 -1.26 -4.94 117.98 135.48 2qan s PHE 9 Ca 1.02 1.55 -0.15 0.00 0.33 0.00 0.00 56.93 59.69 2qan s PHE 9 Cb -0.30 -2.77 0.01 0.00 -1.31 0.00 0.00 43.02 38.65 2qan s PHE 9 CO 0.29 0.09 0.61 0.96 1.83 0.00 0.00 175.22 179.00 2qan s ILE 10 N -1.87 0.00 0.10 3.12 -4.36 -1.26 -2.72 121.20 114.21 2qan s ILE 10 Ca 0.54 -1.23 -0.16 0.00 -0.26 0.00 0.00 60.65 59.54 2qan s ILE 10 Cb -0.13 -2.32 -0.07 0.00 1.25 0.00 0.00 42.46 41.19 2qan s ILE 10 CO 0.18 0.00 0.53 -1.81 0.24 0.00 0.00 174.94 174.09 2qan s ASP 11 N -3.02 6.89 0.33 4.36 1.11 -1.26 -4.98 116.67 120.10 2qan s ASP 11 Ca 0.19 1.11 0.04 0.00 0.18 0.00 0.00 52.55 54.07 2qan s ASP 11 Cb -0.03 -2.30 0.65 0.00 1.07 0.00 0.00 42.92 42.31 2qan s ASP 11 CO 0.10 0.18 1.92 0.25 1.18 0.00 0.00 175.17 178.81 2qan h LEU 12 N 3.99 0.78 -0.00 1.23 6.46 -2.01 -3.08 115.31 122.68 2qan h LEU 12 Ca -0.49 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.28 2qan h LEU 12 Cb 1.20 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.97 2qan h LEU 12 CO 0.65 0.48 -0.05 0.45 -0.62 0.00 0.00 178.44 179.35 2qan h HIS 13 N 0.87 -0.14 -0.95 1.25 -0.00 -2.00 -1.94 115.15 112.24 2qan h HIS 13 Ca 0.37 0.00 0.21 0.00 -0.00 0.00 0.00 60.37 60.96 2qan h HIS 13 Cb 0.31 0.06 -0.08 0.00 -0.00 0.00 0.00 27.41 27.70 2qan h HIS 13 CO -0.00 -0.05 0.62 1.37 -0.00 0.00 0.00 177.93 179.87 2qan h LEU 14 N -0.06 0.48 0.54 2.43 -0.00 -1.97 -1.97 115.31 114.76 2qan h LEU 14 Ca 0.00 0.06 -0.03 0.00 -0.00 0.00 0.00 57.88 57.91 2qan h LEU 14 Cb 0.06 -0.03 0.01 0.00 -0.00 0.00 0.00 40.66 40.70 2qan h LEU 14 CO -0.03 0.17 -0.26 0.25 -0.00 0.00 0.00 178.44 178.57 2qan h LEU 15 N 0.47 -0.61 -1.47 0.17 6.46 -1.35 1.00 115.31 119.98 2qan h LEU 15 Ca 0.52 0.02 0.16 0.00 -0.12 0.00 0.00 57.88 58.45 2qan h LEU 15 Cb 1.19 0.16 -0.06 0.00 -0.73 0.00 0.00 40.66 41.22 2qan h LEU 15 CO -0.23 -0.43 0.55 0.11 -0.62 0.00 0.00 178.44 177.82 2qan h LYS 16 N -0.75 0.49 0.01 1.25 1.57 -1.11 0.14 116.57 118.17 2qan h LYS 16 Ca -0.07 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 2qan h LYS 16 Cb 0.55 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2qan h LYS 16 CO 0.12 0.33 -0.23 0.87 -0.57 0.00 0.00 179.45 179.97 2qan h LYS 17 N 0.51 0.14 -0.68 3.15 1.79 -1.23 -3.25 116.57 116.99 2qan h LYS 17 Ca 0.42 -0.16 -0.05 0.00 -2.18 0.00 0.00 60.65 58.68 2qan h LYS 17 Cb 0.87 0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.53 2qan h LYS 17 CO -0.16 0.94 0.24 -0.24 -1.08 0.00 0.00 179.45 179.15 2qan h VAL 18 N -0.59 1.24 -0.99 0.50 3.04 0.15 -2.65 116.25 116.95 2qan h VAL 18 Ca -0.03 -0.80 0.05 0.00 -1.01 0.00 0.00 66.70 64.91 2qan h VAL 18 Cb 1.02 0.46 -0.06 0.00 -2.01 0.00 0.00 31.29 30.70 2qan h VAL 18 CO 0.04 0.31 0.65 -0.08 -1.01 0.00 0.00 177.57 177.48 2qan h GLU 19 N 0.99 1.19 -0.85 