#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qb9 n SER 3 N 0.00 -3.47 -0.24 2.89 7.64 -1.26 -4.90 113.62 114.28 2qb9 n SER 3 Ca 0.00 0.47 -0.00 0.00 1.01 0.00 0.00 58.87 60.35 2qb9 n SER 3 Cb 0.00 -0.97 -0.00 0.00 -1.01 0.00 0.00 64.21 62.23 2qb9 n SER 3 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2qb9 n LEU 4 N 1.62 -0.00 0.00 -3.43 4.77 -1.26 -5.11 117.00 113.58 2qb9 n LEU 4 Ca 0.06 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 2qb9 n LEU 4 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2qb9 n LEU 4 CO 0.52 0.73 0.00 0.29 -1.33 0.00 0.00 177.39 177.61 2qb9 n LYS 5 N 0.00 0.00 -3.86 3.23 5.02 -1.26 -3.75 118.16 117.54 2qb9 n LYS 5 Ca -0.00 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.99 2qb9 n LYS 5 Cb 0.23 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 35.10 2qb9 n LYS 5 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2qb9 s LYS 6 N 0.00 1.15 0.00 1.97 -0.14 -1.26 -4.97 119.74 116.49 2qb9 s LYS 6 Ca 0.00 -1.58 0.00 0.00 -1.36 0.00 0.00 55.97 53.03 2qb9 s LYS 6 Cb 0.00 -2.59 0.00 0.00 -1.68 0.00 0.00 37.83 33.56 2qb9 s LYS 6 CO 0.00 -0.99 0.00 0.41 -0.76 0.00 0.00 175.35 174.01 2qb9 n GLY 7 N 4.38 -1.07 3.69 -3.33 0.00 -1.25 -5.12 105.19 102.49 2qb9 n GLY 7 Ca 0.02 0.48 -0.44 0.00 0.00 0.00 0.00 46.02 46.07 2qb9 n GLY 7 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qb9 n PRO 8 N 0.00 2.46 -4.40 1.61 -0.02 -1.26 -4.99 135.00 128.39 2qb9 n PRO 8 Ca 0.00 0.89 -0.26 0.00 -2.02 0.00 0.00 63.50 62.11 2qb9 n PRO 8 Cb 0.00 -2.71 -0.13 0.00 -0.02 0.00 0.00 33.50 30.64 2qb9 n PRO 8 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2qb9 s PHE 9 N 1.48 2.00 -0.10 6.00 2.19 -1.26 -5.07 117.98 123.21 2qb9 s PHE 9 Ca 0.79 -0.40 -0.15 0.00 0.33 0.00 0.00 56.93 57.50 2qb9 s PHE 9 Cb -0.59 -1.11 0.04 0.00 -1.31 0.00 0.00 43.02 40.05 2qb9 s PHE 9 CO 0.37 0.23 0.38 0.96 1.83 0.00 0.00 175.22 178.99 2qb9 s ILE 10 N -1.06 0.02 0.76 3.12 -4.36 -1.26 -2.87 121.20 115.55 2qb9 s ILE 10 Ca 0.09 -0.15 -0.15 0.00 -0.26 0.00 0.00 60.65 60.18 2qb9 s ILE 10 Cb -0.10 -0.60 0.02 0.00 1.25 0.00 0.00 42.46 43.03 2qb9 s ILE 10 CO 0.04 -0.08 0.87 0.47 0.24 0.00 0.00 174.94 176.48 2qb9 n ASP 11 N 2.26 0.00 -0.32 4.36 9.92 -1.26 -4.83 116.55 126.68 2qb9 n ASP 11 Ca -0.16 0.60 0.03 0.00 -0.53 0.00 0.00 54.79 54.73 2qb9 n ASP 11 Cb 0.57 -1.37 0.18 0.00 -0.64 0.00 0.00 41.12 39.85 2qb9 n ASP 11 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 2qb9 h LEU 12 N -0.55 0.83 0.00 0.64 6.46 -2.01 -3.07 115.31 117.61 2qb9 h LEU 12 Ca -0.46 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.33 2qb9 h LEU 12 Cb 1.32 