#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 2.10 0.54 3.23 -2.85 -1.26 -2.02 119.74 119.48 1ffj s LYS 2 Ca 0.00 -1.66 0.06 0.00 -1.00 0.00 0.00 55.97 53.37 1ffj s LYS 2 Cb 0.00 -3.47 0.04 0.00 -2.06 0.00 0.00 37.83 32.35 1ffj s LYS 2 CO 0.00 -0.94 0.46 0.00 0.10 0.00 0.00 175.35 174.97 1ffj s LYS 4 N -4.33 3.75 0.12 0.00 -0.14 -1.26 -1.54 119.74 116.33 1ffj s LYS 4 Ca 0.39 0.17 -0.02 0.00 -1.36 0.00 0.00 55.97 55.16 1ffj s LYS 4 Cb -0.03 -2.69 0.03 0.00 -1.68 0.00 0.00 37.83 33.46 1ffj s LYS 4 CO 0.24 0.34 0.16 1.63 -0.76 0.00 0.00 175.35 176.96 1ffj n LYS 5 N -0.18 0.04 -0.02 1.68 4.76 -1.06 -4.55 118.16 118.82 1ffj n LYS 5 Ca -0.00 -0.30 -0.03 0.00 -2.87 0.00 0.00 58.31 55.11 1ffj n LYS 5 Cb 0.52 -0.15 -0.02 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 -0.34 -9.66 -0.35 4.07 -1.87 -3.40 115.31 103.75 1ffj h LEU 6 Ca -0.05 0.04 -0.54 0.00 0.08 0.00 0.00 57.88 57.41 1ffj h LEU 6 Cb 0.16 0.14 -0.04 0.00 1.08 0.00 0.00 40.66 42.00 1ffj h LEU 6 CO 0.04 -0.08 0.13 -0.69 -1.08 0.00 0.00 178.44 176.76 1ffj s VAL 7 N -3.50 4.54 -0.50 1.22 1.01 -1.26 -4.34 120.40 117.58 1ffj s VAL 7 Ca -0.03 1.58 -0.06 0.00 0.00 0.00 0.00 61.98 63.48 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 0.11 0.48 2.70 -0.81 0.00 0.00 0.00 175.10 177.58 1ffj n PRO 8 N 1.97 2.02 -0.02 2.72 -0.04 -1.26 -3.46 135.00 136.93 1ffj n PRO 8 Ca -0.06 -1.16 -0.02 0.00 -0.04 0.00 0.00 63.50 62.21 1ffj n PRO 8 Cb 0.49 -2.17 -0.02 0.00 -0.04 0.00 0.00 33.50 31.76 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 3.16 1.83 -4.20 1.53 4.77 -1.26 -5.07 117.00 117.75 1ffj n LEU 9 Ca 0.43 -0.01 -0.12 0.00 -0.03 0.00 0.00 56.01 56.28 1ffj n LEU 9 Cb 0.48 -0.06 -0.10 0.00 -2.33 0.00 0.00 43.42 41.41 1ffj n LEU 9 CO 0.40 0.38 -0.33 -0.36 -1.33 0.00 0.00 177.39 176.16 1ffj s PHE 10 N -2.08 1.04 0.14 -1.77 0.40 -1.23 -5.12 117.98 109.37 1ffj s PHE 10 Ca -0.04 -1.07 0.09 0.00 -0.60 0.00 0.00 56.93 55.31 1ffj s PHE 10 Cb 0.01 -0.60 -0.04 0.00 0.51 0.00 0.00 43.02 42.90 1ffj s PHE 10 CO 0.11 -0.30 -0.20 -1.54 0.70 0.00 0.00 175.22 173.99 1ffj s SER 11 N -3.11 2.75 0.08 1.36 1.04 -1.26 -2.58 113.70 111.98 1ffj s SER 11 Ca 0.22 -0.79 -0.04 0.00 0.48 0.00 0.00 55.95 55.82 1ffj s SER 11 Cb 0.06 -0.17 -0.02 0.00 0.10 0.00 0.00 66.02 66.00 1ffj s SER 11 CO 0.02 0.03 0.08 -0.75 0.98 0.00 0.00 173.24 173.60 1ffj s LYS 12 N -2.40 0.76 -0.17 4.02 2.47 -0.59 -4.90 119.74 118.93 1ffj s LYS 12 Ca 0.13 -1.14 -0.09 0.00 -1.56 0.00 0.00 55.97 53.30 1ffj s LYS 12 Cb -0.08 0.27 -0.05 0.00 -1.46 0.00 0.00 37.83 36.52 1ffj s LYS 12 CO 0.06 -0.20 0.13 0.99 0.16 0.00 0.00 175.35 176.49 1ffj