#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dj8 s SER 2 N 0.00 6.42 0.06 1.61 0.15 -1.26 -5.11 113.70 115.57 2dj8 s SER 2 Ca 0.00 0.42 0.04 0.00 0.70 0.00 0.00 55.95 57.11 2dj8 s SER 2 Cb 0.00 -2.02 -0.04 0.00 -1.71 0.00 0.00 66.02 62.25 2dj8 s SER 2 CO 0.00 0.14 -0.02 -0.44 1.20 0.00 0.00 173.24 174.13 2dj8 s SER 3 N -2.37 4.95 -0.18 5.45 0.01 -1.26 -5.11 113.70 115.19 2dj8 s SER 3 Ca 0.36 -0.15 -0.04 0.00 1.31 0.00 0.00 55.95 57.43 2dj8 s SER 3 Cb -0.13 -1.18 0.08 0.00 0.21 0.00 0.00 66.02 65.00 2dj8 s SER 3 CO 0.25 0.21 0.18 -0.83 0.41 0.00 0.00 173.24 173.46 2dj8 s GLY 4 N -2.02 0.09 0.01 3.44 0.00 -1.26 -5.14 107.32 102.44 2dj8 s GLY 4 Ca 0.23 0.17 -0.04 0.00 0.00 0.00 0.00 44.72 45.08 2dj8 s GLY 4 CO 0.15 1.99 0.06 -0.45 0.00 0.00 0.00 173.10 174.84 2dj8 s SER 5 N 2.28 0.12 0.27 1.64 0.15 -1.26 -5.17 113.70 111.73 2dj8 s SER 5 Ca 0.05 -0.33 0.02 0.00 0.70 0.00 0.00 55.95 56.39 2dj8 s SER 5 Cb -0.15 0.15 -0.05 0.00 -1.71 0.00 0.00 66.02 64.26 2dj8 s SER 5 CO -0.10 -0.32 0.08 -0.44 1.20 0.00 0.00 173.24 173.65 2dj8 s SER 6 N -1.36 1.49 0.04 5.45 0.01 -1.26 -5.16 113.70 112.90 2dj8 s SER 6 Ca -0.15 -1.37 0.08 0.00 1.31 0.00 0.00 55.95 55.83 2dj8 s SER 6 Cb -0.08 0.10 -0.03 0.00 0.21 0.00 0.00 66.02 66.21 2dj8 s SER 6 CO 0.00 -0.69 -0.24 -0.83 0.41 0.00 0.00 173.24 171.90 2dj8 s GLY 7 N -3.35 1.45 -0.23 3.44 0.00 -1.26 -5.12 107.32 102.26 2dj8 s GLY 7 Ca 0.37 -1.23 -0.12 0.00 0.00 0.00 0.00 44.72 43.73 2dj8 s GLY 7 CO 0.14 -1.11 0.24 -0.42 0.00 0.00 0.00 173.10 171.95 2dj8 s ILE 8 N -0.83 5.30 1.20 0.90 1.01 -1.26 -5.08 121.20 122.43 2dj8 s ILE 8 Ca 0.12 0.36 -0.18 0.00 0.00 0.00 0.00 60.65 60.95 2dj8 s ILE 8 Cb -0.10 -3.58 0.28 0.00 0.01 0.00 0.00 42.46 39.07 2dj8 s ILE 8 CO 0.03 0.30 1.07 0.20 0.00 0.00 0.00 174.94 176.54 2dj8 s ASN 9 N 1.15 0.91 -0.47 3.58 -0.87 -1.26 -4.98 114.94 112.99 2dj8 s ASN 9 Ca 0.11 0.84 -0.16 0.00 -1.57 0.00 0.00 52.86 52.08 2dj8 s ASN 9 Cb -0.14 -1.23 0.06 0.00 -0.02 0.00 0.00 41.25 39.93 2dj8 s ASN 9 CO 0.06 -4.15 0.44 -1.58 -2.57 0.00 0.00 177.10 169.30 2dj8 s GLN 10 N -5.19 3.01 0.51 -0.60 2.00 -1.26 -5.05 119.66 113.08 2dj8 s GLN 10 Ca 0.69 -1.22 0.03 0.00 -2.00 0.00 0.00 55.36 52.87 2dj8 s GLN 10 Cb -0.13 -4.11 0.00 0.00 0.80 0.00 0.00 33.01 29.57 2dj8 s GLN 10 CO 0.57 -1.04 0.17 -0.65 -0.50 0.00 0.00 175.29 173.85 2dj8 s GLN 11 N 1.86 2.22 0.00 1.67 -1.52 -1.26 -5.08 119.66 117.54 2dj8 s GLN 11 Ca 0.07 -2.20 0.00 0.00 -1.95 0.00 0.00 55.36 51.27 2dj8 s GLN 11 Cb -0.23 -1.79 0.00 0.00 -0.22 0.00 0.00 33.01 30.77 2dj8 s GLN 11 CO 0.08 -0.44 0.00 -0.85 -0.25 0.00 0.00 175.29 173.84 2dj8 n GLU 12 N -1.45 0.00 -4.05 2.91 0.28 -1.26 -5.04 120.64 112.04 2dj8 n GLU 12 Ca -0.11 0.00 -0.31 0.00 -0.16 0.00 