#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fi9 s ASP 2 N 0.00 6.87 0.16 1.61 -1.08 -1.26 -4.68 116.67 118.29 1fi9 s ASP 2 Ca 0.00 1.88 -0.10 0.00 -0.52 0.00 0.00 52.55 53.81 1fi9 s ASP 2 Cb 0.00 -2.54 0.02 0.00 -1.46 0.00 0.00 42.92 38.94 1fi9 s ASP 2 CO 0.00 -0.79 1.54 0.58 0.52 0.00 0.00 175.17 177.02 1fi9 h VAL 3 N 5.43 1.27 0.40 1.11 2.07 -1.85 0.16 116.25 124.85 1fi9 h VAL 3 Ca -0.31 -1.41 -0.02 0.00 0.82 0.00 0.00 66.70 65.77 1fi9 h VAL 3 Cb 1.13 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1fi9 h VAL 3 CO 0.95 0.48 -0.19 -0.33 0.02 0.00 0.00 177.57 178.51 1fi9 h GLU 4 N 0.83 -0.52 -0.54 1.57 4.39 -1.92 0.77 114.58 119.16 1fi9 h GLU 4 Ca 0.10 0.04 0.02 0.00 0.34 0.00 0.00 59.36 59.86 1fi9 h GLU 4 Cb 0.83 0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.56 1fi9 h GLU 4 CO 0.07 -0.22 0.33 0.87 -1.16 0.00 0.00 179.01 178.91 1fi9 h LYS 5 N -0.86 0.64 -0.69 2.33 1.57 -1.93 -1.55 116.57 116.08 1fi9 h LYS 5 Ca -0.06 -0.04 0.15 0.00 -1.87 0.00 0.00 60.65 58.84 1fi9 h LYS 5 Cb 0.55 -0.14 -0.11 0.00 0.08 0.00 0.00 32.23 32.60 1fi9 h LYS 5 CO 0.09 0.42 0.08 0.78 -0.57 0.00 0.00 179.45 180.25 1fi9 h GLY 6 N 0.66 0.85 0.86 3.86 0.00 -0.57 0.41 103.07 109.13 1fi9 h GLY 6 Ca 0.21 0.04 0.02 0.00 0.00 0.00 0.00 47.33 47.60 1fi9 h GLY 6 CO -0.09 -0.22 0.05 1.70 0.00 0.00 0.00 176.54 177.98 1fi9 h LYS 7 N 0.18 0.12 -0.51 4.80 3.64 -0.07 -0.20 116.57 124.53 1fi9 h LYS 7 Ca 0.38 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.64 1fi9 h LYS 7 Cb 0.65 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 1fi9 h LYS 7 CO -0.55 0.08 -0.14 0.87 -2.27 0.00 0.00 179.45 177.44 1fi9 h LYS 8 N 0.12 1.00 0.38 1.90 6.56 -0.29 -2.70 116.57 123.54 1fi9 h LYS 8 Ca 0.07 -0.39 -0.01 0.00 -1.06 0.00 0.00 60.65 59.26 1fi9 h LYS 8 Cb 0.05 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 31.64 1fi9 h LYS 8 CO -0.08 1.07 -0.29 0.82 -2.06 0.00 0.00 179.45 178.90 1fi9 h ILE 9 N 0.86 0.39 -0.86 1.86 2.04 0.22 0.22 117.51 122.24 1fi9 h ILE 9 Ca 0.13 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.18 1fi9 h ILE 9 Cb 0.71 0.39 -0.11 0.00 -0.74 0.00 0.00 36.82 37.06 1fi9 h ILE 9 CO 0.05 0.00 0.37 0.15 0.00 0.00 0.00 178.15 178.72 1fi9 h PHE 10 N -0.67 0.62 -0.07 1.37 3.57 -1.03 0.39 116.94 121.12 1fi9 h PHE 10 Ca -0.03 0.04 -0.12 0.00 3.53 0.00 0.00 57.97 61.39 1fi9 h PHE 10 Cb 0.58 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 1fi9 h PHE 10 CO -0.14 0.01 -0.49 0.28 -2.23 0.00 0.00 178.31 175.73 1fi9 h VAL 11 N 0.44 1.35 0.00 1.41 2.07 -1.01 0.20 116.25 120.71 1fi9 h VAL 11 Ca 0.51 -1.71 0.00 0.00 0.82 0.00 0.00 66.70 66.32 1fi9 h VAL 11 Cb 0.90 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1fi9 h VAL 11 CO -0.48 0.51 -0.61 0.00 0.02 0.00 0.00 177.57 177.00 1fi9 n GLN 12 N -3.96 0.15 -0.06 1.57 6.02 0.69 -4.31 117.38 117.48 1fi9 n GLN 12 Ca -0.02 0.03 -0.10 0.00 -0.01 0.00 0.00 57.00 56.91 1fi9 n GLN 12 Cb 0.53 -1.58 -0.05 0.00 1.02 0.00 0.00 30.24 30.16 1fi9 n GLN 12 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1fi9 n LYS 13 N -1.79 0.26 0.01 -1.09 4.76 0.12 -4.99 118.16 115.44 1fi9 n LYS 13 Ca 0.04 0.08 -0.01 0.00 -2.87 0.00 0.00 58.31 55.56 1fi9 n LYS 13 Cb 0.39 -1.09 -0.00 0.00 -1.84 0.00 0.00 35.03 32.49 1fi9 n LYS 13 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1fi9 n ALA 15 N -2.99 0.00 -1.05 0.00 0.00 -0.44 -2.77 120.51 113.26 1fi9 n ALA 15 Ca -0.01 