4.17 4.57 -1.09 0.17 114.58 123.72 2qan h GLU 19 Ca 0.23 -0.07 0.03 0.00 -1.18 0.00 0.00 59.36 58.37 2qan h GLU 19 Cb 0.23 -0.27 -0.05 0.00 -0.16 0.00 0.00 28.75 28.51 2qan h GLU 19 CO -0.01 0.79 0.56 -0.22 -1.18 0.00 0.00 179.01 178.94 2qan h LYS 20 N 1.22 1.03 -0.49 1.92 3.11 -1.51 -0.19 116.57 121.66 2qan h LYS 20 Ca 0.40 -0.06 -0.04 0.00 -2.81 0.00 0.00 60.65 58.14 2qan h LYS 20 Cb 0.05 -0.23 -0.02 0.00 -1.00 0.00 0.00 32.23 31.03 2qan h LYS 20 CO -0.14 0.68 0.15 0.00 -2.81 0.00 0.00 179.45 177.34 2qan h ALA 21 N 1.50 1.35 -0.64 5.00 0.00 -0.90 0.24 119.26 125.80 2qan h ALA 21 Ca 0.34 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 55.19 2qan h ALA 21 Cb 0.03 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.53 2qan h ALA 21 CO -0.10 0.47 0.22 0.28 0.00 0.00 0.00 179.25 180.13 2qan h VAL 22 N 0.71 0.72 0.00 0.00 2.07 -0.34 0.41 116.25 119.81 2qan h VAL 22 Ca 0.16 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.51 2qan h VAL 22 Cb 0.22 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2qan h VAL 22 CO -0.01 0.07 -0.56 1.05 0.02 0.00 0.00 177.57 178.14 2qan h GLU 23 N 0.38 0.00 0.00 1.57 -0.00 -1.39 -3.35 114.58 111.79 2qan h GLU 23 Ca 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.69 2qan h GLU 23 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.20 2qan h GLU 23 CO -0.35 0.20 0.24 0.66 -0.00 0.00 0.00 179.01 179.76 2qan h SER 24 N -1.00 0.00 -4.35 3.06 4.64 -0.59 -3.47 113.55 111.84 2qan h SER 24 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2qan h SER 24 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 2qan h SER 24 CO -0.04 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.53 2qan n GLY 25 N -1.22 -0.81 3.70 -0.77 0.00 0.14 -4.95 105.19 101.28 2qan n GLY 25 Ca -0.02 -1.67 -0.34 0.00 0.00 0.00 0.00 46.02 43.99 2qan n GLY 25 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qan s ASP 26 N -3.23 3.69 0.00 1.61 1.11 -1.25 -4.70 116.67 113.90 2qan s ASP 26 Ca 0.00 2.40 0.00 0.00 0.18 0.00 0.00 52.55 55.13 2qan s ASP 26 Cb 0.00 -2.59 0.00 0.00 1.07 0.00 0.00 42.92 41.40 2qan s ASP 26 CO 0.00 -2.60 0.00 2.29 1.18 0.00 0.00 175.17 176.04 2qan n LYS 27 N -3.15 0.00 -0.87 8.23 2.85 -1.26 -5.08 118.16 118.88 2qan n LYS 27 Ca 0.14 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 57.10 2qan n LYS 27 Cb 0.50 0.00 0.19 0.00 -0.65 0.00 0.00 35.03 35.07 2qan n LYS 27 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 2qan s LYS 28 N 4.33 0.31 0.00 -1.58 0.00 -1.26 -4.66 119.74 116.88 2qan s LYS 28 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 55.97 56.90 2qan s LYS 28 Cb 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 37.83 36.14 2qan s LYS 28 CO 0.00 -2.92 0.00 -0.35 0.00 0.00 0.00 175.35 172.08 2qan n PRO 29 N -4.37 -1.61 -3.59 1.78 -0.04 -1.25 -4.62 135.00 121.30 2qan n PRO 29 Ca 0.06 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.23 2qan n PRO 29 Cb 0.54 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.88 2qan n PRO 29 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qan s LEU 30 N 0.00 1.75 -0.44 1.53 1.43 -0.80 -4.77 118.68 117.38 2qan s LEU 30 Ca 0.00 -2.27 -0.28 0.00 -1.03 0.00 0.00 54.13 50.55 2qan s LEU 30 Cb 0.00 -0.69 -0.08 0.00 0.03 0.00 0.00 46.19 45.44 2qan s LEU 30 CO 0.00 -0.31 2.36 -1.14 0.23 0.00 0.00 176.35 177.49 2qan n ARG 31 N 3.98 1.20 -4.02 1.70 3.00 -1.26 -0.66 116.66 120.60 2qan n ARG 31 Ca 0.08 0.18 -0.09 0.00 -0.00 0.00 0.00 57.85 58.02 2qan n ARG 31 Cb 0.37 -3.09 -0.11 0.00 0.00 0.00 0.00 32.46 29.63 2qan n ARG 31 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2qan s THR 32 N 10.25 0.21 -0.21 5.15 2.01 -0.17 -4.97 115.64 127.91 2qan s THR 32 Ca 1.04 -1.10 0.04 0.00 0.31 0.00 0.00 61.69 61.98 2qan s THR 32 Cb -0.41 -0.55 -0.05 0.00 0.01 0.00 0.00 72.50 71.51 2qan s THR 32 CO 0.34 -0.57 0.19 0.79 -0.69 0.00 0.00 174.62 174.68 2qan n TRP 33 N 1.30 0.00 -0.60 4.92 8.01 -1.26 -2.12 117.44 127.69 2qan n TRP 33 Ca -0.22 0.00 -0.09 0.00 -1.31 0.00 0.00 57.50 55.88 2qan n TRP 33 Cb 0.56 0.00 -0.09 0.00 -2.01 0.00 0.00 31.31 29.77 2qan n TRP 33 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 2qan n SER 34 N -1.09 3.28 0.06 -0.99 3.41 -1.26 -4.44 113.62 112.59 2qan n SER 34 Ca 0.01 -2.10 0.05 0.00 -0.26 0.00 0.00 58.87 56.57 2qan n SER 34 Cb 0.07 -0.86 0.26 0.00 -0.26 0.00 0.00 64.21 63.42 2qan n SER 34 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2qan n ARG 35 N 2.87 0.06 -0.22 4.33 1.85 -1.26 -1.05 116.66 123.24 2qan n ARG 35 Ca 0.27 0.52 0.06 0.00 -1.00 0.00 0.00 57.85 57.70 2qan n ARG 35 Cb 0.49 -1.68 0.18 0.00 -1.05 0.00 0.00 32.46 30.40 2qan n ARG 35 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2qan n ARG 36 N -1.81 1.98 -3.84 2.89 1.85 -1.26 0.69 116.66 117.16 2qan n ARG 36 Ca -0.00 -1.45 -0.37 0.00 -1.00 0.00 0.00 57.85 55.03 2qan n ARG 36 Cb 0.04 -1.34 -0.06 0.00 -1.05 0.00 0.00 32.46 30.05 2qan n ARG 36 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2qan s SER 37 N -0.97 6.43 0.38 2.89 0.01 -0.21 -4.83 113.70 117.39 2qan s SER 37 Ca 0.27 0.52 -0.25 0.00 1.31 0.00 0.00 55.95 57.79 2qan s SER 37 Cb 0.14 -2.09 -0.09 0.00 0.21 0.00 0.00 66.02 64.20 2qan s SER 37 CO 0.18 0.40 1.08 0.42 0.41 0.00 0.00 173.24 175.72 2qan s THR 38 N -1.05 3.59 0.31 1.44 -4.23 -1.10 -1.04 115.64 113.55 2qan s THR 38 Ca 0.16 1.30 -0.28 0.00 -1.18 0.00 0.00 61.69 61.70 2qan s THR 38 Cb -0.13 -3.72 -0.09 0.00 1.34 0.00 0.00 72.50 69.90 2qan s THR 38 CO 0.05 0.09 1.00 -0.63 -0.54 0.00 0.00 174.62 174.60 2qan s ILE 39 N -1.52 3.89 0.23 2.99 1.01 0.33 -4.84 121.20 123.28 2qan s ILE 39 Ca 0.55 1.71 0.11 0.00 0.00 0.00 0.00 60.65 63.02 2qan s ILE 39 Cb -0.25 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.16 2qan s ILE 39 CO 0.32 0.26 -0.19 -0.36 0.00 0.00 0.00 174.94 174.97 2qan s PHE 40 N -1.39 2.37 -0.95 3.97 0.40 -1.26 -3.98 117.98 117.13 2qan s PHE 40 Ca 0.48 -0.32 0.11 0.00 -0.60 0.00 0.00 56.93 56.60 2qan s PHE 40 Cb -0.25 -1.11 0.46 0.00 0.51 0.00 0.00 43.02 42.64 2qan s PHE 40 CO 0.31 0.59 1.34 -0.35 0.70 0.00 0.00 175.22 177.81 2qan n PRO 41 N -0.16 0.01 0.04 0.24 -0.04 -1.26 -2.34 135.00 131.49 2qan n PRO 41 Ca -0.09 0.35 -0.13 0.00 -0.04 0.00 0.00 63.50 63.59 2qan n PRO 41 Cb 0.58 -1.53 -0.02 0.00 -0.04 0.00 0.00 33.50 32.49 2qan n PRO 41 CO 0.00 0.00 0.00 -2.95 -0.04 0.00 0.00 175.50 172.51 2qan h ASN 42 N 0.00 0.62 -0.09 3.54 -0.00 -2.00 -2.81 115.58 114.83 2qan h ASN 42 Ca 0.00 -0.43 0.00 0.00 -0.00 0.00 0.00 56.30 55.87 2qan h ASN 42 Cb 0.17 -0.18 0.00 0.00 -0.00 0.00 0.00 38.32 38.31 2qan h ASN 42 CO 0.00 1.20 0.00 1.15 -0.00 0.00 0.00 177.43 179.78 2qan n MET 43 N -3.84 1.52 -1.57 4.14 0.00 -0.99 -4.76 117.12 111.63 2qan n MET 43 Ca -0.06 -0.78 -0.61 0.00 0.00 0.00 0.00 57.70 56.25 2qan n MET 43 Cb 0.75 -1.40 -0.09 0.00 0.00 0.00 0.00 33.22 32.48 2qan n MET 43 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 175.97 177.48 2qan n ILE 44 N -0.01 0.00 -3.82 3.17 0.13 -1.06 -0.17 119.36 117.59 2qan n ILE 44 Ca 0.17 0.00 -0.27 0.00 -1.10 0.00 0.00 62.75 61.55 2qan n ILE 44 Cb 0.27 -0.27 0.04 0.00 -0.84 0.00 0.00 39.64 38.83 2qan n ILE 44 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2qan n GLY 45 N 2.80 -0.45 3.92 4.50 0.00 0.20 -4.86 105.19 111.31 2qan n GLY 45 Ca 0.25 0.18 -0.20 0.00 0.00 0.00 0.00 46.02 46.26 2qan n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qan s LEU 46 N -7.12 3.62 -0.66 0.99 2.01 0.76 -4.80 118.68 113.48 2qan s LEU 46 Ca 0.48 -0.49 -0.18 0.00 0.01 0.00 0.00 54.13 53.95 2qan s LEU 46 Cb -0.24 -2.38 0.13 0.00 0.01 0.00 0.00 46.19 43.72 2qan s LEU 46 CO 0.81 -0.55 0.73 -0.89 1.01 0.00 0.00 176.35 177.46 2qan s THR 47 N -2.34 5.01 0.56 5.49 2.01 -1.26 -3.61 115.64 121.49 2qan s THR 47 Ca 0.47 -1.39 0.04 0.00 0.31 0.00 0.00 61.69 61.12 2qan s THR 47 Cb -0.07 -4.50 0.04 0.00 0.01 0.00 0.00 72.50 67.99 2qan s THR 47 CO 0.29 -1.11 0.33 -0.38 -0.69 0.00 0.00 174.62 173.06 2qan n ILE 48 N 5.23 0.00 -3.68 1.82 5.41 0.55 -1.91 119.36 126.78 2qan n ILE 48 Ca -0.03 -2.30 -0.10 0.00 1.00 0.00 0.00 62.75 61.32 2qan n ILE 48 Cb 0.43 0.11 -0.11 0.00 -0.71 0.00 0.00 39.64 39.37 2qan n ILE 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qan s ALA 49 N -2.84 -1.05 -0.06 -1.39 0.00 0.16 -2.14 121.76 114.44 2qan s ALA 49 Ca 0.25 1.48 0.05 0.00 0.00 0.00 0.00 51.96 53.74 2qan s ALA 49 Cb -0.02 -1.