#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 1.93 -0.25 0.00 1.02 -1.26 -2.76 119.74 118.42 1qcv s LYS 2 Ca 0.00 -1.95 -0.01 0.00 0.02 0.00 0.00 55.97 54.03 1qcv s LYS 2 Cb 0.00 -1.74 0.07 0.00 -0.52 0.00 0.00 37.83 35.64 1qcv s LYS 2 CO 0.00 0.07 0.03 -1.58 -0.92 0.00 0.00 175.35 172.95 1qcv s TRP 3 N -2.62 1.84 0.16 3.18 0.52 -0.79 -3.17 118.94 118.06 1qcv s TRP 3 Ca 0.34 -1.54 -0.11 0.00 0.02 0.00 0.00 56.10 54.81 1qcv s TRP 3 Cb 0.04 -1.53 -0.07 0.00 -1.15 0.00 0.00 33.47 30.77 1qcv s TRP 3 CO 0.18 -0.76 0.50 0.54 0.02 0.00 0.00 176.95 177.43 1qcv s VAL 4 N 1.58 4.96 -0.52 4.03 0.11 -0.45 -0.91 120.40 129.20 1qcv s VAL 4 Ca 0.01 0.56 -0.15 0.00 -2.93 0.00 0.00 61.98 59.48 1qcv s VAL 4 Cb -0.18 -3.67 0.12 0.00 -1.53 0.00 0.00 36.38 31.12 1qcv s VAL 4 CO -0.13 0.13 0.46 -0.22 -3.33 0.00 0.00 175.10 172.01 1qcv s LEU 5 N -2.30 6.00 0.65 2.54 0.20 -0.17 -0.83 118.68 124.77 1qcv s LEU 5 Ca 0.40 -1.70 0.32 0.00 0.69 0.00 0.00 54.13 53.84 1qcv s LEU 5 Cb -0.13 -2.18 1.74 0.00 -0.43 0.00 0.00 46.19 45.19 1qcv s LEU 5 CO 0.20 -0.79 2.01 0.11 -0.29 0.00 0.00 176.35 177.59 1qcv h LYS 6 N 8.80 0.00 -0.00 1.98 1.79 -1.90 0.91 116.57 128.15 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 -0.12 -0.89 -1.08 0.00 0.00 179.45 178.34 1qcv n ILE 7 N -3.16 0.00 0.00 1.86 -0.00 -1.26 -4.63 119.36 112.17 1qcv n ILE 7 Ca -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.74 1qcv n ILE 7 Cb 0.36 -0.31 0.00 0.00 -0.00 0.00 0.00 39.64 39.69 1qcv n ILE 7 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 1qcv n THR 8 N -1.46 0.00 0.00 1.39 -2.24 0.48 -5.05 114.28 107.40 1qcv n THR 8 Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1qcv n THR 8 Cb 0.33 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 1qcv n THR 8 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qcv n GLY 9 N 0.27 1.71 3.63 3.38 0.00 0.29 -5.00 105.19 109.47 1qcv n GLY 9 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 1.63 -4.18 1.61 9.36 -1.26 -4.38 117.16 119.93 1qcv n TYR 10 Ca 0.00 0.63 -0.31 0.00 3.32 0.00 0.00 57.90 61.54 1qcv n TYR 10 Cb 0.00 -2.31 -0.16 0.00 -0.63 0.00 0.00 39.34 36.24 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 -1.11 1.73 -0.43 2.97 -1.09 -1.26 -1.00 121.20 121.01 1qcv s ILE 11 Ca 0.58 -0.74 -0.25 0.00 -2.23 0.00 0.00 60.65 58.01 1qcv s ILE 11 Cb -0.63 -1.59 0.02 0.00 -1.58 0.00 0.00 42.46 38.69 1qcv s ILE 11 CO 0.60 0.49 0.88 -0.47 -1.23 0.00 0.00 174.94 175.21 1qcv s TYR 12 N 1.29 2.98 -1.25 3.97 5.04 -0.08 -4.83 117.35 124.47 1qcv s TYR 12 Ca 0.02 0.42 -0.19 0.00 -2.44 0.00 0.00 57.07 54.88 1qcv s TYR 12 Cb -0.13 -3.79 0.06 0.00 0.35 0.00 0.00 41.96 38.45 1qcv s TYR 12 CO -0.09 -0.99 1.70 0.16 -1.34 0.00 0.00 175.55 174.99 1qcv s ASP 13 N 2.13 6.70 0.65 4.32 -4.77 -1.24 -1.88 116.67 122.58 1qcv s ASP 13 Ca 0.35 -2.25 0.31 0.00 -3.30 0.00 0.00 52.55 47.66 1qcv s ASP 13 Cb -0.11 -2.58 1.68 0.00 -1.09 0.00 0.00 42.92 40.82 1qcv s ASP 13 CO 0.23 -1.31 1.97 -0.08 0.70 0.00 0.00 175.17 176.68 1qcv h GLU 14 N 8.03 0.00 0.00 2.11 4.81 -1.72 1.06 114.58 128.87 1qcv h GLU 14 Ca 0.40 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.60 1qcv h GLU 14 Cb 0.90 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.27 1qcv h GLU 14 CO 1.44 0.00 -0.13 0.22 -0.73 0.00 0.00 179.01 179.82 1qcv h ASP 15 N 0.00 0.00 0.00 1.04 3.58 -1.86 -3.27 116.42 115.91 1qcv h ASP 15 Ca 0.04 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.41 1qcv h ASP 15 Cb 0.66 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.70 1qcv h ASP 15 CO -0.00 0.13 -1.28 0.00 -2.88 0.00 0.00 179.24 175.21 1qcv n ALA 16 N -2.48 2.17 0.00 -0.78 0.00 0.96 -4.31 120.51 116.07 1qcv n ALA 16 Ca -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1qcv n ALA 16 Cb 0.20 0.41 0.00 0.00 0.00 0.00 0.00 19.45 20.06 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 3.07 1.19 0.00 0.00 0.00 0.33 0.10 105.19 109.88 1qcv n GLY 17 Ca -0.09 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1qcv n GLY 17 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1qcv n ASP 18 N 0.00 0.00 0.13 1.61 2.03 -1.26 -3.71 116.55 115.35 1qcv n ASP 18 Ca 0.00 0.00 0.11 0.00 0.52 0.00 0.00 54.79 55.42 1qcv n ASP 18 Cb 0.00 0.00 0.49 0.00 -0.72 0.00 0.00 41.12 40.89 1qcv n ASP 18 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1qcv n PRO 19 N 0.00 0.17 0.14 -0.67 -0.04 -1.26 -1.68 135.00 131.66 1qcv n PRO 19 Ca 0.00 0.47 -0.23 0.00 -0.04 0.00 0.00 63.50 63.70 1qcv n PRO 19 Cb 0.00 -1.87 -0.16 0.00 -0.04 0.00 0.00 33.50 31.44 1qcv n PRO 19 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1qcv h ASP 20 N 0.00 0.78 -0.38 3.54 3.32 -1.96 -3.26 116.42 118.47 1qcv h ASP 20 Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 57.03 56.22 1qcv h ASP 20 Cb 0.26 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1qcv h ASP 20 CO 0.00 1.65 0.00 0.59 -1.72 0.00 0.00 179.24 179.76 1qcv n ASN 21 N -3.69 3.60 -3.35 6.45 3.02 -1.05 -4.92 115.26 115.31 1qcv n ASN 21 Ca -0.15 -2.45 -0.15 0.00 -0.03 0.00 0.00 54.58 51.80 1qcv n ASN 21 Cb 1.09 -0.55 0.03 0.00 -0.61 0.00 0.00 39.78 39.74 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 0.57 -1.17 3.68 7.41 0.00 -1.14 -5.00 105.19 109.55 1qcv n GLY 22 Ca 0.17 0.52 -0.24 0.00 0.00 0.00 0.00 46.02 46.46 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 -3.21 2.74 0.42 -0.61 -1.09 -0.67 -4.99 