#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 6.77 0.22 1.61 2.15 -1.26 -4.68 116.67 121.47 1fi9 s ASP 2 Ca 0.00 2.24 -0.07 0.00 0.43 0.00 0.00 52.55 55.15 1fi9 s ASP 2 Cb 0.00 -2.56 0.18 0.00 -0.30 0.00 0.00 42.92 40.24 1fi9 s ASP 2 CO 0.00 -0.77 1.75 0.58 -0.17 0.00 0.00 175.17 176.55 1fi9 h VAL 3 N 4.87 1.26 0.64 1.11 2.07 -1.84 0.16 116.25 124.51 1fi9 h VAL 3 Ca -0.39 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.16 1fi9 h VAL 3 Cb 1.19 0.53 0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1fi9 h VAL 3 CO 0.91 0.36 -0.31 -0.33 0.02 0.00 0.00 177.57 178.22 1fi9 h GLU 4 N 1.04 -0.83 -0.89 1.57 4.39 -1.92 0.15 114.58 118.09 1fi9 h GLU 4 Ca 0.22 0.06 0.08 0.00 0.34 0.00 0.00 59.36 60.06 1fi9 h GLU 4 Cb 0.34 0.19 -0.07 0.00 -0.10 0.00 0.00 28.75 29.11 1fi9 h GLU 4 CO -0.00 -0.53 0.55 0.87 -1.16 0.00 0.00 179.01 178.73 1fi9 h LYS 5 N -1.20 0.93 -0.60 2.33 1.57 -1.92 -0.57 116.57 117.11 1fi9 h LYS 5 Ca -0.09 -0.06 0.12 0.00 -1.87 0.00 0.00 60.65 58.76 1fi9 h LYS 5 Cb 0.67 -0.21 -0.10 0.00 0.08 0.00 0.00 32.23 32.68 1fi9 h LYS 5 CO 0.14 0.62 0.03 0.78 -0.57 0.00 0.00 179.45 180.44 1fi9 h GLY 6 N 0.96 0.66 0.92 3.86 0.00 -0.54 0.27 103.07 109.20 1fi9 h GLY 6 Ca 0.41 0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 1fi9 h GLY 6 CO -0.20 -0.18 -0.10 1.70 0.00 0.00 0.00 176.54 177.76 1fi9 h LYS 7 N 0.14 -0.24 -0.55 4.80 3.64 0.75 0.07 116.57 125.18 1fi9 h LYS 7 Ca 0.31 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.69 1fi9 h LYS 7 Cb 0.49 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.34 1fi9 h LYS 7 CO -0.49 -0.16 0.29 0.87 -2.27 0.00 0.00 179.45 177.69 1fi9 h LYS 8 N -0.24 0.78 0.35 1.90 1.79 -0.25 -1.55 116.57 119.34 1fi9 h LYS 8 Ca -0.01 -0.10 -0.00 0.00 -2.18 0.00 0.00 60.65 58.36 1fi9 h LYS 8 Cb 0.22 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.70 1fi9 h LYS 8 CO -0.00 0.62 -0.33 0.82 -1.08 0.00 0.00 179.45 179.48 1fi9 h ILE 9 N 0.74 0.32 -0.82 1.86 2.04 -0.26 0.48 117.51 121.88 1fi9 h ILE 9 Ca 0.19 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.23 1fi9 h ILE 9 Cb 0.08 0.32 -0.15 0.00 -0.74 0.00 0.00 36.82 36.33 1fi9 h ILE 9 CO -0.03 0.00 -0.10 0.15 0.00 0.00 0.00 178.15 178.17 1fi9 h PHE 10 N -0.70 -0.25 0.00 1.37 3.57 -0.74 0.39 116.94 120.59 1fi9 h PHE 10 Ca -0.02 0.07 -0.09 0.00 3.53 0.00 0.00 57.97 61.45 1fi9 h PHE 10 Cb 0.63 0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.59 1fi9 h PHE 10 CO -0.18 -0.32 -0.44 0.28 -2.23 0.00 0.00 178.31 175.41 1fi9 h VAL 11 N 0.04 0.92 0.00 1.41 2.07 -0.46 0.90 116.25 121.13 1fi9 h VAL 11 Ca 0.43 -1.81 0.00 0.00 0.82 0.00 0.00 66.70 66.13 1fi9 h VAL 11 Cb 0.73 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 1fi9 h VAL 11 CO -0.79 0.43 -0.76 0.00 0.02 0.00 0.00 177.57 176.48 1fi9 n GLN 12 N -3.43 0.04 -0.04 1.57 1.13 0.16 -4.28 117.38 112.53 1fi9 n GLN 12 Ca 0.00 -0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.98 1fi9 n GLN 12 Cb 0.59 -1.51 -0.03 0.00 0.11 0.00 0.00 30.24 29.41 1fi9 n GLN 12 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1fi9 n LYS 13 N -1.56 0.15 0.00 -1.09 4.76 0.12 -5.00 118.16 115.54 1fi9 n LYS 13 Ca 0.04 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 1fi9 n LYS 13 Cb 0.35 -0.76 0.00 0.00 -1.84 0.00 0.00 35.03 32.77 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 -1.85 0.00 -0.87 0.00 0.00 -0.51 -2.97 120.51 114.31 1fi9 n ALA 15 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1fi9 n ALA 15 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 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 1.74 0.00 0.00 6.02 -1.26 -2.95 117.38 120.93 1fi9 n GLN 16 Ca 0.00 -0.83 0.00 0.00 -0.01 0.00 0.00 57.00 56.16 1fi9 n GLN 16 Cb 0.00 -1.87 0.00 0.00 1.02 0.00 0.00 30.24 29.39 1fi9 n GLN 16 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fi9 s HIS 18 N -1.37 2.20 0.00 0.00 3.76 -1.15 -2.10 115.29 116.62 1fi9 s HIS 18 Ca 0.00 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 54.53 1fi9 s HIS 18 Cb 0.00 -1.16 0.00 0.00 1.11 0.00 0.00 32.58 32.53 1fi9 s HIS 18 CO 0.00 0.36 0.00 2.41 -0.85 0.00 0.00 174.74 176.66 1fi9 n THR 19 N 0.73 0.00 -1.08 1.30 -1.04 -1.26 -3.85 114.28 109.08 1fi9 n THR 19 Ca -0.16 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.82 1fi9 n THR 19 Cb 0.54 -0.78 -0.01 0.00 -1.82 0.00 0.00 70.33 68.26 1fi9 n THR 19 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1fi9 n VAL 20 N -2.02 0.00 -4.01 12.58 0.24 -1.26 -4.92 118.33 118.93 1fi9 n VAL 20 Ca 0.00 0.00 -0.24 0.00 -2.04 0.00 0.00 64.34 62.06 1fi9 n VAL 20 Cb 0.46 -0.95 -0.06 0.00 -1.47 0.00 0.00 33.84 31.82 1fi9 n VAL 20 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1fi9 s GLU 21 N -1.91 2.29 0.00 7.34 2.12 -1.26 -3.00 118.70 124.28 1fi9 s GLU 21 Ca 0.00 -1.82 0.28 0.00 0.36 0.00 0.00 54.97 53.79 1fi9 s GLU 21 Cb 0.00 -2.06 1.28 0.00 0.26 0.00 0.00 34.13 33.61 1fi9 s GLU 21 CO 0.00 -0.20 1.94 0.36 -0.54 0.00 0.00 175.26 176.82 1fi9 n LYS 22 N -1.36 0.12 -0.72 4.30 0.00 -1.26 -3.57 118.16 115.67 1fi9 n LYS 22 Ca -0.01 0.01 0.05 0.00 -0.00 0.00 0.00 58.31 58.37 1fi9 n LYS 22 Cb 0.64 -1.50 0.10 0.00 -0.00 0.00 0.00 35.03 34.27 1fi9 n LYS 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1fi9 n GLY 23 N 1.35 3.03 0.00 2.58 0.00 -1.26 -4.83 105.19 106.06 1fi9 n GLY 23 Ca 0.09 -0.89 0.11 0.00 0.00 0.00 0.00 46.02 45.33 1fi9 n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fi9 n GLY 24 N -0.52 -1.10 4.64 -0.02 0.00 -1.23 -5.02 105.19 101.93 1fi9 n GLY 24 Ca 0.11 -0.10 0.06 0.00 0.00 0.00 0.00 46.02 46.09 1fi9 n GLY 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fi9 n LYS 25 N -1.33 -0.87 -0.02 1.61 5.02 -1.26 -4.80 118.16 116.52 1fi9 n LYS 25 Ca 0.10 0.57 -0.01 0.00 -2.02 0.00 0.00 58.31 56.95 1fi9 n LYS 25 Cb 0.20 -1.06 -0.00 0.00 -0.02 0.00 0.00 35.03 34.15 1fi9 n LYS 25 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1fi9 n HIS 26 N -2.25 0.20 -2.72 2.13 8.25 -1.26 -3.92 115.22 115.65 1fi9 n HIS 26 Ca 0.00 0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 1fi9 n HIS 26 Cb 0.20 -0.35 0.00 0.00 1.12 0.00 0.00 29.99 30.95 1fi9 n HIS 26 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1fi9 n LYS 27 N -2.77 0.00 0.04 -0.41 5.02 -1.26 -3.83 118.16 114.95 1fi9 n LYS 27 Ca -0.02 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.26 1fi9 n LYS 27 Cb 0.06 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.06 1fi9 n LYS 27 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1fi9 h THR 28 N 0.00 0.00 -3.06 -0.18 2.02 -1.94 -3.41 112.91 106.33 1fi9 h THR 28 Ca 0.00 -0.00 -0.58 0.00 0.77 0.00 0.00 66.41 66.60 1fi9 h THR 28 Cb 0.00 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.35 1fi9 h THR 28 CO 0.00 0.00 0.81 -0.83 