#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 -0.02 0.20 3.23 2.20 -1.26 -2.23 119.74 121.86 1ffj s LYS 2 Ca 0.00 0.24 0.02 0.00 -0.36 0.00 0.00 55.97 55.88 1ffj s LYS 2 Cb 0.00 -0.27 -0.01 0.00 -1.51 0.00 0.00 37.83 36.05 1ffj s LYS 2 CO 0.00 -0.19 0.09 0.00 -0.36 0.00 0.00 175.35 174.89 1ffj s LYS 4 N -2.78 3.89 0.07 0.00 -0.14 -1.26 -1.69 119.74 117.82 1ffj s LYS 4 Ca 0.12 0.36 -0.01 0.00 -1.36 0.00 0.00 55.97 55.08 1ffj s LYS 4 Cb 0.01 -3.00 0.02 0.00 -1.68 0.00 0.00 37.83 33.17 1ffj s LYS 4 CO 0.09 0.54 0.08 1.63 -0.76 0.00 0.00 175.35 176.93 1ffj n LYS 5 N 0.99 -0.42 -0.01 1.68 4.76 -1.01 -4.55 118.16 119.60 1ffj n LYS 5 Ca -0.08 -0.13 -0.01 0.00 -2.87 0.00 0.00 58.31 55.23 1ffj n LYS 5 Cb 0.52 -0.10 -0.01 0.00 -1.84 0.00 0.00 35.03 33.61 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 -0.12 -9.67 -0.35 4.07 -1.88 -3.40 115.31 103.96 1ffj h LEU 6 Ca -0.03 0.02 -0.53 0.00 0.08 0.00 0.00 57.88 57.42 1ffj h LEU 6 Cb 0.08 0.05 -0.03 0.00 1.08 0.00 0.00 40.66 41.84 1ffj h LEU 6 CO 0.02 -0.03 0.20 -0.69 -1.08 0.00 0.00 178.44 176.86 1ffj s VAL 7 N -3.18 4.45 -0.45 1.22 1.01 -1.26 -4.21 120.40 117.98 1ffj s VAL 7 Ca -0.01 1.74 -0.06 0.00 0.00 0.00 0.00 61.98 63.66 1ffj s VAL 7 Cb 0.01 -4.16 -0.15 0.00 0.00 0.00 0.00 36.38 32.07 1ffj s VAL 7 CO 0.04 0.47 2.71 -0.81 0.00 0.00 0.00 175.10 177.51 1ffj n PRO 8 N 1.99 1.98 -0.02 2.72 -0.04 -1.26 -3.44 135.00 136.92 1ffj n PRO 8 Ca -0.04 -1.13 -0.02 0.00 -0.04 0.00 0.00 63.50 62.27 1ffj n PRO 8 Cb 0.49 -2.14 -0.02 0.00 -0.04 0.00 0.00 33.50 31.79 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 3.11 1.64 -4.16 1.53 4.77 -1.26 -5.07 117.00 117.54 1ffj n LEU 9 Ca 0.42 -0.01 -0.10 0.00 -0.03 0.00 0.00 56.01 56.29 1ffj n LEU 9 Cb 0.50 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 1ffj n LEU 9 CO 0.38 0.35 -0.33 -0.36 -1.33 0.00 0.00 177.39 176.10 1ffj s PHE 10 N -2.08 0.89 0.24 -1.77 0.08 -1.22 -5.12 117.98 109.00 1ffj s PHE 10 Ca -0.04 -1.11 0.11 0.00 0.12 0.00 0.00 56.93 56.01 1ffj s PHE 10 Cb 0.01 -0.52 -0.05 0.00 -0.57 0.00 0.00 43.02 41.89 1ffj s PHE 10 CO 0.11 -0.37 -0.19 -1.54 -0.10 0.00 0.00 175.22 173.13 1ffj s SER 11 N -3.06 3.28 0.13 1.36 1.04 -1.26 -2.40 113.70 112.80 1ffj s SER 11 Ca 0.19 -0.99 -0.10 0.00 0.48 0.00 0.00 55.95 55.54 1ffj s SER 11 Cb 0.07 -0.25 -0.00 0.00 0.10 0.00 0.00 66.02 65.94 1ffj s SER 11 CO -0.01 0.00 0.27 -0.54 0.98 0.00 0.00 173.24 173.94 1ffj s LYS 12 N -3.34 1.04 0.03 4.02 1.02 -0.68 -4.87 119.74 116.96 1ffj s LYS 12 Ca 0.26 -1.04 -0.03 0.00 0.02 0.00 0.00 55.97 55.17 1ffj s LYS 12 Cb -0.05 0.38 -0.04 0.00 -0.52 0.00 0.00 37.83 37.60 1ffj s LYS 12 CO 0.12 -0.37 0.23 0.99 -0.92 0.00 0.00 175.35 175.40 