#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gab n ILE 2 N 0.00 1.29 0.25 1.09 5.41 -1.26 -4.86 119.36 121.28 1gab n ILE 2 Ca 0.00 -3.24 0.10 0.00 1.00 0.00 0.00 62.75 60.61 1gab n ILE 2 Cb 0.00 0.60 0.64 0.00 -0.71 0.00 0.00 39.64 40.17 1gab n ILE 2 CO 0.00 0.00 0.00 -2.24 0.00 0.00 0.00 176.55 174.31 1gab h ASP 3 N 2.79 0.00 -0.37 4.38 3.04 -2.05 -1.68 116.42 122.54 1gab h ASP 3 Ca -0.05 0.00 0.11 0.00 -3.24 0.00 0.00 57.03 53.85 1gab h ASP 3 Cb 1.20 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.48 1gab h ASP 3 CO 0.44 0.15 0.55 1.56 -2.04 0.00 0.00 179.24 179.90 1gab h GLN 4 N 0.00 0.00 -0.38 4.15 1.08 -1.97 -2.56 115.11 115.43 1gab h GLN 4 Ca -0.00 0.00 0.04 0.00 -1.45 0.00 0.00 58.65 57.24 1gab h GLN 4 Cb 0.35 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.72 1gab h GLN 4 CO 0.02 0.00 -0.40 2.35 -0.95 0.00 0.00 178.83 179.85 1gab h TRP 5 N 0.00 -1.24 -0.60 2.96 7.01 -1.54 -0.38 115.95 122.15 1gab h TRP 5 Ca 0.17 0.07 0.23 0.00 2.11 0.00 0.00 58.89 61.47 1gab h TRP 5 Cb 1.26 0.59 -0.09 0.00 -2.10 0.00 0.00 29.16 28.83 1gab h TRP 5 CO 0.00 -0.33 0.35 -0.11 -2.79 0.00 0.00 178.44 175.56 1gab n LEU 6 N -4.59 0.16 0.00 0.65 -0.00 -0.97 -4.72 117.00 107.53 1gab n LEU 6 Ca -0.02 0.82 0.00 0.00 -0.00 0.00 0.00 56.01 56.81 1gab n LEU 6 Cb 0.23 -0.40 0.00 0.00 -0.00 0.00 0.00 43.42 43.25 1gab n LEU 6 CO -0.02 -0.91 0.00 -0.11 -0.00 0.00 0.00 177.39 176.35 1gab n LEU 7 N -4.01 0.00 -2.23 -1.96 7.94 -0.16 -4.89 117.00 111.70 1gab n LEU 7 Ca 0.20 0.00 -0.16 0.00 -1.11 0.00 0.00 56.01 54.95 1gab n LEU 7 Cb 0.73 0.00 0.03 0.00 0.53 0.00 0.00 43.42 44.71 1gab n LEU 7 CO 0.04 0.00 0.03 0.29 -1.11 0.00 0.00 177.39 176.64 1gab n LYS 8 N 13.01 -3.78 0.00 1.96 4.76 -1.26 -4.88 118.16 127.97 1gab n LYS 8 Ca 0.00 0.61 0.00 0.00 -2.87 0.00 0.00 58.31 56.05 1gab n LYS 8 Cb 0.00 -4.88 0.00 0.00 -1.84 0.00 0.00 35.03 28.31 1gab n LYS 8 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 1gab n ASN 9 N -1.25 0.14 0.12 4.39 0.23 -1.26 -4.79 115.26 112.84 1gab n ASN 9 Ca -0.06 0.00 0.13 0.00 -0.53 0.00 0.00 54.58 54.12 1gab n ASN 9 Cb 0.58 0.00 0.37 0.00 -2.08 0.00 0.00 39.78 38.64 1gab n ASN 9 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1gab h ALA 10 N 0.00 0.98 -0.21 -2.53 0.00 -1.95 -3.17 119.26 112.39 1gab h ALA 10 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1gab h ALA 10 Cb 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1gab h ALA 10 CO 0.00 0.00 -0.05 1.57 0.00 0.00 0.00 179.25 180.77 1gab h LYS 11 N 0.00 0.31 0.06 0.00 2.10 -1.86 0.83 116.57 118.00 1gab h LYS 11 Ca 0.00 -0.06 -0.34 0.00 -2.00 0.00 0.00 60.65 58.25 1gab h LYS 11 Cb 0.77 -0.05 -0.03 0.00 -0.90 0.00 0.00 32.23 32.02 1gab h LYS 11 CO 0.00 0.38 -1.89 0.39 -2.00 0.00 0.00 179.45 176.33 1gab n GLU 12 N -4.32 0.67 0.27 0.07 -0.58 -1.22 -2.04 120.64 113.48 1gab n