0.37 0.00 0.00 175.52 175.87 1fi9 s GLY 29 N -1.12 1.69 0.57 2.16 0.00 -0.89 -5.01 107.32 104.73 1fi9 s GLY 29 Ca -0.01 0.21 -0.20 0.00 0.00 0.00 0.00 44.72 44.72 1fi9 s GLY 29 CO 0.04 2.23 1.28 2.56 0.00 0.00 0.00 173.10 179.22 1fi9 s PRO 30 N 3.25 3.01 -1.06 2.90 0.04 -1.25 -4.35 135.00 137.54 1fi9 s PRO 30 Ca 0.45 2.04 -0.25 0.00 0.04 0.00 0.00 61.00 63.29 1fi9 s PRO 30 Cb -0.16 -2.09 -0.13 0.00 0.04 0.00 0.00 34.50 32.17 1fi9 s PRO 30 CO 0.07 -1.23 2.04 0.54 0.04 0.00 0.00 177.00 178.47 1fi9 s ASN 31 N -1.26 4.46 0.05 6.66 4.22 -1.25 -4.53 114.94 123.28 1fi9 s ASN 31 Ca 0.75 -1.08 -0.10 0.00 -2.14 0.00 0.00 52.86 50.29 1fi9 s ASN 31 Cb -0.36 -2.58 -0.02 0.00 1.28 0.00 0.00 41.25 39.57 1fi9 s ASN 31 CO 0.41 -3.59 1.02 0.18 -2.04 0.00 0.00 177.10 173.08 1fi9 n LEU 32 N 16.33 -0.34 -2.90 3.54 4.77 -1.26 -4.42 117.00 132.73 1fi9 n LEU 32 Ca 0.43 1.10 -0.01 0.00 -0.03 0.00 0.00 56.01 57.50 1fi9 n LEU 32 Cb 0.46 -0.34 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 1fi9 n LEU 32 CO 0.62 -0.73 -0.46 1.57 -1.33 0.00 0.00 177.39 177.06 1fi9 n HIS 33 N -3.68 -2.29 -0.90 -1.77 -0.00 -1.16 -4.52 115.22 100.89 1fi9 n HIS 33 Ca 0.01 1.12 0.00 0.00 0.46 0.00 0.00 57.72 59.31 1fi9 n HIS 33 Cb 0.08 -2.64 0.00 0.00 -0.12 0.00 0.00 29.99 27.31 1fi9 n HIS 33 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1fi9 n GLY 34 N 1.32 0.99 0.41 1.57 0.00 0.13 -5.00 105.19 104.61 1fi9 n GLY 34 Ca -0.07 -0.25 -0.17 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.85 -6.07 0.99 5.85 -1.79 -3.33 115.31 110.11 1fi9 h LEU 35 Ca 0.00 0.01 -0.64 0.00 0.84 0.00 0.00 57.88 58.09 1fi9 h LEU 35 Cb 0.36 0.22 0.01 0.00 0.37 0.00 0.00 40.66 41.62 1fi9 h LEU 35 CO 0.00 -0.53 2.75 0.49 -0.34 0.00 0.00 178.44 180.81 1fi9 n PHE 36 N -5.48 2.42 0.00 1.25 3.72 -1.26 -3.49 117.46 114.63 1fi9 n PHE 36 Ca -0.14 -2.33 0.00 0.00 -0.05 0.00 0.00 57.45 54.94 1fi9 n PHE 36 Cb 0.41 -2.05 0.00 0.00 -0.94 0.00 0.00 39.48 36.89 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 4.21 -0.81 3.64 1.37 0.00 -1.25 -5.03 105.19 107.32 1fi9 n GLY 37 Ca 0.52 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.81 1fi9 n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fi9 s ARG 38 N 0.00 0.53 0.71 1.61 0.52 -1.23 -5.07 118.95 116.02 1fi9 s ARG 38 Ca 0.00 -0.29 -0.01 0.00 -0.52 0.00 0.00 55.73 54.91 1fi9 s ARG 38 Cb 0.00 0.18 0.12 0.00 0.52 0.00 0.00 34.95 35.77 1fi9 s ARG 38 CO 0.00 -0.24 0.98 0.15 0.02 0.00 0.00 175.30 176.21 1fi9 s LYS 39 N -2.58 1.74 0.07 3.54 3.01 -1.26 -3.13 119.74 121.13 1fi9 s LYS 39 Ca 0.13 -1.04 -0.32 0.00 -1.01 0.00 0.00 55.97 53.73 1fi9 s LYS 39 Cb 0.03 -2.33 -0.18 0.00 -1.01 0.00 0.00 37.83 34.35 1fi9 s LYS 39 CO -0.03 -1.40 1.63 1.79 0.51 0.00 0.00 175.35 177.85 1fi9 h THR 40 N -0.51 0.38 0.00 2.17 1.35 -1.74 -3.26 112.91 111.29 1fi9 h THR 40 Ca -0.37 0.00 -0.20 0.00 -0.55 0.00 0.00 66.41 65.29 1fi9 h THR 40 Cb 1.27 0.38 -0.03 0.00 -1.73 0.00 0.00 68.15 68.04 1fi9 h THR 40 CO 0.42 0.00 0.65 0.61 -0.25 0.00 0.00 175.52 176.94 1fi9 n GLY 41 N -1.45 2.56 2.32 5.82 0.00 -1.10 -4.20 105.19 109.14 1fi9 n GLY 41 Ca -0.13 -0.83 -0.16 0.00 0.00 0.00 0.00 46.02 44.90 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 3.02 0.97 -2.92 1.61 1.13 -1.23 -4.98 117.38 114.98 1fi9 n GLN 42 Ca 0.34 -3.01 -0.34 0.00 -1.94 0.00 0.00 57.00 52.04 1fi9 n GLN 42 Cb 0.49 -1.53 -0.07 