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 41.12 2qb9 h LEU 12 CO 0.45 0.49 0.00 1.41 -0.62 0.00 0.00 178.44 180.17 2qb9 n HIS 13 N -4.65 0.00 -0.17 1.25 -0.00 -1.26 -1.41 115.22 108.99 2qb9 n HIS 13 Ca 0.15 0.00 -0.01 0.00 -0.00 0.00 0.00 57.72 57.85 2qb9 n HIS 13 Cb 0.25 -0.23 0.07 0.00 -0.00 0.00 0.00 29.99 30.08 2qb9 n HIS 13 CO 0.00 0.00 0.00 1.37 -0.00 0.00 0.00 176.34 177.71 2qb9 h LEU 14 N 0.00 -0.10 -1.06 2.41 -0.00 -1.94 0.18 115.31 114.79 2qb9 h LEU 14 Ca 0.00 0.11 0.29 0.00 -0.00 0.00 0.00 57.88 58.28 2qb9 h LEU 14 Cb 0.00 0.17 -0.13 0.00 -0.00 0.00 0.00 40.66 40.70 2qb9 h LEU 14 CO 0.00 -0.03 0.61 0.25 -0.00 0.00 0.00 178.44 179.27 2qb9 h LEU 15 N 0.18 0.55 0.00 0.17 6.46 -1.35 1.45 115.31 122.77 2qb9 h LEU 15 Ca 0.27 0.16 -0.19 0.00 -0.12 0.00 0.00 57.88 57.99 2qb9 h LEU 15 Cb 0.39 0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.38 2qb9 h LEU 15 CO -0.39 -0.03 -1.40 0.11 -0.62 0.00 0.00 178.44 176.11 2qb9 h LYS 16 N 0.41 0.00 0.00 1.25 1.79 0.00 -3.27 116.57 116.75 2qb9 h LYS 16 Ca 0.69 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 59.15 2qb9 h LYS 16 Cb 1.54 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.19 2qb9 h LYS 16 CO -0.51 0.36 -0.06 0.87 -1.08 0.00 0.00 179.45 179.03 2qb9 h LYS 17 N 0.00 0.00 -0.54 3.15 1.57 0.24 -3.09 116.57 117.90 2qb9 h LYS 17 Ca -0.17 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 2qb9 h LYS 17 Cb 1.67 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.95 2qb9 h LYS 17 CO 0.06 0.75 0.29 -0.24 -0.57 0.00 0.00 179.45 179.74 2qb9 h VAL 18 N -1.00 1.17 -0.37 0.50 3.04 0.16 -1.15 116.25 118.60 2qb9 h VAL 18 Ca -0.01 -0.43 -0.15 0.00 -1.01 0.00 0.00 66.70 65.10 2qb9 h VAL 18 Cb 0.77 0.44 -0.01 0.00 -2.01 0.00 0.00 31.29 30.49 2qb9 h VAL 18 CO -0.01 0.19 -0.37 -0.08 -1.01 0.00 0.00 177.57 176.29 2qb9 h GLU 19 N 0.75 0.86 -0.63 4.17 4.57 -1.68 -2.85 114.58 119.77 2qb9 h GLU 19 Ca 0.19 -0.44 -0.09 0.00 -1.18 0.00 0.00 59.36 57.84 2qb9 h GLU 19 Cb 0.03 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 2qb9 h GLU 19 CO -0.03 1.08 0.03 -0.22 -1.18 0.00 0.00 179.01 178.69 2qb9 h LYS 20 N 0.71 1.09 -0.51 1.92 3.11 -1.34 -2.36 116.57 119.18 2qb9 h LYS 20 Ca 0.06 -0.33 0.07 0.00 -2.81 0.00 0.00 60.65 57.64 2qb9 h LYS 20 Cb 0.94 -0.11 -0.03 0.00 -1.00 0.00 0.00 32.23 32.03 2qb9 h LYS 20 CO 0.09 1.04 0.34 0.00 -2.81 0.00 0.00 179.45 178.11 2qb9 h ALA 21 N 1.01 1.93 -0.06 5.00 0.00 -1.09 0.11 119.26 126.15 2qb9 h ALA 21 Ca 0.18 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.11 2qb9 h ALA 21 Cb 0.53 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2qb9 h ALA 21 CO 0.03 -0.02 -0.21 0.28 0.00 0.00 0.00 179.25 179.32 2qb9 h VAL 22 N 0.43 0.49 0.04 0.00 2.07 -1.19 0.45 116.25 118.54 2qb9 h VAL 22 Ca 0.23 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.74 2qb9 h VAL 22 Cb 0.34 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2qb9 h VAL 22 CO -0.06 0.00 -0.02 1.05 0.02 0.00 0.00 177.57 178.56 2qb9 h GLU 23 N -0.31 -0.06 -0.80 1.57 -0.00 -1.47 -3.28 114.58 110.23 2qb9 h GLU 23 Ca 0.08 0.00 0.19 0.00 -0.00 0.00 0.00 59.36 59.63 2qb9 h GLU 23 Cb 0.42 0.01 -0.05 0.00 -0.00 0.00 0.00 28.75 29.13 2qb9 h GLU 23 CO -0.24 0.55 0.55 0.66 -0.00 0.00 0.00 179.01 180.53 2qb9 h SER 24 N -0.92 0.28 -5.00 3.06 4.64 -1.01 -3.47 113.55 111.13 2qb9 h SER 24 Ca -0.01 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2qb9 h SER 24 Cb 0.64 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2qb9 h SER 24 CO 0.01 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 2qb9 n GLY 25 N -1.57 2.36 3.67 -0.77 0.00 0.16 -4.97 105.19 104.07 2qb9 n GLY 25 Ca 0.16 -1.96 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 2qb9 n GLY 25 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qb9 s ASP 26 N 0.00 6.62 0.00 1.61 1.11 -1.26 -4.73 116.67 120.02 2qb9 s ASP 26 Ca 0.00 2.38 0.00 0.00 0.18 0.00 0.00 52.55 55.11 2qb9 s ASP 26 Cb 0.00 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.45 2qb9 s ASP 26 CO 0.00 -0.92 0.00 2.29 1.18 0.00 0.00 175.17 177.72 2qb9 n LYS 27 N 6.57 0.00 -0.92 8.23 2.85 -1.26 -5.12 118.16 128.51 2qb9 n LYS 27 Ca 0.17 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 57.10 2qb9 n LYS 27 Cb 0.42 0.00 0.14 0.00 -0.65 0.00 0.00 35.03 34.94 2qb9 n LYS 27 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 2qb9 n LYS 28 N 0.00 -0.09 -0.70 -1.58 0.00 -1.26 -4.60 118.16 109.93 2qb9 n LYS 28 Ca 0.00 0.05 -0.30 0.00 -0.00 0.00 0.00 58.31 58.06 2qb9 n LYS 28 Cb 0.00 -2.38 0.26 0.00 -0.00 0.00 0.00 35.03 32.91 2qb9 n LYS 28 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2qb9 s PRO 29 N -4.28 -1.77 -0.52 -1.58 0.04 -1.26 -4.66 135.00 120.99 2qb9 s PRO 29 Ca 0.70 0.23 -0.08 0.00 0.04 0.00 0.00 61.00 61.89 2qb9 s PRO 29 Cb -0.27 -1.51 0.13 0.00 0.04 0.00 0.00 34.50 32.90 2qb9 s PRO 29 CO 0.54 -4.13 0.38 -0.51 0.04 0.00 0.00 177.00 173.32 2qb9 s LEU 30 N -7.34 5.68 -0.20 -3.56 1.43 0.30 -4.63 118.68 110.37 2qb9 s LEU 30 Ca 0.69 -2.13 -0.29 0.00 -1.03 0.00 0.00 54.13 51.37 2qb9 s LEU 30 Cb -0.15 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.04 2qb9 s LEU 30 CO 0.59 -0.62 2.01 -0.60 0.23 0.00 0.00 176.35 177.96 2qb9 s ARG 31 N 1.03 3.41 0.19 1.70 6.06 -1.26 -0.36 118.95 129.72 2qb9 s ARG 31 Ca 