#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qxf s HIS 2 N 0.00 3.56 0.69 2.03 0.09 -1.26 -4.95 115.29 115.44 1qxf s HIS 2 Ca 0.00 1.69 -0.16 0.00 -0.00 0.00 0.00 55.06 56.59 1qxf s HIS 2 Cb 0.00 -3.30 -0.13 0.00 -0.00 0.00 0.00 32.58 29.15 1qxf s HIS 2 CO 0.00 -0.60 -0.43 0.45 -0.00 0.00 0.00 174.74 174.16 1qxf n SER 3 N 1.18 -4.42 -4.92 1.40 2.88 -1.26 -4.93 113.62 103.56 1qxf n SER 3 Ca -0.01 0.36 -0.27 0.00 -1.33 0.00 0.00 58.87 57.63 1qxf n SER 3 Cb 0.45 -0.72 0.08 0.00 -0.75 0.00 0.00 64.21 63.26 1qxf n SER 3 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1qxf s ARG 4 N -1.37 2.12 -0.08 -1.46 3.52 -1.26 -5.00 118.95 115.42 1qxf s ARG 4 Ca 0.43 -0.14 -0.05 0.00 -0.13 0.00 0.00 55.73 55.84 1qxf s ARG 4 Cb -0.30 -2.10 -0.04 0.00 -1.56 0.00 0.00 34.95 30.95 1qxf s ARG 4 CO 0.67 -1.36 0.12 -0.59 -0.81 0.00 0.00 175.30 173.34 1qxf s PHE 5 N -3.35 3.49 -0.08 5.12 -0.12 -1.26 -3.86 117.98 117.91 1qxf s PHE 5 Ca 0.61 0.41 -0.04 0.00 -0.05 0.00 0.00 56.93 57.86 1qxf s PHE 5 Cb -0.11 -1.87 0.04 0.00 -0.63 0.00 0.00 43.02 40.45 1qxf s PHE 5 CO 0.46 0.66 0.19 0.14 -0.05 0.00 0.00 175.22 176.62 1qxf s VAL 6 N -1.09 -0.04 -0.24 -2.49 -7.23 -1.23 -4.17 120.40 103.90 1qxf s VAL 6 Ca 0.18 0.16 -0.17 0.00 -1.81 0.00 0.00 61.98 60.35 1qxf s VAL 6 Cb -0.12 -0.30 -0.03 0.00 0.56 0.00 0.00 36.38 36.48 1qxf s VAL 6 CO 0.08 0.07 0.45 -0.75 -0.31 0.00 0.00 175.10 174.63 1qxf s LYS 7 N 1.20 4.09 0.37 4.82 2.20 -0.13 -2.70 119.74 129.59 1qxf s LYS 7 Ca -0.09 0.22 0.08 0.00 -0.36 0.00 0.00 55.97 55.83 1qxf s LYS 7 Cb -0.11 -3.62 -0.07 0.00 -1.51 0.00 0.00 37.83 32.53 1qxf s LYS 7 CO -0.07 -0.24 -0.00 0.14 -0.36 0.00 0.00 175.35 174.82 1qxf s VAL 8 N 1.95 2.26 -0.02 4.02 -7.23 0.31 -1.54 120.40 120.15 1qxf s VAL 8 Ca 0.19 -2.02 0.02 0.00 -1.81 0.00 0.00 61.98 58.35 1qxf s VAL 8 Cb -0.15 -2.84 0.01 0.00 0.56 0.00 0.00 36.38 33.95 1qxf s VAL 8 CO 0.09 -0.11 -0.05 -0.75 -0.31 0.00 0.00 175.10 173.97 1qxf s LYS 9 N -3.70 0.64 0.10 4.82 2.20 -0.76 0.19 119.74 123.23 1qxf s LYS 9 Ca 0.35 -0.16 -0.31 0.00 -0.36 0.00 0.00 55.97 55.49 1qxf s LYS 9 Cb 0.04 -0.65 -0.07 0.00 -1.51 0.00 0.00 37.83 35.65 1qxf s LYS 9 CO 0.18 0.03 1.31 0.00 -0.36 0.00 0.00 175.35 176.52 1qxf h PRO 11 N 6.74 0.48 0.15 0.00 0.13 -1.89 1.51 132.00 139.12 1qxf h PRO 11 Ca -0.42 -0.47 -0.28 0.00 -0.87 0.00 0.00 