0.00 0.11 0.00 0.00 30.24 29.24 1fi9 n GLN 42 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1fi9 s ALA 43 N -1.71 3.19 -1.15 -1.58 0.00 -1.26 -4.92 121.76 114.33 1fi9 s ALA 43 Ca 0.35 0.32 -0.20 0.00 0.00 0.00 0.00 51.96 52.44 1fi9 s ALA 43 Cb 0.33 -3.03 -0.04 0.00 0.00 0.00 0.00 23.12 20.37 1fi9 s ALA 43 CO -0.08 0.21 1.94 -0.35 0.00 0.00 0.00 175.76 177.49 1fi9 n PRO 44 N -0.14 2.21 0.00 0.00 -0.04 -1.26 -4.47 135.00 131.31 1fi9 n PRO 44 Ca 0.04 -2.52 0.00 0.00 -0.04 0.00 0.00 63.50 60.98 1fi9 n PRO 44 Cb 0.53 -3.36 0.00 0.00 -0.04 0.00 0.00 33.50 30.62 1fi9 n PRO 44 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fi9 n GLY 45 N 5.00 1.80 3.27 0.55 0.00 -1.26 -4.96 105.19 109.60 1fi9 n GLY 45 Ca 0.49 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.14 1fi9 n GLY 45 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1fi9 n PHE 46 N 0.00 -2.67 -0.52 1.61 7.35 -1.26 -4.97 117.46 116.99 1fi9 n PHE 46 Ca 0.00 0.29 -0.30 0.00 -0.76 0.00 0.00 57.45 56.68 1fi9 n PHE 46 Cb 0.00 -1.71 0.27 0.00 0.35 0.00 0.00 39.48 38.39 1fi9 n PHE 46 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1fi9 s THR 47 N -1.98 1.38 -0.57 -2.13 -4.23 -1.26 -4.78 115.64 102.08 1fi9 s THR 47 Ca 0.56 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 61.11 1fi9 s THR 47 Cb -0.36 -2.14 0.16 0.00 1.34 0.00 0.00 72.50 71.50 1fi9 s THR 47 CO 0.67 0.00 0.40 -0.31 -0.54 0.00 0.00 174.62 174.85 1fi9 s TYR 48 N -2.43 2.51 0.49 3.99 2.02 -1.26 -4.88 117.35 117.79 1fi9 s TYR 48 Ca 0.69 -2.87 -0.22 0.00 -0.37 0.00 0.00 57.07 54.29 1fi9 s TYR 48 Cb -0.14 -1.99 -0.08 0.00 -0.40 0.00 0.00 41.96 39.35 1fi9 s TYR 48 CO 0.59 -0.68 1.08 2.41 -1.57 0.00 0.00 175.55 177.38 1fi9 n THR 49 N 2.49 2.99 -1.29 -0.71 -1.04 -1.26 -4.80 114.28 110.67 1fi9 n THR 49 Ca 0.22 -0.50 -0.38 0.00 -2.04 0.00 0.00 64.05 61.34 1fi9 n THR 49 Cb 0.39 -1.28 -0.07 0.00 -1.82 0.00 0.00 70.33 67.55 1fi9 n THR 49 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1fi9 n ASP 50 N -0.10 2.34 0.02 8.00 8.00 -1.26 -1.60 116.55 131.94 1fi9 n ASP 50 Ca 0.10 -2.64 0.00 0.00 0.71 0.00 0.00 54.79 52.96 1fi9 n ASP 50 Cb 0.42 -1.20 0.00 0.00 -0.02 0.00 0.00 41.12 40.33 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 10.10 0.00 -1.46 2.24 0.00 -1.26 -4.71 120.51 125.42 1fi9 n ALA 51 Ca 0.48 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.59 1fi9 n ALA 51 Cb 0.43 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.92 1fi9 n ALA 51 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1fi9 n ASN 52 N -2.92 7.29 0.21 0.00 6.94 -0.63 -3.67 115.26 122.48 1fi9 n ASN 52 Ca 0.00 -3.60 0.00 0.00 -0.02 0.00 0.00 54.58 50.96 1fi9 n ASN 52 Cb 0.00 -1.06 0.00 0.00 -2.36 0.00 0.00 39.78 36.36 1fi9 n ASN 52 CO 0.00 0.00 0.00 1.17 -1.03 0.00 0.00 177.26 177.40 1fi9 n LYS 53 N -0.34 0.00 0.26 -3.83 4.81 -1.25 -2.73 118.16 115.08 1fi9 n LYS 53 Ca 0.53 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 58.09 1fi9 n LYS 53 Cb 0.50 0.00 0.71 0.00 0.02 0.00 0.00 35.03 36.26 1fi9 n LYS 53 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1fi9 h ASN 54 N 0.00 0.00 0.84 3.14 2.35 -1.85 -3.27 115.58 116.79 1fi9 h ASN 54 Ca 0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 1fi9 h ASN 54 Cb 0.00 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.38 1fi9 h ASN 54 CO 0.00 0.13 -0.40 0.50 -1.65 0.00 0.00 177.43 