0.00 57.16 56.58 2dj8 n GLU 12 Cb 0.66 -0.57 -0.01 0.00 1.43 0.00 0.00 31.44 32.95 2dj8 n GLU 12 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2dj8 n ASP 13 N -2.57 -2.67 -4.61 -1.84 2.03 -1.26 -4.80 116.55 100.83 2dj8 n ASP 13 Ca 0.00 -0.95 -0.50 0.00 0.52 0.00 0.00 54.79 53.86 2dj8 n ASP 13 Cb 0.35 -3.18 -0.05 0.00 -0.72 0.00 0.00 41.12 37.52 2dj8 n ASP 13 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2dj8 n SER 14 N -2.82 2.04 -3.66 1.67 3.41 -1.26 -4.97 113.62 108.04 2dj8 n SER 14 Ca -0.07 1.11 -0.12 0.00 -0.26 0.00 0.00 58.87 59.54 2dj8 n SER 14 Cb 0.57 -1.25 -0.06 0.00 -0.26 0.00 0.00 64.21 63.21 2dj8 n SER 14 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dj8 s SER 15 N 0.62 -0.25 -0.26 4.04 0.15 -1.26 -5.15 113.70 111.58 2dj8 s SER 15 Ca 0.83 -0.14 -0.01 0.00 0.70 0.00 0.00 55.95 57.33 2dj8 s SER 15 Cb -0.88 0.44 0.15 0.00 -1.71 0.00 0.00 66.02 64.02 2dj8 s SER 15 CO 0.44 -0.73 0.43 -1.61 1.20 0.00 0.00 173.24 172.97 2dj8 s GLU 16 N -3.00 0.40 0.34 5.44 0.41 -1.26 -5.16 118.70 115.88 2dj8 s GLU 16 Ca -0.02 0.54 0.08 0.00 -0.41 0.00 0.00 54.97 55.16 2dj8 s GLU 16 Cb 0.00 -0.25 -0.03 0.00 -1.78 0.00 0.00 34.13 32.07 2dj8 s GLU 16 CO -0.06 -0.72 0.24 -1.12 -0.49 0.00 0.00 175.26 173.11 2dj8 s SER 17 N 2.61 5.07 0.08 -0.19 0.01 -1.26 -3.75 113.70 116.27 2dj8 s SER 17 Ca 0.13 -0.60 -0.31 0.00 1.31 0.00 0.00 55.95 56.49 2dj8 s SER 17 Cb -0.15 -0.88 -0.08 0.00 0.21 0.00 0.00 66.02 65.12 2dj8 s SER 17 CO -0.20 -0.35 1.62 0.00 0.41 0.00 0.00 173.24 174.72 2dj8 h TRP 19 N 8.03 0.97 0.00 0.00 4.06 -1.56 0.10 115.95 127.55 2dj8 h TRP 19 Ca -0.42 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.51 2dj8 h TRP 19 Cb 1.20 -0.31 0.00 0.00 -1.00 0.00 0.00 29.16 29.05 2dj8 h TRP 19 CO 0.75 0.68 0.00 -1.71 -3.56 0.00 0.00 178.44 174.61 2dj8 n ASN 20 N -4.36 0.00 0.00 -3.49 5.15 -1.26 -4.56 115.26 106.74 2dj8 n ASN 20 Ca 0.07 0.51 0.00 0.00 -0.60 0.00 0.00 54.58 54.56 2dj8 n ASN 20 Cb 0.11 -0.25 0.00 0.00 -0.53 0.00 0.00 39.78 39.11 2dj8 n ASN 20 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dj8 n GLY 22 N -0.45 1.09 0.00 0.00 0.00 0.02 -5.00 105.19 100.86 2dj8 n GLY 22 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2dj8 n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dj8 n ARG 23 N -0.00 0.00 -3.99 1.61 1.74 -1.26 -4.65 116.66 110.10 2dj8 n ARG 23 Ca 0.00 0.19 -0.09 0.00 -0.77 0.00 0.00 57.85 57.18 2dj8 n ARG 23 Cb 0.00 -0.63 -0.11 0.00 -1.02 0.00 0.00 32.46 30.70 2dj8 n ARG 23 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2dj8 s LYS 24 N -0.50 0.37 -0.10 5.56 2.36 -1.26 -4.59 119.74 121.58 2dj8 s LYS 24 Ca 0.00 -0.71 0.04 0.00 -2.55 0.00 0.00 55.97 52.75 2dj8 s LYS 24 Cb 0.00 0.13 0.00 0.00 -1.05 0.00 