#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 0.29 0.40 3.23 0.00 -1.26 -2.27 119.74 120.13 1ffj s LYS 2 Ca 0.00 0.37 0.04 0.00 0.00 0.00 0.00 55.97 56.37 1ffj s LYS 2 Cb 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 37.83 37.92 1ffj s LYS 2 CO 0.00 -0.04 0.07 0.00 0.00 0.00 0.00 175.35 175.38 1ffj s LYS 4 N -3.81 3.46 0.00 0.00 -0.14 -1.26 -1.76 119.74 116.23 1ffj s LYS 4 Ca 0.26 -0.25 0.00 0.00 -1.36 0.00 0.00 55.97 54.63 1ffj s LYS 4 Cb 0.05 -3.12 0.00 0.00 -1.68 0.00 0.00 37.83 33.09 1ffj s LYS 4 CO 0.13 0.70 0.00 1.63 -0.76 0.00 0.00 175.35 177.05 1ffj n LYS 5 N 1.22 -0.01 -0.09 1.68 4.76 -1.07 -4.64 118.16 120.01 1ffj n LYS 5 Ca -0.13 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.24 1ffj n LYS 5 Cb 0.53 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.67 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 -0.99 -9.61 -0.35 4.07 -1.89 -3.39 115.31 103.15 1ffj h LEU 6 Ca 0.00 0.13 -0.58 0.00 0.08 0.00 0.00 57.88 57.51 1ffj h LEU 6 Cb 0.00 0.41 -0.05 0.00 1.08 0.00 0.00 40.66 42.10 1ffj h LEU 6 CO 0.00 -0.20 -0.09 -0.69 -1.08 0.00 0.00 178.44 176.37 1ffj s VAL 7 N -4.37 4.91 -0.54 1.22 1.01 -1.26 -4.93 120.40 116.43 1ffj s VAL 7 Ca -0.07 1.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.93 1ffj s VAL 7 Cb 0.04 -3.84 -0.14 0.00 0.00 0.00 0.00 36.38 32.44 1ffj s VAL 7 CO 0.32 0.50 2.68 -0.81 0.00 0.00 0.00 175.10 177.80 1ffj n PRO 8 N 2.21 2.07 -0.02 2.72 -0.04 -1.26 -3.48 135.00 137.19 1ffj n PRO 8 Ca -0.10 -1.21 -0.03 0.00 -0.04 0.00 0.00 63.50 62.13 1ffj n PRO 8 Cb 0.51 -2.20 -0.02 0.00 -0.04 0.00 0.00 33.50 31.75 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 3.21 1.77 -4.14 1.53 4.77 -1.26 -5.05 117.00 117.83 1ffj n LEU 9 Ca 0.44 -0.01 -0.18 0.00 -0.03 0.00 0.00 56.01 56.23 1ffj n LEU 9 Cb 0.46 -0.06 -0.12 0.00 -2.33 0.00 0.00 43.42 41.37 1ffj n LEU 9 CO 0.43 0.38 -0.45 -0.36 -1.33 0.00 0.00 177.39 176.05 1ffj s PHE 10 N -2.09 1.13 0.14 -1.77 0.08 -1.23 -5.11 117.98 109.13 1ffj s PHE 10 Ca -0.04 -0.42 0.09 0.00 0.12 0.00 0.00 56.93 56.68 1ffj s PHE 10 Cb 0.01 -0.65 -0.04 0.00 -0.57 0.00 0.00 43.02 41.77 1ffj s PHE 10 CO 0.12 0.03 -0.21 -1.54 -0.10 0.00 0.00 175.22 173.52 1ffj s SER 11 N -1.50 2.86 0.08 1.36 1.04 -1.26 -2.58 113.70 113.69 1ffj s SER 11 Ca -0.02 -0.79 0.01 0.00 0.48 0.00 0.00 55.95 55.63 1ffj s SER 11 Cb -0.09 -0.18 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 1ffj s SER 11 CO 0.02 0.05 -0.06 -0.75 0.98 0.00 0.00 173.24 173.48 1ffj s LYS 12 N -2.38 0.74 -0.06 4.02 2.36 -0.72 -4.97 119.74 118.72 1ffj s LYS 12 Ca 0.13 -1.21 -0.09 0.00 -2.55 0.00 0.00 55.97 52.25 1ffj s LYS 12 Cb -0.08 -0.14 -0.05 0.00 -1.05 0.00 0.00 37.83 36.51 1ffj s LYS 12 CO 0.06 -0.02 0.23 0.99 1.55 0.00 0.00 175.35 178.16 1ffj s THR 13 N -3.29 5.35 -0.36 3.43 2.01 -1.26 -1.49 115.64 120.03 1ffj s THR 13 Ca 0.07 0.35 -0.17 0.00 0.31 0.00 0.00 61.69 62.25 1ffj s THR 13 Cb 0.03 -3.51 -0.00 0.00 0.01 0.00 0.00 72.50 69.03 1ffj s THR 13 CO -0.05 0.55 0.46 0.00 -0.69 0.00 0.00 174.62 174.89 1ffj s PRO 15 N 2.25 -0.20 0.42 0.00 0.04 -1.26 -4.73 135.00 131.54 1ffj s PRO 15 Ca 0.16 -0.21 -0.22 0.00 0.04 0.00 0.00 61.00 60.77 1ffj s PRO 15 Cb -0.16 -1.73 -0.14 0.00 0.04 0.00 0.00 34.50 32.51 1ffj s PRO 15 CO 0.13 -3.01 0.35 0.00 0.04 0.00 0.00 177.00 174.51 1ffj n ALA 16 N -4.23 -2.13 0.00 8.56 0.00 -1.26 -1.84 120.51 119.61 1ffj n ALA 16 Ca 0.14 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1ffj n ALA 16 Cb 0.59 -1.65 0.00 0.00 0.00 0.00 0.00 19.45 18.40 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 2.03 3.12 2.88 0.00 0.00 -1.26 -4.95 105.19 107.00 1ffj n GLY 17 Ca 0.11 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 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 1.33 0.00 1.61 -2.85 -0.77 -4.06 119.74 115.00 1ffj s LYS 18 Ca 0.00 -0.86 0.00 0.00 -1.00 0.00 0.00 55.97 54.11 1ffj s LYS 18 Cb 0.00 -2.45 0.00 0.00 -2.06 0.00 0.00 37.83 33.32 1ffj s LYS 18 CO 0.00 -0.63 0.51 0.09 0.10 0.00 0.00 175.35 175.42 1ffj n ASN 19 N 4.77 0.97 -4.27 0.03 4.13 -1.14 -3.99 115.26 115.77 1ffj n ASN 19 Ca -0.11 -1.17 -0.32 0.00 1.68 0.00 0.00 54.58 54.66 1ffj n ASN 19 Cb 0.45 0.00 -0.16 0.00 -1.54 0.00 0.00 39.78 38.53 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 -0.17 2.30 0.22 3.41 1.02 -1.05 -4.78 118.68 119.63 1ffj s LEU 20 Ca 0.00 -0.48 -0.27 0.00 0.02 0.00 0.00 54.13 53.40 1ffj s LEU 20 Cb 0.00 -1.48 -0.09 0.00 0.02 0.00 0.00 46.19 44.65 1ffj s LEU 20 CO 0.00 0.16 0.86 0.00 0.02 0.00 0.00 176.35 177.39 1ffj s TYR 22 N -1.27 1.95 -0.06 0.00 -0.85 -0.32 -2.18 117.35 114.62 1ffj s TYR 22 Ca 0.41 -0.40 -0.01 0.00 -0.52 0.00 0.00 57.07 56.55 1ffj s TYR 22 Cb -0.23 -1.10 0.03 0.00 0.38 0.00 0.00 41.96 41.04 1ffj s TYR 22 CO 0.27 0.20 0.01 -1.59 -1.52 0.00 0.00 175.55 172.92 1ffj s LYS 23 N -1.69 0.47 -0.21 -3.49 -2.85 -0.90 -2.39 119.74 108.69 1ffj s LYS 23 Ca 0.09 0.13 -0.04 0.00 -1.00 0.00 0.00 55.97 55.15 1ffj s LYS 23 Cb -0.10 -0.81 -0.01 0.00 -2.06 0.00 0.00 37.83 34.85 1ffj s LYS 23 CO 0.04 -0.26 -0.04 -1.64 0.10 0.00 0.00 175.35 173.55 1ffj s MET 24 N 1.75 3.45 0.14 1.78 -1.94 -0.54 -2.79 119.30 121.16 1ffj s MET 24 Ca 0.01 -0.60 -0.06 0.00 -1.71 0.00 0.00 55.69 53.33 1ffj s MET 24 Cb -0.13 -2.99 -0.02 0.00 2.01 0.00 0.00 34.83 33.70 1ffj s MET 24 