#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 6.39 0.23 1.61 -1.08 -1.26 -4.78 116.67 117.77 1fi9 s ASP 2 Ca 0.00 0.45 -0.08 0.00 -0.52 0.00 0.00 52.55 52.40 1fi9 s ASP 2 Cb 0.00 -2.21 0.20 0.00 -1.46 0.00 0.00 42.92 39.45 1fi9 s ASP 2 CO 0.00 -0.04 1.89 0.58 0.52 0.00 0.00 175.17 178.11 1fi9 h VAL 3 N 5.01 1.23 0.78 1.11 2.07 -1.81 0.18 116.25 124.81 1fi9 h VAL 3 Ca -0.37 -0.47 -0.04 0.00 0.82 0.00 0.00 66.70 66.64 1fi9 h VAL 3 Cb 1.16 -0.02 0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1fi9 h VAL 3 CO 0.71 0.24 -0.37 -0.33 0.02 0.00 0.00 177.57 177.83 1fi9 h GLU 4 N 1.19 -1.00 -0.83 1.57 4.39 -1.94 0.16 114.58 118.11 1fi9 h GLU 4 Ca 0.32 0.07 0.07 0.00 0.34 0.00 0.00 59.36 60.15 1fi9 h GLU 4 Cb -0.09 0.23 -0.06 0.00 -0.10 0.00 0.00 28.75 28.73 1fi9 h GLU 4 CO -0.06 -0.65 0.50 0.87 -1.16 0.00 0.00 179.01 178.50 1fi9 h LYS 5 N -1.16 0.86 -0.58 2.33 1.57 -1.90 -0.92 116.57 116.77 1fi9 h LYS 5 Ca -0.11 -0.05 0.11 0.00 -1.87 0.00 0.00 60.65 58.73 1fi9 h LYS 5 Cb 0.82 -0.19 -0.09 0.00 0.08 0.00 0.00 32.23 32.84 1fi9 h LYS 5 CO 0.17 0.57 0.07 0.78 -0.57 0.00 0.00 179.45 180.48 1fi9 h GLY 6 N 0.89 0.68 0.92 3.86 0.00 -0.38 0.31 103.07 109.34 1fi9 h GLY 6 Ca 0.37 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.70 1fi9 h GLY 6 CO -0.19 -0.14 -0.18 1.70 0.00 0.00 0.00 176.54 177.73 1fi9 h LYS 7 N 0.19 -0.48 -0.73 4.80 3.64 0.33 0.44 116.57 124.75 1fi9 h LYS 7 Ca 0.30 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.74 1fi9 h LYS 7 Cb 0.46 0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.35 1fi9 h LYS 7 CO -0.43 -0.26 0.47 0.87 -2.27 0.00 0.00 179.45 177.82 1fi9 h LYS 8 N -0.58 0.90 0.72 1.90 6.56 -0.63 -0.66 116.57 124.78 1fi9 h LYS 8 Ca -0.05 -0.05 -0.03 0.00 -1.06 0.00 0.00 60.65 59.45 1fi9 h LYS 8 Cb 0.43 -0.20 -0.00 0.00 -0.57 0.00 0.00 32.23 31.89 1fi9 h LYS 8 CO 0.08 0.60 -0.44 0.82 -2.06 0.00 0.00 179.45 178.45 1fi9 h ILE 9 N 0.93 0.11 -0.86 1.86 2.04 -0.24 0.42 117.51 121.77 1fi9 h ILE 9 Ca 0.29 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.37 1fi9 h ILE 9 Cb -0.02 0.11 -0.15 0.00 -0.74 0.00 0.00 36.82 36.03 1fi9 h ILE 9 CO -0.10 0.00 0.07 0.15 0.00 0.00 0.00 178.15 178.28 1fi9 h PHE 10 N -1.09 0.06 0.00 1.37 3.57 -0.43 0.42 116.94 120.84 1fi9 h PHE 10 Ca -0.09 0.06 -0.12 0.00 3.53 0.00 0.00 57.97 61.34 1fi9 h PHE 10 Cb 0.88 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.71 1fi9 h PHE 10 CO -0.10 -0.29 -0.58 0.28 -2.23 0.00 0.00 178.31 175.39 1fi9 h VAL 11 N 0.10 1.34 -0.01 1.41 2.07 -0.66 0.13 116.25 120.63 1fi9 h VAL 11 Ca 0.51 -2.03 0.00 0.00 0.82 0.00 0.00 66.70 66.00 1fi9 h VAL 11 Cb 0.98 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.87 1fi9 h VAL 11 CO -0.74 0.57 -0.22 0.00 0.02 0.00 0.00 177.57 177.19 1fi9 n GLN 12 N -3.74 1.33 -0.01 1.57 1.13 0.14 -4.35 117.38 113.46 1fi9 n GLN 12 Ca -0.01 -0.93 -0.02 0.00 -1.94 0.00 0.00 57.00 54.09 1fi9 n GLN 12 Cb 0.60 -1.48 -0.01 0.00 0.11 0.00 0.00 30.24 29.46 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 -0.02 0.05 0.00 -1.09 4.76 0.12 -5.01 118.16 116.97 1fi9 n LYS 13 Ca 0.13 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.59 1fi9 n LYS 13 Cb 0.42 -0.58 0.00 0.00 -1.84 0.00 0.00 35.03 33.02 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 -1.22 0.00 -0.79 0.00 0.00 -0.52 -3.84 120.51 114.14 1fi9 n ALA 15 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1fi9 n ALA 15 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1fi9 n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fi9 n GLN 16 N 0.00 1.57 0.00 0.00 10.64 -1.26 -3.19 117.38 125.14 1fi9 n GLN 16 Ca 0.00 -0.66 0.00 0.00 -1.83 0.00 0.00 57.00 54.51 1fi9 n GLN 16 Cb 0.00 -1.70 0.00 0.00 -0.86 0.00 0.00 30.24 27.68 1fi9 n GLN 16 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1fi9 s HIS 18 N -1.36 2.49 0.03 0.00 3.76 -1.19 -1.76 115.29 117.25 1fi9 s HIS 18 Ca 0.00 -0.28 0.02 0.00 -0.15 0.00 0.00 55.06 54.65 1fi9 s HIS 18 Cb 0.00 -1.18 -0.02 0.00 1.11 0.00 0.00 32.58 32.49 1fi9 s HIS 18 CO 0.00 0.56 -0.06 0.99 -0.85 0.00 0.00 174.74 175.38 1fi9 s THR 19 N -1.94 0.42 -0.21 1.30 2.01 -1.26 -4.13 115.64 111.83 1fi9 s THR 19 Ca 0.26 -0.86 0.19 0.00 0.31 0.00 0.00 61.69 61.58 1fi9 s THR 19 Cb -0.07 -0.48 0.47 0.00 0.01 0.00 0.00 72.50 72.43 1fi9 s THR 19 CO 0.14 -0.31 1.15 1.33 -0.69 0.00 0.00 174.62 176.25 1fi9 n VAL 20 N 1.80 1.43 -4.24 3.82 0.24 -1.26 -0.13 118.33 119.99 1fi9 n VAL 20 Ca -0.21 -2.92 -0.16 0.00 -2.04 0.00 0.00 64.34 59.02 1fi9 n VAL 20 Cb 0.55 0.51 -0.10 0.00 -1.47 0.00 0.00 33.84 33.33 1fi9 n VAL 20 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1fi9 s GLU 21 N -3.01 1.03 0.09 7.34 -1.05 -1.26 -4.50 118.70 117.35 1fi9 s GLU 21 Ca 0.35 -1.35 -0.31 0.00 -0.15 0.00 0.00 54.97 53.51 1fi9 s GLU 21 Cb 0.36 -0.73 -0.07 0.00 -0.44 0.00 0.00 34.13 33.25 1fi9 s GLU 21 CO -0.05 0.11 1.36 0.21 0.95 0.00 0.00 175.26 177.85 1fi9 s LYS 22 N -3.25 4.33 0.00 -4.83 2.36 -1.26 -2.30 119.74 114.79 1fi9 s LYS 22 Ca 0.13 2.01 0.00 0.00 -2.55 0.00 0.00 55.97 55.56 1fi9 s LYS 22 Cb -0.01 -3.30 0.00 0.00 -1.05 0.00 0.00 37.83 33.47 1fi9 s LYS 22 CO 0.02 -0.43 0.00 0.41 1.55 0.00 0.00 175.35 176.90 1fi9 n GLY 23 N 3.47 0.50 0.00 5.54 0.00 -1.26 -4.95 105.19 108.49 1fi9 n GLY 23 Ca 0.11 -0.89 0.08 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.26 -0.58 3.44 -0.02 0.00 -0.97 -4.99 105.19 99.81 1fi9 n GLY 24 Ca 0.00 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.09 -1.89 -3.61 1.61 4.76 -1.26 -4.75 118.16 111.93 1fi9 n LYS 25 Ca 0.10 1.25 -0.23 0.00 -2.87 0.00 0.00 58.31 56.56 1fi9 n LYS 25 Cb 0.07 -2.31 -0.17 0.00 -1.84 0.00 0.00 35.03 30.79 1fi9 n LYS 25 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 1fi9 s HIS 26 N -1.44 0.07 0.00 2.13 3.76 -1.26 -4.12 115.29 114.44 1fi9 s HIS 26 Ca 0.00 -0.04 0.00 0.00 -0.15 0.00 0.00 55.06 54.87 1fi9 s HIS 26 Cb 0.00 -0.57 0.00 0.00 1.11 0.00 0.00 32.58 33.12 1fi9 s HIS 26 CO 0.00 -0.43 0.00 1.63 -0.85 0.00 0.00 174.74 175.09 1fi9 n LYS 27 N 5.29 0.00 0.05 1.40 5.02 -1.26 -5.03 118.16 123.63 1fi9 n LYS 27 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1fi9 n LYS 27 Cb 0.49 -0.18 0.00 0.00 -0.02 0.00 0.00 35.03 35.32 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 -2.49 0.79 -2.80 -0.18 -1.04 -1.26 -5.04 114.28 102.26 1fi9 n THR 28 Ca 0.00 0.26 -0.34 0.00 -2.04 0.00 0.00 64.05 61.93 1fi9 n THR 28 Cb 0.00 -1.43 -0.07 0.00 -1.82 0.00 0.00 70.33 67.01 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 -4.37 2.50 0.91 3.41 0.00 -0.72 -5.06 107.32 103.99 1fi9 s GLY 29 Ca 0.00 0.44 -0.12 0.00 0.00 0.00 0.00 44.72 45.04 1fi9 s GLY 29 CO 0.00 