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.03 2qan s ALA 49 CO 0.16 -0.45 -0.23 0.08 0.00 0.00 0.00 175.76 175.32 2qan s VAL 50 N 1.86 2.24 0.86 0.00 1.01 -0.88 -1.00 120.40 124.48 2qan s VAL 50 Ca -0.06 -1.00 -0.12 0.00 0.00 0.00 0.00 61.98 60.79 2qan s VAL 50 Cb -0.10 -1.83 0.11 0.00 0.00 0.00 0.00 36.38 34.56 2qan s VAL 50 CO -0.12 0.57 1.16 -2.28 0.00 0.00 0.00 175.10 174.43 2qan s HIS 51 N -0.16 2.70 -0.16 5.22 2.46 -0.90 -0.39 115.29 124.06 2qan s HIS 51 Ca -0.03 0.79 0.06 0.00 0.47 0.00 0.00 55.06 56.34 2qan s HIS 51 Cb -0.14 -3.46 0.19 0.00 -0.13 0.00 0.00 32.58 29.04 2qan s HIS 51 CO 0.04 -2.09 1.02 0.27 -2.47 0.00 0.00 174.74 171.51 2qan n ASN 52 N -3.55 -0.84 0.00 9.88 6.94 -0.71 -4.89 115.26 122.09 2qan n ASN 52 Ca 0.08 -1.63 0.00 0.00 -0.02 0.00 0.00 54.58 53.01 2qan n ASN 52 Cb 0.60 0.37 0.00 0.00 -2.36 0.00 0.00 39.78 38.39 2qan n ASN 52 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2qan n GLY 53 N -0.74 2.25 0.00 4.83 0.00 -1.26 -4.69 105.19 105.59 2qan n GLY 53 Ca -0.13 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2qan n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qan n ARG 54 N 0.00 0.00 0.00 1.61 1.74 -1.26 -5.09 116.66 113.66 2qan n ARG 54 Ca 0.00 0.18 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 2qan n ARG 54 Cb 0.00 -0.66 0.00 0.00 -1.02 0.00 0.00 32.46 30.78 2qan n ARG 54 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2qan n GLN 55 N -1.16 0.00 -3.37 5.56 1.13 -1.26 -5.14 117.38 113.14 2qan n GLN 55 Ca 0.00 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 54.85 2qan n GLN 55 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 30.24 30.35 2qan n GLN 55 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2qan s HIS 56 N -1.35 3.23 0.02 1.08 3.76 -1.26 -1.74 115.29 119.03 2qan s HIS 56 Ca 0.00 0.00 0.03 0.00 -0.15 0.00 0.00 55.06 54.94 2qan s HIS 56 Cb 0.00 -2.03 -0.02 0.00 1.11 0.00 0.00 32.58 31.64 2qan s HIS 56 CO 0.00 -0.05 -0.10 0.14 -0.85 0.00 0.00 174.74 173.87 2qan s VAL 57 N -2.29 0.79 -0.99 -0.90 -7.23 0.48 -4.84 120.40 105.41 2qan s VAL 57 Ca 0.44 -0.76 -0.24 0.00 -1.81 0.00 0.00 61.98 59.61 2qan s VAL 57 Cb -0.10 -0.73 -0.07 0.00 0.56 0.00 0.00 36.38 36.04 2qan s VAL 57 CO 0.33 -0.02 1.98 -2.16 -0.31 0.00 0.00 175.10 174.92 2qan s PRO 58 N -0.87 2.43 -0.11 4.82 0.04 -1.26 -2.08 135.00 137.97 2qan s PRO 58 Ca -0.00 -0.54 -0.16 0.00 0.04 0.00 0.00 61.00 60.34 2qan s PRO 58 Cb -0.06 -5.10 -0.05 0.00 0.04 0.00 0.00 34.50 29.33 2qan s PRO 58 CO 0.00 -3.72 0.41 0.14 0.04 0.00 0.00 177.00 173.87 2qan s VAL 59 N 10.93 5.19 -0.10 -0.36 -7.23 -0.91 -4.94 120.40 122.99 2qan s VAL 59 Ca 0.71 0.81 0.01 0.00 -1.81 0.00 0.00 61.98 61.70 2qan s VAL 59 Cb -0.05 -3.74 0.02 0.00 0.56 0.00 0.00 36.38 