121.20 113.79 1qcv s ILE 23 Ca 0.23 -1.85 -0.22 0.00 -2.23 0.00 0.00 60.65 56.59 1qcv s ILE 23 Cb -0.06 -2.88 -0.10 0.00 -1.58 0.00 0.00 42.46 37.84 1qcv s ILE 23 CO 0.79 -0.17 0.97 -0.44 -1.23 0.00 0.00 174.94 174.85 1qcv s SER 24 N -3.78 6.91 -0.50 3.58 0.01 -1.26 -4.64 113.70 114.03 1qcv s SER 24 Ca 0.36 1.76 -0.28 0.00 1.31 0.00 0.00 55.95 59.11 1qcv s SER 24 Cb -0.01 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.67 1qcv s SER 24 CO 0.21 -0.38 1.67 -2.16 0.41 0.00 0.00 173.24 172.99 1qcv s PRO 25 N -2.98 3.12 0.00 12.44 0.04 -1.26 -3.54 135.00 142.83 1qcv s PRO 25 Ca 0.61 0.82 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1qcv s PRO 25 Cb -0.12 -4.22 0.00 0.00 0.04 0.00 0.00 34.50 30.20 1qcv s PRO 25 CO 0.16 -2.14 0.00 0.41 0.04 0.00 0.00 177.00 175.48 1qcv n GLY 26 N 5.43 0.80 3.36 0.56 0.00 0.29 -4.94 105.19 110.69 1qcv n GLY 26 Ca 0.18 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.52 2.74 -0.08 2.61 2.01 -1.23 -4.99 115.64 114.18 1qcv s THR 27 Ca 0.00 -0.81 -0.30 0.00 0.31 0.00 0.00 61.69 60.90 1qcv s THR 27 Cb 0.00 -2.09 -0.02 0.00 0.01 0.00 0.00 72.50 70.40 1qcv s THR 27 CO 0.00 0.56 1.14 -0.54 -0.69 0.00 0.00 174.62 175.09 1qcv s LYS 28 N -0.08 4.36 0.30 4.92 3.01 -1.26 -4.66 119.74 126.33 1qcv s LYS 28 Ca -0.04 1.58 0.04 0.00 -1.01 0.00 0.00 55.97 56.55 1qcv s LYS 28 Cb -0.14 -3.57 0.77 0.00 -1.01 0.00 0.00 37.83 33.89 1qcv s LYS 28 CO 0.04 -0.43 1.65 0.35 0.51 0.00 0.00 175.35 177.47 1qcv h PHE 29 N 7.39 0.47 -0.42 3.18 3.04 -1.96 0.70 116.94 129.34 1qcv h PHE 29 Ca -0.32 0.05 0.12 0.00 3.98 0.00 0.00 57.97 61.79 1qcv h PHE 29 Cb 1.15 -0.06 -0.02 0.00 2.56 0.00 0.00 35.95 39.58 1qcv h PHE 29 CO 0.73 -0.19 0.47 1.05 -2.02 0.00 0.00 178.31 178.35 1qcv h GLU 30 N 0.24 0.00 0.00 1.11 4.11 -1.99 -3.33 114.58 114.72 1qcv h GLU 30 Ca 0.58 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.01 1qcv h GLU 30 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1qcv h GLU 30 CO -0.64 0.00 0.00 -1.91 0.07 0.00 0.00 179.01 176.53 1qcv n GLU 31 N -3.66 0.00 -0.90 1.06 2.13 0.24 -5.09 120.64 114.42 1qcv n GLU 31 Ca 0.08 0.00 0.12 0.00 0.66 0.00 0.00 57.16 58.02 1qcv n GLU 31 Cb 0.65 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.32 1qcv n GLU 31 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1qcv n LEU 32 N -0.36 -0.44 0.00 4.31 4.77 -0.84 -4.86 117.00 119.57 1qcv n LEU 32 Ca 0.00 0.97 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 1qcv n LEU 32 Cb 0.00 -2.92 0.00 0.00 -2.33 0.00 0.00 43.42 38.17 1qcv n LEU 32 CO 0.00 -2.40 0.00 -0.81 -1.33 0.00 0.00 177.39 172.85 1qcv n PRO 33 N -2.84 0.88 -3.26 3.23 -0.04 -1.26 -5.07 135.00 126.66 1qcv n PRO 33 Ca 0.00 