#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 1.50 0.26 1.47 1.02 -1.26 -2.42 119.74 120.32 1ffj s LYS 2 Ca 0.00 -0.34 0.03 0.00 0.02 0.00 0.00 55.97 55.68 1ffj s LYS 2 Cb 0.00 -1.27 -0.01 0.00 -0.52 0.00 0.00 37.83 36.02 1ffj s LYS 2 CO 0.00 0.00 0.11 0.00 -0.92 0.00 0.00 175.35 174.54 1ffj s LYS 4 N -3.01 3.53 0.10 0.00 1.02 -1.26 -1.83 119.74 118.28 1ffj s LYS 4 Ca 0.15 -0.29 -0.00 0.00 0.02 0.00 0.00 55.97 55.84 1ffj s LYS 4 Cb 0.01 -2.86 0.02 0.00 -0.52 0.00 0.00 37.83 34.48 1ffj s LYS 4 CO 0.11 0.43 0.13 1.63 -0.92 0.00 0.00 175.35 176.73 1ffj n LYS 5 N -0.41 0.39 -0.05 1.68 5.02 -1.02 -4.71 118.16 119.07 1ffj n LYS 5 Ca -0.04 -0.32 -0.01 0.00 -2.02 0.00 0.00 58.31 55.91 1ffj n LYS 5 Cb 0.53 -0.10 -0.01 0.00 -0.02 0.00 0.00 35.03 35.43 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 -0.28 -9.68 -0.35 4.07 -1.89 -3.38 115.31 103.80 1ffj h LEU 6 Ca -0.04 0.04 -0.57 0.00 0.08 0.00 0.00 57.88 57.39 1ffj h LEU 6 Cb 0.15 0.12 -0.04 0.00 1.08 0.00 0.00 40.66 41.97 1ffj h LEU 6 CO 0.04 -0.03 0.00 -0.69 -1.08 0.00 0.00 178.44 176.68 1ffj s VAL 7 N -3.33 4.71 -0.53 1.22 1.01 -1.26 -4.83 120.40 117.40 1ffj s VAL 7 Ca -0.02 1.30 -0.06 0.00 0.00 0.00 0.00 61.98 63.20 1ffj s VAL 7 Cb 0.01 -3.94 -0.14 0.00 0.00 0.00 0.00 36.38 32.31 1ffj s VAL 7 CO 0.08 0.53 2.69 -0.81 0.00 0.00 0.00 175.10 177.59 1ffj n PRO 8 N 1.85 2.05 -0.02 2.72 -0.04 -1.26 -3.47 135.00 136.82 1ffj n PRO 8 Ca -0.09 -1.19 -0.02 0.00 -0.04 0.00 0.00 63.50 62.16 1ffj n PRO 8 Cb 0.50 -2.19 -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 3.19 1.71 -4.23 1.53 4.77 -1.26 -5.07 117.00 117.63 1ffj n LEU 9 Ca 0.44 -0.01 -0.13 0.00 -0.03 0.00 0.00 56.01 56.28 1ffj n LEU 9 Cb 0.47 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.41 1ffj n LEU 9 CO 0.42 0.36 -0.32 -0.36 -1.33 0.00 0.00 177.39 176.16 1ffj s PHE 10 N -2.08 1.17 0.18 -1.77 0.40 -1.23 -5.11 117.98 109.54 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 -0.66 -0.04 0.00 0.51 0.00 0.00 43.02 42.83 1ffj s PHE 10 CO 0.11 -0.28 -0.19 -1.54 0.70 0.00 0.00 175.22 174.02 1ffj s SER 11 N -3.16 2.89 0.09 1.36 1.04 -1.26 -2.44 113.70 112.22 1ffj s SER 11 Ca 0.25 -0.88 0.02 0.00 0.48 0.00 0.00 55.95 55.82 1ffj s SER 11 Cb 0.06 -0.19 -0.04 0.00 0.10 0.00 0.00 66.02 65.96 1ffj s SER 11 CO 0.04 -0.00 -0.07 -0.75 0.98 0.00 0.00 173.24 173.44 1ffj s LYS 12 N -2.86 0.78 -0.11 4.02 2.47 -0.76 -4.90 119.74 118.38 1ffj s LYS 12 Ca 0.18 -1.23 -0.09 0.00 -1.56 0.00 0.00 55.97 53.28 1ffj s LYS 12 Cb -0.06 -0.22 -0.04 0.00 -1.46 0.00 0.00 37.83 36.05 1ffj s LYS 12 CO 0.08 -0.01 0.19 0.99 0.16 0.00 0.00 175.35 176.76 1ffj s THR 13 N -3.21 5.42 -0.37 3.43 2.01 -1.26 -2.12 115.64 119.54 1ffj s THR 13 Ca 0.08 0.32 -0.28 0.00 0.31 0.00 0.00 61.69 62.12 1ffj s THR 13 Cb 0.02 -3.46 0.02 0.00 0.01 0.00 0.00 72.50 69.09 1ffj s THR 13 CO -0.04 0.59 1.04 0.00 -0.69 0.00 0.00 174.62 175.52 1ffj s PRO 15 N 3.75 2.29 0.60 0.00 0.04 -1.26 -4.86 135.00 135.55 1ffj s PRO 15 Ca 0.43 0.72 -0.18 0.00 0.04 0.00 0.00 61.00 62.01 1ffj s PRO 15 Cb -0.11 -1.94 -0.14 0.00 0.04 0.00 0.00 34.50 32.35 1ffj s PRO 15 CO 0.20 -1.50 -0.16 0.00 0.04 0.00 0.00 177.00 175.58 1ffj n ALA 16 N -3.36 -3.27 0.00 8.56 0.00 -1.26 -1.83 120.51 119.35 1ffj n ALA 16 Ca 0.07 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1ffj n ALA 16 Cb 0.56 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 2.58 2.56 3.06 0.00 0.00 -1.26 -4.93 105.19 107.20 1ffj n GLY 17 Ca 0.07 -0.62 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 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 2.14 0.00 1.61 -2.85 -0.76 -4.31 119.74 115.57 1ffj s LYS 18 Ca 0.00 -1.42 0.03 0.00 -1.00 0.00 0.00 55.97 53.58 1ffj s LYS 18 Cb 0.00 -2.94 0.05 0.00 -2.06 0.00 0.00 37.83 32.88 1ffj s LYS 18 CO 0.00 -0.62 0.85 0.09 0.10 0.00 0.00 175.35 175.77 1ffj n ASN 19 N 4.41 1.78 -4.22 0.03 3.02 -1.19 -4.16 115.26 114.93 1ffj n ASN 19 Ca -0.12 -1.61 -0.32 0.00 -0.03 0.00 0.00 54.58 52.50 1ffj n ASN 19 Cb 0.42 -0.03 -0.17 0.00 -0.61 0.00 0.00 39.78 39.39 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 -0.66 2.13 0.04 3.41 1.43 -1.07 -4.76 118.68 119.20 1ffj s LEU 20 Ca 0.04 -0.55 -0.22 0.00 -1.03 0.00 0.00 54.13 52.37 1ffj s LEU 20 Cb 0.03 -1.42 -0.06 0.00 0.03 0.00 0.00 46.19 44.76 1ffj s LEU 20 CO 0.04 0.15 0.66 0.00 0.23 0.00 0.00 176.35 177.43 1ffj s TYR 22 N -0.42 1.74 -0.05 0.00 -0.85 -0.43 -2.23 117.35 115.10 1ffj s TYR 22 Ca 0.33 -0.43 -0.01 0.00 -0.52 0.00 0.00 57.07 56.44 1ffj s TYR 22 Cb -0.20 -0.94 0.03 0.00 0.38 0.00 0.00 41.96 41.23 1ffj s TYR 22 CO 0.20 0.20 0.02 0.21 -1.52 0.00 0.00 175.55 174.67 1ffj s LYS 23 N -2.00 0.27 -0.22 -3.49 2.20 -0.86 -2.41 119.74 113.22 1ffj s LYS 23 Ca 0.07 0.20 -0.05 0.00 -0.36 0.00 0.00 55.97 55.82 1ffj s LYS 23 Cb -0.09 -0.66 -0.02 0.00 -1.51 0.00 0.00 37.83 35.55 1ffj s LYS 23 CO 0.04 -0.26 0.01 -1.64 -0.36 0.00 0.00 175.35 173.14 1ffj s MET 24 N 1.75 3.54 0.02 4.03 -1.94 -0.64 -2.70 119.30 123.37 1ffj s MET 24 Ca 0.01 -0.54 -0.02 0.00 -1.71 0.00 0.00 55.69 53.43 1ffj s MET 24 Cb -0.13 -3.14 -0.02 0.00 2.01 0.00 0.00 34.83 33.56 1ffj s MET 24 CO -0.03 -0.14 0.01 -0.59 -0.01 0.00 0.00 175.02 174.26 1ffj s PHE 25 N 1.39 0.25 0.26 -0.03 -0.71 -1.19 -1.84 117.98 116.12 1ffj s PHE 25 Ca 0.05 -0.52 -0.07 0.00 -1.04 0.00 0.00 56.93 55.35 1ffj s PHE 25 Cb -0.15 -0.18 -0.06 0.00 -1.21 0.00 0.00 43.02 41.42 1ffj s PHE 25 CO 0.01 -0.24 0.56 -1.64 -1.34 0.00 0.00 175.22 172.57 1ffj s MET 26 N -1.76 3.71 0.27 1.99 -1.94 -1.25 -2.80 119.30 117.52 1ffj s MET 26 Ca -0.13 0.14 0.18 0.00 -1.71 0.00 0.00 55.69 54.18 1ffj s MET 26 Cb -0.07 -2.64 1.00 0.00 2.01 0.00 0.00 34.83 35.13 1ffj s MET 26 CO -0.02 0.25 1.56 1.55 -0.01 0.00 0.00 175.02 178.36 1ffj n VAL 27 N -0.57 1.18 -0.28 -6.03 3.14 -0.98 -2.59 118.33 112.21 1ffj n VAL 27 Ca -0.01 0.70 0.27 0.00 -2.96 0.00 0.00 64.34 62.35 1ffj n VAL 27 Cb 0.53 -1.70 0.50 0.00 -1.06 0.00 0.00 33.84 32.11 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 0.88 -3.24 1.55 0.00 -1.26 -4.42 120.51 112.27 1ffj n ALA 28 Ca -0.01 0.88 -0.14 0.00 0.00 0.00 0.00 53.44 54.17 1ffj n ALA 28 Cb 0.03 -0.87 -0.07 0.00 0.00 0.00 0.00 19.45 18.53 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 -5.32 -1.03 -0.57 0.00 0.00 -1.07 -5.03 121.76 108.75 1ffj s ALA 29 Ca -0.08 0.47 0.25 0.00 0.00 0.00 0.00 51.96 52.60 1ffj s ALA 29 Cb 0.29 0.17 0.90 0.00 0.00 0.00 0.00 23.12 24.48 1ffj s ALA 29 CO 0.67 -0.36 1.75 -1.00 0.00 0.00 0.00 175.76 176.82 1ffj h PRO 30 N 3.37 0.00 -1.88 0.00 0.13 -1.84 -3.32 132.00 128.47 1ffj h PRO 30 Ca -0.30 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.34 1ffj h PRO 30 Cb 1.18 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.93 1ffj h PRO 30 CO 0.41 0.00 -1.12 1.58 -0.23 0.00 0.00 178.00 178.64 1ffj n HIS 31 N -2.32 -0.23 -3.30 1.56 -0.00 -1.26 -5.01 115.22 104.66 1ffj n HIS 31 Ca 0.04 -3.61 -0.10 0.00 0.46 0.00 0.00 57.72 54.51 1ffj n HIS 31 Cb 0.34 -0.27 -0.05 0.00 -0.12 0.00 0.00 29.99 29.89 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 -1.78 -0.60 0.74 3.57 1.01 -1.25 -5.15 120.40 116.95 1ffj s VAL 32 Ca 0.37 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.64 1ffj s VAL 32 Cb 0.28 -0.42 0.03 0.00 0.00 0.00 0.00 36.38 36.27 1ffj s VAL 32 CO -0.09 -0.35 1.08 -2.16 0.00 0.00 0.00 175.10 173.57 1ffj s PRO 33 N 1.60 2.57 -0.03 2.72 0.04 -1.26 -3.93 135.00 136.71 1ffj s PRO 33 Ca 0.17 0.82 0.00 0.00 0.04 0.00 0.00 61.00 62.02 1ffj s PRO 33 Cb -0.11 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.46 1ffj s PRO 33 CO -0.05 -1.33 -0.02 1.55 0.04 0.00 0.00 177.00 177.19 1ffj n VAL 34 N -3.26 0.14 -3.63 -0.36 3.14 -0.76 -4.92 118.33 108.68 1ffj n VAL 34 Ca 0.07 -0.06 -0.12 0.00 -2.96 0.00 0.00 64.34 61.28 1ffj n VAL 34 Cb 0.55 -0.59 -0.07 0.00 -1.06 0.00 0.00 33.84 32.67 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 -2.05 0.68 0.24 1.45 2.20 -1.06 -5.07 119.74 116.12 1ffj s LYS 35 