33.17 2qan s VAL 59 CO 0.05 0.40 -0.13 -0.36 -0.31 0.00 0.00 175.10 174.75 2qan s PHE 60 N 0.24 1.74 0.74 2.82 0.08 -1.26 -0.33 117.98 122.01 2qan s PHE 60 Ca 0.23 -0.78 -0.15 0.00 0.12 0.00 0.00 56.93 56.35 2qan s PHE 60 Cb -0.15 -1.29 0.04 0.00 -0.57 0.00 0.00 43.02 41.06 2qan s PHE 60 CO 0.09 -0.43 1.19 0.08 -0.10 0.00 0.00 175.22 176.05 2qan s VAL 61 N 1.02 2.38 0.15 -0.44 1.01 -1.24 -4.79 120.40 118.50 2qan s VAL 61 Ca -0.07 0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.07 2qan s VAL 61 Cb -0.15 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 2qan s VAL 61 CO -0.01 -0.11 0.11 -0.89 0.00 0.00 0.00 175.10 174.20 2qan s THR 62 N -2.08 0.08 0.00 3.92 2.01 -1.23 -0.63 115.64 117.71 2qan s THR 62 Ca 0.73 -1.85 0.00 0.00 0.31 0.00 0.00 61.69 60.88 2qan s THR 62 Cb -0.28 -2.11 0.00 0.00 0.01 0.00 0.00 72.50 70.12 2qan s THR 62 CO 0.46 -0.34 0.15 -0.67 -0.69 0.00 0.00 174.62 173.53 2qan n ASP 63 N -0.15 0.00 0.29 3.53 -0.08 -1.26 -1.56 116.55 117.32 2qan n ASP 63 Ca -0.04 0.15 0.16 0.00 -1.51 0.00 0.00 54.79 53.55 2qan n ASP 63 Cb 0.64 0.00 0.93 0.00 2.34 0.00 0.00 41.12 45.03 2qan n ASP 63 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 2qan h GLU 64 N 0.00 0.00 -4.73 -0.67 -0.00 -2.04 -3.35 114.58 103.79 2qan h GLU 64 Ca 0.00 0.00 -0.58 0.00 -0.00 0.00 0.00 59.36 58.78 2qan h GLU 64 Cb 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 28.75 28.78 2qan h GLU 64 CO 0.00 0.00 2.02 -0.12 -0.00 0.00 0.00 179.01 180.91 2qan n MET 65 N -3.80 1.57 0.07 1.06 1.56 -0.60 -4.10 117.12 112.88 2qan n MET 65 Ca -0.02 -2.02 0.00 0.00 -0.27 0.00 0.00 57.70 55.38 2qan n MET 65 Cb 0.11 -3.12 0.00 0.00 2.15 0.00 0.00 33.22 32.36 2qan n MET 65 CO 0.00 0.00 0.00 1.33 -0.73 0.00 0.00 175.97 176.57 2qan n VAL 66 N 6.43 0.09 0.00 1.12 0.24 -1.26 -3.48 118.33 121.47 2qan n VAL 66 Ca 0.49 0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.82 2qan n VAL 66 Cb 0.42 -0.41 0.00 0.00 -1.47 0.00 0.00 33.84 32.38 2qan n VAL 66 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qan n GLY 67 N 1.77 0.00 4.02 7.63 0.00 -1.26 -1.54 105.19 115.82 2qan n GLY 67 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2qan n GLY 67 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qan s HIS 68 N -1.72 1.88 -0.08 1.61 3.76 -1.26 -4.82 115.29 114.66 2qan s HIS 68 Ca 0.00 -0.59 -0.05 0.00 -0.15 0.00 0.00 55.06 54.26 2qan s HIS 68 Cb 0.00 -2.31 -0.04 0.00 1.11 0.00 0.00 32.58 31.34 2qan s HIS 68 CO 0.00 -0.94 0.15 0.15 -0.85 0.00 0.00 174.74 173.25 2qan s LYS 69 N -4.59 3.43 0.39 1.40 -0.14 -1.26 0.12 119.74 119.09 2qan s LYS 69 Ca 0.60 -0.20 0.22 0.00 -1.36 0.00 0.00 55.97 55.23 2qan s LYS 69 Cb -0.07 -3.15 1.21 0.00 -1.68 0.00 0.00 37.83 34.14 2qan s LYS 69 CO 0.37 0.74 1.65 1.25 -0.76 0.00 0.00 