GLU 12 Ca -0.00 0.35 0.18 0.00 -0.42 0.00 0.00 57.16 57.26 1gab n GLU 12 Cb 0.23 -1.68 0.82 0.00 -0.57 0.00 0.00 31.44 30.24 1gab n GLU 12 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 1gab h ASP 13 N -0.38 0.00 0.01 1.62 3.32 -1.53 -0.98 116.42 118.48 1gab h ASP 13 Ca -0.45 0.00 -0.41 0.00 0.02 0.00 0.00 57.03 56.19 1gab h ASP 13 Cb 1.75 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 41.23 1gab h ASP 13 CO -0.08 0.00 -2.43 0.00 -1.72 0.00 0.00 179.24 175.01 1gab n ALA 14 N -2.01 1.30 0.24 3.45 0.00 0.28 -4.30 120.51 119.47 1gab n ALA 14 Ca -0.01 -1.05 0.07 0.00 0.00 0.00 0.00 53.44 52.46 1gab n ALA 14 Cb 0.19 -0.07 0.58 0.00 0.00 0.00 0.00 19.45 20.16 1gab n ALA 14 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1gab h ILE 15 N -0.38 1.00 0.00 0.00 2.04 -1.31 0.02 117.51 118.89 1gab h ILE 15 Ca -0.61 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 64.80 1gab h ILE 15 Cb 1.79 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 39.12 1gab h ILE 15 CO -0.20 0.13 0.00 0.00 0.00 0.00 0.00 178.15 178.07 1gab h ALA 16 N 1.87 1.00 0.00 1.87 0.00 -1.36 -1.88 119.26 120.76 1gab h ALA 16 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1gab h ALA 16 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1gab h ALA 16 CO 0.02 0.00 -0.59 -1.91 0.00 0.00 0.00 179.25 176.76 1gab n GLU 17 N -2.38 3.37 -0.01 0.00 2.13 -0.47 -4.64 120.64 118.63 1gab n GLU 17 Ca 0.01 -0.01 -0.12 0.00 0.66 0.00 0.00 57.16 57.69 1gab n GLU 17 Cb 0.20 -0.84 -0.14 0.00 0.27 0.00 0.00 31.44 30.93 1gab n GLU 17 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1gab n LEU 18 N -1.31 1.40 0.32 4.31 4.77 -0.13 -3.73 117.00 122.63 1gab n LEU 18 Ca 0.00 0.36 0.18 0.00 -0.03 0.00 0.00 56.01 56.52 1gab n LEU 18 Cb 0.07 -0.22 0.99 0.00 -2.33 0.00 0.00 43.42 41.93 1gab n LEU 18 CO 0.07 0.53 1.13 0.07 -1.33 0.00 0.00 177.39 177.85 1gab h LYS 19 N 0.02 0.00 0.02 3.23 2.10 -1.58 0.25 116.57 120.61 1gab h LYS 19 Ca -0.33 0.00 -0.28 0.00 -2.00 0.00 0.00 60.65 58.05 1gab h LYS 19 Cb 2.02 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 33.31 1gab h LYS 19 CO 0.08 0.00 -1.53 -0.22 -2.00 0.00 0.00 179.45 175.79 1gab h LYS 20 N 0.00 0.04 -0.01 0.07 3.64 -1.83 -3.28 116.57 115.20 1gab h LYS 20 Ca 0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1gab h LYS 20 Cb 0.31 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1gab h LYS 20 CO 0.00 0.73 0.27 0.00 -2.27 0.00 0.00 179.45 178.18 1gab h ALA 21 N 0.89 1.30 0.00 5.00 0.00 -0.60 -3.44 119.26 122.41 1gab h ALA 21 Ca -0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1gab h ALA 21 Cb 1.95 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1gab h ALA 21 CO 0.10 -0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.48 1gab n GLY 22 N -1.20 2.88 3.50 0.00 0.00 -1.22 -5.04 105.19 104.12 1gab n GLY 22 Ca -0.02 -1.01 -0.46 