#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 0.18 0.38 3.23 1.02 -1.26 -2.34 119.74 120.95 1ffj s LYS 2 Ca 0.00 0.21 0.05 0.00 0.02 0.00 0.00 55.97 56.25 1ffj s LYS 2 Cb 0.00 -0.87 -0.07 0.00 -0.52 0.00 0.00 37.83 36.37 1ffj s LYS 2 CO 0.00 -0.38 0.04 0.00 -0.92 0.00 0.00 175.35 174.09 1ffj s LYS 4 N -3.80 4.05 0.22 0.00 1.02 -1.26 -1.51 119.74 118.46 1ffj s LYS 4 Ca 0.34 0.58 -0.04 0.00 0.02 0.00 0.00 55.97 56.87 1ffj s LYS 4 Cb 0.09 -2.99 0.05 0.00 -0.52 0.00 0.00 37.83 34.46 1ffj s LYS 4 CO 0.16 0.50 0.25 1.63 -0.92 0.00 0.00 175.35 176.98 1ffj n LYS 5 N 0.98 -0.70 -0.04 1.68 4.76 -0.96 -4.40 118.16 119.48 1ffj n LYS 5 Ca -0.06 -0.40 -0.02 0.00 -2.87 0.00 0.00 58.31 54.97 1ffj n LYS 5 Cb 0.52 -0.30 -0.01 0.00 -1.84 0.00 0.00 35.03 33.39 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 -0.28 -9.51 -0.35 3.38 -1.89 -3.38 115.31 103.29 1ffj h LEU 6 Ca -0.09 0.04 -0.53 0.00 0.09 0.00 0.00 57.88 57.39 1ffj h LEU 6 Cb 0.25 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1ffj h LEU 6 CO 0.06 -0.04 0.29 -0.69 0.09 0.00 0.00 178.44 178.15 1ffj s VAL 7 N -3.34 4.69 -0.57 1.22 1.01 -1.26 -4.52 120.40 117.62 1ffj s VAL 7 Ca -0.02 1.91 -0.06 0.00 0.00 0.00 0.00 61.98 63.81 1ffj s VAL 7 Cb 0.01 -4.25 -0.14 0.00 0.00 0.00 0.00 36.38 32.01 1ffj s VAL 7 CO 0.08 0.29 2.67 -0.81 0.00 0.00 0.00 175.10 177.33 1ffj n PRO 8 N 3.12 2.10 -0.02 2.72 -0.04 -1.26 -3.51 135.00 138.11 1ffj n PRO 8 Ca 0.02 -1.23 -0.03 0.00 -0.04 0.00 0.00 63.50 62.22 1ffj n PRO 8 Cb 0.50 -2.21 -0.03 0.00 -0.04 0.00 0.00 33.50 31.72 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 3.24 1.76 -4.08 1.53 4.77 -1.26 -5.07 117.00 117.89 1ffj n LEU 9 Ca 0.45 -0.02 -0.08 0.00 -0.03 0.00 0.00 56.01 56.33 1ffj n LEU 9 Cb 0.45 -0.06 -0.10 0.00 -2.33 0.00 0.00 43.42 41.37 1ffj n LEU 9 CO 0.44 0.38 -0.37 -0.36 -1.33 0.00 0.00 177.39 176.16 1ffj s PHE 10 N -2.10 0.53 0.20 -1.77 0.08 -1.23 -5.11 117.98 108.58 1ffj s PHE 10 Ca -0.05 -0.93 0.09 0.00 0.12 0.00 0.00 56.93 56.17 1ffj s PHE 10 Cb 0.01 -0.37 -0.04 0.00 -0.57 0.00 0.00 43.02 42.05 1ffj s PHE 10 CO 0.13 -0.30 -0.18 -1.54 -0.10 0.00 0.00 175.22 173.24 1ffj s SER 11 N -2.62 2.85 0.17 1.36 1.04 -1.26 -2.27 113.70 112.98 1ffj s SER 11 Ca 0.03 -0.95 -0.04 0.00 0.48 0.00 0.00 55.95 55.47 1ffj s SER 11 Cb 0.04 -0.18 -0.03 0.00 0.10 0.00 0.00 66.02 65.95 1ffj s SER 11 CO -0.07 -0.06 0.18 -0.54 0.98 0.00 0.00 173.24 173.73 1ffj s LYS 12 N -3.21 1.14 0.12 4.02 -0.14 -0.57 -4.92 119.74 116.18 1ffj s LYS 12 Ca 0.21 -1.41 -0.18 0.00 -1.36 0.00 0.00 55.97 53.23 1ffj s LYS 12 Cb -0.04 0.31 -0.07 0.00 -1.68 0.00 0.00 37.83 36.35 1ffj s LYS 12 CO 0.08 -0.38 0.59 0.99 -0.76 0.00 0.00 175.35 