1ffj s THR 13 N -3.91 5.36 -0.15 2.17 2.01 -1.26 -1.58 115.64 118.27 1ffj s THR 13 Ca 0.11 -0.11 -0.13 0.00 0.31 0.00 0.00 61.69 61.88 1ffj s THR 13 Cb 0.04 -3.58 -0.05 0.00 0.01 0.00 0.00 72.50 68.92 1ffj s THR 13 CO -0.05 0.26 0.26 0.00 -0.69 0.00 0.00 174.62 174.40 1ffj s PRO 15 N 0.22 1.19 1.00 0.00 0.04 -1.26 -4.90 135.00 131.28 1ffj s PRO 15 Ca 0.16 0.31 -0.19 0.00 0.04 0.00 0.00 61.00 61.32 1ffj s PRO 15 Cb -0.13 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.47 1ffj s PRO 15 CO 0.04 -2.17 -0.69 0.00 0.04 0.00 0.00 177.00 174.22 1ffj n ALA 16 N -3.75 -4.93 0.00 8.56 0.00 -1.26 -2.17 120.51 116.96 1ffj n ALA 16 Ca 0.07 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.60 1ffj n ALA 16 Cb 0.59 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.83 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 2.99 1.63 3.41 0.00 0.00 -1.26 -4.84 105.19 107.12 1ffj n GLY 17 Ca -0.00 -0.12 -0.45 0.00 0.00 0.00 0.00 46.02 45.45 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 3.66 -0.08 1.61 -0.14 -0.92 -4.41 119.74 119.46 1ffj s LYS 18 Ca 0.00 -2.08 0.15 0.00 -1.36 0.00 0.00 55.97 52.68 1ffj s LYS 18 Cb 0.00 -4.78 0.53 0.00 -1.68 0.00 0.00 37.83 31.90 1ffj s LYS 18 CO 0.00 -1.62 1.45 0.09 -0.76 0.00 0.00 175.35 174.51 1ffj n ASN 19 N 5.60 3.88 -3.84 2.83 3.02 -1.22 -4.58 115.26 120.94 1ffj n ASN 19 Ca 0.22 -2.41 -0.17 0.00 -0.03 0.00 0.00 54.58 52.19 1ffj n ASN 19 Cb 0.48 -0.45 -0.16 0.00 -0.61 0.00 0.00 39.78 39.04 1ffj n ASN 19 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ffj s LEU 20 N -1.76 1.32 -0.06 3.41 1.43 -1.00 -4.75 118.68 117.28 1ffj s LEU 20 Ca 0.39 -0.04 -0.15 0.00 -1.03 0.00 0.00 54.13 53.31 1ffj s LEU 20 Cb 0.26 -0.22 -0.05 0.00 0.03 0.00 0.00 46.19 46.21 1ffj s LEU 20 CO 0.18 -0.07 0.39 0.00 0.23 0.00 0.00 176.35 177.08 1ffj s TYR 22 N -0.45 2.67 -0.07 0.00 -0.85 -0.60 -2.30 117.35 115.75 1ffj s TYR 22 Ca 0.23 -0.19 -0.01 0.00 -0.52 0.00 0.00 57.07 56.57 1ffj s TYR 22 Cb -0.16 -1.40 0.03 0.00 0.38 0.00 0.00 41.96 40.81 1ffj s TYR 22 CO 0.11 0.41 0.01 0.21 -1.52 0.00 0.00 175.55 174.77 1ffj s LYS 23 N -2.19 0.54 -0.23 -3.49 2.20 -0.89 -2.39 119.74 113.29 1ffj s LYS 23 Ca 0.20 0.12 -0.08 0.00 -0.36 0.00 0.00 55.97 55.84 1ffj s LYS 23 Cb -0.11 -0.97 -0.04 0.00 -1.51 0.00 0.00 37.83 35.20 1ffj s LYS 23 CO 0.12 -0.32 0.10 -1.64 -0.36 0.00 0.00 175.35 173.25 1ffj s MET 24 N 1.99 3.89 0.02 4.03 -1.94 -0.58 -2.69 119.30 124.02 1ffj s MET 24 Ca 0.05 -0.37 0.01 0.00 -1.71 0.00 0.00 55.69 53.66 1ffj s MET 24 Cb -0.12 -3.37 -0.02 0.00 2.01 0.00 0.00 34.83 33.33 1ffj s MET 24 CO -0.05 0.02 -0.04 -0.59 -0.01 0.00 0.00 175.02 174.35 1ffj s PHE 25 N 1.09 0.33 0.16 -0.03 -0.12 -1.18 -1.97 