0.00 0.00 0.00 0.00 46.02 44.54 1gab n GLY 22 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1gab n ILE 23 N 0.00 0.17 -0.01 -0.61 5.41 -1.26 -4.74 119.36 118.33 1gab n ILE 23 Ca 0.00 -0.38 0.03 0.00 1.00 0.00 0.00 62.75 63.40 1gab n ILE 23 Cb 0.00 -1.99 0.07 0.00 -0.71 0.00 0.00 39.64 37.00 1gab n ILE 23 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1gab n THR 24 N 7.49 0.75 -1.41 1.39 -2.24 -1.26 -4.54 114.28 114.46 1gab n THR 24 Ca 0.39 -0.88 -0.35 0.00 -2.27 0.00 0.00 64.05 60.94 1gab n THR 24 Cb 0.32 0.65 0.10 0.00 -2.10 0.00 0.00 70.33 69.31 1gab n THR 24 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1gab n SER 25 N 0.10 1.56 -0.08 3.42 2.88 -1.26 -4.92 113.62 115.32 1gab n SER 25 Ca 0.05 0.71 0.10 0.00 -1.33 0.00 0.00 58.87 58.40 1gab n SER 25 Cb 0.29 -1.53 -0.10 0.00 -0.75 0.00 0.00 64.21 62.12 1gab n SER 25 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1gab n ASP 26 N -2.60 1.15 0.19 -3.46 5.75 -1.26 -3.84 116.55 112.47 1gab n ASP 26 Ca 0.15 -1.07 0.07 0.00 -0.01 0.00 0.00 54.79 53.92 1gab n ASP 26 Cb 0.49 0.91 0.28 0.00 -1.03 0.00 0.00 41.12 41.78 1gab n ASP 26 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 1gab h PHE 27 N 0.40 0.00 0.05 2.11 3.57 -1.99 -2.02 116.94 119.06 1gab h PHE 27 Ca 0.00 0.00 -0.37 0.00 3.53 0.00 0.00 57.97 61.13 1gab h PHE 27 Cb 0.53 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.23 1gab h PHE 27 CO 0.00 0.33 -2.15 0.66 -2.23 0.00 0.00 178.31 174.92 1gab n TYR 28 N -3.35 0.62 -0.11 0.41 4.01 -1.26 -3.42 117.16 114.07 1gab n TYR 28 Ca 0.01 0.16 -0.09 0.00 -0.16 0.00 0.00 57.90 57.81 1gab n TYR 28 Cb 0.55 -1.08 -0.02 0.00 -0.31 0.00 0.00 39.34 38.48 1gab n TYR 28 CO 0.00 0.00 0.00 0.74 -0.46 0.00 0.00 176.86 177.14 1gab h PHE 29 N -0.21 0.51 -0.61 -0.72 0.04 -1.66 -0.91 116.94 113.37 1gab h PHE 29 Ca -0.51 -0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.14 1gab h PHE 29 Cb 1.85 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 39.82 1gab h PHE 29 CO 0.04 0.46 0.03 -0.91 -0.60 0.00 0.00 178.31 177.33 1gab h ASN 30 N 0.41 1.02 0.62 2.17 2.35 -1.56 -1.68 115.58 118.91 1gab h ASN 30 Ca 0.12 -0.27 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 1gab h ASN 30 Cb 0.15 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.25 1gab h ASN 30 CO -0.01 1.06 0.00 0.00 -1.65 0.00 0.00 177.43 176.83 1gab n ALA 31 N -2.48 1.77 0.26 -0.83 0.00 -1.06 -2.50 120.51 115.67 1gab n ALA 31 Ca 0.03 -0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.56 1gab n ALA 31 Cb 0.33 -1.29 0.70 0.00 0.00 0.00 0.00 19.45 19.18 1gab n ALA 31 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1gab h ILE 32 N 0.00 0.53 0.19 0.00 6.09 -0.18 -2.64 117.51 121.50 1gab h ILE 32 Ca 0.00 -0.61 -0.31 0.00 -1.37 0.00 0.00 64.86 62.57 1gab h ILE 32 Cb 0.31 1.41 0.02 0.00 0.47 0.00 0.00 36.82 39.03 1gab h