0.76 1.10 2.56 0.00 0.00 0.00 173.10 177.52 1fi9 s PRO 30 N -2.89 1.17 -0.38 2.90 0.04 -1.26 -4.67 135.00 129.92 1fi9 s PRO 30 Ca 0.59 0.63 -0.27 0.00 0.04 0.00 0.00 61.00 61.98 1fi9 s PRO 30 Cb -0.12 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 1fi9 s PRO 30 CO 0.16 -2.25 2.11 1.21 0.04 0.00 0.00 177.00 178.27 1fi9 s ASN 31 N -3.61 5.27 0.37 6.66 2.47 -1.26 -4.21 114.94 120.64 1fi9 s ASN 31 Ca 0.63 1.30 0.26 0.00 0.42 0.00 0.00 52.86 55.48 1fi9 s ASN 31 Cb -0.17 -2.51 1.32 0.00 -1.45 0.00 0.00 41.25 38.44 1fi9 s ASN 31 CO 0.56 -2.20 1.80 0.25 -3.72 0.00 0.00 177.10 173.80 1fi9 h LEU 32 N 16.09 0.00 -8.20 3.21 6.46 -0.89 -3.42 115.31 128.56 1fi9 h LEU 32 Ca -0.32 0.00 -0.75 0.00 -0.12 0.00 0.00 57.88 56.69 1fi9 h LEU 32 Cb 1.22 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.12 1fi9 h LEU 32 CO 1.07 0.00 1.31 1.57 -0.62 0.00 0.00 178.44 181.77 1fi9 n HIS 33 N -2.43 1.32 -0.34 1.25 -0.00 -1.24 -0.20 115.22 113.57 1fi9 n HIS 33 Ca -0.01 0.66 0.00 0.00 0.46 0.00 0.00 57.72 58.83 1fi9 n HIS 33 Cb 0.11 -2.35 0.00 0.00 -0.12 0.00 0.00 29.99 27.63 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 7.05 0.81 0.41 1.57 0.00 0.43 -5.01 105.19 110.44 1fi9 n GLY 34 Ca 0.50 -0.19 -0.16 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.86 -9.77 0.99 5.85 -0.79 -3.42 115.31 107.31 1fi9 h LEU 35 Ca 0.00 0.03 -0.53 0.00 0.84 0.00 0.00 57.88 58.22 1fi9 h LEU 35 Cb 0.00 0.22 0.08 0.00 0.37 0.00 0.00 40.66 41.33 1fi9 h LEU 35 CO 0.00 -0.53 0.91 0.49 -0.34 0.00 0.00 178.44 178.97 1fi9 n PHE 36 N -5.21 2.84 -2.39 1.25 3.01 -1.26 -2.57 117.46 113.14 1fi9 n PHE 36 Ca -0.13 0.22 -0.05 0.00 1.01 0.00 0.00 57.45 58.50 1fi9 n PHE 36 Cb 0.40 -2.61 0.01 0.00 -0.01 0.00 0.00 39.48 37.26 1fi9 n PHE 36 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1fi9 n GLY 37 N 2.47 0.38 3.32 1.37 0.00 -0.35 -4.99 105.19 107.39 1fi9 n GLY 37 Ca 0.10 -0.59 -0.15 0.00 0.00 0.00 0.00 46.02 45.38 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 -4.71 1.57 0.53 1.61 0.52 -1.06 -5.02 118.95 112.38 1fi9 s ARG 38 Ca 0.06 -1.77 0.08 0.00 -0.52 0.00 0.00 55.73 53.58 1fi9 s ARG 38 Cb -0.03 0.34 0.06 0.00 0.52 0.00 0.00 34.95 35.84 1fi9 s ARG 38 CO 0.07 -0.58 0.72 0.15 0.02 0.00 0.00 175.30 175.68 1fi9 s LYS 39 N -3.68 2.47 0.01 3.54 3.01 -1.26 -2.69 119.74 121.14 1fi9 s LYS 39 Ca 0.37 -1.41 -0.25 0.00 -1.01 0.00 0.00 55.97 53.67 1fi9 s LYS 39 Cb 0.03 -2.66 -0.15 0.00 -1.01 0.00 0.00 37.83 34.05 1fi9 s LYS 39 CO 0.19 -0.68 1.09 1.79 0.51 0.00 0.00 175.35 178.26 1fi9 h THR 40 N 0.29 0.21 0.00 2.17 1.35 -1.68 -3.38 112.91 111.87 1fi9 h THR 40 Ca -0.35 -0.42 -0.15 0.00 -0.55 0.00 0.00 66.41 64.94 1fi9 h THR 40 Cb 1.28 0.31 -0.06 0.00 -1.73 0.00 0.00 68.15 67.96 1fi9 h THR 40 CO 0.43 0.04 -0.22 0.61 -0.25 0.00 0.00 175.52 176.12 1fi9 n GLY 41 N -0.43 2.62 3.56 5.82 0.00 -1.24 -4.51 105.19 111.01 1fi9 n GLY 41 Ca -0.11 -0.98 0.01 0.00 0.00 0.00 0.00 46.02 44.94 1fi9 n GLY 41 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1fi9 s GLN 42 N 1.37 0.21 -0.07 1.61 -2.07 -1.26 -4.94 119.66 114.51 1fi9 s GLN 42 Ca 0.54 0.40 -0.17 0.00 -1.82 0.00 0.00 55.36 54.31 1fi9 s GLN 42 Cb 0.26 0.10 0.04 0.00 -1.09 0.00 0.00 33.01 32.32 1fi9 s GLN 42 CO 0.00 -0.05 0.41 0.00 -1.32 0.00 0.00 175.29 174.33 1fi9 s ALA 43 N 1.47 -1.03 -0.31 