117.98 116.25 1ffj s PHE 25 Ca 0.05 -0.44 -0.09 0.00 -0.05 0.00 0.00 56.93 56.40 1ffj s PHE 25 Cb -0.14 -0.22 -0.06 0.00 -0.63 0.00 0.00 43.02 41.97 1ffj s PHE 25 CO 0.04 -0.14 0.47 -1.64 -0.05 0.00 0.00 175.22 173.90 1ffj s MET 26 N -1.25 3.78 0.28 1.99 -1.94 -1.25 -2.98 119.30 117.92 1ffj s MET 26 Ca -0.12 0.20 0.19 0.00 -1.71 0.00 0.00 55.69 54.25 1ffj s MET 26 Cb -0.08 -2.82 1.01 0.00 2.01 0.00 0.00 34.83 34.94 1ffj s MET 26 CO -0.01 0.44 1.57 1.55 -0.01 0.00 0.00 175.02 178.56 1ffj n VAL 27 N 0.32 1.17 -0.28 -6.03 3.14 -1.01 -2.58 118.33 113.06 1ffj n VAL 27 Ca -0.03 0.71 0.26 0.00 -2.96 0.00 0.00 64.34 62.31 1ffj n VAL 27 Cb 0.52 -1.71 0.48 0.00 -1.06 0.00 0.00 33.84 32.07 1ffj n VAL 27 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ffj n ALA 28 N -1.74 0.84 -3.19 1.55 0.00 -1.26 -4.44 120.51 112.27 1ffj n ALA 28 Ca -0.01 0.89 -0.13 0.00 0.00 0.00 0.00 53.44 54.19 1ffj n ALA 28 Cb 0.03 -0.86 -0.07 0.00 0.00 0.00 0.00 19.45 18.55 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 -5.39 -0.97 -0.19 0.00 0.00 -1.06 -5.03 121.76 109.11 1ffj s ALA 29 Ca -0.08 0.35 0.28 0.00 0.00 0.00 0.00 51.96 52.51 1ffj s ALA 29 Cb 0.29 0.25 0.87 0.00 0.00 0.00 0.00 23.12 24.53 1ffj s ALA 29 CO 0.68 -0.40 1.80 -1.00 0.00 0.00 0.00 175.76 176.84 1ffj h PRO 30 N 3.24 0.00 -2.07 0.00 0.13 -1.84 -3.31 132.00 128.15 1ffj h PRO 30 Ca -0.31 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.32 1ffj h PRO 30 Cb 1.19 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.92 1ffj h PRO 30 CO 0.43 0.00 -1.06 1.58 -0.23 0.00 0.00 178.00 178.71 1ffj n HIS 31 N -3.04 1.11 -3.31 1.56 -0.00 -1.26 -4.98 115.22 105.30 1ffj n HIS 31 Ca 0.02 -3.86 -0.11 0.00 0.46 0.00 0.00 57.72 54.23 1ffj n HIS 31 Cb 0.41 -0.44 -0.06 0.00 -0.12 0.00 0.00 29.99 29.79 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 -2.89 -0.54 0.73 3.57 1.01 -1.25 -5.15 120.40 115.88 1ffj s VAL 32 Ca 0.42 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.61 1ffj s VAL 32 Cb 0.33 -0.49 0.03 0.00 0.00 0.00 0.00 36.38 36.25 1ffj s VAL 32 CO -0.09 -0.40 1.07 -2.16 0.00 0.00 0.00 175.10 173.52 1ffj s PRO 33 N 1.59 2.68 -0.12 2.72 0.04 -1.26 -3.86 135.00 136.79 1ffj s PRO 33 Ca 0.16 0.86 0.01 0.00 0.04 0.00 0.00 61.00 62.08 1ffj s PRO 33 Cb -0.12 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.38 1ffj s PRO 33 CO -0.05 -1.26 -0.10 1.55 0.04 0.00 0.00 177.00 177.18 1ffj n VAL 34 N -3.22 0.68 -3.60 -0.36 3.14 -0.83 -4.88 118.33 109.26 1ffj n VAL 34 Ca 0.07 -0.26 -0.05 0.00 -2.96 0.00 0.00 64.34 61.14 1ffj n VAL 34 Cb 0.54 -0.92 -0.03 0.00 -1.06 0.00 0.00 33.84 32.38 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 -2.24 0.32 0.26 1.45 0.00 -1.06 -5.00 