#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 7.22 0.11 1.61 -1.08 -1.26 -4.72 116.67 118.54 1fi9 s ASP 2 Ca 0.00 1.79 -0.14 0.00 -0.52 0.00 0.00 52.55 53.68 1fi9 s ASP 2 Cb 0.00 -2.57 -0.09 0.00 -1.46 0.00 0.00 42.92 38.80 1fi9 s ASP 2 CO 0.00 -0.39 1.41 0.58 0.52 0.00 0.00 175.17 177.29 1fi9 h VAL 3 N 4.75 1.30 0.22 1.11 2.07 -1.87 0.14 116.25 123.97 1fi9 h VAL 3 Ca -0.39 -1.56 -0.01 0.00 0.82 0.00 0.00 66.70 65.55 1fi9 h VAL 3 Cb 1.20 1.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 1fi9 h VAL 3 CO 0.80 0.50 -0.11 -0.33 0.02 0.00 0.00 177.57 178.45 1fi9 h GLU 4 N 0.52 -0.29 -0.38 1.57 4.39 -1.93 0.12 114.58 118.57 1fi9 h GLU 4 Ca 0.04 0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.79 1fi9 h GLU 4 Cb 0.97 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.64 1fi9 h GLU 4 CO 0.09 0.05 0.16 0.87 -1.16 0.00 0.00 179.01 179.02 1fi9 h LYS 5 N -0.67 0.32 -0.84 2.33 1.57 -1.93 -1.39 116.57 115.96 1fi9 h LYS 5 Ca -0.03 -0.02 0.20 0.00 -1.87 0.00 0.00 60.65 58.93 1fi9 h LYS 5 Cb 0.47 -0.07 -0.12 0.00 0.08 0.00 0.00 32.23 32.59 1fi9 h LYS 5 CO 0.05 0.21 0.28 0.78 -0.57 0.00 0.00 179.45 180.20 1fi9 h GLY 6 N 0.33 1.31 1.00 3.86 0.00 -0.58 0.30 103.07 109.29 1fi9 h GLY 6 Ca 0.17 -0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 1fi9 h GLY 6 CO -0.15 -0.27 -0.22 1.70 0.00 0.00 0.00 176.54 177.60 1fi9 h LYS 7 N 0.31 -0.60 -0.62 4.80 3.64 0.25 0.69 116.57 125.04 1fi9 h LYS 7 Ca 0.51 0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.88 1fi9 h LYS 7 Cb 0.94 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.87 1fi9 h LYS 7 CO -0.55 -0.40 0.21 0.87 -2.27 0.00 0.00 179.45 177.31 1fi9 h LYS 8 N -0.64 0.92 0.93 1.90 1.79 -0.24 -1.87 116.57 119.37 1fi9 h LYS 8 Ca -0.06 -0.17 -0.05 0.00 -2.18 0.00 0.00 60.65 58.19 1fi9 h LYS 8 Cb 0.49 -0.15 0.01 0.00 -1.58 0.00 0.00 32.23 30.99 1fi9 h LYS 8 CO 0.11 0.78 -0.45 0.82 -1.08 0.00 0.00 179.45 179.63 1fi9 h ILE 9 N 0.90 0.04 -0.75 1.86 2.04 -0.28 0.89 117.51 122.21 1fi9 h ILE 9 Ca 0.21 -0.06 0.15 0.00 1.00 0.00 0.00 64.86 66.16 1fi9 h ILE 9 Cb 0.23 0.04 -0.14 0.00 -0.74 0.00 0.00 36.82 36.21 1fi9 h ILE 9 CO -0.01 0.00 -0.18 0.15 0.00 0.00 0.00 178.15 178.11 1fi9 h PHE 10 N -1.30 -0.39 0.57 1.37 3.57 -0.66 0.27 116.94 120.37 1fi9 h PHE 10 Ca -0.13 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.41 1fi9 h PHE 10 Cb 0.96 0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.98 1fi9 h PHE 10 CO -0.00 -0.32 -0.35 0.28 -2.23 0.00 0.00 178.31 175.69 1fi9 h VAL 11 N 0.00 0.00 0.00 1.41 2.07 -1.21 0.18 116.25 118.70 1fi9 h VAL 11 Ca 0.36 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.88 1fi9 h VAL 11 Cb 0.55 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1fi9 h VAL 11 CO -0.77 0.00 -0.02 1.56 0.02 0.00 0.00 177.57 178.36 1fi9 h GLN 12 N -0.86 0.00 0.03 1.57 1.08 0.25 -0.65 115.11 116.53 1fi9 h GLN 12 Ca -0.08 0.00 -0.36 0.00 -1.45 0.00 0.00 58.65 56.77 1fi9 h GLN 12 Cb 0.69 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.06 1fi9 h GLN 12 CO 0.08 0.02 -2.18 1.63 -0.95 0.00 0.00 178.83 177.43 1fi9 n LYS 13 N -4.01 0.68 0.00 1.46 4.01 0.85 -4.84 118.16 116.31 1fi9 n LYS 13 Ca -0.03 0.16 0.00 0.00 -0.51 0.00 0.00 58.31 57.93 1fi9 n LYS 13 Cb 0.10 -1.62 0.00 0.00 -0.51 0.00 0.00 35.03 33.00 1fi9 n LYS 13 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1fi9 n ALA 15 N -1.70 0.00 -1.22 0.00 0.00 -0.27 -1.89 120.51 115.43 1fi9 n ALA 15 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1fi9 n ALA 15 Cb 0.30 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.71 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 -0.61 3.36 0.00 0.00 6.02 -1.26 -2.43 117.38 122.46 1fi9 n GLN 16 Ca 0.00 -1.99 0.00 0.00 -0.01 0.00 0.00 57.00 55.00 1fi9 n GLN 16 Cb 0.00 -2.67 0.00 0.00 1.02 0.00 0.00 30.24 28.59 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 2.55 0.16 0.00 3.76 -1.02 -1.33 115.29 118.04 1fi9 s HIS 18 Ca 0.00 -0.25 0.10 0.00 -0.15 0.00 0.00 55.06 54.75 1fi9 s HIS 18 Cb 0.00 -1.34 -0.04 0.00 1.11 0.00 0.00 32.58 32.30 1fi9 s HIS 18 CO 0.00 0.40 -0.22 0.99 -0.85 0.00 0.00 174.74 175.06 1fi9 s THR 19 N -1.19 2.04 -0.40 1.30 2.01 -1.26 -4.34 115.64 113.80 1fi9 s THR 19 Ca 0.19 -1.87 0.11 0.00 0.31 0.00 0.00 61.69 60.43 1fi9 s THR 19 Cb -0.10 -1.91 0.40 0.00 0.01 0.00 0.00 72.50 70.89 1fi9 s THR 19 CO 0.11 -0.15 0.92 1.33 -0.69 0.00 0.00 174.62 176.13 1fi9 n VAL 20 N 0.49 1.28 -3.57 3.82 0.24 -1.26 0.10 118.33 119.43 1fi9 n VAL 20 Ca -0.15 -4.32 -0.16 0.00 -2.04 0.00 0.00 64.34 57.68 1fi9 n VAL 20 Cb 0.56 -0.34 -0.06 0.00 -1.47 0.00 0.00 33.84 32.52 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 -3.06 1.01 0.22 7.34 -1.05 -1.26 -4.19 118.70 117.70 1fi9 s GLU 21 Ca 0.39 0.00 -0.32 0.00 -0.15 0.00 0.00 54.97 54.89 1fi9 s GLU 21 Cb 0.38 0.47 -0.13 0.00 -0.44 0.00 0.00 34.13 34.42 1fi9 s GLU 21 CO -0.07 -0.34 1.62 0.36 0.95 0.00 0.00 175.26 177.79 1fi9 n LYS 22 N 0.74 2.52 -0.94 -4.83 -0.00 -1.26 -1.48 118.16 112.91 1fi9 n LYS 22 Ca -0.19 0.91 0.00 0.00 -0.00 0.00 0.00 58.31 59.03 1fi9 n LYS 22 Cb 0.58 -2.70 0.00 0.00 -0.00 0.00 0.00 35.03 32.91 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 3.23 0.52 0.00 2.58 0.00 -1.26 -4.94 105.19 105.32 1fi9 n GLY 23 Ca 0.14 -0.10 0.02 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.94 -0.37 1.31 -0.02 0.00 -0.55 -4.96 105.19 97.66 1fi9 n GLY 24 Ca 0.00 -0.02 0.18 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.65 -2.64 -3.39 1.61 4.76 -1.26 -4.59 118.16 112.01 1fi9 n LYS 25 Ca 0.03 1.75 -0.18 0.00 -2.87 0.00 0.00 58.31 57.03 1fi9 n LYS 25 Cb 0.01 -3.21 -0.09 0.00 -1.84 0.00 0.00 35.03 29.90 1fi9 n LYS 25 CO 0.00 0.00 0.00 -3.38 -1.37 0.00 0.00 177.40 172.65 1fi9 s HIS 26 N -2.14 -0.27 0.00 2.13 -3.43 -1.26 -3.53 115.29 106.79 1fi9 s HIS 26 Ca 0.00 -0.58 0.00 0.00 -0.80 0.00 0.00 55.06 53.68 1fi9 s HIS 26 Cb 0.00 -0.49 0.00 0.00 -1.43 0.00 0.00 32.58 30.66 1fi9 s HIS 26 CO 0.00 -0.93 0.00 1.63 -2.00 0.00 0.00 174.74 173.44 1fi9 n LYS 27 N 4.77 0.00 -0.10 -0.38 5.02 -1.26 -4.97 118.16 121.24 1fi9 n LYS 27 Ca 0.04 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.16 1fi9 n LYS 27 Cb 0.45 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.38 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 1.50 -2.68 -0.18 -1.04 -1.26 -4.89 114.28 105.72 1fi9 n THR 28 Ca 0.00 -0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.63 1fi9 n THR 28 Cb 0.00 -2.15 -0.06 0.00 -1.82 0.00 0.00 70.33 66.31 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 -4.80 2.84 0.87 3.41 0.00 -0.44 -5.05 107.32 104.15 1fi9 s GLY 29 Ca -0.27 0.62 -0.10 0.00 0.00 0.00 0.00 44.72 44.97 1fi9 s GLY 29 CO 0.45 1.09 1.12 2.56 0.00 0.00 0.00 173.10 178.32 1fi9 s PRO 30 N -2.03 1.43 -0.44 2.90 0.04 -1.26 -4.63 135.00 131.00 1fi9 s PRO 30 Ca 0.51 1.36 -0.27 0.00 0.04 0.00 0.00 61.00 62.63 1fi9 s PRO 30 Cb -0.22 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1fi9 s PRO 30 CO 0.27 -2.28 2.06 1.21 0.04 0.00 0.00 177.00 178.30 1fi9 s ASN 31 N -2.97 5.22 -1.08 6.66 2.47 -1.23 -4.09 114.94 119.92 1fi9 s ASN 31 Ca 0.65 1.04 -0.19 0.00 0.42 0.00 0.00 52.86 54.77 1fi9 s ASN 31 Cb -0.21 -2.52 -0.07 0.00 -1.45 0.00 0.00 41.25 37.01 1fi9 s ASN 31 CO 0.57 -2.28 1.99 0.18 -3.72 0.00 0.00 177.10 173.84 1fi9 n LEU 32 N 12.86 4.81 -4.01 3.21 7.99 0.12 -4.83 117.00 137.14 1fi9 n LEU 32 Ca 0.27 -3.39 -0.28 0.00 -0.01 0.00 0.00 56.01 52.61 1fi9 n LEU 32 Cb 0.50 -1.42 -0.17 0.00 -0.11 0.00 0.00 43.42 42.23 1fi9 n LEU 32 CO 0.70 -0.11 -0.47 -2.28 -1.51 0.00 0.00 177.39 173.71 1fi9 s HIS 33 N 5.28 1.79 -0.74 -1.77 2.46 -1.26 -4.31 115.29 116.73 1fi9 s HIS 33 Ca 0.56 -0.85 -0.01 0.00 0.47 0.00 0.00 55.06 55.23 1fi9 s HIS 33 Cb 0.11 -1.34 0.00 0.00 -0.13 0.00 0.00 32.58 31.23 1fi9 s HIS 33 CO 0.06 -0.48 0.13 0.41 -2.47 0.00 0.00 174.74 172.39 1fi9 n GLY 34 N 4.39 0.06 0.41 1.59 0.00 0.29 -4.98 105.19 106.95 1fi9 n GLY 34 Ca -0.18 -0.44 -0.18 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.30 -0.86 -8.87 0.99 5.85 -1.82 -3.38 115.31 106.91 1fi9 h LEU 35 Ca -0.23 0.01 -0.57 0.00 0.84 0.00 0.00 57.88 57.93 1fi9 h LEU 35 Cb 1.16 0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.38 1fi9 h LEU 35 CO 0.26 -0.57 1.16 -0.36 -0.34 0.00 0.00 178.44 178.58 1fi9 s PHE 36 N -5.66 2.14 0.00 1.25 0.40 -1.26 -2.76 117.98 112.09 1fi9 s PHE 36 Ca -0.17 0.64 0.00 0.00 -0.60 0.00 0.00 56.93 56.80 1fi9 s PHE 36 Cb 0.02 -4.17 0.00 0.00 0.51 0.00 0.00 43.02 39.38 1fi9 s PHE 36 CO 0.57 -2.50 0.00 0.41 0.70 0.00 0.00 175.22 174.40 1fi9 n GLY 37 N 5.12 1.85 3.47 4.36 0.00 -1.26 -5.00 105.19 113.72 1fi9 n GLY 37 Ca 0.19 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.40 1.54 0.20 1.61 6.06 -1.11 -5.11 118.95 121.75 1fi9 s ARG 38 Ca 0.00 -1.46 0.08 0.00 -2.50 0.00 0.00 55.73 51.84 1fi9 s ARG 38 Cb 0.00 0.41 -0.04 0.00 0.06 0.00 0.00 34.95 35.38 1fi9 s ARG 38 CO 0.00 -0.61 0.02 0.15 -2.50 0.00 0.00 175.30 172.35 1fi9 s LYS 39 N -3.83 2.42 0.10 5.12 1.02 -1.26 -3.59 119.74 119.71 1fi9 s LYS 39 Ca 0.29 -1.18 -0.32 0.00 0.02 0.00 0.00 55.97 54.77 1fi9 s LYS 39 Cb 0.01 -2.33 -0.13 0.00 -0.52 0.00 0.00 37.83 34.86 1fi9 s LYS 39 CO 0.12 0.43 1.59 1.79 -0.92 0.00 0.00 175.35 178.37 1fi9 h THR 40 N 2.23 0.18 -0.12 2.17 1.35 -1.79 0.81 112.91 117.74 1fi9 h THR 40 Ca -0.46 0.00 0.04 0.00 -0.55 0.00 0.00 66.41 65.43 1fi9 h THR 40 Cb 1.22 0.18 -0.00 0.00 -1.73 0.00 0.00 68.15 67.81 1fi9 h THR 40 CO 0.59 0.00 0.28 1.23 -0.25 0.00 0.00 175.52 177.37 1fi9 h GLY 41 N -0.78 0.00 -3.39 5.82 0.00 -1.58 -2.97 103.07 100.16 1fi9 h GLY 41 Ca -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.12 1fi9 h GLY 41 CO -0.11 0.00 0.17 -1.06 0.00 0.00 0.00 176.54 175.54 1fi9 n GLN 42 N -3.28 1.52 -1.57 4.80 1.13 0.28 -4.94 117.38 115.33 1fi9 n GLN 42 Ca 0.01 -0.91 -0.32 0.00 -1.94 0.00 0.00 57.00 53.84 1fi9 n GLN 42 Cb 0.38 -1.42 0.06 0.00 0.11 0.00 0.00 30.24 29.36 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 -0.80 2.45 -1.09 -1.58 0.00 -1.12 -4.74 121.76 114.88 1fi9 s ALA 43 Ca 0.23 0.34 -0.17 0.00 0.00 0.00 0.00 51.96 52.36 1fi9 s ALA 43 Cb 0.16 -3.27 -0.07 0.00 0.00 0.00 0.00 23.12 19.94 1fi9 s ALA 43 CO -0.02 -1.40 2.10 -0.35 0.00 0.00 0.00 175.76 176.10 1fi9 n PRO 44 N -2.91 2.16 -4.02 0.00 -0.04 -1.26 -4.51 135.00 124.41 1fi9 n PRO 44 Ca 0.09 -2.13 -0.27 0.00 -0.04 0.00 0.00 63.50 61.15 1fi9 n PRO 44 Cb 0.53 -3.03 -0.03 0.00 -0.04 0.00 0.00 33.50 30.92 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 4.27 -0.25 3.69 0.55 0.00 -1.26 -4.96 105.19 107.23 1fi9 n GLY 45 Ca 0.51 0.17 -0.23 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 -4.02 2.82 -1.21 1.61 5.36 -1.26 -5.04 117.98 116.24 1fi9 s PHE 46 Ca 0.04 -0.18 -0.21 0.00 -0.96 0.00 0.00 56.93 55.62 1fi9 s PHE 46 Cb -0.02 -1.28 -0.03 0.00 -0.34 0.00 0.00 43.02 41.36 1fi9 s PHE 46 CO 0.91 0.58 1.85 -0.08 -1.46 0.00 0.00 175.22 177.03 1fi9 s THR 47 N -2.17 3.75 1.05 0.12 -1.32 -1.26 -4.95 115.64 110.86 1fi9 s THR 47 Ca 0.31 -1.26 -0.18 0.00 -1.21 0.00 0.00 61.69 59.36 1fi9 s THR 47 Cb -0.07 -4.79 0.26 0.00 -1.51 0.00 0.00 72.50 66.38 1fi9 s THR 47 CO 0.21 -1.38 1.04 0.00 -2.21 0.00 0.00 174.62 172.28 1fi9 n TYR 48 N 12.14 -3.85 -4.32 9.09 0.18 -1.26 -5.01 117.16 124.12 1fi9 n TYR 48 Ca 0.46 -0.93 -0.24 0.00 1.88 0.00 0.00 57.90 59.07 1fi9 n TYR 48 Cb 0.46 -1.00 -0.08 0.00 -0.38 0.00 0.00 39.34 38.34 1fi9 n TYR 48 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1fi9 s THR 49 N -2.99 2.83 -1.33 -3.48 -4.23 -1.26 -5.02 115.64 100.16 1fi9 s THR 49 Ca 0.65 -1.97 -0.08 0.00 -1.18 0.00 0.00 61.69 59.10 1fi9 s THR 49 Cb -0.05 -2.78 -0.08 0.00 1.34 0.00 0.00 72.50 70.94 1fi9 s THR 49 CO 0.49 -0.26 2.63 0.47 -0.54 0.00 0.00 174.62 177.41 1fi9 n ASP 50 N -0.93 7.23 0.19 3.99 8.00 -1.26 -3.14 116.55 130.63 1fi9 n ASP 50 Ca -0.05 -2.47 0.00 0.00 0.71 0.00 0.00 54.79 52.98 1fi9 n ASP 50 Cb 0.61 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.34 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 3.81 0.78 0.74 2.24 0.00 -1.26 -4.89 120.51 121.92 1fi9 n ALA 51 Ca 0.65 0.00 0.00 0.00 0.00 0.00 0.00 53.44 54.09 1fi9 n ALA 51 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 -3.35 3.10 0.00 0.00 6.94 -1.19 -2.21 115.26 118.56 1fi9 n ASN 52 Ca 0.00 -1.93 0.00 0.00 -0.02 0.00 0.00 54.58 52.63 1fi9 n ASN 52 Cb 0.00 -0.55 0.00 0.00 -2.36 0.00 0.00 39.78 36.87 1fi9 n ASN 52 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 1fi9 n LYS 53 N 0.67 0.00 0.24 -3.83 2.85 -1.25 -2.15 118.16 114.70 1fi9 n LYS 53 Ca 0.00 0.00 0.15 0.00 -1.05 0.00 0.00 58.31 57.41 1fi9 n LYS 53 Cb 0.47 -0.33 0.53 0.00 -0.65 0.00 0.00 35.03 35.05 1fi9 n LYS 53 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 177.40 176.44 1fi9 h ASN 54 N 0.00 0.00 0.17 -5.58 2.35 -1.84 -3.31 115.58 107.36 1fi9 h ASN 54 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1fi9 h ASN 54 Cb 0.64 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.01 1fi9 h ASN 54 CO 0.00 0.00 -0.08 0.50 -1.65 0.00 0.00 177.43 176.20 1fi9 h LYS 55 N 0.00 -0.22 -2.92 0.81 3.64 -1.74 -3.47 