2.60 0.00 -1.26 -4.77 121.76 118.47 1fi9 s ALA 43 Ca -0.07 0.77 -0.29 0.00 0.00 0.00 0.00 51.96 52.37 1fi9 s ALA 43 Cb -0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 1fi9 s ALA 43 CO -0.14 -0.26 1.52 -1.25 0.00 0.00 0.00 175.76 175.63 1fi9 s PRO 44 N -0.80 3.69 -0.95 0.00 0.04 -1.26 -4.12 135.00 131.61 1fi9 s PRO 44 Ca -0.09 1.34 -0.10 0.00 0.04 0.00 0.00 61.00 62.19 1fi9 s PRO 44 Cb -0.04 -4.02 -0.00 0.00 0.04 0.00 0.00 34.50 30.48 1fi9 s PRO 44 CO 0.04 -1.41 0.71 0.41 0.04 0.00 0.00 177.00 176.79 1fi9 n GLY 45 N 4.81 -1.14 3.51 0.56 0.00 -1.26 -4.98 105.19 106.69 1fi9 n GLY 45 Ca 0.18 0.50 -0.09 0.00 0.00 0.00 0.00 46.02 46.61 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 -3.21 0.16 -0.45 1.61 5.36 -1.26 -5.10 117.98 115.09 1fi9 s PHE 46 Ca 0.22 -0.52 0.01 0.00 -0.96 0.00 0.00 56.93 55.69 1fi9 s PHE 46 Cb -0.08 0.23 0.12 0.00 -0.34 0.00 0.00 43.02 42.95 1fi9 s PHE 46 CO 0.85 -0.91 0.20 -0.08 -1.46 0.00 0.00 175.22 173.83 1fi9 s THR 47 N -3.94 2.86 0.78 0.12 -1.32 -1.26 -4.92 115.64 107.96 1fi9 s THR 47 Ca 0.15 -2.59 -0.09 0.00 -1.21 0.00 0.00 61.69 57.95 1fi9 s THR 47 Cb -0.00 -2.99 0.10 0.00 -1.51 0.00 0.00 72.50 68.10 1fi9 s THR 47 CO 0.02 -0.71 1.11 -0.72 -2.21 0.00 0.00 174.62 172.11 1fi9 s TYR 48 N 0.54 2.58 0.37 9.09 -0.85 -1.26 -5.10 117.35 122.72 1fi9 s TYR 48 Ca 0.13 0.44 0.08 0.00 -0.52 0.00 0.00 57.07 57.20 1fi9 s TYR 48 Cb -0.22 -3.43 -0.04 0.00 0.38 0.00 0.00 41.96 38.66 1fi9 s TYR 48 CO -0.04 -1.75 0.20 0.95 -1.52 0.00 0.00 175.55 173.38 1fi9 s THR 49 N -3.44 2.87 0.23 -3.49 -4.23 -1.26 -5.01 115.64 101.31 1fi9 s THR 49 Ca 0.64 -1.61 -0.18 0.00 -1.18 0.00 0.00 61.69 59.36 1fi9 s THR 49 Cb -0.09 -3.01 0.23 0.00 1.34 0.00 0.00 72.50 70.98 1fi9 s THR 49 CO 0.47 -0.12 1.56 0.44 -0.54 0.00 0.00 174.62 176.43 1fi9 h ASP 50 N 1.41 -1.38 -0.08 3.99 5.19 -1.99 0.02 116.42 123.58 1fi9 h ASP 50 Ca -0.43 0.30 0.04 0.00 -0.62 0.00 0.00 57.03 56.32 1fi9 h ASP 50 Cb 1.25 0.73 -0.05 0.00 0.18 0.00 0.00 39.33 41.44 1fi9 h ASP 50 CO 0.63 -0.29 -0.23 0.00 -3.12 0.00 0.00 179.24 176.23 1fi9 h ALA 51 N 1.35 -0.24 0.00 3.45 0.00 -1.97 0.25 119.26 122.09 1fi9 h ALA 51 Ca 0.34 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.11 1fi9 h ALA 51 Cb 0.60 0.43 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 1fi9 h ALA 51 CO -0.95 -0.71 -0.32 -1.71 0.00 0.00 0.00 179.25 175.56 1fi9 n ASN 52 N -5.36 5.16 0.20 0.00 2.85 -0.02 -2.30 115.26 115.79 1fi9 n ASN 52 Ca -0.04 -2.45 0.00 0.00 -0.11 0.00 0.00 54.58 51.98 1fi9 n ASN 52 Cb 0.27 -1.36 0.00 0.00 1.24 0.00 0.00 39.78 39.94 1fi9 n ASN 52 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1fi9 n LYS 53 N 2.38 0.00 0.26 1.20 0.00 -0.90 -3.68 118.16 117.41 1fi9 n LYS 53 Ca 0.37 0.00 0.09 0.00 0.00 0.00 0.00 58.31 58.76 1fi9 n LYS 53 Cb 0.85 0.00 0.66 0.00 0.00 0.00 0.00 35.03 36.53 1fi9 n LYS 53 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 1fi9 h ASN 54 N 0.00 0.00 -0.03 3.14 2.35 -0.53 -3.11 115.58 117.40 1fi9 h ASN 54 Ca 0.00 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1fi9 h ASN 54 Cb 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 1fi9 h ASN 54 CO 0.00 0.06 -0.20 0.50 -1.65 0.00 0.00 177.43 176.14 1fi9 h LYS 55 N 0.00 -0.29 0.00 0.81 3.64 -1.66 -3.46 116.57 115.61 1fi9 h LYS 55 Ca -0.00 