#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ffj s LYS 2 N 0.00 3.28 0.30 3.23 2.20 -1.26 -2.05 119.74 125.44 1ffj s LYS 2 Ca 0.00 -0.42 0.03 0.00 -0.36 0.00 0.00 55.97 55.21 1ffj s LYS 2 Cb 0.00 -4.02 -0.01 0.00 -1.51 0.00 0.00 37.83 32.29 1ffj s LYS 2 CO 0.00 -1.24 0.10 0.00 -0.36 0.00 0.00 175.35 173.85 1ffj s LYS 4 N -3.15 3.84 0.11 0.00 -0.14 -1.26 -1.56 119.74 117.58 1ffj s LYS 4 Ca 0.14 0.31 -0.02 0.00 -1.36 0.00 0.00 55.97 55.04 1ffj s LYS 4 Cb 0.01 -2.83 0.03 0.00 -1.68 0.00 0.00 37.83 33.35 1ffj s LYS 4 CO 0.10 0.43 0.16 1.63 -0.76 0.00 0.00 175.35 176.90 1ffj n LYS 5 N 0.42 -0.09 -0.03 1.68 4.76 -1.06 -4.80 118.16 119.04 1ffj n LYS 5 Ca -0.03 -0.25 -0.02 0.00 -2.87 0.00 0.00 58.31 55.14 1ffj n LYS 5 Cb 0.52 -0.16 -0.01 0.00 -1.84 0.00 0.00 35.03 33.54 1ffj n LYS 5 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1ffj h LEU 6 N 0.00 -0.27 -9.60 -0.35 4.07 -1.89 -3.39 115.31 103.89 1ffj h LEU 6 Ca -0.05 0.04 -0.54 0.00 0.08 0.00 0.00 57.88 57.40 1ffj h LEU 6 Cb 0.14 0.11 -0.04 0.00 1.08 0.00 0.00 40.66 41.96 1ffj h LEU 6 CO 0.04 -0.05 0.13 -0.69 -1.08 0.00 0.00 178.44 176.79 1ffj s VAL 7 N -3.35 4.65 -0.49 1.22 1.01 -1.26 -4.41 120.40 117.76 1ffj s VAL 7 Ca -0.02 1.57 -0.06 0.00 0.00 0.00 0.00 61.98 63.47 1ffj s VAL 7 Cb 0.01 -4.08 -0.15 0.00 0.00 0.00 0.00 36.38 32.16 1ffj s VAL 7 CO 0.08 0.43 2.70 -0.81 0.00 0.00 0.00 175.10 177.51 1ffj n PRO 8 N 2.36 2.01 -0.02 2.72 -0.04 -1.26 -3.47 135.00 137.30 1ffj n PRO 8 Ca -0.05 -1.16 -0.03 0.00 -0.04 0.00 0.00 63.50 62.23 1ffj n PRO 8 Cb 0.50 -2.16 -0.03 0.00 -0.04 0.00 0.00 33.50 31.77 1ffj n PRO 8 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1ffj n LEU 9 N 3.14 1.66 -4.14 1.53 4.77 -1.26 -5.07 117.00 117.63 1ffj n LEU 9 Ca 0.43 -0.01 -0.10 0.00 -0.03 0.00 0.00 56.01 56.30 1ffj n LEU 9 Cb 0.49 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.42 1ffj n LEU 9 CO 0.40 0.36 -0.38 -0.36 -1.33 0.00 0.00 177.39 176.08 1ffj s PHE 10 N -2.09 0.76 0.11 -1.77 0.40 -1.23 -5.12 117.98 109.05 1ffj s PHE 10 Ca -0.04 -0.94 0.07 0.00 -0.60 0.00 0.00 56.93 55.41 1ffj s PHE 10 Cb 0.01 -0.47 -0.04 0.00 0.51 0.00 0.00 43.02 43.03 1ffj s PHE 10 CO 0.13 -0.22 -0.09 -1.54 0.70 0.00 0.00 175.22 174.20 1ffj s SER 11 N -2.94 4.45 0.01 1.36 