116.57 112.68 1fi9 h LYS 55 Ca 0.00 0.01 -0.37 0.00 -1.27 0.00 0.00 60.65 59.03 1fi9 h LYS 55 Cb 0.62 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.49 1fi9 h LYS 55 CO 0.00 -0.10 -0.49 0.41 -2.27 0.00 0.00 179.45 177.00 1fi9 n GLY 56 N -1.05 -0.39 3.42 5.01 0.00 -1.25 -5.00 105.19 105.93 1fi9 n GLY 56 Ca -0.09 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 1fi9 n GLY 56 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1fi9 n ILE 57 N -4.09 0.00 -4.53 -0.61 -6.64 -1.26 -4.83 119.36 97.40 1fi9 n ILE 57 Ca -0.20 -1.36 -0.33 0.00 -1.77 0.00 0.00 62.75 59.10 1fi9 n ILE 57 Cb 0.66 -0.99 -0.16 0.00 -1.44 0.00 0.00 39.64 37.71 1fi9 n ILE 57 CO 0.00 0.00 0.00 0.42 -1.77 0.00 0.00 176.55 175.20 1fi9 s THR 58 N -2.75 2.44 -1.29 7.28 -4.23 -1.26 -3.15 115.64 112.67 1fi9 s THR 58 Ca 0.59 -0.85 -0.19 0.00 -1.18 0.00 0.00 61.69 60.07 1fi9 s THR 58 Cb -0.03 -2.01 0.05 0.00 1.34 0.00 0.00 72.50 71.84 1fi9 s THR 58 CO 0.39 0.53 1.77 0.79 -0.54 0.00 0.00 174.62 177.56 1fi9 n TRP 59 N 4.12 4.41 -3.02 3.99 7.02 -1.24 -4.51 117.44 128.22 1fi9 n TRP 59 Ca -0.19 -2.67 -0.25 0.00 -1.02 0.00 0.00 57.50 53.37 1fi9 n TRP 59 Cb 0.51 -2.64 -0.04 0.00 -2.42 0.00 0.00 31.31 26.73 1fi9 n TRP 59 CO 0.00 0.00 0.00 0.36 -2.02 0.00 0.00 177.69 176.03 1fi9 n LYS 60 N 8.35 2.61 0.00 -0.99 2.85 -1.26 -4.14 118.16 125.57 1fi9 n LYS 60 Ca 0.49 -4.46 0.00 0.00 -1.05 0.00 0.00 58.31 53.29 1fi9 n LYS 60 Cb 0.46 -2.09 0.00 0.00 -0.65 0.00 0.00 35.03 32.75 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 -0.08 0.00 -0.22 -1.58 0.00 -1.26 -4.62 120.64 112.88 1fi9 n GLU 61 Ca 0.29 0.00 -0.13 0.00 0.00 0.00 0.00 57.16 57.32 1fi9 n GLU 61 Cb 0.46 0.00 -0.10 0.00 0.00 0.00 0.00 31.44 31.80 1fi9 n GLU 61 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1fi9 h GLU 62 N 0.00 -0.27 -0.09 3.44 5.08 -1.93 0.29 114.58 121.10 1fi9 h GLU 62 Ca 0.00 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1fi9 h GLU 62 Cb 0.00 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1fi9 h GLU 62 CO 0.00 -0.18 0.04 1.15 -1.00 0.00 0.00 179.01 179.02 1fi9 h THR 63 N -0.28 1.13 -0.77 1.13 2.02 -1.82 -2.88 112.91 111.45 1fi9 h THR 63 Ca 0.10 -0.38 0.15 0.00 0.77 0.00 0.00 66.41 67.05 1fi9 h THR 63 Cb 0.54 1.21 -0.10 0.00 -1.74 0.00 0.00 68.15 68.07 1fi9 h THR 63 CO -0.70 0.11 0.30 -0.07 0.37 0.00 0.00 175.52 175.53 1fi9 h LEU 64 N 0.01 0.27 -0.63 2.58 4.07 -1.69 0.10 115.31 120.02 1fi9 h LEU 64 Ca 0.03 0.11 0.12 0.00 0.08 0.00 0.00 57.88 58.23 1fi9 h LEU 64 Cb 0.14 0.10 -0.12 0.00 1.08 0.00 0.00 40.66 41.86 1fi9 h LEU 64 CO -0.00 0.09 -0.20 0.24 -1.08 0.00 0.00 178.44 177.49 1fi9 h MET 65 N 0.43 -0.04 0.17 1.13 2.86 -0.22 0.17 114.93 119.43 1fi9 h MET 65 Ca 0.43 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.78 1fi9 h MET 65 Cb 0.67 0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.35 1fi9 h MET 65 CO -0.42 -0.03 -1.42 0.93 1.06 0.00 0.00 176.91 177.03 1fi9 h GLU 66 N -0.04 0.36 -0.84 1.72 5.08 -1.47 -0.40 114.58 118.99 1fi9 h GLU 66 Ca 0.29 -0.61 0.16 0.00 -1.00 0.00 0.00 59.36 58.21 1fi9 h GLU 66 Cb 0.49 0.23 -0.10 0.00 0.50 0.00 0.00 28.75 29.87 1fi9 h GLU 66 CO -0.67 1.29 0.40 -0.92 -1.00 0.00 0.00 179.01 178.11 1fi9 h TYR 67 N -0.11 0.68 0.14 4.33 3.20 -0.33 0.15 