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1fi9 n ALA 15 Cb 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.36 1fi9 n ALA 15 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1fi9 n GLN 16 N 0.00 2.43 0.01 0.00 1.13 -1.26 -3.09 117.38 116.60 1fi9 n GLN 16 Ca 0.00 -1.32 0.00 0.00 -1.94 0.00 0.00 57.00 53.74 1fi9 n GLN 16 Cb 0.00 -2.22 0.00 0.00 0.11 0.00 0.00 30.24 28.13 1fi9 n GLN 16 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1fi9 s HIS 18 N -2.00 2.82 -0.13 0.00 3.76 -1.18 -3.41 115.29 115.15 1fi9 s HIS 18 Ca 0.00 -0.14 -0.01 0.00 -0.15 0.00 0.00 55.06 54.76 1fi9 s HIS 18 Cb 0.00 -1.38 0.03 0.00 1.11 0.00 0.00 32.58 32.34 1fi9 s HIS 18 CO 0.00 0.51 -0.04 0.99 -0.85 0.00 0.00 174.74 175.34 1fi9 s THR 19 N -1.64 0.91 -1.01 1.30 2.01 -1.26 -4.15 115.64 111.79 1fi9 s THR 19 Ca 0.26 -0.38 0.18 0.00 0.31 0.00 0.00 61.69 62.07 1fi9 s THR 19 Cb -0.10 -1.05 0.73 0.00 0.01 0.00 0.00 72.50 72.10 1fi9 s THR 19 CO 0.18 0.21 1.65 1.33 -0.69 0.00 0.00 174.62 177.29 1fi9 n VAL 20 N 4.96 1.97 -4.14 3.82 0.24 -1.26 0.27 118.33 124.18 1fi9 n VAL 20 Ca -0.11 -1.24 -0.28 0.00 -2.04 0.00 0.00 64.34 60.67 1fi9 n VAL 20 Cb 0.49 0.07 -0.07 0.00 -1.47 0.00 0.00 33.84 32.86 1fi9 n VAL 20 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1fi9 s GLU 21 N -1.98 2.59 0.64 7.34 0.41 -1.26 -4.17 118.70 122.28 1fi9 s GLU 21 Ca 0.52 -0.95 0.27 0.00 -0.41 0.00 0.00 54.97 54.40 1fi9 s GLU 21 Cb 0.34 -2.50 1.46 0.00 -1.78 0.00 0.00 34.13 31.65 1fi9 s GLU 21 CO 0.23 0.49 1.84 1.57 -0.49 0.00 0.00 175.26 178.90 1fi9 h LYS 22 N 2.87 0.00 -0.15 1.61 2.10 -1.92 -1.05 116.57 120.03 1fi9 h LYS 22 Ca -0.47 0.00 0.04 0.00 -2.00 0.00 0.00 60.65 58.22 1fi9 h LYS 22 Cb 1.19 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.48 1fi9 h LYS 22 CO 0.60 0.00 -0.12 0.78 -2.00 0.00 0.00 179.45 178.72 1fi9 h GLY 23 N 0.00 0.00 -4.01 0.07 0.00 -1.96 -3.49 103.07 93.68 1fi9 h GLY 23 Ca 0.07 0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1fi9 h GLY 23 CO -0.00 -0.13 -0.86 0.61 0.00 0.00 0.00 176.54 176.16 1fi9 n GLY 24 N -1.26 -5.22 2.77 4.60 0.00 -0.40 -5.07 105.19 100.60 1fi9 n GLY 24 Ca -0.03 -0.27 -0.18 0.00 0.00 0.00 0.00 46.02 45.54 1fi9 n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fi9 s LYS 25 N -0.90 0.19 0.03 1.61 1.02 -1.26 -5.01 119.74 115.41 1fi9 s LYS 25 Ca 0.00 0.17 -0.30 0.00 0.02 0.00 0.00 55.97 55.86 1fi9 s LYS 25 Cb 0.00 -0.50 -0.17 0.00 -0.52 0.00 0.00 37.83 36.64 1fi9 s LYS 25 CO 0.00 -0.20 1.25 0.45 -0.92 0.00 0.00 175.35 175.92 1fi9 h HIS 26 N 7.65 -1.00 0.00 3.18 3.86 -1.87 -3.38 115.15 123.59 1fi9 h HIS 26 Ca -0.34 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 58.85 1fi9 h HIS 26 Cb 1.13 0.33 0.00 0.00 1.06 0.00 0.00 27.41 29.93 1fi9 h HIS 26 CO 0.50 -0.62 0.00 1.63 0.86 0.00 0.00 177.93 180.30 1fi9 n LYS 27 N -5.49 0.00 0.00 2.45 5.02 -1.26 -0.74 118.16 118.13 1fi9 n LYS 27 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1fi9 n LYS 27 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.44 1fi9 n LYS 27 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1fi9 n THR 28 N 0.00 0.00 -3.86 -0.18 -1.04 -1.26 -5.10 114.28 102.85 1fi9 n THR 28 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 1fi9 n THR 28 Cb 0.00 -0.73 -0.10 0.00 -1.82 0.00 0.00 70.33 67.68 1fi9 n THR 28 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1fi9 s GLY 29 N -2.55 0.02 0.90 