66.00 63.96 1qxf h PRO 11 Cb 1.21 0.12 0.01 0.00 0.13 0.00 0.00 31.00 32.47 1qxf h PRO 11 CO 0.84 1.11 -1.38 -0.44 -0.23 0.00 0.00 178.00 177.91 1qxf h ASP 12 N 0.30 0.50 0.91 1.44 3.32 -1.97 -3.32 116.42 117.60 1qxf h ASP 12 Ca -0.07 -0.90 -0.16 0.00 0.02 0.00 0.00 57.03 55.92 1qxf h ASP 12 Cb 1.50 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.87 1qxf h ASP 12 CO 0.16 1.62 -0.77 0.00 -1.72 0.00 0.00 179.24 178.53 1qxf n GLU 14 N -3.51 -1.13 -3.78 0.00 1.02 0.51 -4.95 120.64 108.80 1qxf n GLU 14 Ca -0.00 0.28 -0.30 0.00 -0.02 0.00 0.00 57.16 57.12 1qxf n GLU 14 Cb 0.77 -4.28 -0.04 0.00 -0.02 0.00 0.00 31.44 27.87 1qxf n GLU 14 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1qxf s HIS 15 N -1.43 3.49 0.06 -0.32 2.46 -1.18 -4.78 115.29 113.60 1qxf s HIS 15 Ca 0.00 0.38 -0.21 0.00 0.47 0.00 0.00 55.06 55.70 1qxf s HIS 15 Cb 0.00 -1.87 -0.06 0.00 -0.13 0.00 0.00 32.58 30.52 1qxf s HIS 15 CO 0.00 0.49 0.62 -1.21 -2.47 0.00 0.00 174.74 172.16 1qxf s GLU 16 N -2.75 4.30 0.05 2.88 2.02 -1.26 0.96 118.70 124.89 1qxf s GLU 16 Ca 0.38 0.81 -0.07 0.00 0.02 0.00 0.00 54.97 56.12 1qxf s GLU 16 Cb -0.12 -3.28 -0.01 0.00 0.10 0.00 0.00 34.13 30.82 1qxf s GLU 16 CO 0.27 0.54 0.13 -0.65 0.02 0.00 0.00 175.26 175.57 1qxf s GLN 17 N -0.81 0.65 -0.20 1.61 -0.21 0.50 -4.92 119.66 116.28 1qxf s GLN 17 Ca 0.31 -0.78 -0.01 0.00 0.02 0.00 0.00 55.36 54.90 1qxf s GLN 17 Cb -0.20 0.26 0.01 0.00 1.00 0.00 0.00 33.01 34.08 1qxf s GLN 17 CO 0.20 -0.18 -0.13 0.08 -2.12 0.00 0.00 175.29 173.15 1qxf s VAL 18 N -2.86 2.68 0.23 1.09 1.01 -1.26 0.12 120.40 121.41 1qxf s VAL 18 Ca -0.03 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.25 1qxf s VAL 18 Cb 0.00 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 1qxf s VAL 18 CO -0.06 0.49 0.03 0.27 0.00 0.00 0.00 175.10 175.83 1qxf s ILE 19 N 1.36 0.86 0.51 2.22 -4.36 -1.10 -4.97 121.20 115.72 1qxf s ILE 19 Ca 0.05 -2.01 -0.19 0.00 -0.26 0.00 0.00 60.65 58.24 1qxf s ILE 19 Cb -0.14 -2.41 -0.07 0.00 1.25 0.00 0.00 42.46 41.09 1qxf s ILE 19 CO -0.08 -0.25 1.04 -0.36 0.24 0.00 0.00 174.94 175.53 1qxf s PHE 20 N -3.54 3.03 -1.72 1.37 0.08 -1.26 -3.58 117.98 112.37 1qxf s PHE 20 Ca 0.31 1.56 0.08 0.00 0.12 0.00 0.00 56.93 58.99 1qxf s PHE 20 Cb 0.07 -3.03 0.27 0.00 -0.57 0.00 0.00 43.02 39.75 1qxf s PHE 20 CO 0.10 -0.83 1.16 -0.40 -0.10 