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.22 1qcv n PRO 33 Cb 0.60 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 34.06 1qcv n PRO 33 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1qcv s ASP 34 N -1.00 6.25 -1.48 3.54 1.01 -1.26 -4.20 116.67 119.53 1qcv s ASP 34 Ca 0.00 0.49 0.00 0.00 0.71 0.00 0.00 52.55 53.75 1qcv s ASP 34 Cb 0.00 -2.01 0.00 0.00 1.01 0.00 0.00 42.92 41.92 1qcv s ASP 34 CO 0.00 -0.37 0.00 -0.67 0.21 0.00 0.00 175.17 174.34 1qcv n ASP 35 N -1.87 -5.19 -4.62 0.27 2.03 -1.26 -4.89 116.55 101.03 1qcv n ASP 35 Ca -0.04 0.35 -0.43 0.00 0.52 0.00 0.00 54.79 55.19 1qcv n ASP 35 Cb 0.56 -4.17 -0.03 0.00 -0.72 0.00 0.00 41.12 36.77 1qcv n ASP 35 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 1qcv s TRP 36 N -2.16 1.64 0.00 -0.67 -0.00 -1.26 -4.89 118.94 111.61 1qcv s TRP 36 Ca 0.00 0.43 0.00 0.00 -0.00 0.00 0.00 56.10 56.53 1qcv s TRP 36 Cb 0.00 -4.04 0.00 0.00 -0.00 0.00 0.00 33.47 29.43 1qcv s TRP 36 CO 0.00 -3.63 0.00 1.33 -0.00 0.00 0.00 176.95 174.65 1qcv n VAL 37 N 6.95 0.00 0.12 5.86 0.24 -1.26 -3.95 118.33 126.29 1qcv n VAL 37 Ca 0.23 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.53 1qcv n VAL 37 Cb 0.45 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 1qcv n VAL 37 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qcv n ALA 38 N -3.00 0.00 -1.00 2.33 0.00 -1.26 -5.06 120.51 112.52 1qcv n ALA 38 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1qcv n ALA 38 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1qcv n ALA 38 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1qcv n PRO 39 N -3.14 0.19 -0.02 0.00 -0.04 -1.26 -5.02 135.00 125.70 1qcv n PRO 39 Ca 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.45 1qcv n PRO 39 Cb 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.40 1qcv n PRO 39 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 1qcv n ILE 40 N -1.31 0.31 -1.57 0.52 3.06 -1.26 -4.91 119.36 114.21 1qcv n ILE 40 Ca 0.00 -0.25 -0.21 0.00 -2.50 0.00 0.00 62.75 59.79 1qcv n ILE 40 Cb 0.00 -0.40 -0.06 0.00 0.54 0.00 0.00 39.64 39.73 1qcv n ILE 40 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 1qcv s THR 41 N -2.30 3.01 0.22 9.51 -4.23 -1.26 -4.68 115.64 115.90 1qcv s THR 41 Ca -0.03 -0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.47 1qcv s THR 41 Cb 0.03 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 70.85 1qcv s THR 41 CO 0.30 -0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.97 1qcv n GLY 42 N 6.55 -1.75 2.39 3.99 0.00 -1.26 -4.77 105.19 110.34 1qcv n GLY 42 Ca 0.44 -1.