176.00 1fi9 h LYS 55 N 0.00 -1.09 -3.27 0.81 3.64 -1.91 -3.48 116.57 111.27 1fi9 h LYS 55 Ca -0.00 0.07 -0.26 0.00 -1.27 0.00 0.00 60.65 59.20 1fi9 h LYS 55 Cb 0.35 0.25 0.05 0.00 -0.41 0.00 0.00 32.23 32.47 1fi9 h LYS 55 CO 0.02 -0.73 -0.40 0.41 -2.27 0.00 0.00 179.45 176.48 1fi9 n GLY 56 N -1.14 -0.06 3.83 5.01 0.00 -1.23 -5.03 105.19 106.57 1fi9 n GLY 56 Ca -0.14 -0.18 -0.24 0.00 0.00 0.00 0.00 46.02 45.46 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 -3.00 4.57 0.38 -0.61 -4.36 -1.26 -4.85 121.20 112.06 1fi9 s ILE 57 Ca 0.24 -1.19 -0.06 0.00 -0.26 0.00 0.00 60.65 59.37 1fi9 s ILE 57 Cb -0.10 -3.40 -0.05 0.00 1.25 0.00 0.00 42.46 40.15 1fi9 s ILE 57 CO 0.29 -0.23 0.69 -0.89 0.24 0.00 0.00 174.94 175.04 1fi9 s THR 58 N -1.93 4.92 -0.53 8.37 2.01 -1.26 -2.13 115.64 125.09 1fi9 s THR 58 Ca 0.32 0.24 -0.12 0.00 0.31 0.00 0.00 61.69 62.45 1fi9 s THR 58 Cb -0.09 -3.78 0.13 0.00 0.01 0.00 0.00 72.50 68.77 1fi9 s THR 58 CO 0.25 -0.55 0.44 0.26 -0.69 0.00 0.00 174.62 174.33 1fi9 s TRP 59 N -2.37 3.39 -0.37 4.92 0.52 -1.19 -4.71 118.94 119.14 1fi9 s TRP 59 Ca 0.47 -1.73 0.12 0.00 0.02 0.00 0.00 56.10 54.99 1fi9 s TRP 59 Cb -0.10 -3.62 0.44 0.00 -1.15 0.00 0.00 33.47 29.04 1fi9 s TRP 59 CO 0.35 -1.00 1.02 1.17 0.02 0.00 0.00 176.95 178.51 1fi9 n LYS 60 N 4.88 2.15 0.00 4.98 4.81 -1.26 -4.12 118.16 129.60 1fi9 n LYS 60 Ca -0.07 -3.80 0.00 0.00 -0.87 0.00 0.00 58.31 53.57 1fi9 n LYS 60 Cb 0.41 -1.69 0.00 0.00 0.02 0.00 0.00 35.03 33.77 1fi9 n LYS 60 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1fi9 n GLU 61 N -0.26 0.00 -0.31 1.64 0.28 -1.26 -4.43 120.64 116.31 1fi9 n GLU 61 Ca 0.22 0.00 0.15 0.00 -0.16 0.00 0.00 57.16 57.37 1fi9 n GLU 61 Cb 0.76 0.00 0.32 0.00 1.43 0.00 0.00 31.44 33.95 1fi9 n GLU 61 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1fi9 h GLU 62 N 0.00 0.22 0.27 3.44 5.08 -1.96 0.32 114.58 121.96 1fi9 h GLU 62 Ca 0.00 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1fi9 h GLU 62 Cb 0.00 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1fi9 h GLU 62 CO 0.00 0.15 -0.13 1.79 -1.00 0.00 0.00 179.01 179.82 1fi9 h THR 63 N 0.23 0.29 -0.83 1.13 1.35 -1.84 -3.29 112.91 109.95 1fi9 h THR 63 Ca 0.58 -0.84 0.14 0.00 -0.55 0.00 0.00 66.41 65.75 1fi9 h THR 63 Cb 1.20 0.49 -0.09 0.00 -1.73 0.00 0.00 68.15 68.02 1fi9 h THR 63 CO -0.65 0.08 0.41 0.17 -0.25 0.00 0.00 175.52 175.28 1fi9 h LEU 64 N -1.04 0.48 -0.87 3.87 -0.00 -1.84 -2.01 115.31 113.91 1fi9 h LEU 64 Ca -0.04 0.09 0.20 0.00 -0.00 0.00 0.00 57.88 58.13 1fi9 h LEU 64 Cb 0.41 0.02 -0.16 0.00 -0.00 0.00 0.00 40.66 40.92 1fi9 h LEU 64 CO 0.06 0.20 -0.13 0.23 -0.00 0.00 0.00 178.44 178.80 1fi9 n MET 65 N -4.90 -0.08 -0.06 0.17 2.81 0.11 -0.08 117.12 115.10 1fi9 n MET 65 Ca 0.16 1.34 -0.13 0.00 -1.81 0.00 0.00 57.70 57.26 1fi9 n MET 65 Cb 0.42 -2.05 -0.12 0.00 -0.71 0.00 0.00 33.22 30.77 1fi9 n MET 65 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1fi9 h GLU 66 N 0.00 -0.00 -0.94 0.03 4.39 -1.46 -3.31 114.58 113.29 1fi9 h GLU 66 Ca 0.46 0.00 0.24 0.00 0.34 0.00 0.00 59.36 60.40 1fi9 h GLU 66 Cb 0.80 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 29.32 1fi9 h GLU 66 CO -0.87 0.88 0.48 -0.92 -1.16 0.00 0.00 179.01 177.42 1fi9 h TYR 67 N -0.92 0.81 -0.46 4.33 3.20 -0.47 0.61 116.97 124.06 1fi9 h TYR 67 Ca -0.00 0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.81 