175.35 178.61 2qan h LEU 70 N 4.58 0.00 0.18 3.17 5.85 -1.06 -2.16 115.31 125.86 2qan h LEU 70 Ca -0.53 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 57.88 2qan h LEU 70 Cb 1.21 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.26 2qan h LEU 70 CO 0.62 0.00 -1.45 1.23 -0.34 0.00 0.00 178.44 178.49 2qan h GLY 71 N 0.00 0.43 -0.89 3.75 0.00 0.01 -3.33 103.07 103.03 2qan h GLY 71 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 47.33 46.24 2qan h GLY 71 CO 0.00 0.95 0.00 -1.84 0.00 0.00 0.00 176.54 175.65 2qan n GLU 72 N -3.58 0.44 0.00 4.80 0.28 -0.81 -1.16 120.64 120.61 2qan n GLU 72 Ca -0.15 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.85 2qan n GLU 72 Cb 1.06 -1.20 0.00 0.00 1.43 0.00 0.00 31.44 32.74 2qan n GLU 72 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2qan n PHE 73 N 0.20 0.00 -3.93 -1.84 3.01 -1.25 -4.94 117.46 108.70 2qan n PHE 73 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.14 2qan n PHE 73 Cb 0.10 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.43 2qan n PHE 73 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2qan s ALA 74 N -0.32 3.17 0.49 4.37 0.00 -0.31 -5.08 121.76 124.08 2qan s ALA 74 Ca 0.00 -2.93 -0.24 0.00 0.00 0.00 0.00 51.96 48.79 2qan s ALA 74 Cb 0.00 -2.17 -0.07 0.00 0.00 0.00 0.00 23.12 20.88 2qan s ALA 74 CO 0.00 -1.89 1.40 -0.35 0.00 0.00 0.00 175.76 174.92 2qan n PRO 75 N 3.71 2.02 0.00 0.00 -0.04 -1.26 -4.94 135.00 134.49 2qan n PRO 75 Ca 0.04 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 64.23 2qan n PRO 75 Cb 0.37 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 31.24 2qan n PRO 75 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2qan n THR 76 N -0.53 0.00 -1.72 0.52 -1.04 -1.26 -4.95 114.28 105.30 2qan n THR 76 Ca 0.07 0.41 -0.42 0.00 -2.04 0.00 0.00 64.05 62.07 2qan n THR 76 Cb 0.42 -1.41 -0.02 0.00 -1.82 0.00 0.00 70.33 67.50 2qan n THR 76 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2qan n ARG 77 N -2.32 2.58 -3.08 -2.82 1.85 -1.26 -4.97 116.66 106.65 2qan n ARG 77 Ca 0.00 0.92 -0.40 0.00 -1.00 0.00 0.00 57.85 57.37 2qan n ARG 77 Cb 0.00 -2.70 -0.05 0.00 -1.05 0.00 0.00 32.46 28.66 2qan n ARG 77 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2qan s THR 78 N 0.24 5.04 -0.29 8.89 2.01 -1.26 -5.04 115.64 125.23 2qan s THR 78 Ca 0.67 1.34 -0.00 0.00 0.31 0.00 0.00 61.69 64.01 2qan s THR 78 Cb -0.53 -4.00 0.09 0.00 0.01 0.00 0.00 72.50 68.07 2qan s THR 78 CO 0.45 0.20 0.07 -0.47 -0.69 0.00 0.00 174.62 174.18 2qan s TYR 79 N 1.20 1.87 0.00 4.92 5.04 -1.26 -5.32 117.35 123.80 2qan s TYR 79 Ca 0.34 -1.73 0.00 0.00 -2.44 0.00 0.00 57.07 53.24 2qan s TYR 79 Cb -0.17 -1.71 0.00 0.00 0.35 0.00 0.00 41.96 40.43 2qan s TYR 79 CO 0.15 -0.84 0.00 0.54 -1.34 0.00 0.00 175.55 174.06