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1fi9 h LYS 55 Cb 0.11 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1fi9 h LYS 55 CO 0.01 -0.19 0.00 0.41 -2.27 0.00 0.00 179.45 177.40 1fi9 n GLY 56 N -1.33 0.16 3.87 5.01 0.00 -1.18 -4.97 105.19 106.76 1fi9 n GLY 56 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.33 4.71 0.72 -0.61 -4.36 -1.26 -4.74 121.20 114.33 1fi9 s ILE 57 Ca 0.00 0.81 -0.01 0.00 -0.26 0.00 0.00 60.65 61.18 1fi9 s ILE 57 Cb 0.00 -3.81 0.12 0.00 1.25 0.00 0.00 42.46 40.03 1fi9 s ILE 57 CO 0.00 -0.87 0.99 0.42 0.24 0.00 0.00 174.94 175.72 1fi9 s THR 58 N -2.82 2.17 -0.13 8.37 -4.23 -1.26 -1.96 115.64 115.78 1fi9 s THR 58 Ca 0.54 -0.57 -0.01 0.00 -1.18 0.00 0.00 61.69 60.47 1fi9 s THR 58 Cb -0.10 -2.60 0.04 0.00 1.34 0.00 0.00 72.50 71.17 1fi9 s THR 58 CO 0.43 0.00 -0.02 0.26 -0.54 0.00 0.00 174.62 174.75 1fi9 s TRP 59 N -3.15 1.11 -0.35 3.99 0.52 -1.09 -4.72 118.94 115.25 1fi9 s TRP 59 Ca 0.66 -0.62 0.11 0.00 0.02 0.00 0.00 56.10 56.27 1fi9 s TRP 59 Cb -0.06 -1.04 0.39 0.00 -1.15 0.00 0.00 33.47 31.61 1fi9 s TRP 59 CO 0.44 -0.49 1.44 0.36 0.02 0.00 0.00 176.95 178.73 1fi9 n LYS 60 N 5.03 1.25 0.00 4.98 2.85 -1.26 -1.21 118.16 129.80 1fi9 n LYS 60 Ca -0.09 -1.41 0.00 0.00 -1.05 0.00 0.00 58.31 55.76 1fi9 n LYS 60 Cb 0.49 0.23 0.00 0.00 -0.65 0.00 0.00 35.03 35.10 1fi9 n LYS 60 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1fi9 n GLU 61 N -1.13 0.00 0.00 -1.58 0.28 -1.26 -4.70 120.64 112.25 1fi9 n GLU 61 Ca -0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.88 1fi9 n GLU 61 Cb 0.85 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.72 1fi9 n GLU 61 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1fi9 n GLU 62 N 0.00 0.00 -0.36 3.44 1.02 -1.26 0.12 120.64 123.60 1fi9 n GLU 62 Ca 0.00 0.57 0.04 0.00 -0.02 0.00 0.00 57.16 57.75 1fi9 n GLU 62 Cb 0.00 -1.30 0.20 0.00 -0.02 0.00 0.00 31.44 30.32 1fi9 n GLU 62 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1fi9 h THR 63 N 0.00 1.03 -0.30 2.62 2.02 -1.85 -2.28 112.91 114.15 1fi9 h THR 63 Ca 0.00 -0.38 0.01 0.00 0.77 0.00 0.00 66.41 66.81 1fi9 h THR 63 Cb 0.00 -0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.22 1fi9 h THR 63 CO 0.00 0.20 0.18 0.25 0.37 0.00 0.00 175.52 176.53 1fi9 h LEU 64 N 1.11 0.31 -0.80 2.58 6.46 -1.80 0.16 115.31 123.32 1fi9 h LEU 64 Ca 0.45 -0.00 0.19 0.00 -0.12 0.00 0.00 57.88 58.40 1fi9 h LEU 64 Cb 0.28 -0.07 -0.13 0.00 -0.73 0.00 0.00 40.66 40.01 1fi9 h LEU 64 CO -0.20 0.22 0.15 0.24 -0.62 0.00 0.00 178.44 178.24 1fi9 h MET 65 N 0.38 0.20 -0.01 1.25 2.86 0.29 0.13 114.93 120.03 1fi9 h MET 65 Ca 0.12 -0.01 -0.20 0.00 -2.06 0.00 0.00 59.70 57.54 1fi9 h MET 65 Cb -0.02 -0.04 0.02 0.00 0.06 0.00 0.00 31.60 31.61 1fi9 h MET 65 CO -0.04 0.13 -0.79 0.93 1.06 0.00 0.00 176.91 178.20 1fi9 h GLU 66 N 0.20 0.55 -0.39 1.72 4.39 -1.40 -1.17 114.58 118.48 1fi9 h GLU 66 Ca 0.47 -0.58 0.08 0.00 0.34 0.00 0.00 59.36 59.67 1fi9 h GLU 66 Cb 0.87 0.16 -0.08 0.00 -0.10 0.00 0.00 28.75 29.60 1fi9 h GLU 66 CO -0.61 1.20 -0.15 -0.92 -1.16 0.00 0.00 179.01 177.38 1fi9 h TYR 67 N 0.13 -0.34 -0.09 4.33 3.20 0.89 -0.49 116.97 124.60 1fi9 h TYR 67 Ca -0.10 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 1fi9 h TYR 67 Cb 1.47 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 39.95 1fi9 h TYR 67 CO 