3.41 0.00 0.08 -5.08 107.32 104.09 1fi9 s GLY 29 Ca 0.00 -0.08 -0.11 0.00 0.00 0.00 0.00 44.72 44.52 1fi9 s GLY 29 CO 0.00 -0.23 1.09 2.56 0.00 0.00 0.00 173.10 176.52 1fi9 s PRO 30 N -1.36 1.26 -0.11 2.90 0.04 -1.26 -4.41 135.00 132.06 1fi9 s PRO 30 Ca -0.14 0.87 -0.29 0.00 0.04 0.00 0.00 61.00 61.48 1fi9 s PRO 30 Cb -0.07 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.59 1fi9 s PRO 30 CO 0.02 -2.25 2.12 0.27 0.04 0.00 0.00 177.00 177.19 1fi9 n ASN 31 N -3.90 3.62 -1.78 6.66 6.94 -1.26 -4.19 115.26 121.35 1fi9 n ASN 31 Ca 0.07 0.51 -0.07 0.00 -0.02 0.00 0.00 54.58 55.07 1fi9 n ASN 31 Cb 0.55 -1.54 -0.07 0.00 -2.36 0.00 0.00 39.78 36.36 1fi9 n ASN 31 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1fi9 n LEU 32 N 9.85 5.41 -4.09 -4.53 0.00 0.14 -4.77 117.00 119.01 1fi9 n LEU 32 Ca 0.26 -2.87 -0.33 0.00 0.00 0.00 0.00 56.01 53.08 1fi9 n LEU 32 Cb 0.42 -1.26 -0.15 0.00 0.00 0.00 0.00 43.42 42.44 1fi9 n LEU 32 CO 0.67 1.35 -0.42 -2.28 0.00 0.00 0.00 177.39 176.72 1fi9 s HIS 33 N 0.27 3.33 0.00 1.96 2.46 -1.25 -4.25 115.29 117.81 1fi9 s HIS 33 Ca 0.33 -2.32 0.00 0.00 0.47 0.00 0.00 55.06 53.54 1fi9 s HIS 33 Cb 0.17 -2.11 0.00 0.00 -0.13 0.00 0.00 32.58 30.51 1fi9 s HIS 33 CO -0.01 -0.88 0.00 0.41 -2.47 0.00 0.00 174.74 171.79 1fi9 n GLY 34 N 4.45 1.43 0.26 1.59 0.00 -1.07 -5.02 105.19 106.84 1fi9 n GLY 34 Ca -0.12 -0.11 -0.14 0.00 0.00 0.00 0.00 46.02 45.65 1fi9 n GLY 34 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1fi9 h LEU 35 N 0.00 -0.58 -5.98 0.99 5.85 -1.82 -3.30 115.31 110.48 1fi9 h LEU 35 Ca 0.00 0.05 -0.62 0.00 0.84 0.00 0.00 57.88 58.15 1fi9 h LEU 35 Cb 0.07 0.19 0.02 0.00 0.37 0.00 0.00 40.66 41.30 1fi9 h LEU 35 CO 0.00 -0.34 2.77 0.49 -0.34 0.00 0.00 178.44 181.02 1fi9 n PHE 36 N -5.35 2.29 0.00 1.25 3.72 -1.24 -2.99 117.46 115.14 1fi9 n PHE 36 Ca -0.09 -2.31 0.00 0.00 -0.05 0.00 0.00 57.45 55.00 1fi9 n PHE 36 Cb 0.26 -2.02 0.00 0.00 -0.94 0.00 0.00 39.48 36.78 1fi9 n PHE 36 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1fi9 n GLY 37 N 4.15 0.00 3.34 1.37 0.00 -1.24 -4.96 105.19 107.85 1fi9 n GLY 37 Ca 0.52 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.44 1fi9 n GLY 37 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1fi9 s ARG 38 N 0.00 1.11 0.20 1.61 6.06 -1.16 -5.10 118.95 121.67 1fi9 s ARG 38 Ca 0.00 -0.73 -0.04 0.00 -2.50 0.00 0.00 55.73 52.46 1fi9 s ARG 38 Cb 0.00 0.48 -0.05 0.00 0.06 0.00 0.00 34.95 35.43 1fi9 s ARG 38 CO 0.00 -0.44 0.44 0.21 -2.50 0.00 0.00 175.30 173.01 1fi9 s LYS 39 N -3.81 3.61 0.00 5.12 2.20 -1.26 -3.39 119.74 122.21 1fi9 s LYS 39 Ca 0.04 -0.10 0.00 0.00 -0.36 0.00 0.00 55.97 55.55 1fi9 s LYS 39 Cb 0.01 -2.78 0.00 0.00 -1.51 0.00 0.00 37.83 33.55 1fi9 s LYS 39 CO -0.11 0.38 0.72 0.25 -0.36 0.00 0.00 175.35 176.23 1fi9 n THR 40 N -0.35 0.00 -0.72 3.43 -2.24 -0.00 -2.78 114.28 111.61 1fi9 n THR 40 Ca -0.02 1.22 -0.13 0.00 -2.27 0.00 0.00 64.05 62.84 1fi9 n THR 40 Cb 0.53 -1.82 -0.08 0.00 -2.10 0.00 0.00 70.33 66.86 1fi9 n THR 40 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fi9 n GLY 41 N -0.94 2.64 2.39 3.38 0.00 -1.25 -4.12 105.19 107.28 1fi9 n GLY 41 Ca 0.00 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 45.03 1fi9 n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fi9 n GLN 42 N 3.11 1.04 -2.58 1.61 6.02 -1.12 -4.86 117.38 120.60 1fi9 n GLN 42 Ca 0.36 -3.26 -0.39 0.00 -0.01 0.00 0.00 57.00 