0.00 37.83 36.91 2dj8 s LYS 24 CO 0.00 -0.06 -0.23 0.00 1.55 0.00 0.00 175.35 176.61 2dj8 s ALA 25 N -1.89 2.07 -0.13 3.13 0.00 -1.25 -3.51 121.76 120.18 2dj8 s ALA 25 Ca -0.12 -0.91 0.06 0.00 0.00 0.00 0.00 51.96 50.99 2dj8 s ALA 25 Cb -0.07 -0.79 -0.12 0.00 0.00 0.00 0.00 23.12 22.14 2dj8 s ALA 25 CO -0.02 0.26 -0.05 0.43 0.00 0.00 0.00 175.76 176.38 2dj8 n SER 26 N 3.57 2.47 -4.86 0.00 7.64 0.23 -4.84 113.62 117.82 2dj8 n SER 26 Ca -0.19 -0.04 -0.26 0.00 1.01 0.00 0.00 58.87 59.38 2dj8 n SER 26 Cb 0.53 0.27 0.00 0.00 -1.01 0.00 0.00 64.21 64.00 2dj8 n SER 26 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dj8 n GLU 27 N -2.69 0.67 -3.72 1.43 -0.58 0.14 -4.93 120.64 110.95 2dj8 n GLU 27 Ca -0.23 -3.45 -0.14 0.00 -0.42 0.00 0.00 57.16 52.92 2dj8 n GLU 27 Cb 0.83 0.34 -0.09 0.00 -0.57 0.00 0.00 31.44 31.95 2dj8 n GLU 27 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2dj8 s THR 28 N -2.75 0.03 -0.35 2.62 2.01 -1.26 -1.60 115.64 114.33 2dj8 s THR 28 Ca 0.33 -0.21 -0.40 0.00 0.31 0.00 0.00 61.69 61.72 2dj8 s THR 28 Cb -0.03 -0.64 -0.15 0.00 0.01 0.00 0.00 72.50 71.70 2dj8 s THR 28 CO 0.21 -0.12 1.94 0.00 -0.69 0.00 0.00 174.62 175.97 2dj8 n SER 30 N 7.04 0.15 -0.09 0.00 7.64 -1.26 0.10 113.62 127.20 2dj8 n SER 30 Ca 0.36 -1.73 -0.12 0.00 1.01 0.00 0.00 58.87 58.39 2dj8 n SER 30 Cb 0.12 -0.07 -0.09 0.00 -1.01 0.00 0.00 64.21 63.16 2dj8 n SER 30 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dj8 n GLY 31 N 0.32 -0.30 0.00 0.23 0.00 -1.26 -4.17 105.19 100.00 2dj8 n GLY 31 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2dj8 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dj8 n ASN 33 N -1.22 -3.82 -0.00 0.00 2.85 0.11 -4.90 115.26 108.28 2dj8 n ASN 33 Ca 0.00 -0.08 -0.00 0.00 -0.11 0.00 0.00 54.58 54.39 2dj8 n ASN 33 Cb 0.12 -2.89 -0.00 0.00 1.24 0.00 0.00 39.78 38.25 2dj8 n ASN 33 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 2dj8 n THR 34 N -3.97 0.02 -2.41 -0.44 -1.04 -1.26 -4.90 114.28 100.28 2dj8 n THR 34 Ca -0.10 -0.01 -0.43 0.00 -2.04 0.00 0.00 64.05 61.48 2dj8 n THR 34 Cb 0.58 -0.88 -0.02 0.00 -1.82 0.00 0.00 70.33 68.19 2dj8 n THR 34 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2dj8 s ALA 35 N -2.01 3.64 0.25 2.41 0.00 -1.26 -4.90 121.76 119.89 2dj8 s ALA 35 Ca -0.00 0.51 -0.10 0.00 0.00 0.00 0.00 51.96 52.36 2dj8 s ALA 35 Cb 0.00 -3.61 -0.07 0.00 0.00 0.00 0.00 23.12 19.44 2dj8 s ALA 35 CO 0.01 -1.12 0.57 1.03 0.00 0.00 0.00 175.76 176.25 2dj8 s ARG 36 N 3.33 3.80 -0.02 0.00 1.81 -1.26 -0.25 118.95 126.37 2dj8 s ARG 36 Ca 0.56 0.29 -0.13 0.00 -1.72 0.00 0.00 55.73 54.72 2dj8 s ARG 36 Cb -0.23 -2.62 0.02 0.00 -0.45 0.00 0.00 34.95 31.67 2dj8 s ARG 36 CO 0.16 0.28 0.28 0.71 -0.68 0.00 0.00 175.30 176.06 