#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 3.48 0.17 3.23 2.20 -1.26 -2.35 119.74 125.21 1ffj s LYS 2 Ca 0.00 0.06 0.01 0.00 -0.36 0.00 0.00 55.97 55.68 1ffj s LYS 2 Cb 0.00 -3.94 -0.01 0.00 -1.51 0.00 0.00 37.83 32.38 1ffj s LYS 2 CO 0.00 -1.21 0.05 0.00 -0.36 0.00 0.00 175.35 173.83 1ffj s LYS 4 N -2.63 3.62 0.07 0.00 -0.14 -1.26 -1.63 119.74 117.77 1ffj s LYS 4 Ca 0.07 -0.04 -0.00 0.00 -1.36 0.00 0.00 55.97 54.63 1ffj s LYS 4 Cb 0.00 -2.68 0.01 0.00 -1.68 0.00 0.00 37.83 33.49 1ffj s LYS 4 CO 0.05 0.25 0.09 1.63 -0.76 0.00 0.00 175.35 176.61 1ffj n LYS 5 N -0.86 0.36 -0.07 1.68 5.02 -1.05 -4.72 118.16 118.51 1ffj n LYS 5 Ca -0.02 -0.21 -0.03 0.00 -2.02 0.00 0.00 58.31 56.02 1ffj n LYS 5 Cb 0.54 -0.07 -0.02 0.00 -0.02 0.00 0.00 35.03 35.45 1ffj n LYS 5 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1ffj h LEU 6 N 0.00 -0.50 -9.67 -0.35 4.07 -1.89 -3.39 115.31 103.58 1ffj h LEU 6 Ca -0.03 0.07 -0.57 0.00 0.08 0.00 0.00 57.88 57.43 1ffj h LEU 6 Cb 0.10 0.21 -0.04 0.00 1.08 0.00 0.00 40.66 42.01 1ffj h LEU 6 CO 0.03 -0.08 -0.01 -0.69 -1.08 0.00 0.00 178.44 176.61 1ffj s VAL 7 N -3.63 4.74 -0.44 1.22 1.01 -1.26 -4.44 120.40 117.61 1ffj s VAL 7 Ca -0.03 1.27 -0.06 0.00 0.00 0.00 0.00 61.98 63.16 1ffj s VAL 7 Cb 0.02 -3.93 -0.15 0.00 0.00 0.00 0.00 36.38 32.32 1ffj s VAL 7 CO 0.15 0.52 2.72 -0.81 0.00 0.00 0.00 175.10 177.69 1ffj n PRO 8 N 1.92 1.96 -0.02 2.72 -0.04 -1.26 -3.42 135.00 136.86 1ffj n PRO 8 Ca -0.09 -1.12 -0.02 0.00 -0.04 0.00 0.00 63.50 62.23 1ffj n PRO 8 Cb 0.51 -2.13 -0.02 0.00 -0.04 0.00 0.00 33.50 31.81 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 3.09 1.62 -4.26 1.53 4.77 -1.26 -5.07 117.00 117.42 1ffj n LEU 9 Ca 0.42 -0.01 -0.14 0.00 -0.03 0.00 0.00 56.01 56.25 1ffj n LEU 9 Cb 0.51 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.46 1ffj n LEU 9 CO 0.37 0.34 -0.34 -0.36 -1.33 0.00 0.00 177.39 176.07 1ffj s PHE 10 N -2.07 1.29 0.22 -1.77 0.40 -1.22 -5.11 117.98 109.71 1ffj s PHE 10 Ca -0.03 -0.96 0.10 0.00 -0.60 0.00 0.00 56.93 55.44 1ffj s PHE 10 Cb 0.01 -0.73 -0.05 0.00 0.51 0.00 0.00 43.02 42.76 1ffj s PHE 10 CO 0.10 -0.13 -0.19 -1.54 0.70 0.00 0.00 175.22 174.15 1ffj s SER 11 N -3.20 3.13 0.30 1.36 1.04 -1.26 -2.54 113.70 112.53 1ffj s SER 11 Ca 0.24 -0.95 -0.07 0.00 0.48 0.00 0.00 55.95 55.64 1ffj s SER 11 Cb 0.06 -0.22 0.00 0.00 0.10 0.00 0.00 66.02 65.95 1ffj s SER 11 CO 0.04 -0.00 0.48 -0.75 0.98 0.00 0.00 173.24 173.99 1ffj s LYS 12 N -3.18 1.76 -0.14 4.02 2.20 -0.64 -4.89 119.74 118.87 1ffj s LYS 12 Ca 0.23 -1.53 0.02 0.00 -0.36 0.00 0.00 55.97 54.32 1ffj s LYS 12 Cb -0.05 0.46 0.01 0.00 -1.51 0.00 0.00 37.83 36.74 