175.87 1ffj s THR 13 N -4.06 4.75 0.01 2.17 2.01 -1.26 -2.02 115.64 117.24 1ffj s THR 13 Ca 0.27 1.10 -0.17 0.00 0.31 0.00 0.00 61.69 63.20 1ffj s THR 13 Cb 0.05 -3.84 -0.06 0.00 0.01 0.00 0.00 72.50 68.67 1ffj s THR 13 CO 0.05 0.40 0.48 0.00 -0.69 0.00 0.00 174.62 174.86 1ffj s PRO 15 N -0.79 0.36 0.55 0.00 0.04 -1.26 -4.90 135.00 129.00 1ffj s PRO 15 Ca 0.26 0.00 -0.20 0.00 0.04 0.00 0.00 61.00 61.11 1ffj s PRO 15 Cb -0.17 -1.78 -0.07 0.00 0.04 0.00 0.00 34.50 32.52 1ffj s PRO 15 CO 0.15 -2.67 0.82 0.00 0.04 0.00 0.00 177.00 175.34 1ffj n ALA 16 N -4.04 -0.29 0.00 8.56 0.00 -1.26 -2.08 120.51 121.40 1ffj n ALA 16 Ca 0.11 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1ffj n ALA 16 Cb 0.59 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 18.04 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 1.44 2.61 3.41 0.00 0.00 -1.26 -4.94 105.19 106.45 1ffj n GLY 17 Ca 0.12 -0.65 -0.44 0.00 0.00 0.00 0.00 46.02 45.05 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 3.36 0.00 1.61 1.02 -0.89 -4.10 119.74 120.74 1ffj s LYS 18 Ca 0.00 -1.58 0.09 0.00 0.02 0.00 0.00 55.97 54.50 1ffj s LYS 18 Cb 0.00 -4.55 0.20 0.00 -0.52 0.00 0.00 37.83 32.96 1ffj s LYS 18 CO 0.00 -1.65 1.08 0.09 -0.92 0.00 0.00 175.35 173.95 1ffj n ASN 19 N 6.31 2.46 -3.77 2.83 3.02 -1.14 -4.58 115.26 120.39 1ffj n ASN 19 Ca 0.08 -1.80 -0.15 0.00 -0.03 0.00 0.00 54.58 52.68 1ffj n ASN 19 Cb 0.46 -0.13 -0.16 0.00 -0.61 0.00 0.00 39.78 39.34 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 -0.93 1.11 0.14 3.41 1.02 -1.02 -4.67 118.68 117.73 1ffj s LEU 20 Ca 0.17 0.04 -0.24 0.00 0.02 0.00 0.00 54.13 54.12 1ffj s LEU 20 Cb 0.10 -0.06 -0.08 0.00 0.02 0.00 0.00 46.19 46.17 1ffj s LEU 20 CO 0.13 -0.12 0.73 0.00 0.02 0.00 0.00 176.35 177.10 1ffj s TYR 22 N -1.10 2.69 -0.17 0.00 1.13 -0.42 -2.33 117.35 117.15 1ffj s TYR 22 Ca 0.34 -0.17 -0.00 0.00 -1.41 0.00 0.00 57.07 55.83 1ffj s TYR 22 Cb -0.22 -1.53 0.04 0.00 -1.10 0.00 0.00 41.96 39.14 1ffj s TYR 22 CO 0.24 0.28 -0.08 0.21 -2.51 0.00 0.00 175.55 173.70 1ffj s LYS 23 N -1.33 1.70 -0.26 -3.49 2.20 -1.01 -2.36 119.74 115.19 1ffj s LYS 23 Ca 0.15 -0.58 -0.09 0.00 -0.36 0.00 0.00 55.97 55.09 1ffj s LYS 23 Cb -0.11 -2.08 -0.04 0.00 -1.51 0.00 0.00 37.83 34.09 1ffj s LYS 23 CO 0.05 -0.39 0.13 -1.64 -0.36 0.00 0.00 175.35 173.14 1ffj s MET 24 N 1.56 3.85 0.25 4.03 -1.94 -0.57 -2.82 119.30 123.67 1ffj s MET 24 Ca 0.01 -0.38 -0.06 0.00 -1.71 0.00 0.00 55.69 53.55 1ffj s MET 24 Cb -0.15 -3.48 -0.02 0.00 2.01 0.00 0.00 34.83 33.19 1ffj s MET 24 CO -0.08 -0.13 0.35 -0.59 -0.01 0.00 0.00 175.02 174.56 1ffj s PHE 25 N 1.53 0.83 0.09 -0.03 -0.71 -1.19 -2.24 117.98 116.27 1ffj s PHE 