0.13 -0.22 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.30 1fi9 h LEU 68 N -0.07 0.19 -3.20 2.82 3.38 -0.88 -2.74 115.31 114.82 1fi9 h LEU 68 Ca 0.19 -0.43 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 1fi9 h LEU 68 Cb 0.36 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1fi9 h LEU 68 CO -0.44 0.58 -0.06 1.21 0.09 0.00 0.00 178.44 179.82 1fi9 n GLU 69 N -4.74 1.21 0.00 1.13 0.00 -0.44 -3.89 120.64 113.91 1fi9 n GLU 69 Ca -0.07 -0.23 0.00 0.00 0.00 0.00 0.00 57.16 56.86 1fi9 n GLU 69 Cb 0.27 -1.20 0.00 0.00 0.00 0.00 0.00 31.44 30.51 1fi9 n GLU 69 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1fi9 n ASN 70 N 1.65 0.00 0.22 4.31 3.02 -0.28 -4.85 115.26 119.33 1fi9 n ASN 70 Ca 0.09 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.51 1fi9 n ASN 70 Cb 0.58 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.68 1fi9 n ASN 70 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1fi9 h PRO 71 N 0.00 -0.56 -2.84 3.52 0.13 -1.61 -3.25 132.00 127.39 1fi9 h PRO 71 Ca 0.00 0.04 -0.59 0.00 -0.87 0.00 0.00 66.00 64.57 1fi9 h PRO 71 Cb 0.00 0.13 0.01 0.00 0.13 0.00 0.00 31.00 31.27 1fi9 h PRO 71 CO 0.00 -0.25 3.18 0.36 -0.23 0.00 0.00 178.00 181.05 1fi9 n LYS 72 N -5.20 3.45 0.08 0.86 0.00 -1.26 -3.62 118.16 112.47 1fi9 n LYS 72 Ca -0.10 -2.02 0.00 0.00 -0.00 0.00 0.00 58.31 56.19 1fi9 n LYS 72 Cb 0.29 -2.67 0.00 0.00 -0.00 0.00 0.00 35.03 32.65 1fi9 n LYS 72 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1fi9 n LYS 73 N 3.38 0.00 -0.16 -1.58 3.00 -1.22 -4.95 118.16 116.63 1fi9 n LYS 73 Ca 0.73 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.98 1fi9 n LYS 73 Cb 0.34 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.37 1fi9 n LYS 73 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.40 179.28 1fi9 h TYR 74 N 0.00 -0.86 -1.89 5.64 -1.99 -1.66 -3.43 116.97 112.78 1fi9 h TYR 74 Ca 0.00 0.06 0.03 0.00 2.00 0.00 0.00 58.73 60.82 1fi9 h TYR 74 Cb 0.00 0.45 -0.22 0.00 2.00 0.00 0.00 36.73 38.96 1fi9 h TYR 74 CO 0.00 -0.37 0.14 -1.50 -0.00 0.00 0.00 178.16 176.42 1fi9 s ILE 75 N -6.02 0.00 -1.22 -2.88 2.07 -1.26 -5.07 121.20 106.83 1fi9 s ILE 75 Ca -0.15 0.00 -0.14 0.00 -1.41 0.00 0.00 60.65 58.95 1fi9 s ILE 75 Cb 0.15 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.68 1fi9 s ILE 75 CO 0.69 0.00 2.27 -0.81 -1.91 0.00 0.00 174.94 175.18 1fi9 n PRO 76 N 3.77 2.52 -1.06 3.50 -0.04 -1.26 -3.49 135.00 138.94 1fi9 n PRO 76 Ca -0.18 -2.13 -0.04 0.00 -0.04 0.00 0.00 63.50 61.11 1fi9 n PRO 76 Cb 0.58 -2.96 -0.03 0.00 -0.04 0.00 0.00 33.50 31.06 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 4.06 0.31 0.00 0.55 0.00 -1.26 -5.14 105.19 103.71 1fi9 n GLY 77 Ca 0.55 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.56 1fi9 n GLY 77 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1fi9 n THR 78 N -0.16 0.00 -3.70 2.61 5.66 -1.23 -4.37 114.28 113.09 1fi9 n THR 78 Ca -0.18 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.50 1fi9 n THR 78 Cb 0.58 -1.27 -0.09 0.00 -1.55 0.00 0.00 70.33 68.01 1fi9 n THR 78 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1fi9 n LYS 79 N -0.31 2.38 -1.10 1.09 4.81 -1.26 -5.08 118.16 118.67 1fi9 n LYS 79 Ca 0.00 -4.51 -0.29 0.00 -0.87 0.00 0.00 58.31 52.63 1fi9 n LYS 79 Cb 0.00 -2.35 0.16 0.00 0.02 0.00 0.00 35.03 32.86 1fi9 