1fi9 h TYR 67 Cb 0.88 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.93 1fi9 h TYR 67 CO 0.24 -0.02 -0.12 -0.07 -1.64 0.00 0.00 178.16 176.56 1fi9 h LEU 68 N 0.46 0.83 -3.18 2.82 3.38 -0.64 -1.88 115.31 117.10 1fi9 h LEU 68 Ca 0.60 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1fi9 h LEU 68 Cb 1.17 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1fi9 h LEU 68 CO -0.52 0.96 0.00 1.21 0.09 0.00 0.00 178.44 180.19 1fi9 n GLU 69 N -4.15 2.68 -2.67 1.13 0.00 -0.14 -3.59 120.64 113.89 1fi9 n GLU 69 Ca 0.01 -2.71 -0.04 0.00 0.00 0.00 0.00 57.16 54.42 1fi9 n GLU 69 Cb 0.38 -1.73 0.10 0.00 0.00 0.00 0.00 31.44 30.19 1fi9 n GLU 69 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1fi9 n ASN 70 N -0.56 -1.35 -1.91 4.31 2.85 0.19 -4.73 115.26 114.07 1fi9 n ASN 70 Ca 0.19 -1.96 -0.08 0.00 -0.11 0.00 0.00 54.58 52.62 1fi9 n ASN 70 Cb 0.80 1.06 -0.11 0.00 1.24 0.00 0.00 39.78 42.77 1fi9 n ASN 70 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1fi9 n PRO 71 N 0.85 1.57 0.06 1.20 -0.04 -0.71 -3.20 135.00 134.73 1fi9 n PRO 71 Ca -0.02 -0.66 0.00 0.00 -0.04 0.00 0.00 63.50 62.77 1fi9 n PRO 71 Cb 0.73 -1.71 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 1fi9 n PRO 71 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1fi9 n LYS 72 N 2.28 0.00 -0.32 0.54 4.01 -1.26 -4.40 118.16 119.00 1fi9 n LYS 72 Ca 0.29 0.00 0.18 0.00 -0.51 0.00 0.00 58.31 58.26 1fi9 n LYS 72 Cb 0.73 0.00 0.36 0.00 -0.51 0.00 0.00 35.03 35.61 1fi9 n LYS 72 CO 0.00 0.00 0.00 0.87 -1.11 0.00 0.00 177.40 177.16 1fi9 h LYS 73 N 0.00 0.09 -0.14 1.97 1.57 -1.93 -0.20 116.57 117.93 1fi9 h LYS 73 Ca 0.00 -0.01 -0.19 0.00 -1.87 0.00 0.00 60.65 58.58 1fi9 h LYS 73 Cb 0.00 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.30 1fi9 h LYS 73 CO 0.00 0.06 -0.66 1.88 -0.57 0.00 0.00 179.45 180.17 1fi9 h TYR 74 N 0.10 0.92 -1.40 -1.35 0.05 -1.91 -3.43 116.97 109.94 1fi9 h TYR 74 Ca 0.64 -0.41 -0.20 0.00 0.05 0.00 0.00 58.73 58.81 1fi9 h TYR 74 Cb 1.41 -0.14 -0.24 0.00 1.01 0.00 0.00 36.73 38.77 1fi9 h TYR 74 CO -0.29 1.22 -0.56 0.96 -1.05 0.00 0.00 178.16 178.44 1fi9 s ILE 75 N -3.73 -0.70 -1.41 -2.88 -4.36 -0.24 -5.07 121.20 102.81 1fi9 s ILE 75 Ca -0.11 -0.53 -0.09 0.00 -0.26 0.00 0.00 60.65 59.65 1fi9 s ILE 75 Cb 0.07 -0.29 -0.10 0.00 1.25 0.00 0.00 42.46 43.39 1fi9 s ILE 75 CO 0.87 -0.26 3.03 -0.81 0.24 0.00 0.00 174.94 178.01 1fi9 n PRO 76 N 4.19 3.52 0.00 0.37 -0.04 -0.34 -2.87 135.00 139.84 1fi9 n PRO 76 Ca 0.12 -2.10 0.00 0.00 -0.04 0.00 0.00 63.50 61.49 1fi9 n PRO 76 Cb 0.52 -2.69 0.00 0.00 -0.04 0.00 0.00 33.50 31.29 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 3.37 0.00 0.10 0.55 0.00 -1.26 -5.04 105.19 102.90 1fi9 n GLY 77 Ca 0.74 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.57 1fi9 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fi9 h THR 78 N 0.00 1.37 0.00 2.61 1.03 -1.81 -3.47 112.91 112.65 1fi9 h THR 78 Ca 0.00 -2.35 0.00 0.00 -0.01 0.00 0.00 66.41 64.05 1fi9 h THR 78 Cb 0.00 2.94 0.00 0.00 -1.07 0.00 0.00 68.15 70.02 1fi9 h THR 78 CO 0.00 0.58 0.00 1.17 -0.01 0.00 0.00 175.52 177.26 1fi9 n LYS 79 N -4.33 0.00 -1.02 0.00 4.81 -1.26 -4.94 118.16 111.42 1fi9 n LYS 79 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.25 1fi9 n LYS 79 Cb 0.68 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.73 1fi9 n LYS 79 