CO -0.04 -0.10 0.18 -0.59 -0.01 0.00 0.00 175.02 174.47 1ffj s PHE 25 N 1.23 0.53 0.14 -0.03 -0.12 -1.19 -1.83 117.98 116.71 1ffj s PHE 25 Ca 0.03 -0.92 -0.12 0.00 -0.05 0.00 0.00 56.93 55.87 1ffj s PHE 25 Cb -0.14 -0.21 -0.07 0.00 -0.63 0.00 0.00 43.02 41.97 1ffj s PHE 25 CO -0.01 -0.62 0.50 -1.64 -0.05 0.00 0.00 175.22 173.41 1ffj s MET 26 N -3.98 3.87 0.33 1.99 -1.94 -1.24 -2.73 119.30 115.60 1ffj s MET 26 Ca 0.18 0.34 0.21 0.00 -1.71 0.00 0.00 55.69 54.71 1ffj s MET 26 Cb 0.05 -2.89 1.14 0.00 2.01 0.00 0.00 34.83 35.14 1ffj s MET 26 CO -0.01 0.47 1.63 1.55 -0.01 0.00 0.00 175.02 178.65 1ffj n VAL 27 N 0.62 0.96 -0.28 -6.03 3.14 -1.14 -2.53 118.33 113.08 1ffj n VAL 27 Ca -0.05 0.75 0.19 0.00 -2.96 0.00 0.00 64.34 62.27 1ffj n VAL 27 Cb 0.52 -1.75 0.36 0.00 -1.06 0.00 0.00 33.84 31.91 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 -1.76 0.62 -3.20 1.55 0.00 -1.26 -4.45 120.51 112.01 1ffj n ALA 28 Ca -0.01 0.88 -0.13 0.00 0.00 0.00 0.00 53.44 54.17 1ffj n ALA 28 Cb 0.07 -0.74 -0.07 0.00 0.00 0.00 0.00 19.45 18.70 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 -5.57 -0.92 -1.48 0.00 0.00 -1.05 -5.02 121.76 107.73 1ffj s ALA 29 Ca -0.09 0.35 0.23 0.00 0.00 0.00 0.00 51.96 52.45 1ffj s ALA 29 Cb 0.26 0.19 1.16 0.00 0.00 0.00 0.00 23.12 24.74 1ffj s ALA 29 CO 0.65 -0.35 1.74 -0.35 0.00 0.00 0.00 175.76 177.45 1ffj n PRO 30 N 0.89 0.36 -3.11 0.00 -0.04 -1.26 -3.78 135.00 128.05 1ffj n PRO 30 Ca -0.20 0.07 -0.21 0.00 -0.04 0.00 0.00 63.50 63.12 1ffj n PRO 30 Cb 0.58 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.26 -0.90 -2.90 0.54 -0.00 -1.26 -5.00 115.22 104.44 1ffj n HIS 31 Ca 0.11 -3.24 -0.08 0.00 0.46 0.00 0.00 57.72 54.98 1ffj n HIS 31 Cb 0.17 -0.01 -0.01 0.00 -0.12 0.00 0.00 29.99 30.02 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 -0.84 -0.78 0.54 3.57 1.01 -1.25 -5.15 120.40 117.51 1ffj s VAL 32 Ca 0.34 -1.21 -0.18 0.00 0.00 0.00 0.00 61.98 60.94 1ffj s VAL 32 Cb 0.18 -0.21 -0.06 0.00 0.00 0.00 0.00 36.38 36.29 1ffj s VAL 32 CO -0.14 -0.21 1.04 -2.16 0.00 0.00 0.00 175.10 173.64 1ffj s PRO 33 N 0.81 3.57 -0.05 2.72 0.04 -1.26 -3.62 135.00 137.21 1ffj s PRO 33 Ca 0.29 1.25 0.01 0.00 0.04 0.00 0.00 61.00 62.59 1ffj s PRO 33 Cb 0.00 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 1ffj s PRO 33 CO -0.07 -0.61 -0.04 1.55 0.04 0.00 0.00 177.00 177.87 1ffj n VAL 34 N -1.56 0.29 -3.58 -0.36 3.14 -0.76 -4.96 118.33 110.53 1ffj n VAL 34 Ca 0.09 -0.12 -0.16 0.00 -2.96 0.00 0.00 64.34 61.19 1ffj n VAL 34 Cb 0.53 -0.71 -0.07 0.00 -1.06 0.00 0.00 33.84 32.53 1ffj n VAL 34 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 1ffj s