n LYS 79 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fi9 s MET 80 N -1.61 0.80 0.26 1.64 0.23 -1.26 -5.04 119.30 114.31 1fi9 s MET 80 Ca 0.28 0.77 0.05 0.00 -1.03 0.00 0.00 55.69 55.77 1fi9 s MET 80 Cb -0.03 -1.76 -0.02 0.00 -1.53 0.00 0.00 34.83 31.49 1fi9 s MET 80 CO -0.12 -2.55 0.18 0.44 -2.03 0.00 0.00 175.02 170.95 1fi9 n ILE 81 N -4.09 0.00 -0.01 3.16 -5.35 -1.26 -5.06 119.36 106.75 1fi9 n ILE 81 Ca 0.06 -1.78 -0.00 0.00 -0.27 0.00 0.00 62.75 60.76 1fi9 n ILE 81 Cb 0.55 0.83 -0.00 0.00 -1.74 0.00 0.00 39.64 39.28 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 -0.52 -0.01 -3.27 4.28 -1.74 -1.26 -4.71 117.46 110.23 1fi9 n PHE 82 Ca 0.03 0.04 -0.01 0.00 -0.56 0.00 0.00 57.45 56.95 1fi9 n PHE 82 Cb 0.45 -0.24 0.01 0.00 1.52 0.00 0.00 39.48 41.21 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 -2.90 -0.43 -0.82 1.98 0.00 -1.26 -5.16 120.51 111.92 1fi9 n ALA 83 Ca 0.00 -0.25 -0.29 0.00 0.00 0.00 0.00 53.44 52.91 1fi9 n ALA 83 Cb 0.01 0.18 0.23 0.00 0.00 0.00 0.00 19.45 19.87 1fi9 n ALA 83 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1fi9 s GLY 84 N -1.65 1.54 0.76 0.00 0.00 -1.26 -4.97 107.32 101.74 1fi9 s GLY 84 Ca 0.04 -0.37 -0.15 0.00 0.00 0.00 0.00 44.72 44.24 1fi9 s GLY 84 CO 0.02 0.35 0.93 1.39 0.00 0.00 0.00 173.10 175.80 1fi9 n ILE 85 N -4.70 2.28 -0.26 0.90 2.08 -1.25 -4.85 119.36 113.55 1fi9 n ILE 85 Ca 0.05 -0.32 0.01 0.00 0.56 0.00 0.00 62.75 63.05 1fi9 n ILE 85 Cb 0.56 -1.05 0.05 0.00 -0.75 0.00 0.00 39.64 38.46 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 -2.07 -0.13 -2.64 0.38 5.02 -1.26 -4.78 118.16 112.68 1fi9 n LYS 86 Ca 0.12 1.09 0.00 0.00 -2.02 0.00 0.00 58.31 57.51 1fi9 n LYS 86 Cb 0.50 -1.62 0.01 0.00 -0.02 0.00 0.00 35.03 33.89 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 -5.08 0.16 -0.19 1.97 2.85 -1.26 -5.03 118.16 111.58 1fi9 n LYS 87 Ca 0.09 -0.46 -0.04 0.00 -1.05 0.00 0.00 58.31 56.85 1fi9 n LYS 87 Cb 0.31 0.68 0.06 0.00 -0.65 0.00 0.00 35.03 35.42 1fi9 n LYS 87 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 177.40 178.92 1fi9 h LYS 88 N 0.00 0.60 -0.38 -1.58 -0.00 -1.99 -1.27 116.57 111.95 1fi9 h LYS 88 Ca -0.10 -0.04 0.04 0.00 -0.00 0.00 0.00 60.65 60.55 1fi9 h LYS 88 Cb 0.51 -0.14 -0.07 0.00 -0.00 0.00 0.00 32.23 32.53 1fi9 h LYS 88 CO 0.14 0.40 -0.43 1.15 -0.00 0.00 0.00 179.45 180.70 1fi9 h THR 89 N 0.62 0.00 -0.51 0.07 2.02 -1.99 0.57 112.91 113.69 1fi9 h THR 89 Ca 0.24 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.45 1fi9 h THR 89 Cb 0.09 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.46 1fi9 h THR 89 CO -0.13 0.00 0.28 -0.33 0.37 0.00 0.00 175.52 175.71 1fi9 h GLU 90 N -0.27 0.53 -0.46 6.66 3.07 -1.88 -0.61 114.58 121.63 1fi9 h GLU 90 Ca 0.06 -0.03 0.07 0.00 -0.50 0.00 0.00 59.36 58.97 1fi9 h GLU 90 Cb 0.44 -0.12 -0.06 0.00 -0.84 0.00 0.00 28.75 28.17 1fi9 h GLU 90 CO -0.49 0.35 0.09 0.00 -1.40 0.00 0.00 179.01 177.56 1fi9 h ARG 91 N 0.55 0.22 0.10 2.33 3.08 -0.50 0.12 114.38 120.27 1fi9 h ARG 91 Ca 0.22 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1fi9 h ARG 91 Cb 0.09 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1fi9 h ARG 91 CO -0.13 0.15 -0.10 1.49 -1.07 0.00 0.00 179.97 180.31 1fi9 h GLU 92 N 0.23 -0.22 -0.28 0.04 4.22 -0.09 0.92 114.58 119.40 1fi9 h GLU 92 Ca 0.23 