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 1fi9 n MET 80 N -2.51 -2.82 -0.64 1.64 0.00 -1.26 -5.13 117.12 106.40 1fi9 n MET 80 Ca 0.00 2.05 0.00 0.00 -0.00 0.00 0.00 57.70 59.75 1fi9 n MET 80 Cb 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 33.22 30.99 1fi9 n MET 80 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 175.97 176.41 1fi9 n ILE 81 N 0.11 0.00 -1.06 1.12 -5.35 -1.26 -5.16 119.36 107.76 1fi9 n ILE 81 Ca 0.00 0.00 -0.35 0.00 -0.27 0.00 0.00 62.75 62.13 1fi9 n ILE 81 Cb 0.00 0.00 0.02 0.00 -1.74 0.00 0.00 39.64 37.92 1fi9 n ILE 81 CO 0.00 0.00 0.00 2.22 -1.76 0.00 0.00 176.55 177.01 1fi9 n PHE 82 N 0.00 -3.94 -0.34 4.28 -1.74 -1.26 -4.85 117.46 109.62 1fi9 n PHE 82 Ca 0.00 0.18 -0.09 0.00 -0.56 0.00 0.00 57.45 56.98 1fi9 n PHE 82 Cb 0.00 -1.47 -0.08 0.00 1.52 0.00 0.00 39.48 39.45 1fi9 n PHE 82 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1fi9 n ALA 83 N -1.93 -0.51 0.00 1.98 0.00 -1.26 -4.93 120.51 113.86 1fi9 n ALA 83 Ca 0.02 0.68 0.00 0.00 0.00 0.00 0.00 53.44 54.15 1fi9 n ALA 83 Cb 0.49 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.86 1fi9 n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fi9 n GLY 84 N -1.20 -0.55 3.60 0.00 0.00 -1.26 -4.21 105.19 101.57 1fi9 n GLY 84 Ca 0.02 -1.43 -0.34 0.00 0.00 0.00 0.00 46.02 44.27 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 9.00 1.67 -0.27 -0.61 2.08 -1.24 -4.90 119.36 125.10 1fi9 n ILE 85 Ca 0.00 -0.24 0.04 0.00 0.56 0.00 0.00 62.75 63.11 1fi9 n ILE 85 Cb 0.00 -1.02 0.13 0.00 -0.75 0.00 0.00 39.64 38.00 1fi9 n ILE 85 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 1fi9 h LYS 86 N -0.90 0.03 -2.12 0.38 1.57 -1.97 -3.46 116.57 110.11 1fi9 h LYS 86 Ca -0.46 -0.00 0.36 0.00 -1.87 0.00 0.00 60.65 58.68 1fi9 h LYS 86 Cb 1.31 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 33.54 1fi9 h LYS 86 CO 0.43 0.02 0.93 -1.59 -0.57 0.00 0.00 179.45 178.68 1fi9 s LYS 87 N -6.18 0.30 0.24 3.15 -2.85 -1.26 -5.03 119.74 108.11 1fi9 s LYS 87 Ca -0.14 -0.19 -0.04 0.00 -1.00 0.00 0.00 55.97 54.59 1fi9 s LYS 87 Cb 0.23 0.08 0.44 0.00 -2.06 0.00 0.00 37.83 36.52 1fi9 s LYS 87 CO 0.75 -0.14 1.76 1.57 0.10 0.00 0.00 175.35 179.40 1fi9 h LYS 88 N 2.00 0.56 -0.01 1.78 2.10 -1.99 -0.93 116.57 120.09 1fi9 h LYS 88 Ca -0.21 -0.03 0.01 0.00 -2.00 0.00 0.00 60.65 58.41 1fi9 h LYS 88 Cb 1.18 -0.13 -0.02 0.00 -0.90 0.00 0.00 32.23 32.36 1fi9 h LYS 88 CO 0.31 0.37 -0.21 1.15 -2.00 0.00 0.00 179.45 179.07 1fi9 h THR 89 N 0.58 0.00 -0.65 0.07 2.02 -1.99 0.28 112.91 113.22 1fi9 h THR 89 Ca 0.41 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.72 1fi9 h THR 89 Cb 0.53 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.84 1fi9 h THR 89 CO -0.33 0.00 0.08 -0.33 0.37 0.00 0.00 175.52 175.31 1fi9 h GLU 90 N -0.26 0.19 -0.59 6.66 3.07 -1.90 -0.74 114.58 121.01 1fi9 h GLU 90 Ca 0.01 -0.01 0.12 0.00 -0.50 0.00 0.00 59.36 58.98 1fi9 h GLU 90 Cb 0.28 -0.04 -0.10 0.00 -0.84 0.00 0.00 28.75 28.05 1fi9 h GLU 90 CO -0.15 0.12 -0.04 0.00 -1.40 0.00 0.00 179.01 177.55 1fi9 h ARG 91 N 0.19 0.08 0.55 2.33 3.08 -0.47 0.14 114.38 120.28 1fi9 h ARG 91 Ca 0.35 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.37 1fi9 h ARG 91 Cb 0.57 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1fi9 h ARG 91 CO -0.50 0.05 -0.28 1.49 -1.07 0.00 0.00 179.97 179.67 1fi9 h GLU 92 N 0.08 -0.73 -0.62 0.04 4.22 