LYS 35 N -2.10 0.92 0.25 1.45 2.20 -1.06 -5.06 119.74 116.33 1ffj s LYS 35 Ca -0.06 0.66 -0.04 0.00 -0.36 0.00 0.00 55.97 56.17 1ffj s LYS 35 Cb 0.02 0.44 -0.02 0.00 -1.51 0.00 0.00 37.83 36.76 1ffj s LYS 35 CO 0.12 -0.20 0.29 1.03 -0.36 0.00 0.00 175.35 176.24 1ffj s ARG 36 N -0.33 1.45 0.00 4.03 3.00 -1.26 -1.46 118.95 124.38 1ffj s ARG 36 Ca -0.05 -1.57 0.00 0.00 0.00 0.00 0.00 55.73 54.11 1ffj s ARG 36 Cb -0.03 0.36 0.00 0.00 0.00 0.00 0.00 34.95 35.28 1ffj s ARG 36 CO 0.05 -0.54 0.00 0.41 0.00 0.00 0.00 175.30 175.21 1ffj n GLY 37 N -0.38 -0.96 3.94 -3.53 0.00 -1.01 -4.51 105.19 98.75 1ffj n GLY 37 Ca 0.01 -0.94 -0.25 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.03 0.00 -0.07 0.00 3.06 -0.61 -4.83 119.36 115.87 1ffj n ILE 39 Ca -0.06 -0.66 -0.15 0.00 -2.50 0.00 0.00 62.75 59.37 1ffj n ILE 39 Cb 0.55 0.76 -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 -0.67 -2.50 0.00 0.00 176.55 173.38 1ffj n ASP 40 N -1.33 1.39 -4.38 9.51 4.64 -1.26 -2.54 116.55 122.59 1ffj n ASP 40 Ca -0.05 0.14 -0.22 0.00 -1.38 0.00 0.00 54.79 53.28 1ffj n ASP 40 Cb 0.51 -0.40 -0.11 0.00 -1.04 0.00 0.00 41.12 40.07 1ffj n ASP 40 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1ffj s VAL 41 N -2.28 2.02 -0.01 5.18 1.01 -1.26 -4.71 120.40 120.35 1ffj s VAL 41 Ca -0.21 -2.09 -0.16 0.00 0.00 0.00 0.00 61.98 59.53 1ffj s VAL 41 Cb 0.08 -2.01 -0.06 0.00 0.00 0.00 0.00 36.38 34.38 1ffj s VAL 41 CO 0.28 -0.35 0.44 0.00 0.00 0.00 0.00 175.10 175.46 1ffj s PRO 43 N -0.78 2.79 0.34 0.00 0.04 -1.26 -4.97 135.00 131.15 1ffj s PRO 43 Ca 0.25 0.90 -0.29 0.00 0.04 0.00 0.00 61.00 61.90 1ffj s PRO 43 Cb -0.17 -1.98 -0.12 0.00 0.04 0.00 0.00 34.50 32.28 1ffj s PRO 43 CO 0.14 -1.19 1.50 1.17 0.04 0.00 0.00 177.00 178.65 1ffj n LYS 44 N -3.19 2.59 -3.22 4.56 3.00 -1.26 -4.85 118.16 115.81 1ffj n LYS 44 Ca 0.07 0.91 -0.39 0.00 -0.00 0.00 0.00 58.31 58.91 1ffj n LYS 44 Cb 0.54 -2.64 -0.06 0.00 0.00 0.00 0.00 35.03 32.87 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 0.08 6.75 0.49 3.14 0.01 -1.26 -4.83 113.70 118.08 1ffj s SER 45 Ca 0.58 0.89 0.06 0.00 1.31 0.00 0.00 55.95 58.80 1ffj s SER 45 Cb -0.50 -2.33 0.01 0.00 0.21 0.00 0.00 66.02 63.41 1ffj s SER 45 CO 0.58 -0.08 0.36 -0.94 0.41 0.00 0.00 173.24 173.56 1ffj s SER 46 N 0.80 4.70 -0.04 2.44 1.04 -0.65 -5.03 113.70 116.97 1ffj s SER 46 Ca 0.29 -1.08 -0.25 0.00 0.48 0.00 0.00 55.95 55.38 1ffj s SER 46 Cb -0.16 0.00 -0.21 0.00 0.10 0.00 0.00 66.02 65.75 1ffj s SER 46 CO 0.12 -0.89 1.13 -0.07 0.98 0.00 0.00 173.24 174.51 1ffj h LEU 47 N 0.94 0.11 0.17 2.42 3.38 -2.02 -3.35 115.31 116.95 1ffj h LEU 47 Ca -0.39 -0.65 -0.01 0.00 