0.09 1.94 -0.23 0.00 -2.50 0.00 0.00 55.73 55.03 2qb9 s ARG 31 Cb -0.24 -4.26 0.06 0.00 0.06 0.00 0.00 34.95 30.57 2qb9 s ARG 31 CO -0.02 -1.78 0.63 0.95 -2.50 0.00 0.00 175.30 172.58 2qb9 s THR 32 N 7.04 0.00 -0.76 4.11 -4.23 -0.06 -4.92 115.64 116.83 2qb9 s THR 32 Ca 0.91 -0.23 0.06 0.00 -1.18 0.00 0.00 61.69 61.25 2qb9 s THR 32 Cb -0.31 -1.23 0.08 0.00 1.34 0.00 0.00 72.50 72.37 2qb9 s THR 32 CO 0.35 0.00 0.79 0.79 -0.54 0.00 0.00 174.62 176.01 2qb9 n TRP 33 N -0.40 0.05 -0.56 3.99 8.01 -1.26 -2.13 117.44 125.15 2qb9 n TRP 33 Ca -0.14 -0.09 -0.06 0.00 -1.31 0.00 0.00 57.50 55.90 2qb9 n TRP 33 Cb 0.64 -0.01 -0.08 0.00 -2.01 0.00 0.00 31.31 29.85 2qb9 n TRP 33 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 2qb9 n SER 34 N 0.31 3.31 0.19 -0.99 3.41 -1.26 -4.34 113.62 114.25 2qb9 n SER 34 Ca 0.04 -2.06 0.03 0.00 -0.26 0.00 0.00 58.87 56.62 2qb9 n SER 34 Cb 0.20 -0.85 0.40 0.00 -0.26 0.00 0.00 64.21 63.70 2qb9 n SER 34 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2qb9 h ARG 35 N 3.65 0.04 0.00 4.33 0.11 -1.90 -2.00 114.38 118.61 2qb9 h ARG 35 Ca 0.09 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.16 2qb9 h ARG 35 Cb 0.88 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.95 2qb9 h ARG 35 CO 0.25 0.32 0.00 2.89 0.10 0.00 0.00 179.97 183.53 2qb9 n ARG 36 N -4.19 0.20 -2.10 0.08 1.85 -1.26 0.16 116.66 111.40 2qb9 n ARG 36 Ca -0.02 0.12 -0.28 0.00 -1.00 0.00 0.00 57.85 56.67 2qb9 n ARG 36 Cb 0.34 -1.50 0.12 0.00 -1.05 0.00 0.00 32.46 30.37 2qb9 n ARG 36 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2qb9 s SER 37 N -2.34 4.09 0.07 2.89 0.01 -0.75 -4.86 113.70 112.81 2qb9 s SER 37 Ca 0.11 0.34 0.02 0.00 1.31 0.00 0.00 55.95 57.73 2qb9 s SER 37 Cb 0.06 -0.70 -0.04 0.00 0.21 0.00 0.00 66.02 65.55 2qb9 s SER 37 CO 0.13 -2.10 0.13 -0.89 0.41 0.00 0.00 173.24 170.92 2qb9 s THR 38 N -3.53 4.86 0.07 1.44 2.01 -1.14 0.07 115.64 119.42 2qb9 s THR 38 Ca 0.66 -0.63 -0.29 0.00 0.31 0.00 0.00 61.69 61.75 2qb9 s THR 38 Cb -0.08 -3.35 -0.05 0.00 0.01 0.00 0.00 72.50 69.03 2qb9 s THR 38 CO 0.48 0.13 0.92 -0.63 -0.69 0.00 0.00 174.62 174.83 2qb9 s ILE 39 N -1.44 4.63 0.29 1.82 1.01 0.13 -4.65 121.20 123.00 2qb9 s ILE 39 Ca 0.31 1.97 0.08 0.00 0.00 0.00 0.00 60.65 63.01 2qb9 s ILE 39 Cb -0.12 -4.27 -0.03 0.00 0.01 0.00 0.00 42.46 38.04 2qb9 s ILE 39 CO 0.24 0.29 0.19 -0.36 0.00 0.00 0.00 174.94 175.31 2qb9 s PHE 40 N 0.21 2.92 0.24 3.97 0.40 -1.26 -3.81 117.98 120.65 2qb9 s PHE 40 Ca 0.46 -0.23 -0.04 0.00 -0.60 0.00 0.00 56.93 56.52 2qb9 s PHE 40 Cb -0.22 -1.53 0.26 0.00 0.51 0.00 0.00 43.02 42.04 2qb9 s PHE 40 CO 0.28 0.40 1.73 -1.00 