0.01 0.07 0.00 0.08 0.00 0.00 59.36 59.75 1fi9 h GLU 92 Cb 0.29 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.51 1fi9 h GLU 92 CO -0.29 -0.15 -0.27 -0.44 -2.18 0.00 0.00 179.01 175.68 1fi9 h ASP 93 N -0.23 -0.88 -0.42 1.04 3.32 -0.76 0.23 116.42 118.72 1fi9 h ASP 93 Ca 0.01 0.15 0.08 0.00 0.02 0.00 0.00 57.03 57.29 1fi9 h ASP 93 Cb 0.22 0.41 -0.09 0.00 0.22 0.00 0.00 39.33 40.09 1fi9 h ASP 93 CO -0.03 -0.30 -0.38 0.25 -1.72 0.00 0.00 179.24 177.06 1fi9 h LEU 94 N -0.26 -1.26 -1.04 1.55 6.46 -0.16 0.24 115.31 120.84 1fi9 h LEU 94 Ca 0.14 0.21 0.08 0.00 -0.12 0.00 0.00 57.88 58.19 1fi9 h LEU 94 Cb 0.49 0.57 -0.07 0.00 -0.73 0.00 0.00 40.66 40.92 1fi9 h LEU 94 CO -0.43 -0.34 0.63 0.40 -0.62 0.00 0.00 178.44 178.08 1fi9 h ILE 95 N -0.28 1.05 -0.39 4.05 5.03 -0.09 -0.21 117.51 126.68 1fi9 h ILE 95 Ca 0.16 -0.38 0.07 0.00 -0.12 0.00 0.00 64.86 64.59 1fi9 h ILE 95 Cb 0.56 -0.16 -0.06 0.00 -3.03 0.00 0.00 36.82 34.13 1fi9 h ILE 95 CO -0.57 0.20 -0.01 0.00 -0.68 0.00 0.00 178.15 177.09 1fi9 h ALA 96 N 1.48 0.35 0.85 1.87 0.00 0.15 0.29 119.26 124.26 1fi9 h ALA 96 Ca 0.44 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.42 1fi9 h ALA 96 Cb 0.24 0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.24 1fi9 h ALA 96 CO -0.19 -0.40 -0.41 -0.92 0.00 0.00 0.00 179.25 177.34 1fi9 h TYR 97 N 0.10 -1.06 -0.89 0.00 3.20 -0.55 -3.21 116.97 114.55 1fi9 h TYR 97 Ca 0.19 -0.03 0.24 0.00 3.14 0.00 0.00 58.73 62.27 1fi9 h TYR 97 Cb 0.27 0.35 -0.14 0.00 1.54 0.00 0.00 36.73 38.75 1fi9 h TYR 97 CO -0.27 -0.66 0.27 -0.07 -1.64 0.00 0.00 178.16 175.80 1fi9 h LEU 98 N -1.29 0.06 -0.66 2.82 4.07 -0.76 0.16 115.31 119.72 1fi9 h LEU 98 Ca -0.12 0.19 0.14 0.00 0.08 0.00 0.00 57.88 58.17 1fi9 h LEU 98 Cb 0.88 0.25 -0.12 0.00 1.08 0.00 0.00 40.66 42.75 1fi9 h LEU 98 CO 0.19 -0.14 -0.11 0.11 -1.08 0.00 0.00 178.44 177.41 1fi9 h LYS 99 N 0.23 0.03 0.10 1.13 1.57 -0.42 0.27 116.57 119.48 1fi9 h LYS 99 Ca 0.57 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.34 1fi9 h LYS 99 Cb 1.15 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1fi9 h LYS 99 CO -0.64 0.02 -0.05 -0.22 -0.57 0.00 0.00 179.45 177.99 1fi9 h LYS 100 N 0.03 -0.13 -0.66 3.15 1.63 -1.12 -3.28 116.57 116.19 1fi9 h LYS 100 Ca 0.33 0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 60.10 1fi9 h LYS 100 Cb 0.52 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.15 1fi9 h LYS 100 CO -0.65 0.39 0.27 0.00 -3.45 0.00 0.00 179.45 176.01 1fi9 h ALA 101 N -0.10 0.85 0.00 5.00 0.00 0.46 0.14 119.26 125.61 1fi9 h ALA 101 Ca -0.01 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 1fi9 h ALA 101 Cb 0.57 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1fi9 h ALA 101 CO 0.02 0.46 -0.72 1.79 0.00 0.00 0.00 179.25 180.81 1fi9 h THR 102 N 0.92 1.42 0.37 0.00 1.35 -0.71 -3.17 112.91 113.09 1fi9 h THR 102 Ca 0.22 -2.53 -0.02 0.00 -0.55 0.00 0.00 66.41 63.53 1fi9 h THR 102 Cb 0.19 2.40 0.00 0.00 -1.73 0.00 0.00 68.15 69.01 1fi9 h THR 102 CO -0.02 0.70 -0.18 -1.13 -0.25 0.00 0.00 175.52 174.64 1fi9 h ASN 103 N 0.00 -0.42 0.00 5.36 -1.24 -1.35 0.12 115.58 118.05 1fi9 h ASN 103 Ca -0.01 -0.13 0.00 0.00 0.71 0.00 0.00 56.30 56.87 1fi9 h ASN 103 Cb 1.34 0.11 0.00 0.00 0.73 0.00 0.00 38.32 40.50 1fi9 h ASN 103 CO 0.09 -0.08 0.00 -0.62 -1.29 0.00 0.00 177.43 175.54