ILE 32 CO 0.00 0.13 -1.40 0.78 -3.07 0.00 0.00 178.15 174.59 1gab h ASN 33 N 0.00 0.64 -0.01 2.19 2.35 -1.62 -3.20 115.58 115.93 1gab h ASN 33 Ca -0.00 -0.70 0.00 0.00 -0.55 0.00 0.00 56.30 55.05 1gab h ASN 33 Cb 0.40 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 1gab h ASN 33 CO 0.02 1.55 0.11 0.11 -1.65 0.00 0.00 177.43 177.57 1gab h LYS 34 N 0.11 0.00 -6.43 0.81 6.56 -1.61 -3.43 116.57 112.58 1gab h LYS 34 Ca -0.21 0.00 -0.56 0.00 -1.06 0.00 0.00 60.65 58.82 1gab h LYS 34 Cb 2.08 0.00 0.20 0.00 -0.57 0.00 0.00 32.23 33.94 1gab h LYS 34 CO 0.24 0.00 -0.89 0.00 -2.06 0.00 0.00 179.45 176.73 1gab n ALA 35 N -2.04 -2.91 -0.09 3.86 0.00 -1.21 -4.94 120.51 113.18 1gab n ALA 35 Ca -0.02 -0.39 -0.13 0.00 0.00 0.00 0.00 53.44 52.89 1gab n ALA 35 Cb 0.17 -1.61 -0.06 0.00 0.00 0.00 0.00 19.45 17.95 1gab n ALA 35 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1gab n LYS 36 N 0.16 0.51 -3.54 0.00 4.76 -1.26 -4.75 118.16 114.04 1gab n LYS 36 Ca 0.06 0.52 -0.18 0.00 -2.87 0.00 0.00 58.31 55.85 1gab n LYS 36 Cb 0.52 -1.70 -0.04 0.00 -1.84 0.00 0.00 35.03 31.97 1gab n LYS 36 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 1gab n THR 37 N -4.51 0.00 0.21 -0.18 5.66 -1.26 -4.39 114.28 109.80 1gab n THR 37 Ca -0.20 -1.45 0.05 0.00 -3.05 0.00 0.00 64.05 59.40 1gab n THR 37 Cb 0.48 0.40 0.50 0.00 -1.55 0.00 0.00 70.33 70.16 1gab n THR 37 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 1gab h VAL 38 N 1.28 1.12 0.00 1.08 2.07 -1.96 0.41 116.25 120.25 1gab h VAL 38 Ca -0.23 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 1gab h VAL 38 Cb 0.76 1.26 -0.00 0.00 -1.52 0.00 0.00 31.29 31.79 1gab h VAL 38 CO 0.37 0.16 -0.10 -0.08 0.02 0.00 0.00 177.57 177.94 1gab h GLU 39 N 0.04 0.00 0.02 1.57 4.81 -1.98 -1.59 114.58 117.45 1gab h GLU 39 Ca 0.01 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.96 1gab h GLU 39 Cb 0.28 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 1gab h GLU 39 CO 0.02 0.10 -1.49 0.93 -0.73 0.00 0.00 179.01 177.84 1gab h GLU 40 N 0.00 0.04 0.25 1.92 4.39 -1.35 -2.01 114.58 117.82 1gab h GLU 40 Ca -0.00 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 1gab h GLU 40 Cb 0.69 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 1gab h GLU 40 CO 0.01 0.74 -0.12 0.28 -1.16 0.00 0.00 179.01 178.77 1gab h VAL 41 N 0.01 0.50 0.00 3.13 2.07 -0.94 -1.48 116.25 119.54 1gab h VAL 41 Ca -0.20 -0.92 -0.02 0.00 0.82 0.00 0.00 66.70 66.37 1gab h VAL 41 Cb 1.94 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 32.55 1gab h VAL 41 CO 0.10 0.13 -0.11 0.78 0.02 0.00 0.00 177.57 178.49 1gab h ASN 42 N -0.97 0.00 -0.19 0.57 2.35 -1.46 -2.33 115.58 113.56 1gab h ASN 42 Ca -0.03 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.68 1gab h ASN 42 Cb 0.47 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 1gab h ASN 42 CO 0.06 0.11 -0.02 0.00 -1.65 0.00 0.00 177.43 175.93 1gab h ALA 43 N 1.89 0.25 -0.56 -0.83 0.00 -1.30 -2.54 119.26 116.17 1gab h ALA 43 Ca -0.00 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.71 1gab h ALA 43 Cb 0.23 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1gab h ALA 43 CO 0.01 -0.00 0.37 -0.07 0.00 0.00 0.00 179.25 179.56 1gab h LEU 44 N 0.08 0.58 -0.84 0.00 3.38 -0.72 -0.81 115.31 116.98 1gab h LEU 44 Ca 0.05 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1gab h LEU 44 Cb 0.44 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1gab h LEU 44 CO 0.01 0.41 0.43 0.50 0.09 0.00 0.00 178.44 179.88 1gab h LYS 45 N 0.68 1.19 0.00 1.13 1.63 -1.19 -0.27 116.57 119.74 1gab h LYS 45 Ca 0.22 -0.16 -0.00 0.00 -0.85 0.00 0.00 60.65 59.86 1gab h LYS 45 Cb 0.04 -0.22 -0.00 0.00 -0.60 0.00 0.00 32.23 31.45 1gab h LYS 45 CO -0.06 0.90 -0.02 -0.91 -3.45 0.00 0.00 179.45 175.91 1gab h ASN 46 N 1.18 0.00 0.24 4.20 2.35 -0.75 -2.31 115.58 120.49 1gab h ASN 46 Ca 0.29 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.82 1gab h ASN 46 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 1gab h ASN 46 CO -0.04 0.02 -0.88 -0.33 -1.65 0.00 0.00 177.43 174.55 1gab h GLU 47 N 0.00 0.47 -0.11 0.81 4.39 -0.63 -2.93 114.58 116.57 1gab h GLU 47 Ca -0.00 -0.46 0.03 0.00 0.34 0.00 0.00 59.36 59.27 1gab h GLU 47 Cb 0.31 0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 29.08 1gab h GLU 47 CO 0.00 1.10 0.10 0.82 -1.16 0.00 0.00 179.01 179.88 1gab h ILE 48 N 0.28 0.68 -0.95 3.13 5.03 -1.14 0.47 117.51 125.02 1gab h ILE 48 Ca -0.07 0.00 0.09 0.00 -0.12 0.00 0.00 64.86 64.76 1gab h ILE 48 Cb 1.50 0.92 -0.07 0.00 -3.03 0.00 0.00 36.82 36.15 1gab h ILE 48 CO 0.16 0.00 0.61 -0.07 -0.68 0.00 0.00 178.15 178.17 1gab h LEU 49 N 0.00 0.90 0.00 1.44 -0.00 -1.56 -2.47 115.31 113.62 1gab h LEU 49 Ca 0.05 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.96 1gab h LEU 49 Cb 0.26 -0.16 0.00 0.00 -0.00 0.00 0.00 40.66 40.75 1gab h LEU 49 CO -0.00 0.53 -0.40 0.29 -0.00 0.00 0.00 178.44 178.86 1gab n LYS 50 N -4.54 0.21 -0.40 1.13 4.76 0.01 -4.61 118.16 114.73 1gab n LYS 50 Ca 0.16 0.08 0.35 0.00 -2.87 0.00 0.00 58.31 56.03 1gab n LYS 50 Cb 0.28 -0.82 0.62 0.00 -1.84 0.00 0.00 35.03 33.27 1gab n LYS 50 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1gab h ALA 51 N -0.63 2.48 -3.30 7.82 0.00 -0.33 -3.34 119.26 121.96 1gab h ALA 51 Ca 0.00 0.18 -0.66 0.00 0.00 0.00 0.00 54.91 54.43 1gab h ALA 51 Cb 0.40 0.25 -0.29 0.00 0.00 0.00 0.00 17.79 18.16 1gab h ALA 51 CO 0.00 -1.18 -0.79 -1.58 0.00 0.00 0.00 179.25 175.70 1gab s HIS 52 N -5.41 2.76 0.00 0.00 5.65 -0.93 -5.00 115.29 112.36 1gab s HIS 52 Ca -0.08 -0.80 0.00 0.00 0.25 0.00 0.00 55.06 54.43 1gab s HIS 52 Cb 0.32 -1.83 0.00 0.00 -1.18 0.00 0.00 32.58 29.89 1gab s HIS 52 CO 0.81 -0.30 0.00 0.00 -0.65 0.00 0.00 174.74 174.59