0.00 0.00 175.22 175.14 1qxf n ASP 21 N -1.22 1.80 -2.69 1.36 5.68 -1.25 -4.15 116.55 116.08 1qxf n ASP 21 Ca 0.09 -2.08 -0.05 0.00 -0.50 0.00 0.00 54.79 52.25 1qxf n ASP 21 Cb 0.53 -0.27 0.09 0.00 -1.14 0.00 0.00 41.12 40.33 1qxf n ASP 21 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 1qxf n HIS 22 N 0.31 -1.33 -1.52 2.11 -0.00 -1.26 -4.48 115.22 109.06 1qxf n HIS 22 Ca 0.10 -1.15 -0.30 0.00 -0.00 0.00 0.00 57.72 56.37 1qxf n HIS 22 Cb 0.32 1.31 0.20 0.00 -0.00 0.00 0.00 29.99 31.81 1qxf n HIS 22 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 1qxf s PRO 23 N 0.19 -0.02 -0.06 1.57 0.04 -1.26 -4.89 135.00 130.57 1qxf s PRO 23 Ca 0.23 -0.14 0.03 0.00 0.04 0.00 0.00 61.00 61.16 1qxf s PRO 23 Cb 0.27 -1.74 -0.06 0.00 0.04 0.00 0.00 34.50 33.01 1qxf s PRO 23 CO -0.15 -2.90 -0.01 -1.13 0.04 0.00 0.00 177.00 172.85 1qxf n SER 24 N -4.17 3.64 -4.84 6.66 3.41 -1.26 -4.70 113.62 112.36 1qxf n SER 24 Ca 0.13 -0.01 -0.21 0.00 -0.26 0.00 0.00 58.87 58.51 1qxf n SER 24 Cb 0.59 0.35 -0.04 0.00 -0.26 0.00 0.00 64.21 64.85 1qxf n SER 24 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1qxf s THR 25 N -2.13 4.10 0.34 6.66 -4.23 -1.26 -4.90 115.64 114.23 1qxf s THR 25 Ca -0.05 -1.37 -0.29 0.00 -1.18 0.00 0.00 61.69 58.81 1qxf s THR 25 Cb 0.02 -3.33 -0.11 0.00 1.34 0.00 0.00 72.50 70.42 1qxf s THR 25 CO 0.19 -0.28 1.39 -0.63 -0.54 0.00 0.00 174.62 174.75 1qxf s ILE 26 N -2.20 2.46 -0.37 2.99 1.01 -1.26 -4.65 121.20 119.19 1qxf s ILE 26 Ca 0.36 0.46 -0.14 0.00 0.00 0.00 0.00 60.65 61.33 1qxf s ILE 26 Cb -0.07 -3.29 -0.00 0.00 0.01 0.00 0.00 42.46 39.10 1qxf s ILE 26 CO 0.26 0.10 0.27 -0.69 0.00 0.00 0.00 174.94 174.88 1qxf s VAL 27 N -1.00 5.27 -0.08 2.92 1.01 -1.04 -5.06 120.40 122.42 1qxf s VAL 27 Ca 0.52 -0.36 -0.01 0.00 0.00 0.00 0.00 61.98 62.12 1qxf s VAL 27 Cb -0.42 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 1qxf s VAL 27 CO 0.55 -0.12 -0.02 -0.54 0.00 0.00 0.00 175.10 174.97 1qxf s LYS 28 N 1.72 2.92 0.01 2.72 1.02 -1.26 -1.98 119.74 124.89 1qxf s LYS 28 Ca 0.06 -0.45 -0.33 0.00 0.02 0.00 0.00 55.97 55.28 1qxf s LYS 28 Cb -0.18 -2.74 -0.11 0.00 -0.52 0.00 0.00 37.83 34.28 1qxf s LYS 28 CO 0.10 0.69 1.86 0.00 -0.92 0.00 0.00 175.35 177.08 1qxf n ILE 30 N 4.93 1.25 0.00 0.00 -5.35 -1.26 -0.83 119.36 118.10 1qxf n ILE 30 Ca 0.20 0.32 0.00 0.00 -0.27 0.00 