0.09 0.00 0.00 57.88 56.92 1ffj h LEU 47 Cb 1.28 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1ffj h LEU 47 CO 0.59 0.75 -0.14 0.25 0.09 0.00 0.00 178.44 179.98 1ffj h LEU 48 N -0.51 -0.38 -9.26 1.67 5.85 -2.00 -3.44 115.31 107.23 1ffj h LEU 48 Ca -0.01 0.03 -0.67 0.00 0.84 0.00 0.00 57.88 58.08 1ffj h LEU 48 Cb 0.74 0.12 -0.16 0.00 0.37 0.00 0.00 40.66 41.74 1ffj h LEU 48 CO 0.02 -0.20 -0.71 0.68 -0.34 0.00 0.00 178.44 177.89 1ffj s VAL 49 N -3.80 3.60 0.04 1.05 -7.23 -1.26 -2.88 120.40 109.93 1ffj s VAL 49 Ca -0.05 -0.99 0.05 0.00 -1.81 0.00 0.00 61.98 59.18 1ffj s VAL 49 Cb 0.01 -2.63 -0.02 0.00 0.56 0.00 0.00 36.38 34.30 1ffj s VAL 49 CO 0.17 0.25 -0.14 -0.54 -0.31 0.00 0.00 175.10 174.52 1ffj s LYS 50 N -1.85 0.94 0.19 4.82 1.02 -1.11 -1.63 119.74 122.12 1ffj s LYS 50 Ca 0.20 -0.79 0.07 0.00 0.02 0.00 0.00 55.97 55.47 1ffj s LYS 50 Cb -0.11 -0.95 -0.05 0.00 -0.52 0.00 0.00 37.83 36.20 1ffj s LYS 50 CO 0.12 0.23 -0.14 0.71 -0.92 0.00 0.00 175.35 175.35 1ffj s TYR 51 N -0.90 1.62 -0.13 3.18 2.02 -1.26 -3.19 117.35 118.69 1ffj s TYR 51 Ca 0.01 -0.60 -0.11 0.00 -0.37 0.00 0.00 57.07 56.00 1ffj s TYR 51 Cb -0.08 -0.77 0.03 0.00 -0.40 0.00 0.00 41.96 40.74 1ffj s TYR 51 CO 0.01 0.30 0.33 0.08 -1.57 0.00 0.00 175.55 174.71 1ffj s VAL 52 N -2.96 -0.00 0.39 0.71 1.01 -1.12 -4.90 120.40 113.53 1ffj s VAL 52 Ca 0.21 0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.27 1ffj s VAL 52 Cb -0.01 -0.47 -0.07 0.00 0.00 0.00 0.00 36.38 35.83 1ffj s VAL 52 CO 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 175.10 175.15 1ffj n ASN 55 N 1.57 6.66 -3.93 0.00 0.23 -1.26 -1.80 115.26 116.73 1ffj n ASN 55 Ca -0.10 -3.63 -0.12 0.00 -0.53 0.00 0.00 54.58 50.20 1ffj n ASN 55 Cb 0.57 -1.08 -0.13 0.00 -2.08 0.00 0.00 39.78 37.06 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 -4.02 0.13 0.03 5.53 -4.23 -1.26 -5.05 115.64 106.76 1ffj s THR 56 Ca 0.39 -0.40 -0.30 0.00 -1.18 0.00 0.00 61.69 60.20 1ffj s THR 56 Cb 0.18 -0.18 -0.09 0.00 1.34 0.00 0.00 72.50 73.75 1ffj s THR 56 CO -0.09 -0.18 1.95 -1.81 -0.54 0.00 0.00 174.62 173.96 1ffj s ASP 57 N -0.61 6.45 -1.00 3.99 1.01 -1.26 -2.09 116.67 123.16 1ffj s ASP 57 Ca -0.06 2.63 -0.03 0.00 0.71 0.00 0.00 52.55 55.80 1ffj s ASP 57 Cb -0.04 -2.53 -0.03 0.00 1.01 0.00 0.00 42.92 41.32 1ffj s ASP 57 CO -0.00 -1.06 0.85 0.29 0.21 0.00 0.00 175.17 175.46 1ffj n LYS 58 N 7.53 -3.85 -0.08 8.23 4.01 -0.98 -4.95 118.16 128.07 1ffj n LYS 58 Ca 0.20 0.77 -0.20 0.00 -0.51 0.00 0.00 58.31 58.56 1ffj n LYS 58 Cb 0.41 -5.43 -0.12 0.00 -0.51 0.00 0.00 35.03 29.39 1ffj n LYS 58 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29