25 Ca 0.06 -1.10 -0.01 0.00 -1.04 0.00 0.00 56.93 54.84 1ffj s PHE 25 Cb -0.15 -0.16 -0.04 0.00 -1.21 0.00 0.00 43.02 41.46 1ffj s PHE 25 CO 0.07 -0.90 0.26 -1.64 -1.34 0.00 0.00 175.22 171.67 1ffj s MET 26 N -3.84 3.49 0.29 1.99 -1.94 -1.25 -2.71 119.30 115.33 1ffj s MET 26 Ca 0.30 -0.35 0.19 0.00 -1.71 0.00 0.00 55.69 54.12 1ffj s MET 26 Cb 0.02 -2.98 1.05 0.00 2.01 0.00 0.00 34.83 34.94 1ffj s MET 26 CO 0.13 0.56 1.59 1.55 -0.01 0.00 0.00 175.02 178.85 1ffj n VAL 27 N 0.17 1.14 -0.29 -6.03 3.14 -1.00 -2.56 118.33 112.89 1ffj n VAL 27 Ca -0.04 0.72 0.24 0.00 -2.96 0.00 0.00 64.34 62.29 1ffj n VAL 27 Cb 0.51 -1.72 0.44 0.00 -1.06 0.00 0.00 33.84 32.02 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 -1.75 0.77 -3.51 1.55 0.00 -1.26 -4.55 120.51 111.76 1ffj n ALA 28 Ca -0.01 0.92 -0.13 0.00 0.00 0.00 0.00 53.44 54.21 1ffj n ALA 28 Cb 0.03 -0.84 -0.04 0.00 0.00 0.00 0.00 19.45 18.60 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 -5.50 -1.78 -1.06 0.00 0.00 -1.06 -5.02 121.76 107.34 1ffj s ALA 29 Ca -0.09 1.16 0.22 0.00 0.00 0.00 0.00 51.96 53.25 1ffj s ALA 29 Cb 0.29 0.08 0.96 0.00 0.00 0.00 0.00 23.12 24.45 1ffj s ALA 29 CO 0.69 -0.49 1.70 -0.35 0.00 0.00 0.00 175.76 177.31 1ffj n PRO 30 N 0.40 0.04 -3.17 0.00 -0.04 -1.26 -3.61 135.00 127.36 1ffj n PRO 30 Ca -0.15 0.12 -0.23 0.00 -0.04 0.00 0.00 63.50 63.20 1ffj n PRO 30 Cb 0.60 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.51 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 -1.47 1.45 -2.84 0.54 -0.00 -1.26 -4.93 115.22 106.70 1ffj n HIS 31 Ca 0.06 -3.85 -0.09 0.00 0.46 0.00 0.00 57.72 54.30 1ffj n HIS 31 Cb 0.25 -0.44 0.01 0.00 -0.12 0.00 0.00 29.99 29.69 1ffj n HIS 31 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 1ffj n VAL 32 N 0.51 -0.16 -1.64 3.57 0.31 -1.24 -5.15 118.33 114.54 1ffj n VAL 32 Ca 0.26 -1.70 -0.31 0.00 -0.01 0.00 0.00 64.34 62.58 1ffj n VAL 32 Cb 0.53 0.75 0.04 0.00 -0.91 0.00 0.00 33.84 34.25 1ffj n VAL 32 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1ffj s PRO 33 N 0.54 3.01 0.00 5.55 0.04 -1.26 -3.76 135.00 139.12 1ffj s PRO 33 Ca 0.32 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.33 1ffj s PRO 33 Cb 0.13 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.67 1ffj s PRO 33 CO -0.16 -1.04 0.00 1.55 0.04 0.00 0.00 177.00 177.39 1ffj n VAL 34 N -2.98 0.00 -3.73 -0.36 3.14 -0.95 -4.96 118.33 108.49 1ffj n VAL 34 Ca 0.08 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.32 1ffj n VAL 34 Cb 0.53 -0.74 -0.10 0.00 -1.06 0.00 0.00 33.84 32.48 1ffj n VAL 34 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1ffj s LYS 35 N -1.91 0.53 0.22 1.45 1.02 -1.07 -5.01 119.74 114.97 