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.13 1qcv n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qcv n ALA 43 N -1.58 0.96 -2.60 4.61 0.00 -1.26 -4.90 120.51 115.75 1qcv n ALA 43 Ca 0.01 -2.67 -0.39 0.00 0.00 0.00 0.00 53.44 50.39 1qcv n ALA 43 Cb 0.42 -1.01 -0.09 0.00 0.00 0.00 0.00 19.45 18.77 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 -1.24 3.98 0.49 0.00 0.04 -1.26 -4.86 135.00 132.14 1qcv s PRO 44 Ca 0.33 -0.02 0.18 0.00 0.04 0.00 0.00 61.00 61.53 1qcv s PRO 44 Cb 0.30 -3.67 1.21 0.00 0.04 0.00 0.00 34.50 32.38 1qcv s PRO 44 CO -0.09 -0.29 2.04 1.57 0.04 0.00 0.00 177.00 180.28 1qcv h LYS 45 N 8.21 0.16 -2.40 4.56 5.09 -1.93 -2.74 116.57 127.51 1qcv h LYS 45 Ca -0.32 -0.01 -0.40 0.00 0.09 0.00 0.00 60.65 60.01 1qcv h LYS 45 Cb 1.16 -0.04 -0.04 0.00 0.10 0.00 0.00 32.23 33.42 1qcv h LYS 45 CO 0.64 0.11 1.35 -1.13 -2.09 0.00 0.00 179.45 178.32 1qcv n SER 46 N -4.46 6.73 -1.29 7.07 3.41 -1.26 -4.15 113.62 119.66 1qcv n SER 46 Ca 0.05 -2.56 0.03 0.00 -0.26 0.00 0.00 58.87 56.13 1qcv n SER 46 Cb 0.33 -1.46 0.09 0.00 -0.26 0.00 0.00 64.21 62.91 1qcv n SER 46 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1qcv n GLU 47 N 2.83 0.84 -1.44 4.33 2.13 -1.04 -5.07 120.64 123.21 1qcv n GLU 47 Ca 0.58 -2.66 0.00 0.00 0.66 0.00 0.00 57.16 55.73 1qcv n GLU 47 Cb 0.62 -0.78 0.00 0.00 0.27 0.00 0.00 31.44 31.55 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 -0.20 0.00 -3.26 4.31 3.01 -1.26 -4.76 117.46 115.30 1qcv n PHE 48 Ca 0.12 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.61 1qcv n PHE 48 Cb 0.96 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.41 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 -1.17 0.57 1.26 -1.08 2.56 -0.01 -4.91 118.70 115.92 1qcv s GLU 49 Ca 0.00 1.10 -0.19 0.00 0.00 0.00 0.00 54.97 55.89 1qcv s GLU 49 Cb 0.00 0.63 0.28 0.00 2.00 0.00 0.00 34.13 37.04 1qcv s GLU 49 CO 0.00 -0.52 0.64 1.63 -0.56 0.00 0.00 175.26 176.45 1qcv n LYS 50 N 5.43 -3.47 -0.39 4.30 5.02 -1.26 -1.35 118.16 126.45 1qcv n LYS 50 Ca -0.04 -1.02 0.04 0.00 -2.02 0.00 0.00 58.31 55.27 1qcv n LYS 50 Cb 0.51 -1.79 0.19 0.00 -0.02 0.00 0.00 35.03 33.92 1qcv n LYS 50 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 1qcv n LEU 51 N -3.86 3.05 -4.34 -0.35 -0.00 -1.19 -4.62 117.00 105.69 1qcv n LEU 51 Ca 0.08 -1.54 -0.31 0.00 -0.00 0.00 0.00 56.01 54.25 1qcv n LEU 51 Cb 0.51 -0.53 0.21 0.00 -0.00 0.00 0.00 43.42 43.62 1qcv n LEU 51 CO 0.38 0.44 -0.14 -0.62 -0.00 0.00 0.00 177.39 177.45 1qcv n GLU 52 N 0.35 -2.09 0.00 1.47 -0.58 -1.26 -5.10 120.64 113.44 1qcv n GLU 52 Ca 0.13 -0.59 0.00 0.00 -0.42 0.00 0.00 57.16 56.28 1qcv n GLU 52 Cb 0.64 -1.87 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 1qcv n GLU 52 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18