#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qcv s LYS 2 N 0.00 1.84 -0.30 0.00 1.02 -1.26 -3.10 119.74 117.95 1qcv s LYS 2 Ca 0.00 -0.92 -0.03 0.00 0.02 0.00 0.00 55.97 55.05 1qcv s LYS 2 Cb 0.00 -2.32 0.11 0.00 -0.52 0.00 0.00 37.83 35.11 1qcv s LYS 2 CO 0.00 -1.34 0.18 -1.58 -0.92 0.00 0.00 175.35 171.69 1qcv s TRP 3 N -3.12 0.19 0.28 3.18 0.52 -0.49 -3.13 118.94 116.37 1qcv s TRP 3 Ca 0.64 -0.81 -0.10 0.00 0.02 0.00 0.00 56.10 55.85 1qcv s TRP 3 Cb -0.07 -0.80 -0.07 0.00 -1.15 0.00 0.00 33.47 31.38 1qcv s TRP 3 CO 0.44 -0.85 0.62 0.54 0.02 0.00 0.00 176.95 177.71 1qcv s VAL 4 N 2.04 4.87 -0.52 4.03 0.11 -0.80 -0.86 120.40 129.26 1qcv s VAL 4 Ca 0.10 0.55 -0.16 0.00 -2.93 0.00 0.00 61.98 59.54 1qcv s VAL 4 Cb -0.16 -3.64 0.11 0.00 -1.53 0.00 0.00 36.38 31.15 1qcv s VAL 4 CO -0.32 -0.18 0.47 -0.22 -3.33 0.00 0.00 175.10 171.53 1qcv s LEU 5 N -3.05 5.93 0.65 2.54 0.20 0.32 -1.55 118.68 123.71 1qcv s LEU 5 Ca 0.49 -1.59 0.39 0.00 0.69 0.00 0.00 54.13 54.11 1qcv s LEU 5 Cb -0.11 -2.21 2.10 0.00 -0.43 0.00 0.00 46.19 45.55 1qcv s LEU 5 CO 0.22 -0.80 2.18 0.11 -0.29 0.00 0.00 176.35 177.78 1qcv h LYS 6 N 8.86 0.00 0.00 1.98 1.79 -1.87 0.72 116.57 128.05 1qcv h LYS 6 Ca -0.29 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 1qcv h LYS 6 Cb 1.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.75 1qcv h LYS 6 CO 0.98 0.00 0.00 0.82 -1.08 0.00 0.00 179.45 180.17 1qcv h ILE 7 N 0.00 0.00 0.00 1.86 2.04 -1.91 -3.41 117.51 116.09 1qcv h ILE 7 Ca 0.00 -0.55 0.00 0.00 1.00 0.00 0.00 64.86 65.31 1qcv h ILE 7 Cb 0.22 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 1qcv h ILE 7 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 178.15 179.22 1qcv n THR 8 N -3.07 0.00 0.00 -0.27 5.66 -0.32 -5.05 114.28 111.23 1qcv n THR 8 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 1qcv n THR 8 Cb 0.33 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.11 1qcv n THR 8 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1qcv n GLY 9 N -0.39 1.63 3.52 1.09 0.00 0.24 -5.02 105.19 106.25 1qcv n GLY 9 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1qcv n GLY 9 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1qcv n TYR 10 N 0.00 -0.21 -4.25 1.61 9.36 -1.26 -4.30 117.16 118.11 1qcv n TYR 10 Ca 0.00 0.44 -0.14 0.00 3.32 0.00 0.00 57.90 61.52 1qcv n TYR 10 Cb 0.00 -2.01 -0.10 0.00 -0.63 0.00 0.00 39.34 36.60 1qcv n TYR 10 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1qcv s ILE 11 N -1.66 0.48 -0.22 2.97 1.01 -1.26 0.12 121.20 122.63 1qcv s ILE 11 Ca 0.71 -1.98 -0.03 0.00 0.00 0.00 0.00 60.65 59.35 1qcv s ILE 11 Cb -0.43 -2.34 0.07 0.00 0.01 0.00 0.00 42.46 39.77 1qcv s ILE 11 CO 0.52 -0.25 0.07 -0.47 0.00 0.00 0.00 174.94 174.80 1qcv s TYR 12 N -3.80 0.90 -1.10 3.97 5.04 -0.04 -4.92 