s THR 13 N -3.91 5.39 -0.33 3.43 2.01 -1.26 -1.59 115.64 119.38 1ffj s THR 13 Ca 0.08 0.18 -0.29 0.00 0.31 0.00 0.00 61.69 61.97 1ffj s THR 13 Cb 0.07 -3.42 0.01 0.00 0.01 0.00 0.00 72.50 69.16 1ffj s THR 13 CO -0.09 0.50 1.21 0.00 -0.69 0.00 0.00 174.62 175.56 1ffj s PRO 15 N 4.07 0.71 0.35 0.00 0.04 -1.26 -4.54 135.00 134.37 1ffj s PRO 15 Ca 0.52 0.12 -0.23 0.00 0.04 0.00 0.00 61.00 61.45 1ffj s PRO 15 Cb -0.14 -1.80 -0.16 0.00 0.04 0.00 0.00 34.50 32.44 1ffj s PRO 15 CO 0.22 -2.46 0.29 0.00 0.04 0.00 0.00 177.00 175.09 1ffj n ALA 16 N -3.91 -2.70 0.00 8.56 0.00 -1.26 -2.39 120.51 118.81 1ffj n ALA 16 Ca 0.09 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1ffj n ALA 16 Cb 0.59 -1.57 0.00 0.00 0.00 0.00 0.00 19.45 18.48 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 2.14 3.02 3.22 0.00 0.00 -1.26 -4.95 105.19 107.36 1ffj n GLY 17 Ca 0.13 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 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 3.00 0.00 1.61 0.00 -1.00 -4.00 119.74 119.35 1ffj s LYS 18 Ca 0.00 -2.34 0.21 0.00 0.00 0.00 0.00 55.97 53.84 1ffj s LYS 18 Cb 0.00 -4.08 0.53 0.00 0.00 0.00 0.00 37.83 34.28 1ffj s LYS 18 CO 0.00 -1.23 1.45 0.09 0.00 0.00 0.00 175.35 175.65 1ffj n ASN 19 N 3.99 3.08 -3.82 0.03 4.13 -1.20 -4.52 115.26 116.96 1ffj n ASN 19 Ca 0.07 -1.95 -0.17 0.00 1.68 0.00 0.00 54.58 54.21 1ffj n ASN 19 Cb 0.42 -0.29 -0.16 0.00 -1.54 0.00 0.00 39.78 38.21 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 -1.30 1.21 0.15 3.41 1.43 -1.04 -4.72 118.68 117.81 1ffj s LEU 20 Ca 0.39 -0.02 -0.22 0.00 -1.03 0.00 0.00 54.13 53.24 1ffj s LEU 20 Cb 0.21 -0.21 -0.08 0.00 0.03 0.00 0.00 46.19 46.15 1ffj s LEU 20 CO 0.29 -0.10 0.69 0.00 0.23 0.00 0.00 176.35 177.47 1ffj s TYR 22 N -1.22 2.21 -0.04 0.00 -0.85 -0.84 -2.19 117.35 114.41 1ffj s TYR 22 Ca 0.35 -0.37 -0.02 0.00 -0.52 0.00 0.00 57.07 56.51 1ffj s TYR 22 Cb -0.20 -1.07 0.03 0.00 0.38 0.00 0.00 41.96 41.10 1ffj s TYR 22 CO 0.23 0.51 0.05 -1.59 -1.52 0.00 0.00 175.55 173.23 1ffj s LYS 23 N -2.86 0.02 -0.24 -3.49 -2.85 -0.82 -2.41 119.74 107.08 1ffj s LYS 23 Ca 0.22 0.31 -0.07 0.00 -1.00 0.00 0.00 55.97 55.43 1ffj s LYS 23 Cb -0.07 -0.52 -0.03 0.00 -2.06 0.00 0.00 37.83 35.15 1ffj s LYS 23 CO 0.10 -0.29 0.06 -1.64 0.10 0.00 0.00 175.35 173.68 1ffj s MET 24 N 1.93 3.67 0.03 1.78 -1.94 -0.56 -2.73 119.30 121.48 1ffj s MET 24 Ca 0.02 -0.48 -0.00 0.00 -1.71 0.00 0.00 55.69 53.52 1ffj s MET 24 Cb -0.12 -3.28 -0.03 0.00 2.01 0.00 0.00 34.83 33.41 1ffj s MET 24 CO -0.03 -0.13 -0.03 -0.59 -0.01 0.00 0.00 175.02 174.22 1ffj s PHE 25 N 1.45 0.35 0.24 -0.03 -0.71 -1.18 -1.97 117.98 116.13 1ffj s PHE 25 Ca 0.05 -0.69 -0.09 0.00 -1.04 0.00 0.00 56.93 55.16 1ffj s PHE 25 Cb -0.15 -0.25 -0.07 0.00 -1.21 0.00 0.00 43.02 41.34 1ffj s PHE 25 CO 0.03 -0.25 0.55 -1.64 -1.34 0.00 0.00 175.22 172.58 1ffj s MET 26 N -2.21 3.79 0.28 1.99 -1.94 -1.25 -2.77 119.30 117.17 1ffj s MET 26 Ca -0.09 0.25 0.19 0.00 -1.71 0.00 0.00 55.69 54.33 1ffj s MET 26 Cb -0.05 -2.64 1.01 0.00 2.01 0.00 0.00 34.83 35.16 1ffj s MET 26 CO -0.04 0.31 1.57 1.55 -0.01 0.00 0.00 175.02 178.40 1ffj n VAL 27 N -0.21 1.17 -0.28 -6.03 3.14 -1.15 -2.57 118.33 112.41 1ffj n VAL 27 Ca 0.00 0.71 0.26 0.00 -2.96 0.00 0.00 64.34 62.35 1ffj n VAL 27 Cb 0.52 -1.71 0.48 0.00 -1.06 0.00 0.00 33.84 32.08 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 -3.16 1.55 0.00 -1.26 -4.42 120.51 112.32 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 -0.08 0.00 0.00 0.00 0.00 19.45 18.54 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 -0.82 -0.30 0.00 0.00 -1.06 -5.03 121.76 109.16 1ffj s ALA 29 Ca -0.08 0.26 0.27 0.00 0.00 0.00 0.00 51.96 52.41 1ffj s ALA 29 Cb 0.29 0.19 0.87 0.00 0.00 0.00 0.00 23.12 24.48 1ffj s ALA 29 CO 0.68 -0.34 1.78 -1.00 0.00 0.00 0.00 175.76 176.88 1ffj h PRO 30 N 3.49 0.00 -2.02 0.00 0.13 -1.84 -3.33 132.00 128.44 1ffj h PRO 30 Ca -0.30 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.29 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 0.42 0.00 -1.10 1.58 -0.23 0.00 0.00 178.00 178.67 1ffj n HIS 31 N -2.84 0.20 -3.16 1.56 -0.00 -1.26 -4.99 115.22 104.73 1ffj n HIS 31 Ca 0.03 -3.70 -0.06 0.00 0.46 0.00 0.00 57.72 54.44 1ffj n HIS 31 Cb 0.39 -0.39 -0.03 0.00 -0.12 0.00 0.00 29.99 29.84 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 -1.83 -0.76 0.69 3.57 1.01 -1.25 -5.15 120.40 116.67 1ffj s VAL 32 Ca 0.38 -0.62 -0.11 0.00 0.00 0.00 0.00 61.98 61.62 1ffj s VAL 32 Cb 0.24 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.39 1ffj s VAL 32 CO -0.09 -0.22 1.06 -2.16 0.00 0.00 0.00 175.10 173.69 1ffj s PRO 33 N 1.42 2.97 -0.10 2.72 0.04 -1.26 -3.97 135.00 136.83 1ffj s PRO 33 Ca 0.20 0.97 0.03 0.00 0.04 0.00 0.00 61.00 62.25 1ffj s PRO 33 Cb -0.05 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 1ffj s PRO 33 CO -0.06 -1.07 -0.05 1.55 0.04 0.00 0.00 177.00 177.41 1ffj n VAL 34 N -3.04 0.59 -3.58 -0.36 3.14 -0.83 -4.93 118.33 109.32 1ffj n VAL 34 Ca 0.08 -0.28 -0.11 0.00 -2.96 0.00 0.00 64.34 61.07 1ffj n VAL 34 Cb 0.53 -0.84 -0.05 0.00 -1.06 0.00 0.00 33.84 32.42 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 -2.21 0.63 0.18 1.45 -2.85 -1.05 -5.02 119.74 110.88 1ffj s LYS 35 Ca -0.10 0.20 -0.03 0.00 -1.00 0.00 0.00 55.97 55.04 1ffj s LYS 35 Cb 0.03 0.30 -0.03 0.00 -2.06 0.00 0.00 37.83 36.06 1ffj s LYS 35 CO 0.28 -0.19 0.16 1.03 0.10 0.00 0.00 175.35 176.74 1ffj s ARG 36 N -0.98 1.16 0.00 1.78 0.52 -1.26 -1.50 118.95 118.67 1ffj s ARG 36 Ca -0.02 -1.49 0.00 0.00 -0.52 0.00 0.00 55.73 53.69 1ffj s ARG 36 Cb -0.01 0.30 0.00 0.00 0.52 0.00 0.00 34.95 35.76 1ffj s ARG 36 CO 0.02 -0.39 0.00 0.41 0.02 0.00 0.00 175.30 175.36 1ffj n GLY 37 N -0.23 1.25 3.24 -3.53 0.00 -1.01 -3.28 105.19 101.62 1ffj n GLY 37 Ca -0.01 -0.41 -0.26 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.69 0.00 -0.18 0.00 1.10 -0.55 -4.88 121.20 115.99 1ffj s ILE 39 Ca 0.08 -1.46 -0.08 0.00 -0.51 0.00 0.00 60.65 58.67 1ffj s ILE 39 Cb -0.09 -2.72 -0.08 0.00 0.15 0.00 0.00 42.46 39.72 1ffj s ILE 39 CO 0.01 0.00 -0.23 -0.67 -2.11 0.00 0.00 174.94 171.94 1ffj n ASP 40 N -1.49 1.35 -4.58 4.50 2.03 -1.26 -2.49 116.55 114.62 1ffj n ASP 40 Ca -0.01 0.20 -0.31 0.00 0.52 0.00 0.00 54.79 55.19 1ffj n ASP 40 Cb 0.61 -0.51 -0.10 0.00 -0.72 0.00 0.00 41.12 40.39 1ffj n ASP 40 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1ffj s VAL 41 N -2.33 3.49 -0.03 5.18 0.11 -1.26 -4.70 120.40 120.86 1ffj s VAL 41 Ca -0.25 -0.96 -0.19 0.00 -2.93 0.00 0.00 61.98 57.64 1ffj s VAL 41 Cb 0.09 -2.55 -0.05 0.00 -1.53 0.00 0.00 36.38 32.34 1ffj s VAL 41 CO 0.32 0.30 0.54 0.00 -3.33 0.00 0.00 175.10 172.93 1ffj s PRO 43 N -0.08 1.77 0.38 0.00 0.04 -1.26 -4.99 135.00 130.86 1ffj s PRO 43 Ca 0.29 0.52 -0.27 0.00 0.04 0.00 0.00 61.00 61.58 1ffj s PRO 43 Cb -0.17 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 1ffj s PRO 43 CO 0.15 -1.81 1.35 0.21 0.04 0.00 0.00 177.00 176.94 1ffj s LYS 44 N -5.20 4.09 -0.14 4.56 2.47 -1.26 -4.88 119.74 119.38 1ffj s LYS 44 Ca 0.62 2.27 -0.16 0.00 -1.56 0.00 0.00 55.97 57.14 1ffj s LYS 44 Cb -0.14 -2.89 -0.04 0.00 -1.46 0.00 0.00 37.83 33.30 1ffj s LYS 44 CO 0.54 -0.43 0.40 -1.12 0.16 0.00 0.00 175.35 174.89 1ffj s SER 45 N -0.53 6.57 0.47 1.43 0.01 -1.26 -4.83 113.70 115.55 1ffj s SER 45 Ca 0.54 0.67 0.06 0.00 1.31 0.00 0.00 55.95 58.54 1ffj s SER 45 Cb -0.41 -2.24 -0.01 0.00 0.21 0.00 0.00 66.02 63.57 1ffj s SER 45 CO 0.53 0.04 0.29 -0.94 0.41 0.00 0.00 173.24 173.58 1ffj s SER 46 N 0.57 4.62 0.00 2.44 1.04 -0.71 -5.03 113.70 116.62 1ffj s SER 46 Ca 0.22 -1.10 -0.22 0.00 0.48 0.00 0.00 55.95 55.32 1ffj s SER 46 Cb -0.14 -0.12 -0.19 0.00 0.10 0.00 0.00 66.02 65.68 1ffj s SER 46 CO 0.07 -0.79 1.21 -0.07 0.98 0.00 0.00 173.24 174.65 1ffj h LEU 47 N 1.09 0.30 0.23 2.42 3.38 -2.03 -3.33 115.31 117.38 1ffj h LEU 47 Ca -0.40 -0.60 -0.01 0.00 0.09 0.00 0.00 57.88 