0.00 62.75 63.01 1qxf n ILE 30 Cb 0.33 -1.15 0.00 0.00 -1.74 0.00 0.00 39.64 37.08 1qxf n ILE 30 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1qxf n ILE 31 N -1.56 0.00 -0.11 7.28 2.08 -1.26 -4.79 119.36 120.99 1qxf n ILE 31 Ca 0.02 0.12 -0.23 0.00 0.56 0.00 0.00 62.75 63.22 1qxf n ILE 31 Cb 0.13 -0.24 -0.10 0.00 -0.75 0.00 0.00 39.64 38.68 1qxf n ILE 31 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1qxf n GLY 33 N 1.38 0.80 3.86 0.00 0.00 -0.01 -4.96 105.19 106.26 1qxf n GLY 33 Ca -0.38 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.30 1qxf n GLY 33 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1qxf s ARG 34 N 0.00 3.90 0.05 1.61 1.70 -1.26 -4.40 118.95 120.56 1qxf s ARG 34 Ca 0.00 0.41 -0.31 0.00 -0.47 0.00 0.00 55.73 55.37 1qxf s ARG 34 Cb 0.00 -2.76 -0.08 0.00 -0.57 0.00 0.00 34.95 31.55 1qxf s ARG 34 CO 0.00 0.37 1.62 0.99 -1.08 0.00 0.00 175.30 177.20 1qxf s THR 35 N -1.67 3.17 -0.02 4.99 2.01 -1.26 0.95 115.64 123.81 1qxf s THR 35 Ca 0.44 0.58 0.06 0.00 0.31 0.00 0.00 61.69 63.08 1qxf s THR 35 Cb -0.13 -3.37 -0.10 0.00 0.01 0.00 0.00 72.50 68.91 1qxf s THR 35 CO 0.20 -0.01 0.12 1.33 -0.69 0.00 0.00 174.62 175.58 1qxf n VAL 36 N 4.77 0.08 -3.70 3.82 0.24 -0.84 -4.90 118.33 117.80 1qxf n VAL 36 Ca 0.16 -0.17 -0.13 0.00 -2.04 0.00 0.00 64.34 62.15 1qxf n VAL 36 Cb 0.41 0.13 -0.09 0.00 -1.47 0.00 0.00 33.84 32.82 1qxf n VAL 36 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qxf s ALA 37 N -2.40 -1.27 -0.19 2.33 0.00 -1.22 -0.88 121.76 118.13 1qxf s ALA 37 Ca -0.03 1.45 0.01 0.00 0.00 0.00 0.00 51.96 53.39 1qxf s ALA 37 Cb 0.04 -0.84 0.04 0.00 0.00 0.00 0.00 23.12 22.35 1qxf s ALA 37 CO 0.27 -0.24 -0.10 -1.21 0.00 0.00 0.00 175.76 174.48 1qxf s GLU 38 N 0.29 1.99 -0.96 0.00 2.02 -0.81 -2.49 118.70 118.74 1qxf s GLU 38 Ca -0.00 -0.76 -0.07 0.00 0.02 0.00 0.00 54.97 54.16 1qxf s GLU 38 Cb -0.04 -2.32 -0.10 0.00 0.10 0.00 0.00 34.13 31.78 1qxf s GLU 38 CO 0.00 -0.40 2.56 -0.35 0.02 0.00 0.00 175.26 177.09 1qxf n PRO 39 N 4.72 2.51 -1.65 0.39 -0.04 -1.26 -2.69 135.00 136.99 1qxf n PRO 39 Ca -0.15 -1.56 -0.46 0.00 -0.04 0.00 0.00 63.50 61.30 1qxf n PRO 39 Cb 0.47 -2.45 -0.03 0.00 -0.04 0.00 0.00 33.50 31.45 1qxf n PRO 39 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1qxf n THR 40 N 3.66 0.79 0.00 0.52 5.66 -1.25 -4.48 114.28 119.18 