117.35 117.40 1qcv s TYR 12 Ca 0.31 -0.92 -0.22 0.00 -2.44 0.00 0.00 57.07 53.80 1qcv s TYR 12 Cb 0.07 -1.07 0.05 0.00 0.35 0.00 0.00 41.96 41.36 1qcv s TYR 12 CO 0.08 -0.67 1.57 0.34 -1.34 0.00 0.00 175.55 175.53 1qcv s ASP 13 N 1.90 6.49 0.59 4.32 -1.08 -1.23 -1.39 116.67 126.27 1qcv s ASP 13 Ca 0.03 -1.70 0.29 0.00 -0.52 0.00 0.00 52.55 50.65 1qcv s ASP 13 Cb -0.17 -2.57 1.30 0.00 -1.46 0.00 0.00 42.92 40.02 1qcv s ASP 13 CO -0.15 -1.51 1.68 -0.08 0.52 0.00 0.00 175.17 175.62 1qcv h GLU 14 N 9.23 0.00 0.00 4.34 4.81 -1.75 1.18 114.58 132.40 1qcv h GLU 14 Ca 0.27 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 1qcv h GLU 14 Cb 0.97 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 1qcv h GLU 14 CO 1.42 0.00 -0.29 -0.44 -0.73 0.00 0.00 179.01 178.97 1qcv h ASP 15 N 0.00 0.00 0.00 1.04 3.32 -1.87 -2.82 116.42 116.09 1qcv h ASP 15 Ca 0.35 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.32 1qcv h ASP 15 Cb 1.91 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.45 1qcv h ASP 15 CO -0.00 0.29 -1.47 0.00 -1.72 0.00 0.00 179.24 176.34 1qcv n ALA 16 N -2.47 2.05 0.00 3.45 0.00 0.29 -3.76 120.51 120.06 1qcv n ALA 16 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1qcv n ALA 16 Cb 0.34 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.70 1qcv n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qcv n GLY 17 N 2.28 0.96 2.85 0.00 0.00 0.33 -2.61 105.19 109.00 1qcv n GLY 17 Ca -0.07 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1qcv n GLY 17 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1qcv s ASP 18 N -4.00 -0.71 0.40 1.61 2.15 -1.26 -3.58 116.67 111.29 1qcv s ASP 18 Ca 0.00 -0.50 0.16 0.00 0.43 0.00 0.00 52.55 52.64 1qcv s ASP 18 Cb 0.00 0.91 0.87 0.00 -0.30 0.00 0.00 42.92 44.40 1qcv s ASP 18 CO 0.00 -0.06 1.87 1.55 -0.17 0.00 0.00 175.17 178.36 1qcv h PRO 19 N 5.51 0.00 -0.11 4.34 0.13 -1.87 0.18 132.00 140.18 1qcv h PRO 19 Ca -0.00 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.03 1qcv h PRO 19 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1qcv h PRO 19 CO -0.03 0.31 -0.36 0.22 -0.23 0.00 0.00 178.00 177.91 1qcv h ASP 20 N 0.00 0.22 -0.39 1.44 1.82 -1.99 -2.75 116.42 114.77 1qcv h ASP 20 Ca -0.00 -0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.55 1qcv h ASP 20 Cb 0.59 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.54 1qcv h ASP 20 CO 0.04 0.57 0.00 0.59 -1.61 0.00 0.00 179.24 178.84 1qcv n ASN 21 N -4.07 3.25 -3.40 2.28 3.02 -0.87 -5.00 115.26 110.48 1qcv n ASN 21 Ca -0.01 -1.93 -0.15 0.00 -0.03 0.00 0.00 54.58 52.46 1qcv n ASN 21 Cb 0.44 -0.26 0.02 0.00 -0.61 0.00 0.00 39.78 39.37 1qcv n ASN 21 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qcv n GLY 22 N 1.20 -1.20 3.60 7.41 0.00 0.49 -4.99 105.19 111.70 1qcv n GLY 22 Ca 0.17 