2dj8 s TYR 37 N -1.88 -0.15 -1.83 -0.53 2.02 -0.63 -1.28 117.35 113.07 2dj8 s TYR 37 Ca 0.48 0.23 0.22 0.00 -0.37 0.00 0.00 57.07 57.63 2dj8 s TYR 37 Cb -0.11 0.08 1.27 0.00 -0.40 0.00 0.00 41.96 42.79 2dj8 s TYR 37 CO 0.22 -0.36 1.71 0.00 -1.57 0.00 0.00 175.55 175.54 2dj8 n GLY 39 N 0.44 1.88 0.38 0.00 0.00 -1.26 -4.17 105.19 102.47 2dj8 n GLY 39 Ca 0.15 -0.61 0.16 0.00 0.00 0.00 0.00 46.02 45.72 2dj8 n GLY 39 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dj8 h SER 40 N 0.00 0.55 -0.53 1.61 4.64 -1.95 -0.04 113.55 117.83 2dj8 h SER 40 Ca 0.00 0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.37 2dj8 h SER 40 Cb 0.00 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 2dj8 h SER 40 CO 0.00 0.22 0.29 2.19 -0.87 0.00 0.00 176.83 178.67 2dj8 h PHE 41 N 0.55 0.73 0.00 4.77 -5.15 -2.00 -1.40 116.94 114.45 2dj8 h PHE 41 Ca 0.50 -0.02 -0.01 0.00 -0.20 0.00 0.00 57.97 58.25 2dj8 h PHE 41 Cb 1.03 -0.23 -0.00 0.00 0.22 0.00 0.00 35.95 36.97 2dj8 h PHE 41 CO -0.00 0.54 -0.03 0.00 -2.00 0.00 0.00 178.31 176.82 2dj8 h GLN 43 N 0.00 0.03 -0.92 0.00 4.15 -0.86 -2.47 115.11 115.04 2dj8 h GLN 43 Ca -0.00 -0.05 0.15 0.00 0.77 0.00 0.00 58.65 59.51 2dj8 h GLN 43 Cb 0.28 0.02 -0.09 0.00 0.21 0.00 0.00 27.48 27.90 2dj8 h GLN 43 CO 0.00 1.03 0.52 0.45 -1.93 0.00 0.00 178.83 178.90 2dj8 h HIS 44 N -0.93 0.93 -0.02 3.99 3.86 -1.11 1.78 115.15 123.65 2dj8 h HIS 44 Ca -0.05 0.03 -0.21 0.00 -1.16 0.00 0.00 60.37 58.99 2dj8 h HIS 44 Cb 1.10 -0.28 -0.00 0.00 1.06 0.00 0.00 27.41 29.29 2dj8 h HIS 44 CO 0.25 0.27 -0.87 1.57 0.86 0.00 0.00 177.93 180.02 2dj8 h LYS 45 N 0.76 0.33 -0.65 2.45 2.10 -1.63 -3.13 116.57 116.81 2dj8 h LYS 45 Ca 0.49 -0.34 0.00 0.00 -2.00 0.00 0.00 60.65 58.80 2dj8 h LYS 45 Cb 0.65 0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.07 2dj8 h LYS 45 CO -0.33 1.02 0.00 -3.47 -2.00 0.00 0.00 179.45 174.67 2dj8 n ASP 46 N -3.74 4.55 -0.03 7.07 2.03 -0.24 -4.47 116.55 121.72 2dj8 n ASP 46 Ca -0.05 -2.47 -0.01 0.00 0.52 0.00 0.00 54.79 52.77 2dj8 n ASP 46 Cb 0.79 -0.57 -0.00 0.00 -0.72 0.00 0.00 41.12 40.62 2dj8 n ASP 46 CO 0.00 0.00 0.00 -0.25 -1.92 0.00 0.00 177.20 175.03 2dj8 h TRP 47 N 3.75 0.00 -0.36 -0.67 2.91 0.27 -1.98 115.95 119.88 2dj8 h TRP 47 Ca 0.00 0.00 0.10 0.00 1.13 0.00 0.00 58.89 60.12 2dj8 h TRP 47 Cb 1.43 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 30.07 2dj8 h TRP 47 CO 0.76 0.00 0.92 1.05 -1.03 0.00 0.00 178.44 180.13 2dj8 h GLU 48 N -0.51 0.00 0.04 2.65 4.11 -1.78 0.78 114.58 119.87 2dj8 h GLU 48 Ca 0.00 0.00 -0.38 0.00 0.07 0.00 0.00 59.36 59.05 2dj8 h GLU 48 Cb 0.15 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 2dj8 h GLU 48 CO 0.00 0.00 -2.22 1.63 0.07 0.00 0.00 179.01 178.49 2dj8 n LYS 49 N -2.90 0.67 0.02 1.06 4.76 -1.26 -4.40 118.16 116.11 2dj8 n LYS 49 Ca 0.08 0.25 -0.13 0.00 -2.87 0.00 0.00 58.31 55.64 2dj8 n LYS 49 Cb 1.04 -1.60 -0.09 0.00 -1.84 0.00 0.00 35.03 32.53 2dj8 n LYS 49 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2dj8 h HIS 50 N -0.24 -0.09 -0.26 2.13 -0.00 0.10 -3.01 115.15 113.78 2dj8 h HIS 50 Ca -0.53 -0.00 0.07 0.00 -0.00 0.00 0.00 60.37 59.91 2dj8 h HIS 50 Cb 1.83 0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 29.26 2dj8 h HIS 50 CO 0.03 0.39 0.89 1.25 -0.00 0.00 0.00 177.93 180.49 2dj8 h HIS 51 N -0.61 0.00 0.00 5.26 -0.00 -0.01 0.81 115.15 120.60 2dj8 h HIS 51 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.36 2dj8 h HIS 51 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.92 2dj8 h HIS 51 CO 0.09 0.00 0.00 0.72 -0.00 0.00 0.00 177.93 178.74 2dj8 n HIS 52 N -2.82 0.00 0.00 5.26 -0.00 -1.14 -2.23 115.22 114.29 2dj8 n HIS 52 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.77 2dj8 n HIS 52 Cb 0.98 -0.21 0.00 0.00 -0.00 0.00 0.00 29.99 30.76 2dj8 n HIS 52 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78 2dj8 n ILE 53 N -1.21 0.00 -4.17 1.59 -5.35 0.28 -5.07 119.36 105.44 2dj8 n ILE 53 Ca 0.03 0.00 -0.22 0.00 -0.27 0.00 0.00 62.75 62.28 2dj8 n ILE 53 Cb 0.03 -0.82 -0.06 0.00 -1.74 0.00 0.00 39.64 37.06 2dj8 n ILE 53 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2dj8 h SER 55 N 1.64 -0.54 -5.00 0.00 0.02 -1.88 -3.42 113.55 104.36 2dj8 h SER 55 Ca -0.46 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2dj8 h SER 55 Cb 1.24 0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.92 2dj8 h SER 55 CO 0.61 -0.12 0.00 0.61 -1.14 0.00 0.00 176.83 176.79 2dj8 n GLY 56 N 0.08 1.74 0.18 -3.77 0.00 -1.26 -4.80 105.19 97.37 2dj8 n GLY 56 Ca -0.08 -2.20 0.04 0.00 0.00 0.00 0.00 46.02 43.77 2dj8 n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dj8 h PRO 57 N 0.00 0.00 -2.07 1.61 0.13 -1.72 -3.45 132.00 126.50 2dj8 h PRO 57 Ca 0.00 0.00 0.30 0.00 -0.87 0.00 0.00 66.00 65.43 2dj8 h PRO 57 Cb 0.00 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.06 2dj8 h PRO 57 CO 0.00 0.41 0.81 -1.54 -0.23 0.00 0.00 178.00 177.45 2dj8 s SER 58 N -6.69 -0.01 -0.07 1.44 1.04 -1.26 -5.05 113.70 103.11 2dj8 s SER 58 Ca -0.02 -0.29 0.06 0.00 0.48 0.00 0.00 55.95 56.18 2dj8 s SER 58 Cb 0.13 0.23 -0.08 0.00 0.10 0.00 0.00 66.02 66.40 2dj8 s SER 58 CO 0.71 -0.45 0.02 -1.54 0.98 0.00 0.00 173.24 172.96 2dj8 n SER 59 N -0.96 3.38 0.00 7.02 3.41 -1.26 -5.14 113.62 120.07 2dj8 n SER 59 Ca -0.01 -0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 2dj8 n SER 59 Cb 0.60 0.61 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 2dj8 n SER 59 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49