56.96 1ffj h LEU 47 Cb 1.28 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1ffj h LEU 47 CO 0.63 0.85 -0.27 0.25 0.09 0.00 0.00 178.44 179.98 1ffj h LEU 48 N -0.23 -0.77 -9.26 1.67 5.85 -2.00 -3.44 115.31 107.13 1ffj h LEU 48 Ca -0.00 0.07 -0.62 0.00 0.84 0.00 0.00 57.88 58.16 1ffj h LEU 48 Cb 0.81 0.26 -0.14 0.00 0.37 0.00 0.00 40.66 41.96 1ffj h LEU 48 CO 0.04 -0.35 -0.75 0.68 -0.34 0.00 0.00 178.44 177.73 1ffj s VAL 49 N -4.51 2.81 0.06 1.05 -7.23 -1.25 -2.91 120.40 108.42 1ffj s VAL 49 Ca -0.09 -2.03 0.03 0.00 -1.81 0.00 0.00 61.98 58.08 1ffj s VAL 49 Cb 0.02 -2.43 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 1ffj s VAL 49 CO 0.32 -0.25 -0.09 -0.54 -0.31 0.00 0.00 175.10 174.23 1ffj s LYS 50 N -3.15 0.67 0.04 4.82 1.02 -1.12 -1.75 119.74 120.29 1ffj s LYS 50 Ca 0.27 -0.94 0.05 0.00 0.02 0.00 0.00 55.97 55.37 1ffj s LYS 50 Cb -0.07 -0.41 -0.02 0.00 -0.52 0.00 0.00 37.83 36.81 1ffj s LYS 50 CO 0.15 0.07 -0.16 0.71 -0.92 0.00 0.00 175.35 175.20 1ffj s TYR 51 N -1.85 1.36 0.01 3.18 2.02 -1.26 -3.10 117.35 117.71 1ffj s TYR 51 Ca -0.03 -0.36 0.05 0.00 -0.37 0.00 0.00 57.07 56.36 1ffj s TYR 51 Cb -0.07 -0.81 -0.01 0.00 -0.40 0.00 0.00 41.96 40.67 1ffj s TYR 51 CO -0.00 0.05 -0.14 0.08 -1.57 0.00 0.00 175.55 173.96 1ffj s VAL 52 N -0.83 1.14 0.14 0.71 1.01 -1.10 -4.92 120.40 116.54 1ffj s VAL 52 Ca 0.03 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 61.35 1ffj s VAL 52 Cb -0.08 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1ffj s VAL 52 CO 0.01 0.22 -0.21 0.00 0.00 0.00 0.00 175.10 175.12 1ffj n ASN 55 N 2.38 6.29 -4.08 0.00 0.23 -1.26 -1.89 115.26 116.92 1ffj n ASN 55 Ca -0.14 -3.59 -0.10 0.00 -0.53 0.00 0.00 54.58 50.23 1ffj n ASN 55 Cb 0.55 -1.05 -0.09 0.00 -2.08 0.00 0.00 39.78 37.12 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 -3.76 0.08 0.27 5.53 -4.23 -1.26 -5.06 115.64 107.22 1ffj s THR 56 Ca 0.39 -1.72 -0.29 0.00 -1.18 0.00 0.00 61.69 58.88 1ffj s THR 56 Cb 0.16 -2.00 -0.10 0.00 1.34 0.00 0.00 72.50 71.91 1ffj s THR 56 CO -0.05 -0.38 1.28 -1.81 -0.54 0.00 0.00 174.62 173.12 1ffj s ASP 57 N -3.02 6.89 -1.44 3.99 1.01 -1.26 -3.11 116.67 119.72 1ffj s ASP 57 Ca 0.22 2.52 -0.12 0.00 0.71 0.00 0.00 52.55 55.89 1ffj s ASP 57 Cb 0.06 -2.63 0.02 0.00 1.01 0.00 0.00 42.92 41.37 1ffj s ASP 57 CO 0.02 -0.48 0.22 2.29 0.21 0.00 0.00 175.17 177.43 1ffj n LYS 58 N 1.58 -0.70 -0.03 8.23 2.85 -1.00 -4.83 118.16 124.25 1ffj n LYS 58 Ca 0.02 0.08 -0.21 0.00 -1.05 0.00 0.00 58.31 57.15 1ffj n LYS 58 Cb 0.42 -3.21 -0.13 0.00 -0.65 0.00 0.00 35.03 31.46 1ffj n LYS 58 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35