1.04 -1.26 -2.56 113.70 113.80 1ffj s SER 11 Ca 0.09 -0.39 -0.10 0.00 0.48 0.00 0.00 55.95 56.03 1ffj s SER 11 Cb 0.05 -0.86 0.01 0.00 0.10 0.00 0.00 66.02 65.32 1ffj s SER 11 CO -0.06 0.16 0.21 -0.75 0.98 0.00 0.00 173.24 173.78 1ffj s LYS 12 N -2.32 0.60 -0.30 4.02 2.47 -0.60 -4.88 119.74 118.72 1ffj s LYS 12 Ca 0.22 -0.41 -0.14 0.00 -1.56 0.00 0.00 55.97 54.09 1ffj s LYS 12 Cb -0.11 0.25 -0.03 0.00 -1.46 0.00 0.00 37.83 36.49 1ffj s LYS 12 CO 0.15 -0.16 0.32 0.99 0.16 0.00 0.00 175.35 176.80 1ffj s THR 13 N -1.72 5.21 0.27 3.43 2.01 -1.26 -2.43 115.64 121.15 1ffj s THR 13 Ca -0.12 0.24 -0.28 0.00 0.31 0.00 0.00 61.69 61.85 1ffj s THR 13 Cb -0.05 -3.71 -0.15 0.00 0.01 0.00 0.00 72.50 68.60 1ffj s THR 13 CO 0.01 0.07 0.81 0.00 -0.69 0.00 0.00 174.62 174.83 1ffj s PRO 15 N -1.37 1.85 0.47 0.00 0.04 -1.26 -4.43 135.00 130.30 1ffj s PRO 15 Ca 0.61 0.55 -0.21 0.00 0.04 0.00 0.00 61.00 61.99 1ffj s PRO 15 Cb -0.77 -1.90 -0.11 0.00 0.04 0.00 0.00 34.50 31.76 1ffj s PRO 15 CO 0.59 -1.76 0.53 0.00 0.04 0.00 0.00 177.00 176.39 1ffj n ALA 16 N -3.51 -1.38 0.00 8.56 0.00 -1.26 -1.91 120.51 121.00 1ffj n ALA 16 Ca 0.07 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1ffj n ALA 16 Cb 0.57 -1.79 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1ffj n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ffj n GLY 17 N 1.79 2.59 3.36 0.00 0.00 -1.26 -4.92 105.19 106.74 1ffj n GLY 17 Ca 0.11 -0.58 -0.46 0.00 0.00 0.00 0.00 46.02 45.09 1ffj n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ffj s LYS 18 N 0.00 3.25 -0.12 1.61 -0.14 -0.80 -4.59 119.74 118.95 1ffj s LYS 18 Ca 0.00 -1.77 0.15 0.00 -1.36 0.00 0.00 55.97 52.99 1ffj s LYS 18 Cb 0.00 -4.40 0.55 0.00 -1.68 0.00 0.00 37.83 32.30 1ffj s LYS 18 CO 0.00 -1.45 1.46 0.09 -0.76 0.00 0.00 175.35 174.69 1ffj n ASN 19 N 5.48 4.03 -4.09 2.83 4.13 -1.24 -4.27 115.26 122.11 1ffj n ASN 19 Ca -0.00 -2.59 -0.26 0.00 1.68 0.00 0.00 54.58 53.41 1ffj n ASN 19 Cb 0.44 -0.48 -0.16 0.00 -1.54 0.00 0.00 39.78 38.03 1ffj n ASN 19 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1ffj s LEU 20 N -2.08 1.82 -0.10 3.41 1.43 -0.97 -4.48 118.68 117.71 1ffj s LEU 20 Ca 0.41 -0.35 -0.15 0.00 -1.03 0.00 0.00 54.13 53.00 1ffj s LEU 20 Cb 0.29 -0.95 -0.05 0.00 0.03 0.00 0.00 