0.51 -0.26 0.00 0.00 0.00 0.00 46.02 46.44 1qcv n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qcv s ILE 23 N -3.14 2.21 -0.25 -0.61 -1.09 -0.37 -5.01 121.20 112.94 1qcv s ILE 23 Ca 0.15 -2.06 -0.40 0.00 -2.23 0.00 0.00 60.65 56.12 1qcv s ILE 23 Cb -0.04 -2.82 -0.16 0.00 -1.58 0.00 0.00 42.46 37.85 1qcv s ILE 23 CO 0.81 -0.11 1.71 -0.24 -1.23 0.00 0.00 174.94 175.88 1qcv n SER 24 N -0.91 2.33 -4.72 3.58 2.88 -1.26 -4.36 113.62 111.15 1qcv n SER 24 Ca -0.05 1.08 -0.42 0.00 -1.33 0.00 0.00 58.87 58.15 1qcv n SER 24 Cb 0.65 -1.15 -0.03 0.00 -0.75 0.00 0.00 64.21 62.93 1qcv n SER 24 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1qcv s PRO 25 N 3.28 4.39 -0.91 -1.46 0.04 -1.26 -3.61 135.00 135.48 1qcv s PRO 25 Ca 0.97 1.93 -0.05 0.00 0.04 0.00 0.00 61.00 63.89 1qcv s PRO 25 Cb -1.06 -3.28 -0.06 0.00 0.04 0.00 0.00 34.50 30.14 1qcv s PRO 25 CO 0.64 -0.30 0.79 0.41 0.04 0.00 0.00 177.00 178.58 1qcv n GLY 26 N 3.10 -0.86 3.17 0.56 0.00 -1.07 -4.87 105.19 105.21 1qcv n GLY 26 Ca 0.09 0.46 -0.29 0.00 0.00 0.00 0.00 46.02 46.28 1qcv n GLY 26 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qcv s THR 27 N -3.34 1.70 0.13 2.61 2.01 -1.07 -4.97 115.64 112.72 1qcv s THR 27 Ca 0.38 -0.84 -0.31 0.00 0.31 0.00 0.00 61.69 61.23 1qcv s THR 27 Cb -0.05 -1.47 -0.10 0.00 0.01 0.00 0.00 72.50 70.89 1qcv s THR 27 CO 0.64 0.48 1.72 -0.54 -0.69 0.00 0.00 174.62 176.22 1qcv s LYS 28 N 0.20 4.16 0.58 4.92 1.02 -1.26 -4.67 119.74 124.69 1qcv s LYS 28 Ca -0.10 2.49 0.31 0.00 0.02 0.00 0.00 55.97 58.69 1qcv s LYS 28 Cb -0.15 -3.41 1.40 0.00 -0.52 0.00 0.00 37.83 35.15 1qcv s LYS 28 CO 0.05 -0.76 1.76 0.35 -0.92 0.00 0.00 175.35 175.84 1qcv h PHE 29 N 7.85 0.00 -0.34 3.18 3.04 -1.93 0.93 116.94 129.68 1qcv h PHE 29 Ca -0.44 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.51 1qcv h PHE 29 Cb 1.21 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.72 1qcv h PHE 29 CO 0.73 0.00 0.00 -0.85 -2.02 0.00 0.00 178.31 176.17 1qcv n GLU 30 N -3.77 1.93 -0.40 1.11 0.00 -1.26 -4.11 120.64 114.15 1qcv n GLU 30 Ca 0.16 -1.44 0.00 0.00 0.00 0.00 0.00 57.16 55.89 1qcv n GLU 30 Cb 1.00 -1.36 0.00 0.00 0.00 0.00 0.00 31.44 31.08 1qcv n GLU 30 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1qcv n GLU 31 N 0.66 0.00 -0.01 3.44 1.02 0.32 -5.10 120.64 120.96 1qcv n GLU 31 Ca 0.15 -0.78 0.00 0.00 -0.02 0.00 0.00 57.16 56.51 1qcv n GLU 31 Cb 0.36 -0.43 0.00 0.00 -0.02 0.00 0.00 31.44 31.35 1qcv n GLU 31 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 1qcv n LEU 32 N 0.00 0.00 -4.83 -4.62 -0.00 -0.81 -4.76 117.00 101.98 1qcv n LEU 32 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 56.01 55.64 1qcv n LEU 32 Cb 0.64 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 44.00 1qcv n LEU 32 CO 0.00 -0.18 0.26 -2.16 -0.00 0.00 0.00 177.39 175.31 1qcv s PRO 33 N -1.00 4.08 1.14 1.47 0.04 -1.26 -5.06 135.00 134.40 1qcv s PRO 33 Ca 0.00 0.60 -0.18 0.00 0.04 0.00 0.00 61.00 61.47 1qcv s PRO 33 Cb 0.00 -3.04 0.15 0.00 0.04 0.00 0.00 34.50 31.65 1qcv s PRO 33 CO 0.00 0.53 0.18 -0.25 0.04 0.00 0.00 177.00 177.50 1qcv n ASP 34 N 1.15 -2.52 0.00 6.66 8.00 -1.26 -3.13 116.55 125.45 1qcv n ASP 34 Ca -0.07 -0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.21 1qcv n ASP 34 Cb 0.51 -0.95 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 1qcv n ASP 34 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1qcv n ASP 35 N -2.17 0.00 -4.63 -2.24 -0.08 -1.26 -4.96 116.55 101.20 1qcv n ASP 35 Ca 0.02 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 52.87 1qcv n ASP 35 Cb 0.58 -0.66 -0.02 0.00 2.34 0.00 0.00 41.12 43.36 1qcv n ASP 35 CO 0.00 0.00 0.00 0.86 0.12 0.00 0.00 177.20 178.18 1qcv s TRP 36 N -2.52 2.78 0.00 -0.67 -0.00 -1.18 -4.83 118.94 112.52 1qcv s TRP 36 Ca 0.00 0.91 0.00 0.00 -0.00 0.00 0.00 56.10 57.01 1qcv s TRP 36 Cb 0.00 -3.94 0.00 0.00 -0.00 0.00 0.00 33.47 29.53 1qcv s TRP 36 CO 0.00 -1.48 0.00 1.33 -0.00 0.00 0.00 176.95 176.80 1qcv n VAL 37 N 6.25 0.00 -3.58 5.86 0.24 -1.26 -4.88 118.33 120.96 1qcv n VAL 37 Ca 0.14 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.31 1qcv n VAL 37 Cb 0.47 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.78 1qcv n VAL 37 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qcv s ALA 38 N -1.31 -1.87 0.25 2.33 0.00 -1.26 -4.91 121.76 114.99 1qcv s ALA 38 Ca 0.00 1.62 0.09 0.00 0.00 0.00 0.00 51.96 53.67 1qcv s ALA 38 Cb 0.00 -0.69 0.29 0.00 0.00 0.00 0.00 23.12 22.72 1qcv s ALA 38 CO 0.00 -0.32 1.58 -1.00 0.00 0.00 0.00 175.76 176.02 1qcv h PRO 39 N 3.32 0.04 0.44 0.00 0.13 -2.01 -2.73 132.00 131.19 1qcv h PRO 39 Ca -0.24 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.84 1qcv h PRO 39 Cb 1.16 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1qcv h PRO 39 CO 0.26 0.68 -0.21 0.82 -0.23 0.00 0.00 178.00 179.32 1qcv h ILE 40 N 0.03 0.32 -0.92 -3.56 2.04 -2.05 -3.44 117.51 109.92 1qcv h ILE 40 Ca -0.01 -0.57 -0.11 0.00 1.00 0.00 0.00 64.86 65.17 1qcv h ILE 40 Cb 1.15 0.48 -0.17 0.00 -0.74 0.00 0.00 36.82 37.55 1qcv h ILE 40 CO 0.09 0.06 -0.45 0.28 0.00 0.00 0.00 178.15 178.13 1qcv s THR 41 N -4.17 -0.92 0.03 -0.27 -1.32 -1.24 -5.15 115.64 102.59 1qcv s THR 41 Ca -0.12 -0.71 -0.06 0.00 -1.21 0.00 0.00 61.69 59.58 1qcv s THR 41 Cb 0.01 0.00 -0.01 0.00 -1.51 0.00 0.00 72.50 71.00 1qcv s THR 41 CO 0.42 0.00 0.11 -0.83 -2.21 0.00 0.00 174.62 172.11 1qcv s GLY 42 N 1.11 0.13 0.01 6.08 0.00 -1.03 -4.76 107.32 108.86 1qcv s GLY 42 Ca 0.26 -0.42 0.00 0.00 0.00 0.00 0.00 44.72 44.56 1qcv s GLY 42 CO -0.06 -0.56 0.00 0.00 0.00 0.00 0.00 173.10 172.48 1qcv n