119.74 113.47 1ffj s LYS 35 Ca -0.16 -0.07 0.03 0.00 0.00 0.00 0.00 55.97 55.77 1ffj s LYS 35 Cb 0.04 0.15 -0.04 0.00 0.00 0.00 0.00 37.83 37.98 1ffj s LYS 35 CO 0.28 -0.13 0.20 1.03 0.00 0.00 0.00 175.35 176.72 1ffj s ARG 36 N -2.07 1.46 -0.02 1.78 0.52 -1.26 -1.52 118.95 117.84 1ffj s ARG 36 Ca 0.08 -1.81 -0.07 0.00 -0.52 0.00 0.00 55.73 53.40 1ffj s ARG 36 Cb -0.01 0.28 0.02 0.00 0.52 0.00 0.00 34.95 35.77 1ffj s ARG 36 CO -0.05 -0.51 0.33 0.41 0.02 0.00 0.00 175.30 175.51 1ffj n GLY 37 N -0.44 0.34 3.76 -3.53 0.00 -1.01 -3.81 105.19 100.50 1ffj n GLY 37 Ca 0.04 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 1ffj n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffj n ILE 39 N 0.43 0.00 -0.05 0.00 0.13 -0.52 -4.86 119.36 114.48 1ffj n ILE 39 Ca -0.09 -0.76 -0.10 0.00 -1.10 0.00 0.00 62.75 60.70 1ffj n ILE 39 Cb 0.52 0.80 -0.04 0.00 -0.84 0.00 0.00 39.64 40.08 1ffj n ILE 39 CO 0.00 0.00 0.00 -0.90 2.80 0.00 0.00 176.55 178.45 1ffj n ASP 40 N -1.39 1.50 -4.64 9.51 5.68 -1.26 -2.37 116.55 123.58 1ffj n ASP 40 Ca -0.06 0.08 -0.25 0.00 -0.50 0.00 0.00 54.79 54.05 1ffj n ASP 40 Cb 0.51 -0.27 -0.08 0.00 -1.14 0.00 0.00 41.12 40.14 1ffj n ASP 40 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1ffj s VAL 41 N -2.20 3.52 -0.15 2.12 0.11 -1.26 -4.67 120.40 117.87 1ffj s VAL 41 Ca -0.15 -1.63 -0.09 0.00 -2.93 0.00 0.00 61.98 57.19 1ffj s VAL 41 Cb 0.05 -2.80 -0.04 0.00 -1.53 0.00 0.00 36.38 32.06 1ffj s VAL 41 CO 0.21 -0.19 0.15 0.00 -3.33 0.00 0.00 175.10 171.94 1ffj s PRO 43 N -0.46 2.38 0.33 0.00 0.04 -1.26 -4.98 135.00 131.04 1ffj s PRO 43 Ca 0.13 0.75 -0.29 0.00 0.04 0.00 0.00 61.00 61.63 1ffj s PRO 43 Cb -0.12 -1.94 -0.11 0.00 0.04 0.00 0.00 34.50 32.37 1ffj s PRO 43 CO 0.02 -1.44 1.45 0.21 0.04 0.00 0.00 177.00 177.29 1ffj s LYS 44 N -5.12 4.20 0.13 4.56 2.20 -1.26 -4.87 119.74 119.59 1ffj s LYS 44 Ca 0.60 2.44 -0.17 0.00 -0.36 0.00 0.00 55.97 58.48 1ffj s LYS 44 Cb -0.14 -3.03 -0.07 0.00 -1.51 0.00 0.00 37.83 33.08 1ffj s LYS 44 CO 0.54 -0.45 0.58 -1.12 -0.36 0.00 0.00 175.35 174.55 1ffj s SER 45 N -0.02 6.94 0.08 1.43 0.01 -1.26 -4.86 113.70 116.02 1ffj s SER 45 Ca 0.55 1.20 0.00 0.00 1.31 0.00 0.00 55.95 59.01 1ffj s SER 45 Cb -0.44 -2.33 0.00 0.00 0.21 0.00 0.00 66.02 63.45 1ffj s SER 45 CO 0.54 0.15 0.01 -1.54 0.41 0.00 0.00 173.24 172.81 1ffj n SER 46 N 1.10 2.09 -0.06 2.44 3.41 -0.69 -5.04 113.62 116.86 1ffj n SER 46 Ca -0.07 -1.32 -0.20 0.00 -0.26 0.00 0.00 58.87 57.02 1ffj n SER 46 Cb 0.51 0.04 -0.13 0.00 -0.26 0.00 0.00 64.21 64.38 1ffj n SER 46 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1ffj h LEU 47 N 0.00 0.15 0.45 1.04 3.38 -2.02 -3.40 115.31 114.90 1ffj h LEU 47 Ca -0.06 -0.73 -0.02 0.00 0.09 0.00 0.00 57.88 57.16 1ffj h LEU 47 Cb 0.19 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1ffj h LEU 47 CO 0.10 1.47 -0.22 0.25 0.09 0.00 0.00 178.44 180.14 1ffj h LEU 48 N -0.71 -0.51 -9.38 1.67 5.85 -2.00 -3.45 115.31 106.79 1ffj h LEU 48 Ca -0.28 0.02 -0.66 0.00 0.84 0.00 0.00 57.88 57.80 1ffj h LEU 48 Cb 1.45 0.13 -0.14 0.00 0.37 0.00 0.00 40.66 42.47 1ffj h LEU 48 CO -0.07 -0.32 -0.68 -0.69 -0.34 0.00 0.00 178.44 176.33 1ffj s VAL 49 N -4.04 3.84 0.10 1.05 1.01 -1.26 -2.41 120.40 118.69 1ffj s VAL 49 Ca -0.09 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.93 1ffj s VAL 49 Cb 0.01 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1ffj s VAL 49 CO 0.26 0.18 -0.06 -0.75 0.00 0.00 0.00 175.10 174.74 1ffj s LYS 50 N -2.09 0.85 0.09 2.72 2.20 -1.16 -1.71 119.74 120.64 1ffj s LYS 50 Ca 0.23 -1.35 0.04 0.00 -0.36 0.00 0.00 55.97 54.53 1ffj s LYS 50 Cb -0.11 -0.19 -0.03 0.00 -1.51 0.00 0.00 37.83 35.98 1ffj s LYS 50 CO 0.15 -0.03 -0.11 0.71 -0.36 0.00 0.00 175.35 175.71 1ffj s TYR 51 N -3.64 1.05 -0.03 4.03 2.02 -1.26 -3.11 117.35 116.41 1ffj s TYR 51 Ca 0.13 -0.61 0.00 0.00 -0.37 0.00 0.00 57.07 56.22 1ffj s TYR 51 Cb 0.05 -0.58 0.02 0.00 -0.40 0.00 0.00 41.96 41.06 1ffj s TYR 51 CO -0.04 0.00 0.00 0.08 -1.57 0.00 0.00 175.55 174.02 1ffj s VAL 52 N -2.16 0.16 0.14 0.71 1.01 -1.10 -4.95 120.40 114.22 1ffj s VAL 52 Ca 0.03 0.08 0.07 0.00 0.00 0.00 0.00 61.98 62.16 1ffj s VAL 52 Cb -0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 1ffj s VAL 52 CO 0.00 0.13 -0.06 0.00 0.00 0.00 0.00 175.10 175.17 1ffj n ASN 55 N 0.83 5.30 -3.89 0.00 6.94 -1.26 -1.82 115.26 121.36 1ffj n ASN 55 Ca -0.18 -3.53 -0.10 0.00 -0.02 0.00 0.00 54.58 50.75 1ffj n ASN 55 Cb 0.57 -0.90 -0.09 0.00 -2.36 0.00 0.00 39.78 37.00 1ffj n ASN 55 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1ffj s THR 56 N -3.30 0.12 0.03 5.53 -4.23 -1.26 -5.07 115.64 107.46 1ffj s THR 56 Ca 0.39 -0.97 -0.30 0.00 -1.18 0.00 0.00 61.69 59.63 1ffj s THR 56 Cb 0.15 -0.85 -0.07 0.00 1.34 0.00 0.00 72.50 73.07 1ffj s THR 56 CO -0.02 -0.53 1.63 -1.81 -0.54 0.00 0.00 174.62 173.34 1ffj s ASP 57 N -2.02 6.65 -1.15 3.99 1.01 -1.26 -2.61 116.67 121.27 1ffj s ASP 57 Ca -0.06 2.39 -0.03 0.00 0.71 0.00 0.00 52.55 55.55 1ffj s ASP 57 Cb -0.02 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 1ffj s ASP 57 CO -0.04 -0.87 0.94 0.29 0.21 0.00 0.00 175.17 175.70 1ffj n LYS 58 N 5.94 -4.68 -0.08 8.23 5.02 -0.89 -4.94 118.16 126.75 1ffj n LYS 58 Ca 0.16 0.82 -0.23 0.00 -2.02 0.00 0.00 58.31 57.05 1ffj n LYS 58 Cb 0.41 -5.74 -0.12 0.00 -0.02 0.00 0.00 35.03 29.56 1ffj n LYS 58 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88