46.19 45.51 1ffj s LEU 20 CO 0.15 0.10 0.39 0.00 0.23 0.00 0.00 176.35 177.22 1ffj s TYR 22 N 0.03 1.42 -0.09 0.00 -0.85 -0.88 -1.93 117.35 115.04 1ffj s TYR 22 Ca 0.22 -0.66 -0.05 0.00 -0.52 0.00 0.00 57.07 56.06 1ffj s TYR 22 Cb -0.15 -0.70 0.04 0.00 0.38 0.00 0.00 41.96 41.53 1ffj s TYR 22 CO 0.09 0.17 0.22 -1.59 -1.52 0.00 0.00 175.55 172.92 1ffj s LYS 23 N -3.49 0.18 -0.12 -3.49 -2.85 -0.87 -2.45 119.74 106.66 1ffj s LYS 23 Ca 0.17 0.47 -0.03 0.00 -1.00 0.00 0.00 55.97 55.58 1ffj s LYS 23 Cb 0.00 -0.12 -0.03 0.00 -2.06 0.00 0.00 37.83 35.61 1ffj s LYS 23 CO 0.03 -0.16 -0.01 -1.64 0.10 0.00 0.00 175.35 173.67 1ffj s MET 24 N 1.17 3.30 -0.02 1.78 -1.94 -0.59 -2.70 119.30 120.32 1ffj s MET 24 Ca -0.09 -0.45 -0.12 0.00 -1.71 0.00 0.00 55.69 53.32 1ffj s MET 24 Cb -0.10 -2.86 0.02 0.00 2.01 0.00 0.00 34.83 33.89 1ffj s MET 24 CO -0.07 0.50 0.26 -0.59 -0.01 0.00 0.00 175.02 175.10 1ffj s PHE 25 N -0.32 -0.13 0.03 -0.03 -0.12 -1.14 -2.36 117.98 113.92 1ffj s PHE 25 Ca 0.06 0.19 -0.20 0.00 -0.05 0.00 0.00 56.93 56.93 1ffj s PHE 25 Cb -0.12 0.06 -0.06 0.00 -0.63 0.00 0.00 43.02 42.26 1ffj s PHE 25 CO 0.02 -0.34 0.59 -1.64 -0.05 0.00 0.00 175.22 173.80 1ffj s MET 26 N -1.22 4.28 0.29 1.99 -1.94 -1.24 -2.65 119.30 118.80 1ffj s MET 26 Ca -0.13 0.75 0.19 0.00 -1.71 0.00 0.00 55.69 54.79 1ffj s MET 26 Cb -0.06 -3.30 1.02 0.00 2.01 0.00 0.00 34.83 34.51 1ffj s MET 26 CO 0.03 0.48 1.57 0.28 -0.01 0.00 0.00 175.02 177.36 1ffj n VAL 27 N 2.32 1.09 -0.27 -6.03 0.31 -1.12 -2.56 118.33 112.06 1ffj n VAL 27 Ca -0.08 0.72 0.24 0.00 -0.01 0.00 0.00 64.34 65.20 1ffj n VAL 27 Cb 0.51 -1.72 0.44 0.00 -0.91 0.00 0.00 33.84 32.16 1ffj n VAL 27 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ffj n ALA 28 N -1.73 0.76 -3.18 3.52 0.00 -1.26 -4.34 120.51 114.28 1ffj n ALA 28 Ca -0.01 0.85 -0.13 0.00 0.00 0.00 0.00 53.44 54.15 1ffj n ALA 28 Cb 0.06 -0.80 -0.10 0.00 0.00 0.00 0.00 19.45 18.61 1ffj n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ffj s ALA 29 N -5.36 -0.62 -1.76 0.00 0.00 -1.06 -5.02 121.76 107.94 1ffj s ALA 29 Ca -0.08 0.26 0.24 0.00 0.00 0.00 0.00 51.96 52.38 1ffj s ALA 29 Cb 0.27 -0.01 1.32 0.00 0.00 0.00 0.00 23.12 24.70 1ffj s ALA 29 CO 0.64 -0.22 1.78 -0.35 0.00 0.00 0.00 175.76 177.61 1ffj