0.70 0.00 0.00 175.22 177.33 2qb9 h PRO 41 N 1.48 0.88 0.00 0.24 0.13 -1.93 -2.38 132.00 130.42 2qb9 h PRO 41 Ca -0.46 -0.24 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 2qb9 h PRO 41 Cb 1.25 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2qb9 h PRO 41 CO 0.60 0.87 0.00 -2.95 -0.23 0.00 0.00 178.00 176.29 2qb9 h ASN 42 N 0.81 0.00 1.42 1.44 -0.00 -1.96 -0.73 115.58 116.57 2qb9 h ASN 42 Ca 0.16 0.00 -0.08 0.00 -0.00 0.00 0.00 56.30 56.38 2qb9 h ASN 42 Cb 0.47 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.78 2qb9 h ASN 42 CO 0.02 0.00 -0.38 0.24 -0.00 0.00 0.00 177.43 177.31 2qb9 h MET 43 N 0.00 0.00 -6.38 4.14 0.00 -1.76 -3.45 114.93 107.49 2qb9 h MET 43 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 59.70 59.07 2qb9 h MET 43 Cb 0.19 0.00 0.09 0.00 0.00 0.00 0.00 31.60 31.88 2qb9 h MET 43 CO 0.00 0.38 0.16 1.51 0.00 0.00 0.00 176.91 178.96 2qb9 n ILE 44 N -3.25 1.45 -0.23 -1.22 3.06 -0.28 -0.42 119.36 118.46 2qb9 n ILE 44 Ca 0.02 -0.36 0.00 0.00 -2.50 0.00 0.00 62.75 59.91 2qb9 n ILE 44 Cb 0.64 -0.86 0.00 0.00 0.54 0.00 0.00 39.64 39.96 2qb9 n ILE 44 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2qb9 n GLY 45 N 1.67 2.14 3.96 4.50 0.00 0.13 -4.95 105.19 112.64 2qb9 n GLY 45 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 2qb9 n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qb9 s LEU 46 N 0.00 3.22 -0.05 0.99 2.01 0.44 -4.92 118.68 120.36 2qb9 s LEU 46 Ca 0.00 0.09 0.04 0.00 0.01 0.00 0.00 54.13 54.27 2qb9 s LEU 46 Cb 0.00 -2.93 -0.02 0.00 0.01 0.00 0.00 46.19 43.24 2qb9 s LEU 46 CO 0.00 -1.19 -0.17 -0.89 1.01 0.00 0.00 176.35 175.11 2qb9 s THR 47 N -2.83 2.77 -0.05 5.49 2.01 -1.26 -3.69 115.64 118.07 2qb9 s THR 47 Ca 0.57 -0.83 -0.02 0.00 0.31 0.00 0.00 61.69 61.72 2qb9 s THR 47 Cb -0.10 -2.06 0.04 0.00 0.01 0.00 0.00 72.50 70.38 2qb9 s THR 47 CO 0.39 0.58 0.09 -0.63 -0.69 0.00 0.00 174.62 174.37 2qb9 s ILE 48 N -0.54 -0.15 -1.00 1.82 1.01 -1.25 -0.54 121.20 120.55 2qb9 s ILE 48 Ca 0.07 0.38 -0.23 0.00 0.00 0.00 0.00 60.65 60.87 2qb9 s ILE 48 Cb -0.11 -0.19 0.05 0.00 0.01 0.00 0.00 42.46 42.21 2qb9 s ILE 48 CO 0.01 0.16 1.46 0.00 0.00 0.00 0.00 174.94 176.56 2qb9 s ALA 49 N 2.06 2.68 -0.31 9.38 0.00 0.52 -3.23 121.76 132.85 2qb9 s ALA 49 Ca 0.02 -2.17 -0.22 0.00 0.00 0.00 0.00 51.96 49.60 2qb9 s ALA 49 Cb -0.12 -4.51 -0.00 0.00 0.00 0.00 0.00 23.12 18.48 2qb9 s ALA 49 CO -0.04 -3.64 0.70 0.08 0.00 0.00 0.00 175.76 172.86 2qb9 s VAL 50 N 5.20 4.87 0.52 0.00 1.01 0.12 -0.88 120.40 131.25 2qb9 s VAL 50 Ca 0.46 0.97 -0.20 0.00 0.00 0.00 0.00 61.98 63.21 2qb9 s VAL 50 Cb -0.01 