1qxf n THR 40 Ca 0.54 -0.20 0.00 0.00 -3.05 0.00 0.00 64.05 61.34 1qxf n THR 40 Cb 0.28 -1.33 0.00 0.00 -1.55 0.00 0.00 70.33 67.73 1qxf n THR 40 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1qxf n GLY 41 N 2.29 2.13 0.33 1.09 0.00 -1.26 -3.52 105.19 106.25 1qxf n GLY 41 Ca 0.13 0.40 -0.04 0.00 0.00 0.00 0.00 46.02 46.52 1qxf n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qxf n GLY 42 N 0.00 -0.36 3.74 -0.02 0.00 -1.26 -4.98 105.19 102.31 1qxf n GLY 42 Ca 0.00 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 1qxf n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qxf s LYS 43 N -1.92 4.26 0.05 1.61 1.02 -1.23 -4.91 119.74 118.62 1qxf s LYS 43 Ca -0.12 2.31 -0.19 0.00 0.02 0.00 0.00 55.97 57.99 1qxf s LYS 43 Cb 0.02 -3.11 -0.06 0.00 -0.52 0.00 0.00 37.83 34.15 1qxf s LYS 43 CO 0.17 -0.44 0.56 0.20 -0.92 0.00 0.00 175.35 174.93 1qxf s GLY 44 N 0.41 2.65 -0.09 -3.33 0.00 -1.26 -3.85 107.32 101.85 1qxf s GLY 44 Ca 0.60 0.02 0.04 0.00 0.00 0.00 0.00 44.72 45.37 1qxf s GLY 44 CO 0.43 0.49 -0.21 0.21 0.00 0.00 0.00 173.10 174.02 1qxf s ASN 45 N -0.95 2.75 -0.18 1.64 3.84 -1.09 -4.72 114.94 116.23 1qxf s ASN 45 Ca 0.29 -0.49 -0.25 0.00 0.21 0.00 0.00 52.86 52.62 1qxf s ASN 45 Cb -0.19 -1.21 -0.01 0.00 -0.55 0.00 0.00 41.25 39.29 1qxf s ASN 45 CO 0.18 0.14 0.81 -0.63 -2.79 0.00 0.00 177.10 174.80 1qxf s ILE 46 N 0.37 4.89 -0.63 -5.21 1.09 -1.26 -1.92 121.20 118.53 1qxf s ILE 46 Ca -0.16 1.57 -0.02 0.00 -1.10 0.00 0.00 60.65 60.94 1qxf s ILE 46 Cb -0.17 -4.11 0.40 0.00 -1.06 0.00 0.00 42.46 37.52 1qxf s ILE 46 CO 0.07 0.03 2.05 0.29 -0.10 0.00 0.00 174.94 177.28 1qxf n LYS 47 N 5.30 2.56 -4.03 2.79 5.02 -0.06 -4.91 118.16 124.84 1qxf n LYS 47 Ca 0.04 -3.05 -0.10 0.00 -2.02 0.00 0.00 58.31 53.18 1qxf n LYS 47 Cb 0.49 -2.19 -0.08 0.00 -0.02 0.00 0.00 35.03 33.23 1qxf n LYS 47 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qxf s ALA 48 N -3.53 0.29 -0.45 7.82 0.00 -1.20 -4.80 121.76 119.90 1qxf s ALA 48 Ca 0.59 -1.10 -0.28 0.00 0.00 0.00 0.00 51.96 51.17 1qxf s ALA 48 Cb 0.46 0.92 0.00 0.00 0.00 0.00 0.00 23.12 24.51 1qxf s ALA 48 CO -0.04 -0.62 1.51 -2.00 0.00 0.00 0.00 175.76 174.61 1qxf s GLU 49 N -4.01 3.40 -0.01 0.00 2.12 -1.11 -4.86 118.70 114.24 1qxf s GLU 49 Ca 0.21 0.89 -0.30 0.00 0.36 0.00 0.00 54.97 56.13 1qxf s GLU 49 Cb 0.04 -4.10 -0.05 