1ffj s LYS 35 Ca 0.00 0.51 -0.03 0.00 0.02 0.00 0.00 55.97 56.47 1ffj s LYS 35 Cb 0.00 0.25 -0.03 0.00 -0.52 0.00 0.00 37.83 37.53 1ffj s LYS 35 CO 0.00 -0.08 0.21 1.03 -0.92 0.00 0.00 175.35 175.59 1ffj s ARG 36 N 0.04 1.31 0.00 1.68 0.52 -1.26 -1.51 118.95 119.73 1ffj s ARG 36 Ca -0.02 -1.59 0.00 0.00 -0.52 0.00 0.00 55.73 53.60 1ffj s ARG 36 Cb -0.03 0.31 0.00 0.00 0.52 0.00 0.00 34.95 35.75 1ffj s ARG 36 CO 0.01 -0.46 0.00 0.41 0.02 0.00 0.00 175.30 175.28 1ffj n GLY 37 N -0.32 -1.12 3.93 -3.53 0.00 -1.00 -3.77 105.19 99.38 1ffj n GLY 37 Ca 0.02 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.87 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 -1.81 0.00 -0.11 0.00 1.10 -0.62 -4.79 121.20 114.97 1ffj s ILE 39 Ca 0.37 -0.90 -0.03 0.00 -0.51 0.00 0.00 60.65 59.58 1ffj s ILE 39 Cb -0.11 -2.85 -0.05 0.00 0.15 0.00 0.00 42.46 39.60 1ffj s ILE 39 CO 0.29 0.00 -0.12 -0.67 -2.11 0.00 0.00 174.94 172.32 1ffj n ASP 40 N -1.33 1.68 -4.38 4.50 4.64 -1.26 -2.44 116.55 117.96 1ffj n ASP 40 Ca -0.07 0.06 -0.25 0.00 -1.38 0.00 0.00 54.79 53.16 1ffj n ASP 40 Cb 0.60 -0.26 -0.12 0.00 -1.04 0.00 0.00 41.12 40.30 1ffj n ASP 40 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 1ffj s VAL 41 N -2.20 2.10 -0.16 5.18 0.11 -1.26 -4.65 120.40 119.51 1ffj s VAL 41 Ca -0.15 -1.95 -0.09 0.00 -2.93 0.00 0.00 61.98 56.87 1ffj s VAL 41 Cb 0.05 -1.97 -0.05 0.00 -1.53 0.00 0.00 36.38 32.88 1ffj s VAL 41 CO 0.21 -0.18 0.13 0.00 -3.33 0.00 0.00 175.10 171.93 1ffj s PRO 43 N -0.25 -0.29 0.71 0.00 0.04 -1.26 -5.02 135.00 128.93 1ffj s PRO 43 Ca 0.11 -0.24 -0.14 0.00 0.04 0.00 0.00 61.00 60.76 1ffj s PRO 43 Cb -0.11 -1.72 0.03 0.00 0.04 0.00 0.00 34.50 32.73 1ffj s PRO 43 CO 0.01 -3.06 1.14 0.21 0.04 0.00 0.00 177.00 175.33 1ffj s LYS 44 N -5.65 2.46 -0.13 4.56 2.20 -1.26 -4.94 119.74 116.97 1ffj s LYS 44 Ca 0.72 1.47 -0.04 0.00 -0.36 0.00 0.00 55.97 57.77 1ffj s LYS 44 Cb -0.07 -1.90 -0.03 0.00 -1.51 0.00 0.00 37.83 34.32 1ffj s LYS 44 CO 0.54 -1.53 0.00 -1.12 -0.36 0.00 0.00 175.35 172.88 1ffj s SER 45 N -2.53 5.17 0.48 1.43 0.01 -1.26 -4.79 113.70 112.21 1ffj s SER 45 Ca 0.68 0.03 0.07 0.00 1.31 0.00 0.00 55.95 58.04 1ffj s SER 45 Cb -0.22 -1.71 0.01 0.00 0.21 0.00 0.00 66.02 64.30 1ffj s SER 45 CO 0.45 0.25 0.37 -0.94 0.41 0.00 0.00 173.24 173.78 1ffj s SER 46 N -0.13 4.73 -0.07 2.44 1.04 -0.63 -5.03 113.70 116.06 1ffj s SER 46 Ca 0.04 -1.05 -0.20 0.00 0.48 0.00 0.00 55.95 55.22 1ffj s SER 46 Cb -0.13 -0.05 -0.15 0.00 0.10 0.00 0.00 66.02 65.79 1ffj s SER 46 CO 0.02 -0.87 0.77 -0.07 0.98 0.00 0.00 173.24 174.06 1ffj h LEU 47 N 0.94 -0.15 0.20 2.42 3.38 -2.02 -3.35 115.31 116.73 1ffj h LEU 47 Ca -0.39 