Ca -0.03 0.75 0.01 0.00 -0.36 0.00 0.00 55.97 56.33 1ffj s LYS 35 Cb 0.01 0.33 -0.04 0.00 -1.51 0.00 0.00 37.83 36.62 1ffj s LYS 35 CO 0.06 -0.09 0.14 1.03 -0.36 0.00 0.00 175.35 176.13 1ffj s ARG 36 N 0.20 1.34 0.00 4.03 0.52 -1.26 -1.61 118.95 122.16 1ffj s ARG 36 Ca 0.01 -1.73 0.00 0.00 -0.52 0.00 0.00 55.73 53.49 1ffj s ARG 36 Cb -0.05 0.13 0.00 0.00 0.52 0.00 0.00 34.95 35.56 1ffj s ARG 36 CO -0.02 -0.41 0.00 0.41 0.02 0.00 0.00 175.30 175.30 1ffj n GLY 37 N -0.38 -1.00 3.71 -3.53 0.00 -1.01 -4.48 105.19 98.51 1ffj n GLY 37 Ca 0.02 -0.94 -0.28 0.00 0.00 0.00 0.00 46.02 44.83 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 0.08 0.00 -0.03 0.00 3.06 -0.55 -4.91 119.36 117.02 1ffj n ILE 39 Ca -0.10 -0.33 -0.05 0.00 -2.50 0.00 0.00 62.75 59.77 1ffj n ILE 39 Cb 0.54 0.33 -0.02 0.00 0.54 0.00 0.00 39.64 41.03 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 -1.17 1.36 -4.55 9.51 5.68 -1.26 -2.58 116.55 123.53 1ffj n ASP 40 Ca -0.03 0.04 -0.32 0.00 -0.50 0.00 0.00 54.79 53.98 1ffj n ASP 40 Cb 0.20 -0.13 -0.11 0.00 -1.14 0.00 0.00 41.12 39.93 1ffj n ASP 40 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 1ffj s VAL 41 N -2.10 3.41 -0.15 2.12 -7.23 -1.26 -4.84 120.40 110.34 1ffj s VAL 41 Ca -0.07 -0.81 -0.10 0.00 -1.81 0.00 0.00 61.98 59.19 1ffj s VAL 41 Cb 0.03 -2.44 -0.05 0.00 0.56 0.00 0.00 36.38 34.48 1ffj s VAL 41 CO 0.10 0.44 0.19 0.00 -0.31 0.00 0.00 175.10 175.52 1ffj s PRO 43 N -0.11 2.94 0.47 0.00 0.04 -1.26 -4.98 135.00 132.09 1ffj s PRO 43 Ca 0.13 0.96 -0.24 0.00 0.04 0.00 0.00 61.00 61.89 1ffj s PRO 43 Cb -0.12 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.35 1ffj s PRO 43 CO 0.02 -1.10 1.26 1.17 0.04 0.00 0.00 177.00 178.39 1ffj n LYS 44 N -3.13 1.78 -3.35 4.56 4.81 -1.26 -4.86 118.16 116.72 1ffj n LYS 44 Ca 0.08 0.64 -0.38 0.00 -0.87 0.00 0.00 58.31 57.77 1ffj n LYS 44 Cb 0.53 -2.40 -0.07 0.00 0.02 0.00 0.00 35.03 33.11 1ffj n LYS 44 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1ffj s SER 45 N -0.68 6.46 0.52 3.14 0.01 -1.26 -4.82 113.70 117.08 1ffj s SER 45 Ca 0.65 0.55 0.07 0.00 1.31 0.00 0.00 55.95 58.53 1ffj s SER 45 Cb -0.48 -2.25 0.04 0.00 0.21 0.00 0.00 66.02 63.54 1ffj s SER 45 CO 0.55 -0.11 0.53 -0.94 0.41 0.00 0.00 173.24 173.68 1ffj s SER 46 N 1.09 4.90 -0.05 2.44 1.04 -0.56 -5.01 113.70 117.56 1ffj s SER 46 Ca 0.20 -0.99 -0.13 0.00 0.48 0.00 0.00 55.95 55.51 1ffj s SER 46 Cb -0.15 0.14 -0.07 0.00 0.10 0.00 0.00 66.02 66.03 1ffj s SER 46 CO 0.08 -1.07 0.53 -0.07 0.98 0.00 0.00 173.24 173.69 1ffj h LEU 47 N 0.63 -0.37 -0.41 2.42 3.38 -2.02 -3.34 115.31 115.60 1ffj h LEU 47 Ca -0.36 