116.97 125.04 1fi9 h TYR 67 Ca -0.28 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.62 1fi9 h TYR 67 Cb 1.92 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 40.01 1fi9 h TYR 67 CO 0.13 0.11 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.62 1fi9 h LEU 68 N 0.54 -0.16 -4.13 2.82 3.38 -0.81 -3.26 115.31 113.69 1fi9 h LEU 68 Ca 0.47 0.01 -0.33 0.00 0.09 0.00 0.00 57.88 58.12 1fi9 h LEU 68 Cb 0.73 0.04 -0.12 0.00 0.09 0.00 0.00 40.66 41.41 1fi9 h LEU 68 CO -0.41 0.22 0.06 1.21 0.09 0.00 0.00 178.44 179.62 1fi9 n GLU 69 N -4.38 2.10 0.00 1.13 2.13 -0.16 -3.53 120.64 117.93 1fi9 n GLU 69 Ca -0.02 -1.59 0.00 0.00 0.66 0.00 0.00 57.16 56.20 1fi9 n GLU 69 Cb 0.07 -1.97 0.00 0.00 0.27 0.00 0.00 31.44 29.82 1fi9 n GLU 69 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1fi9 n ASN 70 N 1.51 0.00 0.03 4.31 3.02 0.48 -4.73 115.26 119.88 1fi9 n ASN 70 Ca 0.42 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 55.06 1fi9 n ASN 70 Cb 0.70 0.00 0.39 0.00 -0.61 0.00 0.00 39.78 40.25 1fi9 n ASN 70 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1fi9 n PRO 71 N 0.00 0.06 -3.17 3.52 -0.04 -1.23 -3.23 135.00 130.91 1fi9 n PRO 71 Ca 0.00 0.27 -0.29 0.00 -0.04 0.00 0.00 63.50 63.44 1fi9 n PRO 71 Cb 0.00 -1.60 -0.05 0.00 -0.04 0.00 0.00 33.50 31.81 1fi9 n PRO 71 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1fi9 n LYS 72 N -1.70 3.09 0.11 0.54 0.00 -1.26 -4.53 118.16 114.41 1fi9 n LYS 72 Ca 0.04 -4.74 0.00 0.00 -0.00 0.00 0.00 58.31 53.61 1fi9 n LYS 72 Cb 0.21 -2.28 0.00 0.00 -0.00 0.00 0.00 35.03 32.96 1fi9 n LYS 72 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1fi9 n LYS 73 N 0.43 0.00 -1.79 -1.58 4.76 -1.20 -5.00 118.16 113.78 1fi9 n LYS 73 Ca 0.31 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.37 1fi9 n LYS 73 Cb 0.39 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.54 1fi9 n LYS 73 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1fi9 n TYR 74 N -2.95 2.89 -1.60 2.13 4.02 -1.25 -4.27 117.16 116.14 1fi9 n TYR 74 Ca 0.00 -2.04 -0.00 0.00 -0.01 0.00 0.00 57.90 55.85 1fi9 n TYR 74 Cb 0.00 -2.30 0.00 0.00 -0.02 0.00 0.00 39.34 37.02 1fi9 n TYR 74 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 1fi9 n ILE 75 N 6.54 -2.81 -1.36 -0.72 -0.00 -1.26 -4.90 119.36 114.85 1fi9 n ILE 75 Ca 0.48 0.15 -0.41 0.00 -0.00 0.00 0.00 62.75 62.97 1fi9 n ILE 75 Cb 0.43 -4.24 -0.03 0.00 -0.00 0.00 0.00 39.64 35.80 1fi9 n ILE 75 CO 0.00 0.00 0.00 -0.81 -0.00 0.00 0.00 176.55 175.74 1fi9 n PRO 76 N 0.04 2.14 -2.69 0.38 -0.04 -1.26 -3.79 135.00 129.78 1fi9 n PRO 76 Ca 0.00 -2.13 -0.06 0.00 -0.04 0.00 0.00 63.50 61.27 1fi9 n PRO 76 Cb 0.00 -3.03 0.08 0.00 -0.04 0.00 0.00 33.50 30.51 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 4.28 0.55 0.00 0.55 0.00 -1.26 -5.11 105.19 104.20 1fi9 n GLY 77 Ca 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 -0.37 0.00 -3.24 2.61 -1.04 -1.25 -4.49 114.28 106.49 1fi9 n THR 78 Ca -0.08 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.81 1fi9 n THR 78 Cb 0.77 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.23 1fi9 n THR 78 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1fi9 s LYS 79 N 1.66 0.78 0.27 -2.82 2.20 -1.26 -5.10 119.74 115.47 1fi9 s LYS 79 Ca 0.00 -0.93 -0.29 0.00 -0.36 0.00 0.00 55.97 54.39 1fi9 s LYS 79 Cb 0.00 -0.53 -0.10 0.00 -1.51 0.00 0.00 37.83 35.69 1fi9 s LYS 79 CO 0.00 -1.24 1.36 0.00 -0.36 0.00 0.00 175.35 175.11 1fi9 s MET 80 N 1.26 4.33 0.00 4.03 0.23 -1.26 -5.00 119.30 122.88 1fi9 s MET 80 Ca 0.21 2.22 0.00 0.00 -1.03 0.00 0.00 55.69 57.09 1fi9 s MET 80 Cb -0.09 -3.11 0.00 0.00 -1.53 0.00 0.00 34.83 30.11 1fi9 s MET 80 CO -0.06 -0.29 0.00 0.44 -2.03 0.00 0.00 175.02 173.08 1fi9 n ILE 81 N 1.75 0.00 -0.53 3.16 -5.35 -1.26 -5.13 119.36 112.00 1fi9 n ILE 81 Ca 0.04 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.22 1fi9 n ILE 81 Cb 0.41 0.00 0.23 0.00 -1.74 0.00 0.00 39.64 38.55 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 -1.55 -1.14 4.28 1.16 -1.26 -4.82 117.46 114.12 1fi9 n PHE 82 Ca 0.00 -0.10 -0.34 0.00 -1.87 0.00 0.00 57.45 55.14 1fi9 n PHE 82 Cb 0.00 -1.61 -0.02 0.00 -1.61 0.00 0.00 39.48 36.24 1fi9 n PHE 82 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1fi9 n ALA 83 N -4.87 5.82 -1.00 1.98 0.00 -1.26 -4.81 120.51 116.37 1fi9 n ALA 83 Ca 0.02 -3.00 0.14 0.00 0.00 0.00 0.00 53.44 50.59 1fi9 n ALA 83 Cb 0.57 -3.29 -0.03 0.00 0.00 0.00 0.00 19.45 16.70 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 3.82 -2.01 0.00 0.00 0.00 -1.26 -4.74 105.19 100.99 1fi9 n GLY 84 Ca 0.60 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.24 0.00 0.06 -0.61 2.08 -1.26 -4.95 119.36 111.44 1fi9 n ILE 85 Ca 0.01 0.71 0.00 0.00 0.56 0.00 0.00 62.75 64.03 1fi9 n ILE 85 Cb 0.45 -1.64 0.00 0.00 -0.75 0.00 0.00 39.64 37.70 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 -0.26 0.00 0.00 0.38 5.02 -1.26 -5.08 118.16 116.96 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 -2.86 0.00 0.06 1.97 2.85 -1.26 -5.06 118.16 113.86 1fi9 n LYS 87 Ca 0.00 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.37 1fi9 n LYS 87 Cb 0.00 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 34.40 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 0.46 -0.01 -1.58 2.85 -1.26 -3.93 118.16 114.69 1fi9 n LYS 88 Ca 0.00 0.05 -0.00 0.00 -1.05 0.00 0.00 58.31 57.30 1fi9 n LYS 88 Cb 0.00 -1.70 -0.00 0.00 -0.65 0.00 0.00 35.03 32.68 1fi9 n LYS 88 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1fi9 h THR 89 N 0.00 0.00 -0.74 0.58 2.02 -1.99 -3.31 112.91 109.47 1fi9 h THR 89 Ca 0.00 -0.21 0.16 0.00 0.77 0.00 0.00 66.41 67.13 1fi9 h THR 89 Cb 0.87 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 67.15 1fi9 h THR 89 CO 0.00 0.00 -0.04 -0.33 0.37 0.00 0.00 175.52 175.52 1fi9 h GLU 90 N -0.21 0.07 -0.97 6.66 3.07 -1.99 0.29 114.58 121.51 1fi9 h GLU 90 Ca 0.00 -0.00 0.05 0.00 -0.50 0.00 0.00 59.36 58.90 1fi9 h GLU 90 Cb 0.04 -0.02 -0.06 0.00 -0.84 0.00 0.00 28.75 27.87 1fi9 h GLU 90 CO 0.00 0.05 0.63 0.07 -1.40 0.00 0.00 179.01 178.36 1fi9 h ARG 91 N 0.08 1.15 -0.47 2.33 -0.00 -1.77 0.68 114.38 116.38 1fi9 h ARG 91 Ca 0.39 -0.07 -0.03 0.00 -0.00 0.00 0.00 59.98 60.27 1fi9 h ARG 91 Cb 0.68 -0.26 -0.02 0.00 -0.00 0.00 0.00 29.97 30.37 1fi9 h ARG 91 CO -0.68 0.76 0.16 1.49 -0.00 0.00 0.00 179.97 181.70 1fi9 h GLU 92 N 1.18 0.71 -0.26 0.08 4.22 -0.57 0.19 114.58 120.14 1fi9 h GLU 92 Ca 0.40 -0.14 0.03 0.00 0.08 0.00 0.00 59.36 59.73 1fi9 h GLU 92 Cb 0.07 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1fi9 