53.69 1fi9 n GLN 42 Cb 0.46 -1.48 -0.05 0.00 1.02 0.00 0.00 30.24 30.19 1fi9 n GLN 42 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fi9 s ALA 43 N -2.57 3.33 -0.61 -1.58 0.00 -1.26 -4.90 121.76 114.17 1fi9 s ALA 43 Ca 0.34 0.77 -0.27 0.00 0.00 0.00 0.00 51.96 52.80 1fi9 s ALA 43 Cb 0.39 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 20.23 1fi9 s ALA 43 CO -0.03 -0.05 1.57 -1.25 0.00 0.00 0.00 175.76 176.00 1fi9 s PRO 44 N -1.56 3.02 -1.17 0.00 0.04 -1.26 -4.28 135.00 129.79 1fi9 s PRO 44 Ca 0.46 0.40 -0.17 0.00 0.04 0.00 0.00 61.00 61.73 1fi9 s PRO 44 Cb -0.28 -4.24 -0.01 0.00 0.04 0.00 0.00 34.50 30.01 1fi9 s PRO 44 CO 0.36 -2.29 0.76 0.41 0.04 0.00 0.00 177.00 176.28 1fi9 n GLY 45 N 5.47 -0.89 3.14 0.56 0.00 -1.26 -4.99 105.19 107.22 1fi9 n GLY 45 Ca 0.14 0.41 -0.10 0.00 0.00 0.00 0.00 46.02 46.47 1fi9 n GLY 45 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1fi9 s PHE 46 N -3.52 0.13 -0.76 1.61 5.36 -1.26 -5.11 117.98 114.42 1fi9 s PHE 46 Ca 0.40 -0.38 -0.24 0.00 -0.96 0.00 0.00 56.93 55.75 1fi9 s PHE 46 Cb -0.14 -0.09 0.05 0.00 -0.34 0.00 0.00 43.02 42.50 1fi9 s PHE 46 CO 0.86 -0.38 1.19 -0.08 -1.46 0.00 0.00 175.22 175.34 1fi9 s THR 47 N -2.48 4.02 0.52 0.12 -1.32 -1.26 -4.93 115.64 110.29 1fi9 s THR 47 Ca -0.06 -0.14 -0.10 0.00 -1.21 0.00 0.00 61.69 60.18 1fi9 s THR 47 Cb -0.02 -4.85 -0.05 0.00 -1.51 0.00 0.00 72.50 66.07 1fi9 s THR 47 CO -0.04 -1.71 0.90 -0.72 -2.21 0.00 0.00 174.62 170.84 1fi9 s TYR 48 N 4.87 3.55 0.16 9.09 -0.85 -1.26 -5.05 117.35 127.86 1fi9 s TYR 48 Ca 0.32 1.13 -0.05 0.00 -0.52 0.00 0.00 57.07 57.95 1fi9 s TYR 48 Cb -0.10 -2.55 -0.06 0.00 0.38 0.00 0.00 41.96 39.63 1fi9 s TYR 48 CO 0.08 -0.40 0.41 0.99 -1.52 0.00 0.00 175.55 175.11 1fi9 s THR 49 N -2.79 5.13 -0.95 -3.49 2.01 -1.26 -4.98 115.64 109.30 1fi9 s THR 49 Ca 0.53 0.07 -0.10 0.00 0.31 0.00 0.00 61.69 62.50 1fi9 s THR 49 Cb -0.10 -3.63 -0.07 0.00 0.01 0.00 0.00 72.50 68.70 1fi9 s THR 49 CO 0.43 -0.00 2.12 0.47 -0.69 0.00 0.00 174.62 176.95 1fi9 n ASP 50 N -0.02 4.58 0.00 3.53 8.00 -1.26 -2.32 116.55 129.06 1fi9 n ASP 50 Ca -0.02 -2.44 0.00 0.00 0.71 0.00 0.00 54.79 53.04 1fi9 n ASP 50 Cb 0.52 -1.15 0.00 0.00 -0.02 0.00 0.00 41.12 40.47 1fi9 n ASP 50 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fi9 n ALA 51 N 4.99 0.00 0.18 2.24 0.00 -1.26 -4.85 120.51 121.81 1fi9 n ALA 51 Ca 0.48 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.77 1fi9 n ALA 51 Cb 0.21 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.58 1fi9 n ALA 51 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1fi9 h ASN 52 N 0.00 -0.34 -0.97 0.00 -1.24 -1.84 -1.71 115.58 109.49 1fi9 h ASN 52 Ca 0.00 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.00 1fi9 h ASN 52 Cb 0.00 0.09 -0.05 0.00 0.73 0.00 0.00 38.32 39.09 1fi9 h ASN 52 CO 0.00 -0.22 0.61 0.50 -1.29 0.00 0.00 177.43 177.03 1fi9 h LYS 53 N -0.44 1.30 -0.47 6.67 3.11 -1.88 -1.45 116.57 123.41 1fi9 h LYS 53 Ca -0.04 -0.10 0.14 0.00 -2.81 0.00 0.00 60.65 57.83 1fi9 h LYS 53 Cb 0.33 -0.28 -0.02 0.00 -1.00 0.00 0.00 32.23 31.26 1fi9 h LYS 53 CO 0.07 0.89 0.35 -0.97 -2.81 0.00 0.00 179.45 176.98 1fi9 h ASN 54 N 1.33 0.00 0.26 4.20 -0.73 -1.74 -2.51 115.58 116.38 1fi9 h ASN 54 Ca 0.35 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.51 1fi9 h ASN 54 Cb -0.09 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.50 1fi9 h ASN 54 CO -0.07 0.00 -0.12 0.50 -0.37 0.00 0.00 177.43 177.37 1fi9 h LYS 55 N 0.00 -0.33 -1.41 6.67 3.64 -0.37 -3.48 116.57 121.29 1fi9 h LYS 55 Ca 0.22 0.02 -0.24 0.00 -1.27 0.00 0.00 60.65 59.39 1fi9 h LYS 55 Cb 0.93 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.79 1fi9 h LYS 55 CO -0.00 -0.00 -0.28 0.41 -2.27 0.00 0.00 179.45 177.30 1fi9 n GLY 56 N 0.48 0.23 3.93 5.01 0.00 -0.95 -5.01 105.19 108.87 1fi9 n GLY 56 Ca -0.07 -0.41 -0.23 0.00 0.00 0.00 0.00 46.02 45.30 1fi9 n GLY 56 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1fi9 s ILE 57 N -2.55 2.12 0.08 -0.61 -4.36 -1.26 -4.84 121.20 109.78 1fi9 s ILE 57 Ca 0.00 -1.32 0.02 0.00 -0.26 0.00 0.00 60.65 59.09 1fi9 s ILE 57 Cb 0.00 -2.44 -0.04 0.00 1.25 0.00 0.00 42.46 41.23 1fi9 s ILE 57 CO 0.00 0.00 0.17 0.42 0.24 0.00 0.00 174.94 175.77 1fi9 s THR 58 N -2.64 5.01 -1.04 8.37 -4.23 -1.26 -0.82 115.64 119.02 1fi9 s THR 58 Ca 0.45 -0.61 -0.05 0.00 -1.18 0.00 0.00 61.69 60.31 1fi9 s THR 58 Cb -0.03 -3.46 0.28 0.00 1.34 0.00 0.00 72.50 70.63 1fi9 s THR 58 CO 0.28 0.09 1.21 0.79 -0.54 0.00 0.00 174.62 176.45 1fi9 n TRP 59 N 0.21 3.65 0.05 3.99 7.02 -1.22 -4.76 117.44 126.38 1fi9 n TRP 59 Ca -0.07 -3.36 -0.17 0.00 -1.02 0.00 0.00 57.50 52.88 1fi9 n TRP 59 Cb 0.52 -1.34 -0.14 0.00 -2.42 0.00 0.00 31.31 27.93 1fi9 n TRP 59 CO 0.00 0.00 0.00 1.57 -2.02 0.00 0.00 177.69 177.24 1fi9 h LYS 60 N 5.81 0.24 0.00 -0.99 2.10 -1.91 -3.31 116.57 118.52 1fi9 h LYS 60 Ca 0.19 -0.41 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 1fi9 h LYS 60 Cb 0.73 0.15 0.00 0.00 -0.90 0.00 0.00 32.23 32.21 1fi9 h LYS 60 CO 1.13 1.09 0.00 -0.85 -2.00 0.00 0.00 179.45 178.81 1fi9 n GLU 61 N -3.43 0.00 -0.32 0.07 0.28 -1.26 -4.91 120.64 111.07 1fi9 n GLU 61 Ca -0.19 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 56.84 1fi9 n GLU 61 Cb 1.05 0.00 0.17 0.00 1.43 0.00 0.00 31.44 34.09 1fi9 n GLU 61 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1fi9 h GLU 62 N 0.00 0.94 0.68 3.44 4.81 -1.95 0.25 114.58 122.75 1fi9 h GLU 62 Ca 0.00 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 1fi9 h GLU 62 Cb 0.00 -0.21 0.01 0.00 0.63 0.00 0.00 28.75 29.18 1fi9 h GLU 62 CO 0.00 0.62 -0.33 1.79 -0.73 0.00 0.00 179.01 180.36 1fi9 h THR 63 N 0.97 0.14 -0.96 0.32 1.35 -1.93 -3.18 112.91 109.62 1fi9 h THR 63 Ca 0.41 -0.28 0.11 0.00 -0.55 0.00 0.00 66.41 66.10 1fi9 h THR 63 Cb 0.27 0.19 -0.08 0.00 -1.73 0.00 0.00 68.15 66.80 1fi9 h THR 63 CO -0.21 0.02 0.59 0.17 -0.25 0.00 0.00 175.52 175.84 1fi9 h LEU 64 N -1.16 0.88 -0.83 3.87 -0.00 -1.83 -1.88 115.31 114.35 1fi9 h LEU 64 Ca -0.09 0.04 0.19 0.00 -0.00 0.00 0.00 57.88 58.02 1fi9 h LEU 64 Cb 0.73 -0.13 -0.15 0.00 -0.00 0.00 0.00 40.66 41.11 1fi9 h LEU 64 CO 0.15 0.48 -0.06 0.24 -0.00 0.00 0.00 178.44 179.25 1fi9 h MET 65 N 0.96 0.05 0.02 0.17 2.86 -0.49 0.23 114.93 118.73 1fi9 h MET 65 Ca 0.46 -0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.94 1fi9 h MET 65 Cb 0.42 -0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.08 1fi9 h MET 65 CO -0.25 0.03 -0.65 0.93 1.06 0.00 0.00 176.91 178.03 1fi9 h GLU 66 N 0.05 0.40 -0.46 1.72 3.07 -1.39 -3.29 114.58 114.67 1fi9 h GLU 66 Ca 0.45 -0.46 0.09 0.00 -0.50 0.00 0.00 59.36 58.94 1fi9 h GLU 66 Cb 0.79 0.14 -0.09 0.00 -0.84 0.00 0.00 28.75 28.75 1fi9 h GLU 66 CO -0.79 1.13 -0.12 -0.92 -1.40 0.00 0.00 179.01 176.91 1fi9 h TYR 67 N -0.14 -0.27 0.00 4.33 3.20 -0.35 0.44 116.97 124.18 