ALA 43 N 0.97 0.00 -2.38 3.20 0.00 -1.26 -4.44 120.51 116.59 1qcv n ALA 43 Ca -0.20 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 52.95 1qcv n ALA 43 Cb 0.58 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.00 1qcv n ALA 43 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1qcv s PRO 44 N -2.00 3.67 -0.01 0.00 0.04 -1.26 -4.94 135.00 130.50 1qcv s PRO 44 Ca 0.00 0.18 -0.22 0.00 0.04 0.00 0.00 61.00 60.99 1qcv s PRO 44 Cb 0.00 -2.53 -0.20 0.00 0.04 0.00 0.00 34.50 31.81 1qcv s PRO 44 CO 0.00 0.08 1.16 0.87 0.04 0.00 0.00 177.00 179.15 1qcv h LYS 45 N 1.34 0.28 -3.11 4.56 1.79 -2.01 -3.33 116.57 116.09 1qcv h LYS 45 Ca -0.48 -0.23 -0.54 0.00 -2.18 0.00 0.00 60.65 57.23 1qcv h LYS 45 Cb 1.19 0.05 0.02 0.00 -1.58 0.00 0.00 32.23 31.91 1qcv h LYS 45 CO 0.65 0.88 3.20 0.43 -1.08 0.00 0.00 179.45 183.53 1qcv n SER 46 N -4.48 7.20 0.00 0.86 7.64 -1.26 -3.91 113.62 119.68 1qcv n SER 46 Ca -0.09 -2.47 0.00 0.00 1.01 0.00 0.00 58.87 57.33 1qcv n SER 46 Cb 0.48 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.30 1qcv n SER 46 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1qcv n GLU 47 N 3.74 3.03 0.00 1.43 2.13 -1.25 -5.07 120.64 124.65 1qcv n GLU 47 Ca 0.65 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.47 1qcv n GLU 47 Cb 0.22 -0.88 0.00 0.00 0.27 0.00 0.00 31.44 31.05 1qcv n GLU 47 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1qcv n PHE 48 N -1.64 -3.07 -3.65 4.31 3.01 -1.25 -4.69 117.46 110.48 1qcv n PHE 48 Ca 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.42 1qcv n PHE 48 Cb 0.38 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.79 1qcv n PHE 48 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1qcv s GLU 49 N -2.30 0.60 1.11 -1.08 2.12 -0.60 -4.92 118.70 113.62 1qcv s GLU 49 Ca 0.00 1.34 -0.15 0.00 0.36 0.00 0.00 54.97 56.52 1qcv s GLU 49 Cb 0.00 0.60 0.16 0.00 0.26 0.00 0.00 34.13 35.15 1qcv s GLU 49 CO 0.00 -0.19 0.48 1.63 -0.54 0.00 0.00 175.26 176.64 1qcv n LYS 50 N 5.08 -1.66 0.10 4.30 5.02 -1.26 -1.91 118.16 127.82 1qcv n LYS 50 Ca -0.14 -0.46 0.01 0.00 -2.02 0.00 0.00 58.31 55.70 1qcv n LYS 50 Cb 0.52 -1.93 -0.02 0.00 -0.02 0.00 0.00 35.03 33.59 1qcv n LYS 50 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1qcv h LEU 51 N -2.21 0.00 -9.85 -0.35 6.46 -1.93 -3.43 115.31 104.00 1qcv h LEU 51 Ca -0.54 0.00 -0.47 0.00 -0.12 0.00 0.00 57.88 56.74 1qcv h LEU 51 Cb 1.33 0.00 0.22 0.00 -0.73 0.00 0.00 40.66 41.49 1qcv h LEU 51 CO 0.42 0.55 -0.62 -1.84 -0.62 0.00 0.00 178.44 176.32 1qcv n GLU 52 N -3.12 -1.45 -0.34 1.25 0.28 -1.26 -5.10 120.64 110.90 1qcv n GLU 52 Ca -0.02 -0.39 0.00 0.00 -0.16 0.00 0.00 57.16 56.59 1qcv n GLU 52 Cb 0.78 -1.90 0.00 0.00 1.43 0.00 0.00 31.44 31.75 1qcv n GLU 52 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50