h GLU 92 CO -0.13 0.66 0.06 -0.44 -2.18 0.00 0.00 179.01 176.98 1fi9 h ASP 93 N 0.61 0.03 -0.21 1.04 3.32 -0.55 -0.68 116.42 119.98 1fi9 h ASP 93 Ca 0.15 0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.28 1fi9 h ASP 93 Cb 0.24 0.05 -0.07 0.00 0.22 0.00 0.00 39.33 39.76 1fi9 h ASP 93 CO -0.01 0.05 -0.50 0.25 -1.72 0.00 0.00 179.24 177.31 1fi9 h LEU 94 N 0.16 -1.62 -0.58 1.55 6.46 -0.31 -1.52 115.31 119.45 1fi9 h LEU 94 Ca 0.12 0.21 0.12 0.00 -0.12 0.00 0.00 57.88 58.20 1fi9 h LEU 94 Cb 0.11 0.65 -0.11 0.00 -0.73 0.00 0.00 40.66 40.59 1fi9 h LEU 94 CO -0.15 -0.45 -0.12 0.40 -0.62 0.00 0.00 178.44 177.51 1fi9 h ILE 95 N -0.50 0.44 -0.32 4.05 5.03 -0.56 -0.39 117.51 125.26 1fi9 h ILE 95 Ca 0.06 -0.01 0.07 0.00 -0.12 0.00 0.00 64.86 64.86 1fi9 h ILE 95 Cb 0.65 0.41 -0.06 0.00 -3.03 0.00 0.00 36.82 34.79 1fi9 h ILE 95 CO -0.47 0.00 -0.11 0.00 -0.68 0.00 0.00 178.15 176.90 1fi9 h ALA 96 N 1.57 0.17 0.63 1.87 0.00 -0.17 0.64 119.26 123.97 1fi9 h ALA 96 Ca 0.28 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 1fi9 h ALA 96 Cb 0.44 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1fi9 h ALA 96 CO -0.58 -0.49 -0.43 -0.92 0.00 0.00 0.00 179.25 176.83 1fi9 h TYR 97 N -0.04 -1.15 -0.79 0.00 3.20 -0.75 -3.23 116.97 114.21 1fi9 h TYR 97 Ca 0.16 -0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.18 1fi9 h TYR 97 Cb 0.28 0.42 -0.15 0.00 1.54 0.00 0.00 36.73 38.82 1fi9 h TYR 97 CO -0.32 -0.63 -0.18 1.25 -1.64 0.00 0.00 178.16 176.64 1fi9 h LEU 98 N -1.01 -0.70 -0.79 2.82 5.85 -0.33 0.16 115.31 121.30 1fi9 h LEU 98 Ca -0.08 0.23 0.10 0.00 0.84 0.00 0.00 57.88 58.98 1fi9 h LEU 98 Cb 0.83 0.48 -0.12 0.00 0.37 0.00 0.00 40.66 42.22 1fi9 h LEU 98 CO 0.05 -0.26 -0.47 0.11 -0.34 0.00 0.00 178.44 177.54 1fi9 h LYS 99 N 0.01 -0.11 0.59 1.25 1.57 -0.92 0.22 116.57 119.18 1fi9 h LYS 99 Ca 0.38 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.14 1fi9 h LYS 99 Cb 0.60 0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.94 1fi9 h LYS 99 CO -0.80 -0.08 -0.28 -0.22 -0.57 0.00 0.00 179.45 177.50 1fi9 h LYS 100 N -0.12 -0.77 -0.56 3.15 1.63 -1.14 -3.31 116.57 115.45 1fi9 h LYS 100 Ca 0.21 0.05 0.11 0.00 -0.85 0.00 0.00 60.65 60.17 1fi9 h LYS 100 Cb 0.54 0.17 -0.11 0.00 -0.60 0.00 0.00 32.23 32.23 1fi9 h LYS 100 CO -0.83 -0.51 -0.27 0.00 -3.45 0.00 0.00 179.45 174.40 1fi9 h ALA 101 N -1.31 0.10 -0.91 5.00 0.00 -0.32 0.27 119.26 122.10 1fi9 h ALA 101 Ca -0.08 0.18 0.18 0.00 0.00 0.00 0.00 54.91 55.19 1fi9 h ALA 101 Cb 0.61 0.65 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1fi9 h ALA 101 CO 0.13 -0.59 0.59 1.79 0.00 0.00 0.00 179.25 181.17 1fi9 h THR 102 N -0.12 0.74 -0.02 0.00 1.35 -1.11 -0.29 112.91 113.46 1fi9 h THR 102 Ca 0.25 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.92 1fi9 h THR 102 Cb 0.52 0.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.08 1fi9 h THR 102 CO -0.64 0.10 -0.23 0.59 -0.25 0.00 0.00 175.52 175.10 1fi9 n ASN 103 N -4.56 2.48 0.00 5.36 3.02 0.70 -0.55 115.26 121.71 1fi9 n ASN 103 Ca 0.19 -1.74 0.00 0.00 -0.03 0.00 0.00 54.58 52.99 1fi9 n ASN 103 Cb 0.59 0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.99 1fi9 n ASN 103 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02