1ffj s LYS 12 CO 0.10 -0.73 -0.19 0.99 -0.36 0.00 0.00 175.35 175.16 1ffj s THR 13 N -3.42 1.88 0.01 3.43 2.01 -1.26 -1.48 115.64 116.81 1ffj s THR 13 Ca 0.27 -0.86 -0.32 0.00 0.31 0.00 0.00 61.69 61.09 1ffj s THR 13 Cb -0.00 -1.69 -0.11 0.00 0.01 0.00 0.00 72.50 70.71 1ffj s THR 13 CO 0.15 0.51 1.89 0.00 -0.69 0.00 0.00 174.62 176.48 1ffj s PRO 15 N 3.79 0.47 0.75 0.00 0.04 -1.25 -4.36 135.00 134.44 1ffj s PRO 15 Ca 0.89 0.04 -0.17 0.00 0.04 0.00 0.00 61.00 61.79 1ffj s PRO 15 Cb -0.56 -1.78 -0.15 0.00 0.04 0.00 0.00 34.50 32.05 1ffj s PRO 15 CO 0.45 -2.61 -0.45 0.00 0.04 0.00 0.00 177.00 174.43 1ffj n ALA 16 N -4.00 -4.26 0.00 8.56 0.00 -1.26 -1.90 120.51 117.65 1ffj n ALA 16 Ca 0.10 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1ffj n ALA 16 Cb 0.59 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.76 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 2.98 1.97 3.25 0.00 0.00 -1.26 -4.85 105.19 107.28 1ffj n GLY 17 Ca 0.03 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 1ffj n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ffj s LYS 18 N 0.00 2.55 -0.00 1.61 -2.85 -0.80 -4.32 119.74 115.93 1ffj s LYS 18 Ca 0.00 -1.58 0.08 0.00 -1.00 0.00 0.00 55.97 53.47 1ffj s LYS 18 Cb 0.00 -3.84 0.22 0.00 -2.06 0.00 0.00 37.83 32.16 1ffj s LYS 18 CO 0.00 -1.05 1.19 0.09 0.10 0.00 0.00 175.35 175.68 1ffj n ASN 19 N 4.91 2.68 -4.13 0.03 3.02 -1.18 -3.76 115.26 116.83 1ffj n ASN 19 Ca -0.09 -2.01 -0.29 0.00 -0.03 0.00 0.00 54.58 52.16 1ffj n ASN 19 Cb 0.42 -0.17 -0.17 0.00 -0.61 0.00 0.00 39.78 39.25 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 -1.01 1.89 0.13 3.41 1.43 -1.04 -3.78 118.68 119.71 1ffj s LEU 20 Ca 0.17 -0.44 -0.25 0.00 -1.03 0.00 0.00 54.13 52.58 1ffj s LEU 20 Cb 0.09 -1.14 -0.07 0.00 0.03 0.00 0.00 46.19 45.09 1ffj s LEU 20 CO 0.11 0.11 0.75 0.00 0.23 0.00 0.00 176.35 177.55 1ffj s TYR 22 N -0.94 1.34 -0.15 0.00 -0.85 -0.73 -1.94 117.35 114.09 1ffj s TYR 22 Ca 0.35 -0.95 -0.07 0.00 -0.52 0.00 0.00 57.07 55.88 1ffj s TYR 22 Cb -0.22 -0.76 0.06 0.00 0.38 0.00 0.00 41.96 41.42 1ffj s TYR 22 CO 0.25 -0.11 0.34 -1.59 -1.52 0.00 0.00 175.55 172.92 1ffj s LYS 23 N -3.88 0.30 -0.18 -3.49 -2.85 -0.89 -2.37 119.74 106.39 1ffj s LYS 23 Ca 0.25 0.72 -0.08 0.00 -1.00 0.00 0.00 55.97 55.85 1ffj s LYS 23 Cb 0.05 -0.03 -0.04 0.00 -2.06 0.00 0.00 37.83 35.75 1ffj s LYS 23 CO 0.05 -0.18 0.09 -1.64 0.10 0.00 0.00 175.35 173.78 1ffj s MET 24 N 1.54 4.01 -0.03 1.78 -1.94 -0.85 -2.85 119.30 120.96 1ffj s MET 24 Ca -0.08 -0.28 -0.12 0.00 -1.71 0.00 0.00 55.69 53.50 1ffj s MET 24 Cb -0.10 -3.29 0.02 0.00 2.01 0.00 0.00 34.83 33.48 1ffj s MET 24 CO -0.11 0.33 0.26 -0.59 -0.01 0.00 0.00 175.02 174.90 1ffj s PHE 25 N 0.24 -0.15 0.27 -0.03 -0.12 -1.19 -2.00 117.98 115.00 1ffj s PHE 25 Ca 0.06 0.27 -0.23 0.00 -0.05 0.00 0.00 56.93 56.99 1ffj s PHE 25 Cb -0.12 0.06 -0.09 0.00 -0.63 0.00 0.00 43.02 42.25 1ffj s PHE 25 CO -0.00 -0.32 0.83 -1.64 -0.05 0.00 0.00 175.22 174.03 1ffj s MET 26 N -1.04 4.41 0.26 1.99 -1.94 -1.26 -3.00 119.30 118.72 1ffj s MET 26 Ca -0.11 1.08 0.18 0.00 -1.71 0.00 0.00 55.69 55.13 1ffj s MET 26 Cb -0.05 -2.85 0.96 0.00 2.01 0.00 0.00 34.83 34.90 1ffj s MET 26 CO 0.03 0.34 1.54 1.55 -0.01 0.00 0.00 175.02 178.48 1ffj n VAL 27 N 0.66 1.21 -0.30 -6.03 3.14 -1.08 -2.59 118.33 113.34 1ffj n VAL 27 Ca -0.00 0.69 0.29 0.00 -2.96 0.00 0.00 64.34 62.36 1ffj n VAL 27 Cb 0.51 -1.69 0.52 0.00 -1.06 0.00 0.00 33.84 32.12 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 -1.73 0.95 -3.20 1.55 0.00 -1.26 -4.35 120.51 112.46 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 0.03 -0.88 -0.09 0.00 0.00 0.00 0.00 19.45 18.51 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 -5.24 -0.67 -0.72 0.00 0.00 -1.07 -5.03 121.76 109.04 1ffj s ALA 29 Ca -0.07 0.23 0.24 0.00 0.00 0.00 0.00 51.96 52.36 1ffj s ALA 29 Cb 0.29 0.06 0.91 0.00 0.00 0.00 0.00 23.12 24.38 1ffj s ALA 29 CO 0.68 -0.24 1.73 -0.35 0.00 0.00 0.00 175.76 177.58 1ffj n PRO 30 N 1.38 0.16 -3.14 0.00 -0.04 -1.26 -3.89 135.00 128.22 1ffj n PRO 30 Ca -0.22 0.26 -0.22 0.00 -0.04 0.00 0.00 63.50 63.29 1ffj n PRO 30 Cb 0.56 -1.74 -0.05 0.00 -0.04 0.00 0.00 33.50 32.22 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 -2.04 -0.65 -3.01 0.54 -0.00 -1.26 -5.00 115.22 103.80 1ffj n HIS 31 Ca 0.04 -3.38 -0.03 0.00 0.46 0.00 0.00 57.72 54.81 1ffj n HIS 31 Cb 0.31 -0.14 -0.01 0.00 -0.12 0.00 0.00 29.99 30.03 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 -1.07 -0.92 0.52 3.57 1.01 -1.25 -5.15 120.40 117.11 1ffj s VAL 32 Ca 0.35 -0.61 -0.19 0.00 0.00 0.00 0.00 61.98 61.53 1ffj s VAL 32 Cb 0.19 -0.07 -0.07 0.00 0.00 0.00 0.00 36.38 36.43 1ffj s VAL 32 CO -0.12 -0.07 1.04 -2.16 0.00 0.00 0.00 175.10 173.79 1ffj s PRO 33 N 1.31 3.66 -0.20 2.72 0.04 -1.26 -3.99 135.00 137.27 1ffj s PRO 33 Ca 0.23 1.29 0.06 0.00 0.04 0.00 0.00 61.00 62.63 1ffj s PRO 33 Cb -0.02 -2.08 -0.17 0.00 0.04 0.00 0.00 34.50 32.27 1ffj s PRO 33 CO -0.06 -0.54 -0.11 1.55 0.04 0.00 0.00 177.00 177.88 1ffj n VAL 34 N -1.33 1.24 -3.82 -0.36 3.14 -0.85 -4.95 118.33 111.40 1ffj n VAL 34 Ca 0.09 -0.57 -0.04 0.00 -2.96 0.00 0.00 64.34 60.86 1ffj n VAL 34 Cb 0.53 -1.02 0.00 0.00 -1.06 0.00 0.00 33.84 32.29 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 -2.43 1.39 0.23 1.45 -2.85 -1.05 -5.07 119.74 111.40 