1fi9 h TYR 67 Ca -0.09 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.82 1fi9 h TYR 67 Cb 1.38 0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.84 1fi9 h TYR 67 CO 0.15 -0.21 0.00 1.28 -1.64 0.00 0.00 178.16 177.74 1fi9 n LEU 68 N -5.35 0.55 -0.00 2.82 4.77 0.64 -1.30 117.00 119.13 1fi9 n LEU 68 Ca 0.04 0.71 0.00 0.00 -0.03 0.00 0.00 56.01 56.73 1fi9 n LEU 68 Cb 0.25 -0.73 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 1fi9 n LEU 68 CO 0.12 -0.80 0.47 -0.62 -1.33 0.00 0.00 177.39 175.22 1fi9 n GLU 69 N -2.19 2.57 -2.66 3.23 -0.58 0.18 -3.22 120.64 117.97 1fi9 n GLU 69 Ca -0.00 -1.38 -0.03 0.00 -0.42 0.00 0.00 57.16 55.33 1fi9 n GLU 69 Cb 0.09 -0.94 0.08 0.00 -0.57 0.00 0.00 31.44 30.10 1fi9 n GLU 69 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1fi9 n ASN 70 N -0.45 -1.10 0.04 1.62 2.85 0.13 -4.71 115.26 113.64 1fi9 n ASN 70 Ca 0.00 -1.65 0.02 0.00 -0.11 0.00 0.00 54.58 52.84 1fi9 n ASN 70 Cb 0.29 1.05 0.37 0.00 1.24 0.00 0.00 39.78 42.74 1fi9 n ASN 70 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1fi9 h PRO 71 N 1.79 0.44 -0.40 1.20 0.13 -1.39 -2.12 132.00 131.66 1fi9 h PRO 71 Ca -0.42 -0.07 -0.08 0.00 -0.87 0.00 0.00 66.00 64.57 1fi9 h PRO 71 Cb 1.23 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 32.27 1fi9 h PRO 71 CO -0.08 0.43 -0.07 0.87 -0.23 0.00 0.00 178.00 178.93 1fi9 h LYS 72 N 0.43 0.67 -0.05 0.86 6.56 -1.88 -3.09 116.57 120.08 1fi9 h LYS 72 Ca 0.10 -0.19 0.00 0.00 -1.06 0.00 0.00 60.65 59.50 1fi9 h LYS 72 Cb 0.21 -0.07 -0.00 0.00 -0.57 0.00 0.00 32.23 31.79 1fi9 h LYS 72 CO -0.00 0.74 0.03 -0.22 -2.06 0.00 0.00 179.45 177.94 1fi9 h LYS 73 N 0.62 0.06 0.41 3.15 3.64 -1.78 -0.38 116.57 122.29 1fi9 h LYS 73 Ca 0.12 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1fi9 h LYS 73 Cb 0.49 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1fi9 h LYS 73 CO 0.03 0.04 -0.19 1.88 -2.27 0.00 0.00 179.45 178.93 1fi9 h TYR 74 N 0.06 -0.50 -1.95 1.91 -1.99 -1.64 -3.47 116.97 109.39 1fi9 h TYR 74 Ca 0.02 -0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.78 1fi9 h TYR 74 Cb -0.00 0.17 -0.22 0.00 2.00 0.00 0.00 36.73 38.68 1fi9 h TYR 74 CO -0.00 -0.23 -0.20 -1.50 -0.00 0.00 0.00 178.16 176.23 1fi9 s ILE 75 N -3.70 -0.93 -1.44 -2.88 2.07 -0.18 -5.06 121.20 109.08 1fi9 s ILE 75 Ca -0.10 0.03 -0.11 0.00 -1.41 0.00 0.00 60.65 59.05 1fi9 s ILE 75 Cb 0.01 -0.94 -0.05 0.00 0.13 0.00 0.00 42.46 41.61 1fi9 s ILE 75 CO 0.34 0.01 2.59 -0.81 -1.91 0.00 0.00 174.94 175.16 1fi9 n PRO 76 N 5.43 3.13 -2.69 3.50 -0.04 -1.02 -4.23 135.00 139.08 1fi9 n PRO 76 Ca -0.10 -2.20 -0.05 0.00 -0.04 0.00 0.00 63.50 61.11 1fi9 n PRO 76 Cb 0.49 -2.90 0.05 0.00 -0.04 0.00 0.00 33.50 31.10 1fi9 n PRO 76 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fi9 n GLY 77 N 3.81 -1.33 0.00 0.55 0.00 -1.26 -5.09 105.19 101.87 1fi9 n GLY 77 Ca 0.65 0.89 0.00 0.00 0.00 0.00 0.00 46.02 47.57 1fi9 n GLY 77 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1fi9 n THR 78 N 1.99 0.00 -2.72 2.61 -1.04 -1.26 -4.80 114.28 109.07 1fi9 n THR 78 Ca 0.07 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.08 1fi9 n THR 78 Cb 0.66 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 69.19 1fi9 n THR 78 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1fi9 s LYS 79 N 0.00 0.18 0.18 -2.82 -2.85 -1.26 -5.13 119.74 108.05 1fi9 s LYS 79 Ca 0.00 -0.12 -0.30 0.00 -1.00 0.00 0.00 55.97 