n PRO 30 N 1.64 0.57 -2.98 0.00 -0.04 -1.26 -3.55 135.00 129.38 1ffj n PRO 30 Ca -0.20 0.03 -0.14 0.00 -0.04 0.00 0.00 63.50 63.15 1ffj n PRO 30 Cb 0.56 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.55 1ffj n PRO 30 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1ffj n HIS 31 N -1.12 -1.22 -3.00 0.54 -0.00 -1.26 -5.02 115.22 104.14 1ffj n HIS 31 Ca 0.15 -3.04 -0.05 0.00 0.46 0.00 0.00 57.72 55.23 1ffj n HIS 31 Cb 0.12 0.52 -0.01 0.00 -0.12 0.00 0.00 29.99 30.50 1ffj n HIS 31 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1ffj s VAL 32 N -1.18 -0.85 0.64 3.57 1.01 -1.23 -5.15 120.40 117.21 1ffj s VAL 32 Ca 0.32 -0.80 -0.13 0.00 0.00 0.00 0.00 61.98 61.36 1ffj s VAL 32 Cb 0.32 -0.15 -0.02 0.00 0.00 0.00 0.00 36.38 36.54 1ffj s VAL 32 CO -0.07 -0.14 1.05 -2.16 0.00 0.00 0.00 175.10 173.79 1ffj s PRO 33 N 1.17 3.16 -0.25 2.72 0.04 -1.26 -3.73 135.00 136.85 1ffj s PRO 33 Ca 0.25 1.06 -0.08 0.00 0.04 0.00 0.00 61.00 62.27 1ffj s PRO 33 Cb -0.02 -2.02 -0.16 0.00 0.04 0.00 0.00 34.50 32.34 1ffj s PRO 33 CO -0.07 -0.93 -0.17 1.55 0.04 0.00 0.00 177.00 177.43 1ffj n VAL 34 N -2.57 1.54 -3.61 -0.36 3.14 -0.99 -4.86 118.33 110.61 1ffj n VAL 34 Ca 0.08 -0.45 -0.01 0.00 -2.96 0.00 0.00 64.34 60.99 1ffj n VAL 34 Cb 0.53 -1.70 -0.01 0.00 -1.06 0.00 0.00 33.84 31.60 1ffj n VAL 34 CO 0.00 0.00 0.00 -1.59 -6.46 0.00 0.00 176.83 168.78 1ffj s LYS 35 N -2.50 0.37 0.31 1.45 0.00 -1.07 -5.06 119.74 113.22 1ffj s LYS 35 Ca -0.35 -0.18 0.03 0.00 0.00 0.00 0.00 55.97 55.48 1ffj s LYS 35 Cb 0.11 0.14 -0.06 0.00 0.00 0.00 0.00 37.83 38.02 1ffj s LYS 35 CO 0.57 -0.16 0.08 1.03 0.00 0.00 0.00 175.35 176.87 1ffj s ARG 36 N -2.43 1.58 0.00 1.78 0.52 -1.26 -1.54 118.95 117.60 1ffj s ARG 36 Ca 0.12 -1.88 -0.06 0.00 -0.52 0.00 0.00 55.73 53.39 1ffj s ARG 36 Cb 0.02 -0.62 0.02 0.00 0.52 0.00 0.00 34.95 34.89 1ffj s ARG 36 CO -0.04 -0.25 0.28 0.41 0.02 0.00 0.00 175.30 175.72 1ffj n GLY 37 N -0.62 0.62 3.35 -3.53 0.00 -1.02 -4.34 105.19 99.65 1ffj n GLY 37 Ca -0.02 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.81 1ffj n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffj s ILE 39 N -0.84 0.00 -0.07 0.00 1.10 -0.61 -4.92 121.20 115.85 1ffj s ILE 39 Ca 0.12 -1.52 0.02 0.00 -0.51 0.00 0.00 60.65 58.76 