0.00 0.26 0.00 0.00 34.13 30.28 1qxf s GLU 49 CO 0.02 -1.79 1.31 0.42 -0.54 0.00 0.00 175.26 174.69 1qxf s ILE 50 N 6.09 3.91 0.00 -3.70 1.01 -1.26 -1.82 121.20 125.43 1qxf s ILE 50 Ca 0.63 1.29 0.00 0.00 0.00 0.00 0.00 60.65 62.57 1qxf s ILE 50 Cb -0.14 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1qxf s ILE 50 CO 0.30 0.01 0.00 -0.38 0.00 0.00 0.00 174.94 174.87 1qxf n ILE 51 N 4.55 0.00 -3.54 2.92 2.08 -0.59 -4.95 119.36 119.82 1qxf n ILE 51 Ca 0.12 0.14 -0.01 0.00 0.56 0.00 0.00 62.75 63.56 1qxf n ILE 51 Cb 0.45 -0.43 0.01 0.00 -0.75 0.00 0.00 39.64 38.91 1qxf n ILE 51 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1qxf n GLU 52 N -0.93 0.22 -2.38 0.38 2.13 -1.14 -5.04 120.64 113.88 1qxf n GLU 52 Ca 0.00 -0.49 -0.39 0.00 0.66 0.00 0.00 57.16 56.94 1qxf n GLU 52 Cb 0.00 0.66 -0.03 0.00 0.27 0.00 0.00 31.44 32.33 1qxf n GLU 52 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 1qxf s TYR 53 N -5.00 3.26 0.37 4.31 1.51 -1.26 -0.95 117.35 119.58 1qxf s TYR 53 Ca 0.07 1.60 -0.06 0.00 -1.01 0.00 0.00 57.07 57.67 1qxf s TYR 53 Cb -0.01 -3.34 -0.05 0.00 -0.11 0.00 0.00 41.96 38.45 1qxf s TYR 53 CO 0.02 -1.01 0.67 0.08 -1.11 0.00 0.00 175.55 174.20 1qxf s VAL 54 N -1.35 4.93 0.00 0.71 1.01 -1.26 -4.77 120.40 119.66 1qxf s VAL 54 Ca 0.53 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.74 1qxf s VAL 54 Cb -0.30 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.31 1qxf s VAL 54 CO 0.39 -0.51 0.00 -0.67 0.00 0.00 0.00 175.10 174.31 1qxf n ASP 55 N -1.37 0.00 -3.71 3.32 2.03 -1.26 -4.78 116.55 110.78 1qxf n ASP 55 Ca -0.00 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.03 1qxf n ASP 55 Cb 0.54 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.79 1qxf n ASP 55 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1qxf n GLN 56 N -0.43 0.00 -0.97 -0.67 6.02 -1.26 -4.82 117.38 115.25 1qxf n GLN 56 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.70 1qxf n GLN 56 Cb 0.00 -1.08 0.21 0.00 1.02 0.00 0.00 30.24 30.39 1qxf n GLN 56 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1qxf s ILE 57 N 4.62 1.96 -2.71 5.09 1.01 -1.26 -5.12 121.20 124.79 1qxf s ILE 57 Ca 1.11 0.00 0.26 0.00 0.00 0.00 0.00 60.65 62.02 1qxf s ILE 57 Cb -0.91 -2.36 0.40 0.00 0.01 0.00 0.00 42.46 39.59 1qxf s ILE 57 CO 0.43 0.00 1.54 1.21 0.00 0.00 0.00 174.94 178.12