54.55 1fi9 s LYS 79 Cb 0.00 0.01 -0.08 0.00 -2.06 0.00 0.00 37.83 35.70 1fi9 s LYS 79 CO 0.00 -0.24 0.97 -1.64 0.10 0.00 0.00 175.35 174.54 1fi9 s MET 80 N 1.51 4.76 0.09 1.78 -1.94 -1.26 -4.97 119.30 119.26 1fi9 s MET 80 Ca 0.19 1.51 0.00 0.00 -1.71 0.00 0.00 55.69 55.68 1fi9 s MET 80 Cb 0.08 -3.32 0.00 0.00 2.01 0.00 0.00 34.83 33.60 1fi9 s MET 80 CO -0.13 0.33 0.00 -0.89 -0.01 0.00 0.00 175.02 174.32 1fi9 n ILE 81 N 2.11 0.98 -4.23 2.53 2.08 -1.26 -5.12 119.36 116.45 1fi9 n ILE 81 Ca 0.00 0.33 -0.13 0.00 0.56 0.00 0.00 62.75 63.51 1fi9 n ILE 81 Cb 0.48 -1.43 -0.10 0.00 -0.75 0.00 0.00 39.64 37.83 1fi9 n ILE 81 CO 0.00 0.00 0.00 0.72 0.56 0.00 0.00 176.55 177.83 1fi9 s PHE 82 N -1.85 1.24 0.13 1.39 -0.12 -1.26 -5.08 117.98 112.44 1fi9 s PHE 82 Ca 0.00 -1.26 -0.27 0.00 -0.05 0.00 0.00 56.93 55.35 1fi9 s PHE 82 Cb 0.00 -0.67 -0.04 0.00 -0.63 0.00 0.00 43.02 41.68 1fi9 s PHE 82 CO 0.00 -0.48 1.61 0.00 -0.05 0.00 0.00 175.22 176.30 1fi9 h ALA 83 N 2.59 -0.43 -1.88 1.99 0.00 -1.96 -3.47 119.26 116.09 1fi9 h ALA 83 Ca -0.37 0.00 0.22 0.00 0.00 0.00 0.00 54.91 54.77 1fi9 h ALA 83 Cb 1.24 0.60 -0.04 0.00 0.00 0.00 0.00 17.79 19.59 1fi9 h ALA 83 CO 0.57 -0.82 0.59 0.41 0.00 0.00 0.00 179.25 180.00 1fi9 n GLY 84 N -1.41 0.41 0.00 0.00 0.00 -1.26 -4.28 105.19 98.65 1fi9 n GLY 84 Ca -0.04 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1fi9 n GLY 84 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1fi9 n ILE 85 N -0.61 0.00 0.09 -0.61 2.08 -1.20 -4.93 119.36 114.18 1fi9 n ILE 85 Ca 0.02 0.88 0.00 0.00 0.56 0.00 0.00 62.75 64.21 1fi9 n ILE 85 Cb 0.39 -1.73 0.00 0.00 -0.75 0.00 0.00 39.64 37.55 1fi9 n ILE 85 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1fi9 n LYS 86 N -0.49 0.00 0.00 0.38 5.02 -1.26 -5.05 118.16 116.76 1fi9 n LYS 86 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1fi9 n LYS 86 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1fi9 n LYS 86 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1fi9 n LYS 87 N -3.03 0.00 -0.06 1.97 2.85 -1.26 -5.06 118.16 113.57 1fi9 n LYS 87 Ca 0.00 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 57.04 1fi9 n LYS 87 Cb 0.00 0.00 -0.13 0.00 -0.65 0.00 0.00 35.03 34.25 1fi9 n LYS 87 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 1fi9 n LYS 88 N 0.00 0.69 0.00 -1.58 2.85 -1.26 -4.00 118.16 114.86 1fi9 n LYS 88 Ca 0.00 0.29 0.00 0.00 -1.05 0.00 0.00 58.31 57.55 1fi9 n LYS 88 Cb 0.00 -1.65 0.00 0.00 -0.65 0.00 0.00 35.03 32.73 1fi9 n LYS 88 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1fi9 n THR 89 N -3.67 0.00 -0.20 0.58 -1.04 -1.26 -0.41 114.28 108.27 1fi9 n THR 89 Ca -0.37 1.49 -0.01 0.00 -2.04 0.00 0.00 64.05 63.12 1fi9 n THR 89 Cb 0.96 -2.36 0.10 0.00 -1.82 0.00 0.00 70.33 67.20 1fi9 n THR 89 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1fi9 h GLU 90 N 0.00 0.46 -0.93 -2.82 3.07 -1.99 0.13 114.58 112.51 1fi9 h GLU 90 Ca 0.00 -0.03 0.17 0.00 -0.50 0.00 0.00 59.36 59.00 1fi9 h GLU 90 Cb 0.00 -0.10 -0.10 0.00 -0.84 0.00 0.00 28.75 27.71 1fi9 h GLU 90 CO 0.00 0.30 0.52 -0.09 -1.40 0.00 0.00 179.01 178.35 1fi9 h ARG 91 N 0.47 0.68 0.11 2.33 2.43 -1.65 0.13 114.38 118.89 1fi9 h ARG 91 Ca 0.29 -0.04 -0.20 0.00 -0.81 0.00 0.00 59.98 59.22 1fi9 h ARG 91 Cb 0.31 -0.15 0.02 0.00 -0.42 0.00 0.00 29.97 29.73 1fi9 h ARG 91 CO -0.26 0.45 -0.85 1.49 -1.51 0.00 0.00 179.97 179.30 1fi9 h GLU 92 N 0.70 0.37 -0.89 