1ffj s ILE 39 Cb -0.10 -2.68 -0.06 0.00 0.15 0.00 0.00 42.46 39.77 1ffj s ILE 39 CO 0.03 0.00 -0.04 -0.90 -2.11 0.00 0.00 174.94 171.92 1ffj n ASP 40 N -1.45 3.45 -4.45 4.50 5.75 -1.26 -2.29 116.55 120.78 1ffj n ASP 40 Ca -0.00 -0.03 -0.33 0.00 -0.01 0.00 0.00 54.79 54.42 1ffj n ASP 40 Cb 0.61 0.14 -0.13 0.00 -1.03 0.00 0.00 41.12 40.71 1ffj n ASP 40 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1ffj s VAL 41 N -2.15 2.97 -0.23 2.12 0.11 -1.26 -4.80 120.40 117.15 1ffj s VAL 41 Ca -0.08 -0.76 -0.23 0.00 -2.93 0.00 0.00 61.98 57.98 1ffj s VAL 41 Cb 0.02 -2.16 -0.01 0.00 -1.53 0.00 0.00 36.38 32.71 1ffj s VAL 41 CO 0.20 0.59 0.77 0.00 -3.33 0.00 0.00 175.10 173.33 1ffj s PRO 43 N 2.60 2.48 0.51 0.00 0.04 -1.26 -5.01 135.00 134.37 1ffj s PRO 43 Ca 0.33 0.77 -0.21 0.00 0.04 0.00 0.00 61.00 61.93 1ffj s PRO 43 Cb -0.16 -1.95 -0.06 0.00 0.04 0.00 0.00 34.50 32.37 1ffj s PRO 43 CO 0.08 -1.38 1.22 0.21 0.04 0.00 0.00 177.00 177.17 1ffj s LYS 44 N -5.11 3.42 -0.07 4.56 2.20 -1.26 -4.90 119.74 118.58 1ffj s LYS 44 Ca 0.59 1.88 -0.12 0.00 -0.36 0.00 0.00 55.97 57.96 1ffj s LYS 44 Cb -0.14 -2.24 -0.05 0.00 -1.51 0.00 0.00 37.83 33.89 1ffj s LYS 44 CO 0.55 -0.86 0.30 -1.12 -0.36 0.00 0.00 175.35 173.86 1ffj s SER 45 N -1.35 6.60 0.46 1.43 0.01 -1.26 -4.82 113.70 114.77 1ffj s SER 45 Ca 0.69 0.71 0.06 0.00 1.31 0.00 0.00 55.95 58.73 1ffj s SER 45 Cb -0.31 -2.18 -0.02 0.00 0.21 0.00 0.00 66.02 63.72 1ffj s SER 45 CO 0.37 0.29 0.26 -0.94 0.41 0.00 0.00 173.24 173.63 1ffj s SER 46 N -0.68 4.56 0.02 2.44 1.04 -0.65 -5.03 113.70 115.39 1ffj s SER 46 Ca 0.20 -1.13 -0.20 0.00 0.48 0.00 0.00 55.95 55.29 1ffj s SER 46 Cb -0.14 -0.13 -0.19 0.00 0.10 0.00 0.00 66.02 65.66 1ffj s SER 46 CO 0.08 -0.76 1.21 -0.07 0.98 0.00 0.00 173.24 174.68 1ffj h LEU 47 N 1.15 0.46 0.36 2.42 3.38 -2.03 -3.34 115.31 117.72 1ffj h LEU 47 Ca -0.41 -0.64 -0.02 0.00 0.09 0.00 0.00 57.88 56.91 1ffj h LEU 47 Cb 1.28 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 1ffj h LEU 47 CO 0.65 1.03 -0.21 0.25 0.09 0.00 0.00 178.44 180.24 1ffj h LEU 48 N -0.07 -0.52 -9.41 1.67 5.85 -2.00 -3.44 115.31 107.40 1ffj h LEU 48 Ca -0.02 0.03 -0.60 0.00 0.84 0.00 0.00 57.88 58.13 1ffj h LEU 48 Cb 1.01 0.15 -0.12 0.00 0.37 0.00 0.00 40.66 42.06 1ffj h