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 32.24 2qb9 s VAL 50 CO -0.08 -0.21 1.12 -2.28 0.00 0.00 0.00 175.10 173.66 2qb9 s HIS 51 N 2.77 2.75 0.00 5.22 2.46 -0.90 0.11 115.29 127.70 2qb9 s HIS 51 Ca 0.28 1.55 0.00 0.00 0.47 0.00 0.00 55.06 57.36 2qb9 s HIS 51 Cb -0.14 -3.27 0.00 0.00 -0.13 0.00 0.00 32.58 29.03 2qb9 s HIS 51 CO 0.12 -1.46 0.00 0.27 -2.47 0.00 0.00 174.74 171.21 2qb9 n ASN 52 N -1.13 0.26 0.05 9.88 6.94 -1.02 -4.87 115.26 125.37 2qb9 n ASN 52 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.67 2qb9 n ASN 52 Cb 0.51 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.93 2qb9 n ASN 52 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2qb9 n GLY 53 N 2.72 -0.89 0.05 4.83 0.00 -1.26 -4.86 105.19 105.78 2qb9 n GLY 53 Ca 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 46.02 46.15 2qb9 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qb9 n ARG 54 N -2.65 0.31 -4.46 1.61 1.74 -1.26 -5.05 116.66 106.89 2qb9 n ARG 54 Ca 0.00 0.40 -0.24 0.00 -0.77 0.00 0.00 57.85 57.24 2qb9 n ARG 54 Cb 0.00 -1.34 -0.08 0.00 -1.02 0.00 0.00 32.46 30.01 2qb9 n ARG 54 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2qb9 s GLN 55 N -1.88 1.84 0.88 5.56 -1.52 -1.26 -5.15 119.66 118.13 2qb9 s GLN 55 Ca -0.11 -2.10 -0.12 0.00 -1.95 0.00 0.00 55.36 51.08 2qb9 s GLN 55 Cb 0.02 -0.48 0.17 0.00 -0.22 0.00 0.00 33.01 32.49 2qb9 s GLN 55 CO 0.16 -0.46 1.22 -1.01 -0.25 0.00 0.00 175.29 174.95 2qb9 s HIS 56 N -3.30 1.79 -0.02 0.91 3.76 -1.26 -2.43 115.29 114.73 2qb9 s HIS 56 Ca 0.28 0.23 -0.08 0.00 -0.15 0.00 0.00 55.06 55.34 2qb9 s HIS 56 Cb 0.03 -3.77 0.01 0.00 1.11 0.00 0.00 32.58 29.97 2qb9 s HIS 56 CO 0.16 -2.30 0.18 0.14 -0.85 0.00 0.00 174.74 172.07 2qb9 s VAL 57 N -3.66 0.06 0.77 -0.90 -7.23 0.31 -4.83 120.40 104.92 2qb9 s VAL 57 Ca 0.70 -0.52 -0.11 0.00 -1.81 0.00 0.00 61.98 60.25 2qb9 s VAL 57 Cb -0.05 -0.43 0.05 0.00 0.56 0.00 0.00 36.38 36.51 2qb9 s VAL 57 CO 0.50 -0.28 1.09 -2.16 -0.31 0.00 0.00 175.10 173.93 2qb9 s PRO 58 N -1.07 2.30 -0.11 4.82 0.04 -1.26 0.12 135.00 139.84 2qb9 s PRO 58 Ca -0.12 1.12 -0.09 0.00 0.04 0.00 0.00 61.00 61.95 2qb9 s PRO 58 Cb -0.06 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.61 2qb9 s PRO 58 CO 0.02 -1.60 0.28 0.14 0.04 0.00 0.00 177.00 175.88 2qb9 s VAL 59 N -2.93 -0.01 -0.91 -0.36 -7.23 -1.20 -4.85 120.40 102.92 2qb9 s VAL 59 Ca 0.61 0.03 -0.03 0.00 -1.81 0.00 0.00 61.98 60.78 2qb9 s VAL 59 Cb -0.17 -0.40 0.22 0.00 0.56 0.00 0.00 36.38 36.59 2qb9 s VAL 59 CO 0.56 0.01 0.80 -0.36 -0.31 0.00 0.00 175.10 175.81 2qb9 s PHE 60 N 0.42 3.92 -0.42 2.82 0.40 -1.26 -3.90 117.98 119.96 2qb9 s PHE 60 Ca -0.02 -2.95 -0.34 0.00 -0.60 0.00 0.00 56.93 53.02 2qb9 s PHE 60 Cb -0.04 -3.33 -0.12 0.00 0.51 0.00 0.00 43.02 40.04 2qb9 s PHE 60 CO -0.02 -0.78 2.26 0.28 0.70 0.00 0.00 175.22 177.67 2qb9 n VAL 61 N 2.48 0.14 -3.31 -0.44 0.31 -1.24 -4.84 118.33 111.43 2qb9 n VAL 61 Ca 0.21 -0.30 -0.21 0.00 -0.01 0.00 0.00 64.34 64.03 2qb9 n VAL 61 Cb 0.38 -1.68 0.02 0.00 -0.91 0.00 0.00 33.84 31.64 2qb9 n VAL 61 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2qb9 s THR 62 N 8.04 2.35 0.00 2.52 2.01 -1.26 0.21 115.64 129.51 2qb9 s THR 62 Ca 1.11 -1.17 0.00 0.00 0.31 0.00 0.00 61.69 61.94 2qb9 s THR 62 Cb -0.81 -2.52 0.00 0.00 0.01 0.00 0.00 72.50 69.18 2qb9 s THR 62 CO 0.46 0.00 0.54 -0.67 -0.69 0.00 0.00 174.62 174.27 2qb9 n ASP 63 N -1.91 0.00 -0.34 3.53 4.64 -1.26 -2.55 116.55 118.65 2qb9 n ASP 63 Ca 0.08 0.54 0.32 0.00 -1.38 0.00 0.00 54.79 54.35 2qb9 n ASP 63 Cb 0.62 -0.04 0.66 0.00 -1.04 0.00 0.00 41.12 41.31 2qb9 n ASP 63 CO 0.00 0.00 0.00 1.05 -0.82 0.00 0.00 177.20 177.43 2qb9 h GLU 64 N 0.00 0.14 -4.73 -0.67 -0.00 -2.01 -3.22 114.58 104.09 2qb9 h GLU 64 Ca 0.00 -0.01 -0.62 0.00 -0.00 0.00 0.00 59.36 58.73 2qb9 h GLU 64 Cb 0.00 -0.03 -0.01 0.00 -0.00 0.00 0.00 28.75 28.70 2qb9 h GLU 64 CO 0.00 0.09 2.34 -0.12 -0.00 0.00 0.00 179.01 181.32 2qb9 n MET 65 N -4.37 2.21 0.00 1.06 1.56 -1.06 -4.30 117.12 112.23 2qb9 n MET 65 Ca 0.27 -2.42 0.00 0.00 -0.27 0.00 0.00 57.70 55.28 2qb9 n MET 65 Cb 1.16 -3.26 0.00 0.00 2.15 0.00 0.00 33.22 33.27 2qb9 n MET 65 CO 0.00 0.00 0.00 1.33 -0.73 0.00 0.00 175.97 176.57 2qb9 n VAL 66 N 6.09 0.00 0.04 1.12 0.24 -1.22 -4.13 118.33 120.48 2qb9 n VAL 66 Ca 0.49 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.81 2qb9 n VAL 66 Cb 0.42 -0.15 0.07 0.00 -1.47 0.00 0.00 33.84 32.71 2qb9 n VAL 66 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qb9 n GLY 67 N 1.75 -0.30 3.89 7.63 0.00 -1.25 -2.34 105.19 114.57 2qb9 n GLY 67 Ca 0.00 0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 2qb9 n GLY 67 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qb9 s HIS 68 N -2.65 3.22 0.15 1.61 4.02 -1.26 -4.74 115.29 115.64 2qb9 s HIS 68 Ca -0.00 0.90 -0.29 0.00 1.02 0.00 0.00 55.06 56.69 2qb9 s HIS 68 Cb 0.01 -3.11 -0.07 0.00 -1.02 0.00 0.00 32.58 28.38 2qb9 s HIS 68 CO 0.02 -1.26 0.90 0.15 1.02 0.00 0.00 174.74 175.57 2qb9 s LYS 69 N -5.35 4.70 0.62 1.40 -0.14 -1.26 0.21 119.74 119.92 2qb9 s LYS 69 Ca 0.58 1.36 0.33 0.00 -1.36 0.00 0.00 55.97 56.88 2qb9 s LYS 69 Cb -0.11 -3.33 1.84 0.00 -1.68 0.00 0.00 37.83 34.55 2qb9 s LYS 69 CO 0.50 0.37 2.13 1.25 -0.76 0.00 0.00 175.35 178.84 2qb9 h LEU 70 N 4.99 0.00 -0.10 3.17 5.85 -0.29 -2.46 115.31 126.47 2qb9 h LEU 70 Ca -0.44 0.00 -0.24 0.00 0.84 0.00 0.00 57.88 58.03 2qb9 h LEU 70 Cb 1.21 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.24 2qb9 h LEU 70 CO 0.70 0.00 -1.00 1.23 -0.34 0.00 0.00 178.44 179.02 2qb9 h GLY 71 N 0.00 0.54 2.00 3.75 0.00 0.13 -3.26 103.07 106.24 2qb9 h GLY 71 Ca 0.05 -0.98 0.00 0.00 0.00 0.00 0.00 47.33 46.40 2qb9 h GLY 71 CO -0.00 0.86 0.00 -1.84 0.00 0.00 0.00 176.54 175.56 2qb9 n GLU 72 N -3.76 0.01 -2.14 4.80 0.28 -0.93 -2.46 120.64 116.44 2qb9 n GLU 72 Ca -0.08 0.51 -0.37 0.00 -0.16 0.00 0.00 57.16 57.06 2qb9 n GLU 72 Cb 0.87 -1.54 0.03 0.00 1.43 0.00 0.00 31.44 32.22 2qb9 n GLU 72 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2qb9 n PHE 73 N -1.57 3.10 -2.87 -1.84 3.01 -1.23 -4.77 117.46 111.30 2qb9 n PHE 73 Ca -0.00 -2.58 0.02 0.00 1.01 0.00 0.00 57.45 55.90 2qb9 n PHE 73 Cb 0.01 -0.92 0.00 0.00 -0.01 0.00 0.00 39.48 38.56 2qb9 n PHE 73 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2qb9 s ALA 74 N -3.96 -4.07 0.54 4.37 0.00 -1.03 -4.99 121.76 112.62 2qb9 s ALA 74 Ca 0.50 1.11 -0.22 0.00 0.00 0.00 0.00 51.96 53.35 2qb9 s ALA 74 Cb 0.40 -2.96 -0.05 0.00 0.00 0.00 0.00 23.12 20.52 2qb9 s ALA 74 CO -0.33 -2.42 1.38 -0.35 0.00 0.00 0.00 175.76 174.03 2qb9 n PRO 75 N 3.91 1.76 -0.07 0.00 -0.04 -1.26 -4.93 135.00 134.37 2qb9 n PRO 75 Ca 0.07 0.65 -0.13 0.00 -0.04 0.00 0.00 63.50 64.04 2qb9 n PRO 75 Cb 0.62 -2.60 -0.05 0.00 -0.04 0.00 0.00 33.50 31.43 2qb9 n PRO 75 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2qb9 n THR 76 N -0.97 0.76 -1.71 0.52 -1.04 -1.26 -4.90 114.28 105.68 2qb9 n THR 76 Ca 0.10 -0.22 -0.32 0.00 -2.04 0.00 0.00 64.05 61.57 2qb9 n THR 76 Cb 0.44 -1.48 0.05 0.00 -1.82 0.00 0.00 70.33 67.52 2qb9 n THR 76 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2qb9 s ARG 77 N -2.26 2.84 -0.22 -2.82 1.70 -1.26 -4.87 118.95 112.06 2qb9 s ARG 77 Ca -0.19 1.24 0.02 0.00 -0.47 0.00 0.00 55.73 56.33 2qb9 s ARG 77 Cb 0.07 -1.97 0.04 0.00 -0.57 0.00 0.00 34.95 32.53 2qb9 s ARG 77 CO 0.26 -1.20 -0.14 0.99 -1.08 0.00 0.00 175.30 174.14 2qb9 s THR 78 N -2.57 2.03 -0.19 4.99 2.01 -1.26 -5.10 115.64 115.54 2qb9 s THR 78 Ca 0.64 -1.31 0.01 0.00 0.31 0.00 0.00 61.69 61.34 2qb9 s THR 78 Cb -0.18 -2.04 0.02 0.00 0.01 0.00 0.00 72.50 70.31 2qb9 s THR 78 CO 0.45 0.18 -0.17 -0.47 -0.69 0.00 0.00 174.62 173.91 2qb9 s TYR 79 N 1.22 2.84 0.00 4.92 5.04 -1.26 -5.33 117.35 124.77 2qb9 s TYR 79 Ca -0.03 -1.61 0.00 0.00 -2.44 0.00 0.00 57.07 52.99 2qb9 s TYR 79 Cb -0.17 -1.95 0.00 0.00 0.35 0.00 0.00 41.96 40.19 2qb9 s TYR 79 CO -0.08 -0.78 0.00 0.54 -1.34 0.00 0.00 175.55 173.89