0.20 4.81 0.10 -2.73 114.58 117.15 1fi9 h GLU 92 Ca 0.52 -0.55 0.15 0.00 -0.13 0.00 0.00 59.36 59.35 1fi9 h GLU 92 Cb 0.76 0.19 -0.10 0.00 0.63 0.00 0.00 28.75 30.24 1fi9 h GLU 92 CO -0.37 1.24 0.48 -0.44 -0.73 0.00 0.00 179.01 179.19 1fi9 h ASP 93 N -0.21 0.61 -0.01 1.04 3.32 -0.52 -0.77 116.42 119.87 1fi9 h ASP 93 Ca -0.14 0.09 0.03 0.00 0.02 0.00 0.00 57.03 57.03 1fi9 h ASP 93 Cb 1.62 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 41.11 1fi9 h ASP 93 CO 0.16 0.25 -0.40 0.25 -1.72 0.00 0.00 179.24 177.79 1fi9 h LEU 94 N 0.68 -1.21 -0.78 1.55 6.46 -0.65 -0.88 115.31 120.49 1fi9 h LEU 94 Ca 0.49 0.15 0.18 0.00 -0.12 0.00 0.00 57.88 58.58 1fi9 h LEU 94 Cb 0.68 0.48 -0.12 0.00 -0.73 0.00 0.00 40.66 40.97 1fi9 h LEU 94 CO -0.36 -0.44 0.21 0.40 -0.62 0.00 0.00 178.44 177.63 1fi9 h ILE 95 N -0.55 0.47 -0.09 4.05 5.03 -0.95 -0.65 117.51 124.83 1fi9 h ILE 95 Ca 0.05 -0.09 0.04 0.00 -0.12 0.00 0.00 64.86 64.74 1fi9 h ILE 95 Cb 0.63 0.17 -0.05 0.00 -3.03 0.00 0.00 36.82 34.55 1fi9 h ILE 95 CO -0.31 0.05 -0.22 0.00 -0.68 0.00 0.00 178.15 176.98 1fi9 h ALA 96 N 1.66 -0.22 0.43 1.87 0.00 0.20 0.32 119.26 123.51 1fi9 h ALA 96 Ca 0.46 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.38 1fi9 h ALA 96 Cb 0.81 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1fi9 h ALA 96 CO -0.54 -0.69 -0.28 -0.92 0.00 0.00 0.00 179.25 176.81 1fi9 h TYR 97 N -0.30 -0.74 -0.88 0.00 3.20 -0.84 -2.67 116.97 114.73 1fi9 h TYR 97 Ca 0.09 -0.01 0.23 0.00 3.14 0.00 0.00 58.73 62.18 1fi9 h TYR 97 Cb 0.43 0.27 -0.15 0.00 1.54 0.00 0.00 36.73 38.81 1fi9 h TYR 97 CO -0.30 -0.43 0.11 -0.07 -1.64 0.00 0.00 178.16 175.83 1fi9 h LEU 98 N -0.68 -0.24 -0.05 2.82 4.07 -0.67 0.79 115.31 121.34 1fi9 h LEU 98 Ca -0.04 0.22 0.03 0.00 0.08 0.00 0.00 57.88 58.17 1fi9 h LEU 98 Cb 0.57 0.36 -0.06 0.00 1.08 0.00 0.00 40.66 42.61 1fi9 h LEU 98 CO 0.03 -0.23 -0.47 0.11 -1.08 0.00 0.00 178.44 176.80 1fi9 h LYS 99 N 0.11 -0.57 -0.21 1.13 1.57 -0.01 0.18 116.57 118.77 1fi9 h LYS 99 Ca 0.54 0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 59.33 1fi9 h LYS 99 Cb 1.07 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 1fi9 h LYS 99 CO -0.75 -0.38 0.05 -0.22 -0.57 0.00 0.00 179.45 177.59 1fi9 h LYS 100 N -0.59 0.35 -0.55 3.15 1.63 -1.32 -1.82 116.57 117.43 1fi9 h LYS 100 Ca 0.04 -0.09 0.02 0.00 -0.85 0.00 0.00 60.65 59.78 1fi9 h LYS 100 Cb 0.68 -0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 32.23 1fi9 h LYS 100 CO -0.37 0.47 0.33 0.00 -3.45 0.00 0.00 179.45 176.43 1fi9 h ALA 101 N 0.86 0.70 0.13 5.00 0.00 -0.09 0.95 119.26 126.81 1fi9 h ALA 101 Ca 0.07 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.67 1fi9 h ALA 101 Cb 0.28 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 17.93 1fi9 h ALA 101 CO 0.00 0.05 -1.24 1.79 0.00 0.00 0.00 179.25 179.85 1fi9 h THR 102 N 0.66 1.35 -0.76 0.00 1.35 -0.72 -3.22 112.91 111.56 1fi9 h THR 102 Ca 0.22 -2.64 0.02 0.00 -0.55 0.00 0.00 66.41 63.46 1fi9 h THR 102 Cb 0.01 2.77 -0.04 0.00 -1.73 0.00 0.00 68.15 69.16 1fi9 h THR 102 CO -0.09 0.79 0.50 -1.13 -0.25 0.00 0.00 175.52 175.33 1fi9 h ASN 103 N 0.20 0.84 0.00 5.36 -1.24 -1.02 -2.83 115.58 116.89 1fi9 h ASN 103 Ca -0.17 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.83 1fi9 h ASN 103 Cb 1.93 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 40.78 1fi9 h ASN 103 CO 0.23 0.59 0.00 1.21 -1.29 0.00 0.00 177.43 178.17