LEU 48 CO 0.08 -0.33 -0.69 -0.69 -0.34 0.00 0.00 178.44 176.47 1ffj s VAL 49 N -4.23 3.27 0.06 1.05 1.01 -1.25 -2.79 120.40 117.52 1ffj s VAL 49 Ca -0.08 -1.78 0.03 0.00 0.00 0.00 0.00 61.98 60.15 1ffj s VAL 49 Cb 0.01 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 1ffj s VAL 49 CO 0.25 -0.22 -0.09 -0.54 0.00 0.00 0.00 175.10 174.50 1ffj s LYS 50 N -3.18 0.67 0.06 2.72 1.02 -1.09 -1.64 119.74 118.30 1ffj s LYS 50 Ca 0.28 -0.93 0.05 0.00 0.02 0.00 0.00 55.97 55.39 1ffj s LYS 50 Cb -0.08 -0.41 -0.03 0.00 -0.52 0.00 0.00 37.83 36.79 1ffj s LYS 50 CO 0.17 0.07 -0.14 0.71 -0.92 0.00 0.00 175.35 175.24 1ffj s TYR 51 N -1.82 1.21 -0.05 3.18 2.02 -1.26 -2.87 117.35 117.76 1ffj s TYR 51 Ca -0.03 -0.42 0.01 0.00 -0.37 0.00 0.00 57.07 56.26 1ffj s TYR 51 Cb -0.07 -0.69 0.02 0.00 -0.40 0.00 0.00 41.96 40.82 1ffj s TYR 51 CO 0.00 0.05 -0.06 0.08 -1.57 0.00 0.00 175.55 174.05 1ffj s VAL 52 N -1.12 0.63 0.28 0.71 1.01 -1.10 -4.90 120.40 115.92 1ffj s VAL 52 Ca -0.01 -0.18 0.12 0.00 0.00 0.00 0.00 61.98 61.91 1ffj s VAL 52 Cb -0.09 -0.64 -0.05 0.00 0.00 0.00 0.00 36.38 35.60 1ffj s VAL 52 CO 0.02 0.25 -0.19 0.00 0.00 0.00 0.00 175.10 175.18 1ffj n ASN 55 N -0.41 3.11 -3.96 0.00 0.23 -1.26 -1.78 115.26 111.19 1ffj n ASN 55 Ca -0.07 -3.42 -0.09 0.00 -0.53 0.00 0.00 54.58 50.47 1ffj n ASN 55 Cb 0.61 -0.59 -0.11 0.00 -2.08 0.00 0.00 39.78 37.62 1ffj n ASN 55 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 1ffj s THR 56 N -3.59 0.11 -0.04 5.53 -4.23 -1.26 -5.07 115.64 107.09 1ffj s THR 56 Ca 0.45 -0.89 -0.30 0.00 -1.18 0.00 0.00 61.69 59.77 1ffj s THR 56 Cb 0.29 -0.33 -0.06 0.00 1.34 0.00 0.00 72.50 73.74 1ffj s THR 56 CO -0.11 -0.49 1.74 -1.81 -0.54 0.00 0.00 174.62 173.41 1ffj s ASP 57 N -1.49 6.58 -0.80 3.99 1.01 -1.26 -2.41 116.67 122.29 1ffj s ASP 57 Ca -0.15 2.32 -0.01 0.00 0.71 0.00 0.00 52.55 55.42 1ffj s ASP 57 Cb -0.09 -2.53 -0.01 0.00 1.01 0.00 0.00 42.92 41.29 1ffj s ASP 57 CO -0.01 -0.99 0.68 1.17 0.21 0.00 0.00 175.17 176.23 1ffj n LYS 58 N 7.28 -3.75 -0.10 8.23 4.81 -0.78 -4.96 118.16 128.88 1ffj n LYS 58 Ca 0.18 0.59 -0.24 0.00 -0.87 0.00 0.00 58.31 57.98 1ffj n LYS 58 Cb 0.42 -4.74 -0.12 0.00 0.02 0.00 0.00 35.03 30.62 1ffj n LYS 58 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57