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 57.65 1ffj h LEU 47 Cb 1.29 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 42.06 1ffj h LEU 47 CO 0.52 0.08 -0.53 0.25 0.09 0.00 0.00 178.44 178.84 1ffj h LEU 48 N -1.11 -1.79 -8.90 1.67 5.85 -1.99 -3.41 115.31 105.62 1ffj h LEU 48 Ca -0.04 0.24 -0.69 0.00 0.84 0.00 0.00 57.88 58.22 1ffj h LEU 48 Cb 0.35 0.74 -0.23 0.00 0.37 0.00 0.00 40.66 41.89 1ffj h LEU 48 CO 0.07 -0.38 -0.85 0.68 -0.34 0.00 0.00 178.44 177.63 1ffj s VAL 49 N -5.51 2.44 0.03 1.05 -7.23 -1.25 -2.31 120.40 107.62 1ffj s VAL 49 Ca -0.14 -1.47 0.03 0.00 -1.81 0.00 0.00 61.98 58.60 1ffj s VAL 49 Cb 0.08 -2.03 -0.02 0.00 0.56 0.00 0.00 36.38 34.97 1ffj s VAL 49 CO 0.58 0.24 -0.11 -0.54 -0.31 0.00 0.00 175.10 174.96 1ffj s LYS 50 N -1.67 0.71 0.12 4.82 1.02 -1.12 -1.50 119.74 122.12 1ffj s LYS 50 Ca 0.14 -0.67 0.09 0.00 0.02 0.00 0.00 55.97 55.55 1ffj s LYS 50 Cb -0.10 -0.64 -0.04 0.00 -0.52 0.00 0.00 37.83 36.53 1ffj s LYS 50 CO 0.05 0.15 -0.21 0.71 -0.92 0.00 0.00 175.35 175.13 1ffj s TYR 51 N -0.91 1.86 0.00 3.18 2.02 -1.26 -3.15 117.35 119.09 1ffj s TYR 51 Ca -0.02 -0.42 0.03 0.00 -0.37 0.00 0.00 57.07 56.29 1ffj s TYR 51 Cb -0.08 -1.00 -0.01 0.00 -0.40 0.00 0.00 41.96 40.48 1ffj s TYR 51 CO 0.01 0.25 -0.09 0.08 -1.57 0.00 0.00 175.55 174.23 1ffj s VAL 52 N -1.34 0.73 0.10 0.71 1.01 -1.10 -4.89 120.40 115.63 1ffj s VAL 52 Ca 0.09 -0.51 0.06 0.00 0.00 0.00 0.00 61.98 61.62 1ffj s VAL 52 Cb -0.09 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 1ffj s VAL 52 CO 0.05 0.12 -0.16 0.00 0.00 0.00 0.00 175.10 175.11 1ffj n ASN 55 N 0.86 6.12 -4.07 0.00 0.23 -1.26 -1.83 115.26 115.32 1ffj n ASN 55 Ca -0.14 -3.67 -0.08 0.00 -0.53 0.00 0.00 54.58 50.16 1ffj n ASN 55 Cb 0.57 -0.93 -0.09 0.00 -2.08 0.00 0.00 39.78 37.25 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 -4.25 0.15 0.27 5.53 -4.23 -1.26 -5.06 115.64 106.79 1ffj s THR 56 Ca 0.42 -1.73 -0.29 0.00 -1.18 0.00 0.00 61.69 58.91 1ffj s THR 56 Cb 0.21 -1.71 -0.09 0.00 1.34 0.00 0.00 72.50 72.25 1ffj s THR 56 CO -0.12 -0.70 1.25 -1.81 -0.54 0.00 0.00 174.62 172.70 1ffj s ASP 57 N -2.96 6.96 -1.56 3.99 1.01 -1.26 -2.97 116.67 119.88 1ffj s ASP 57 Ca 0.14 2.46 -0.06 0.00 0.71 0.00 0.00 52.55 55.80 1ffj s ASP 57 Cb 0.07 -2.63 0.05 0.00 1.01 0.00 0.00 42.92 41.42 1ffj s ASP 57 CO -0.05 -0.42 0.36 2.29 0.21 0.00 0.00 175.17 177.56 1ffj n LYS 58 N 1.61 -2.22 -0.05 8.23 2.85 -0.84 -4.84 118.16 122.89 1ffj n LYS 58 Ca 0.02 0.27 -0.20 0.00 -1.05 0.00 0.00 58.31 57.35 1ffj n LYS 58 Cb 0.43 -4.33 -0.13 0.00 -0.65 0.00 0.00 35.03 30.36 1ffj n LYS 58 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35