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.20 1ffj h LEU 47 Cb 1.28 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 42.04 1ffj h LEU 47 CO 0.59 0.45 -0.45 0.25 0.09 0.00 0.00 178.44 179.37 1ffj h LEU 48 N -0.90 -1.32 -9.28 1.67 6.46 -2.00 -3.43 115.31 106.51 1ffj h LEU 48 Ca -0.02 0.13 -0.63 0.00 -0.12 0.00 0.00 57.88 57.24 1ffj h LEU 48 Cb 0.52 0.47 -0.15 0.00 -0.73 0.00 0.00 40.66 40.78 1ffj h LEU 48 CO 0.03 -0.51 -0.74 0.68 -0.62 0.00 0.00 178.44 177.29 1ffj s VAL 49 N -5.37 3.09 0.04 1.05 -7.23 -1.26 -2.38 120.40 108.35 1ffj s VAL 49 Ca -0.14 -1.69 -0.02 0.00 -1.81 0.00 0.00 61.98 58.32 1ffj s VAL 49 Cb 0.05 -2.53 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 1ffj s VAL 49 CO 0.51 -0.10 -0.01 -0.75 -0.31 0.00 0.00 175.10 174.44 1ffj s LYS 50 N -2.79 0.54 0.11 4.82 2.20 -1.10 -1.61 119.74 121.91 1ffj s LYS 50 Ca 0.24 -1.01 0.05 0.00 -0.36 0.00 0.00 55.97 54.89 1ffj s LYS 50 Cb -0.09 0.19 -0.04 0.00 -1.51 0.00 0.00 37.83 36.39 1ffj s LYS 50 CO 0.14 -0.11 -0.12 0.71 -0.36 0.00 0.00 175.35 175.62 1ffj s TYR 51 N -3.18 1.22 -0.05 4.03 2.02 -1.26 -3.17 117.35 116.96 1ffj s TYR 51 Ca 0.00 -0.59 -0.02 0.00 -0.37 0.00 0.00 57.07 56.09 1ffj s TYR 51 Cb 0.03 -0.65 0.04 0.00 -0.40 0.00 0.00 41.96 40.97 1ffj s TYR 51 CO -0.07 0.07 0.09 0.08 -1.57 0.00 0.00 175.55 174.15 1ffj s VAL 52 N -2.20 -0.13 0.25 0.71 1.01 -1.13 -4.95 120.40 113.96 1ffj s VAL 52 Ca 0.06 0.32 0.07 0.00 0.00 0.00 0.00 61.98 62.43 1ffj s VAL 52 Cb -0.04 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.11 1ffj s VAL 52 CO 0.02 0.13 0.16 0.00 0.00 0.00 0.00 175.10 175.41 1ffj n ASN 55 N 1.81 6.10 -3.84 0.00 6.94 -1.26 -1.70 115.26 123.31 1ffj n ASN 55 Ca -0.14 -3.45 -0.11 0.00 -0.02 0.00 0.00 54.58 50.86 1ffj n ASN 55 Cb 0.56 -1.16 -0.09 0.00 -2.36 0.00 0.00 39.78 36.73 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 -2.92 0.08 -0.03 5.53 -4.23 -1.26 -5.05 115.64 107.77 1ffj s THR 56 Ca 0.33 -0.70 -0.30 0.00 -1.18 0.00 0.00 61.69 59.85 1ffj s THR 56 Cb 0.08 -0.59 -0.07 0.00 1.34 0.00 0.00 72.50 73.26 1ffj s THR 56 CO 0.07 -0.38 1.77 -1.81 -0.54 0.00 0.00 174.62 173.72 1ffj s ASP 57 N -1.54 6.58 -0.96 3.99 1.01 -1.26 -2.34 116.67 122.14 1ffj s ASP 57 Ca -0.12 2.37 -0.01 0.00 0.71 0.00 0.00 52.55 55.50 1ffj s ASP 57 Cb -0.06 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.33 1ffj s ASP 57 CO 0.01 -0.98 0.81 0.29 0.21 0.00 0.00 175.17 175.50 1ffj n LYS 58 N 7.30 -4.46 -0.08 8.23 4.01 -0.77 -4.95 118.16 127.44 1ffj n LYS 58 Ca 0.18 0.71 -0.22 0.00 -0.51 0.00 0.00 58.31 58.47 1ffj n LYS 58 Cb 0.42 -5.22 -0.12 0.00 -0.51 0.00 0.00 35.03 29.60 1ffj n LYS 58 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29