0.51 0.57 114.58 118.65 1fi9 h GLU 92 Ca 0.30 0.05 0.12 0.00 0.08 0.00 0.00 59.36 59.91 1fi9 h GLU 92 Cb 0.48 0.17 -0.12 0.00 0.50 0.00 0.00 28.75 29.77 1fi9 h GLU 92 CO -0.53 -0.49 -0.17 -0.44 -2.18 0.00 0.00 179.01 175.21 1fi9 h ASP 93 N -0.76 -0.62 -0.12 1.04 3.32 -1.00 0.63 116.42 118.91 1fi9 h ASP 93 Ca -0.07 0.19 0.04 0.00 0.02 0.00 0.00 57.03 57.21 1fi9 h ASP 93 Cb 0.59 0.40 -0.07 0.00 0.22 0.00 0.00 39.33 40.47 1fi9 h ASP 93 CO 0.11 -0.22 -0.40 0.25 -1.72 0.00 0.00 179.24 177.27 1fi9 h LEU 94 N -0.01 -1.24 -0.72 1.55 6.46 -0.10 -0.65 115.31 120.60 1fi9 h LEU 94 Ca 0.30 0.17 0.12 0.00 -0.12 0.00 0.00 57.88 58.34 1fi9 h LEU 94 Cb 0.47 0.51 -0.08 0.00 -0.73 0.00 0.00 40.66 40.82 1fi9 h LEU 94 CO -0.65 -0.41 0.30 0.40 -0.62 0.00 0.00 178.44 177.46 1fi9 h ILE 95 N -0.48 0.73 -0.41 4.05 5.03 0.14 -0.29 117.51 126.28 1fi9 h ILE 95 Ca 0.08 -0.17 0.08 0.00 -0.12 0.00 0.00 64.86 64.73 1fi9 h ILE 95 Cb 0.61 0.20 -0.07 0.00 -3.03 0.00 0.00 36.82 34.54 1fi9 h ILE 95 CO -0.38 0.09 -0.02 0.00 -0.68 0.00 0.00 178.15 177.16 1fi9 h ALA 96 N 1.49 0.36 0.67 1.87 0.00 0.60 0.31 119.26 124.56 1fi9 h ALA 96 Ca 0.38 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.39 1fi9 h ALA 96 Cb 0.51 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1fi9 h ALA 96 CO -0.35 -0.40 -0.42 -0.92 0.00 0.00 0.00 179.25 177.16 1fi9 h TYR 97 N 0.09 -1.12 -0.89 0.00 3.20 -0.63 -3.20 116.97 114.41 1fi9 h TYR 97 Ca 0.20 -0.01 0.19 0.00 3.14 0.00 0.00 58.73 62.25 1fi9 h TYR 97 Cb 0.29 0.40 -0.17 0.00 1.54 0.00 0.00 36.73 38.80 1fi9 h TYR 97 CO -0.29 -0.62 -0.18 -0.07 -1.64 0.00 0.00 178.16 175.36 1fi9 h LEU 98 N -1.02 -0.75 -0.79 2.82 4.07 -0.40 0.18 115.31 119.41 1fi9 h LEU 98 Ca -0.09 0.26 0.17 0.00 0.08 0.00 0.00 57.88 58.30 1fi9 h LEU 98 Cb 0.82 0.52 -0.15 0.00 1.08 0.00 0.00 40.66 42.94 1fi9 h LEU 98 CO 0.08 -0.29 -0.13 0.11 -1.08 0.00 0.00 178.44 177.14 1fi9 h LYS 99 N 0.01 0.03 0.00 1.13 1.57 -0.41 0.13 116.57 119.03 1fi9 h LYS 99 Ca 0.44 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.22 1fi9 h LYS 99 Cb 0.72 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1fi9 h LYS 99 CO -0.89 0.02 -0.00 0.87 -0.57 0.00 0.00 179.45 178.87 1fi9 h LYS 100 N 0.03 -0.01 -0.87 3.15 1.57 -1.05 -3.25 116.57 116.14 1fi9 h LYS 100 Ca 0.40 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 59.19 1fi9 h LYS 100 Cb 0.66 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.93 1fi9 h LYS 100 CO -0.78 0.75 0.57 0.00 -0.57 0.00 0.00 179.45 179.43 1fi9 h ALA 101 N -0.21 1.38 0.00 3.86 0.00 -0.01 0.22 119.26 124.50 1fi9 h ALA 101 Ca -0.00 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.65 1fi9 h ALA 101 Cb 0.76 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1fi9 h ALA 101 CO 0.00 0.58 -0.99 1.79 0.00 0.00 0.00 179.25 180.62 1fi9 h THR 102 N 1.18 1.55 -0.13 0.00 1.35 -0.97 -3.26 112.91 112.62 1fi9 h THR 102 Ca 0.32 -3.23 -0.02 0.00 -0.55 0.00 0.00 66.41 62.94 1fi9 h THR 102 Cb -0.14 2.76 -0.01 0.00 -1.73 0.00 0.00 68.15 69.04 1fi9 h THR 102 CO -0.07 0.88 0.02 -1.13 -0.25 0.00 0.00 175.52 174.98 1fi9 h ASN 103 N 0.00 0.21 0.00 5.36 -0.73 -0.98 0.38 115.58 119.82 1fi9 h ASN 103 Ca -0.03 -0.26 0.00 0.00 1.87 0.00 0.00 56.30 57.88 1fi9 h ASN 103 Cb 1.74 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 40.27 1fi9 h ASN 103 CO 0.12 0.41 0.00 -0.62 -0.37 0.00 0.00 177.43 176.97