1ffj s LYS 35 Ca -0.22 -0.84 -0.08 0.00 -1.00 0.00 0.00 55.97 53.83 1ffj s LYS 35 Cb 0.07 0.42 -0.02 0.00 -2.06 0.00 0.00 37.83 36.24 1ffj s LYS 35 CO 0.58 -0.64 0.34 1.03 0.10 0.00 0.00 175.35 176.76 1ffj s ARG 36 N -2.71 1.44 0.00 1.78 0.52 -1.26 -2.01 118.95 116.70 1ffj s ARG 36 Ca 0.17 -1.43 0.00 0.00 -0.52 0.00 0.00 55.73 53.95 1ffj s ARG 36 Cb -0.02 0.39 0.00 0.00 0.52 0.00 0.00 34.95 35.84 1ffj s ARG 36 CO 0.05 -0.56 0.00 0.41 0.02 0.00 0.00 175.30 175.22 1ffj n GLY 37 N -0.35 -0.92 3.27 -3.53 0.00 -1.00 -4.18 105.19 98.48 1ffj n GLY 37 Ca 0.00 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 45.00 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 1.97 0.00 -0.07 0.00 3.06 -0.48 -4.91 119.36 118.93 1ffj n ILE 39 Ca -0.17 -1.48 -0.14 0.00 -2.50 0.00 0.00 62.75 58.46 1ffj n ILE 39 Cb 0.53 0.78 -0.06 0.00 0.54 0.00 0.00 39.64 41.43 1ffj n ILE 39 CO 0.00 0.00 0.00 -0.90 -2.50 0.00 0.00 176.55 173.15 1ffj n ASP 40 N -2.04 1.54 -4.12 9.51 5.75 -1.26 -2.49 116.55 123.45 1ffj n ASP 40 Ca 0.04 0.11 -0.24 0.00 -0.01 0.00 0.00 54.79 54.69 1ffj n ASP 40 Cb 0.40 -0.38 -0.16 0.00 -1.03 0.00 0.00 41.12 39.95 1ffj n ASP 40 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1ffj s VAL 41 N -2.27 1.28 0.07 2.12 1.01 -1.26 -4.70 120.40 116.64 1ffj s VAL 41 Ca -0.20 -0.66 -0.31 0.00 0.00 0.00 0.00 61.98 60.81 1ffj s VAL 41 Cb 0.07 -1.09 -0.07 0.00 0.00 0.00 0.00 36.38 35.29 1ffj s VAL 41 CO 0.28 0.37 1.49 0.00 0.00 0.00 0.00 175.10 177.23 1ffj s PRO 43 N 1.97 2.23 0.33 0.00 0.04 -1.26 -4.97 135.00 133.33 1ffj s PRO 43 Ca 0.67 0.69 -0.29 0.00 0.04 0.00 0.00 61.00 62.12 1ffj s PRO 43 Cb -0.37 -1.93 -0.12 0.00 0.04 0.00 0.00 34.50 32.12 1ffj s PRO 43 CO 0.30 -1.53 1.42 1.17 0.04 0.00 0.00 177.00 178.40 1ffj n LYS 44 N -3.38 2.38 -3.78 4.56 3.00 -1.26 -4.88 118.16 114.80 1ffj n LYS 44 Ca 0.07 0.84 -0.36 0.00 -0.00 0.00 0.00 58.31 58.86 1ffj n LYS 44 Cb 0.56 -2.51 -0.07 0.00 0.00 0.00 0.00 35.03 33.00 1ffj n LYS 44 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1ffj s SER 45 N -0.00 6.25 0.46 3.14 0.01 -1.26 -4.88 113.70 117.42 1ffj s SER 45 Ca 0.58 0.30 0.07 0.00 1.31 0.00 0.00 55.95 58.21 1ffj s SER 45 Cb -0.54 -2.08 -0.02 0.00 0.21 0.00 0.00 66.02 63.59 1ffj s SER 45 CO 0.58 0.24 0.29 -0.94 0.41 0.00 0.00 173.24 173.82 1ffj s SER 46 N -0.03 4.63 0.08 2.44 1.04 -0.58 -5.03 113.70 116.25 1ffj s SER 46 Ca 0.10 -1.07 -0.16 0.00 0.48 0.00 0.00 55.95 55.30 1ffj s SER 46 Cb -0.11 -0.20 -0.12 0.00 0.10 0.00 0.00 66.02 65.69 1ffj s SER 46 CO -0.00 -0.75 1.35 -0.07 0.98 0.00 0.00 173.24 174.75 1ffj h LEU 47 N 1.13 0.68 0.43 2.42 3.38 -2.03 -3.32 115.31 118.00 1ffj h LEU 47 Ca -0.41 -0.53 -0.02 0.00 0.09 0.00 0.00 57.88 57.02 1ffj h LEU 47 Cb 1.27 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1ffj h LEU 47 CO 0.63 1.07 -0.25 0.25 0.09 0.00 0.00 178.44 180.24 1ffj h LEU 48 N 0.30 -0.63 -9.28 1.67 7.12 -2.01 -3.44 115.31 109.05 1ffj h LEU 48 Ca 0.02 0.03 -0.62 0.00 0.13 0.00 0.00 57.88 57.43 1ffj h LEU 48 Cb 0.94 0.18 -0.14 0.00 -0.53 0.00 0.00 40.66 41.10 1ffj h LEU 48 CO 0.08 -0.39 -0.74 0.68 -0.13 0.00 0.00 178.44 177.94 1ffj s VAL 49 N -4.48 3.04 0.05 1.05 -7.23 -1.25 -2.62 120.40 108.96 1ffj s VAL 49 Ca -0.10 -1.77 0.00 0.00 -1.81 0.00 0.00 61.98 58.30 1ffj s VAL 49 Cb 0.01 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.41 1ffj s VAL 49 CO 0.30 -0.14 -0.04 -0.54 -0.31 0.00 0.00 175.10 174.37 1ffj s LYS 50 N -2.89 0.57 0.05 4.82 1.02 -1.16 -1.52 119.74 120.62 1ffj s LYS 50 Ca 0.25 -1.04 0.04 0.00 0.02 0.00 0.00 55.97 55.23 1ffj s LYS 50 Cb -0.08 0.07 -0.03 0.00 -0.52 0.00 0.00 37.83 37.27 1ffj s LYS 50 CO 0.15 -0.06 -0.11 0.71 -0.92 0.00 0.00 175.35 175.11 1ffj s TYR 51 N -3.02 0.95 -0.05 3.18 2.02 -1.26 -3.14 117.35 116.03 1ffj s TYR 51 Ca 0.00 -0.45 0.03 0.00 -0.37 0.00 0.00 57.07 56.28 1ffj s TYR 51 Cb 0.01 -0.55 0.01 0.00 -0.40 0.00 0.00 41.96 41.03 1ffj s TYR 51 CO -0.06 -0.01 -0.13 0.08 -1.57 0.00 0.00 175.55 173.86 1ffj s VAL 52 N -1.23 1.17 0.34 0.71 1.01 -1.13 -4.97 120.40 116.30 1ffj s VAL 52 Ca -0.05 -0.53 0.08 0.00 0.00 0.00 0.00 61.98 61.49 1ffj s VAL 52 Cb -0.09 -1.05 -0.07 0.00 0.00 0.00 0.00 36.38 35.17 1ffj s VAL 52 CO 0.01 0.36 -0.07 0.00 0.00 0.00 0.00 175.10 175.40 1ffj n ASN 55 N 0.16 4.42 -3.92 0.00 6.94 -1.26 -1.67 115.26 119.93 1ffj n ASN 55 Ca -0.01 -3.61 -0.10 0.00 -0.02 0.00 0.00 54.58 50.85 1ffj n ASN 55 Cb 0.58 -0.63 -0.10 0.00 -2.36 0.00 0.00 39.78 37.27 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 -3.81 0.10 -0.03 5.53 -4.23 -1.26 -5.06 115.64 106.88 1ffj s THR 56 Ca 0.45 -0.83 -0.30 0.00 -1.18 0.00 0.00 61.69 59.84 1ffj s THR 56 Cb 0.23 -0.42 -0.06 0.00 1.34 0.00 0.00 72.50 73.59 1ffj s THR 56 CO -0.09 -0.46 1.74 -1.81 -0.54 0.00 0.00 174.62 173.46 1ffj s ASP 57 N -1.50 6.60 -0.81 3.99 1.01 -1.26 -2.40 116.67 122.29 1ffj s ASP 57 Ca -0.14 2.34 -0.01 0.00 0.71 0.00 0.00 52.55 55.45 1ffj s ASP 57 Cb -0.08 -2.53 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 1ffj s ASP 57 CO -0.00 -0.97 0.69 0.29 0.21 0.00 0.00 175.17 175.38 1ffj n LYS 58 N 7.26 -3.81 -0.09 8.23 5.02 -0.90 -4.96 118.16 128.90 1ffj n LYS 58 Ca 0.18 0.60 -0.23 0.00 -2.02 0.00 0.00 58.31 56.84 1ffj n LYS 58 Cb 0.42 -4.78 -0.12 0.00 -0.02 0.00 0.00 35.03 30.54 1ffj n LYS 58 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88