#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ccq s LYS 2 N 0.00 2.44 -0.07 3.23 2.20 -1.26 -2.01 119.74 124.28 1ccq s LYS 2 Ca 0.00 -1.40 -0.01 0.00 -0.36 0.00 0.00 55.97 54.20 1ccq s LYS 2 Cb 0.00 -3.51 -0.03 0.00 -1.51 0.00 0.00 37.83 32.78 1ccq s LYS 2 CO 0.00 -0.81 -0.02 0.00 -0.36 0.00 0.00 175.35 174.15 1ccq s LYS 4 N -0.94 3.29 0.29 0.00 1.02 -1.26 -2.14 119.74 119.99 1ccq s LYS 4 Ca 0.14 -0.47 0.02 0.00 0.02 0.00 0.00 55.97 55.68 1ccq s LYS 4 Cb -0.11 -2.97 0.02 0.00 -0.52 0.00 0.00 37.83 34.24 1ccq s LYS 4 CO 0.03 0.62 0.15 1.63 -0.92 0.00 0.00 175.35 176.86 1ccq n LYS 5 N 0.56 1.14 -3.57 1.68 4.01 -1.04 -4.31 118.16 116.62 1ccq n LYS 5 Ca -0.08 -1.87 -0.37 0.00 -0.51 0.00 0.00 58.31 55.49 1ccq n LYS 5 Cb 0.52 0.29 -0.06 0.00 -0.51 0.00 0.00 35.03 35.26 1ccq n LYS 5 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1ccq s LEU 6 N 0.00 4.35 0.71 -0.35 1.02 -1.24 -4.69 118.68 118.48 1ccq s LEU 6 Ca 0.12 0.67 -0.18 0.00 0.02 0.00 0.00 54.13 54.76 1ccq s LEU 6 Cb -0.01 -2.41 -0.14 0.00 0.02 0.00 0.00 46.19 43.65 1ccq s LEU 6 CO 0.07 0.22 -0.36 0.52 0.02 0.00 0.00 176.35 176.83 1ccq n VAL 7 N 2.71 0.07 1.42 -1.59 0.31 -1.26 -1.69 118.33 118.31 1ccq n VAL 7 Ca -0.14 -0.49 0.12 0.00 -0.01 0.00 0.00 64.34 63.82 1ccq n VAL 7 Cb 0.53 -0.03 0.69 0.00 -0.91 0.00 0.00 33.84 34.11 1ccq n VAL 7 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1ccq n PRO 8 N 1.79 0.67 -1.94 5.55 -0.04 -1.26 -5.02 135.00 134.76 1ccq n PRO 8 Ca 0.04 0.01 -0.42 0.00 -0.04 0.00 0.00 63.50 63.09 1ccq n PRO 8 Cb 0.51 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.44 1ccq n PRO 8 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1ccq s LEU 9 N -2.10 4.35 0.00 1.53 0.20 -0.68 -4.98 118.68 116.99 1ccq s LEU 9 Ca 0.33 2.34 0.00 0.00 0.69 0.00 0.00 54.13 57.50 1ccq s LEU 9 Cb 0.16 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.39 1ccq s LEU 9 CO 0.29 -0.94 0.00 0.33 -0.29 0.00 0.00 176.35 175.74 1ccq n PHE 10 N 7.05 0.00 -2.86 5.38 7.35 -1.26 -3.62 117.46 129.49 1ccq n PHE 10 Ca 0.18 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.54 1ccq n PHE 10 Cb 0.42 0.00 -0.07 0.00 0.35 0.00 0.00 39.48 40.18 1ccq n PHE 10 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 1ccq s SER 11 N -1.00 6.93 -0.19 -2.13 1.04 -1.26 -2.49 113.70 114.59 1ccq s SER 11 Ca 0.00 1.64 -0.28 0.00 0.48 0.00 0.00 55.95 57.79 1ccq s SER 11 Cb 0.00 -2.52 0.10 0.00 0.10 0.00 0.00 66.02 63.70 1ccq s SER 11 CO 0.00 -0.33 0.89 -0.75 0.98 0.00 0.00 173.24 174.03 1ccq s LYS 12 N -3.11 0.72 -0.06 4.02 2.20 -0.91 -4.97 119.74 117.63 1ccq s LYS 12 Ca 0.60 0.46 -0.27 0.00 -0.36 0.00 0.00 55.97 56.40 1ccq s LYS 12 Cb -0.09 0.34 -0.03 0.00 -1.51 0.00 0.00 37.83 36.54 1ccq s LYS 12 CO 0.14 -0.17 0.89 0.99 -0.36 0.00 0.00 175.35 176.84 1ccq s THR 13 N -0.46 4.90 -0.33 3.43 2.01 -1.26 -1.87 115.64 122.05 1ccq s THR 13 Ca -0.02 1.83 -0.35 0.00 0.31 0.00 0.00 61.69 63.46 1ccq s THR 13 Cb -0.03 -4.22 -0.11 0.00 0.01 0.00 0.00 72.50 68.16 1ccq s THR 13 CO 0.01 0.14 2.17 0.00 -0.69 0.00 0.00 174.62 176.25 1ccq s PRO 15 N 6.08 0.39 0.06 0.00 0.04 -1.26 -4.77 135.00 135.53 1ccq s PRO 15 Ca 1.09 -0.00 -0.37 0.00 0.04 0.00 0.00 61.00 61.75 1ccq s PRO 15 Cb -0.84 -1.78 -0.18 0.00 0.04 0.00 0.00 34.50 31.73 1ccq s PRO 15 CO 0.49 -2.65 1.08 0.00 0.04 0.00 0.00 177.00 175.96 1ccq n ALA 16 N -4.02 -2.67 0.00 8.56 0.00 -1.26 -1.58 120.51 119.54 1ccq n ALA 16 Ca 0.11 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.10 1ccq n ALA 16 Cb 0.59 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1ccq n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ccq n GLY 17 N 1.83 3.16 3.36 0.00 0.00 -1.26 -5.04 105.19 107.24 1ccq n GLY 17 Ca 0.19 -1.04 -0.32 0.00 0.00 0.00 0.00 46.02 44.85 1ccq n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ccq s LYS 18 N 0.00 2.64 0.00 1.61 3.01 -0.61 -3.90 119.74 122.49 1ccq s LYS 18 Ca 0.00 -0.80 0.00 0.00 -1.01 0.00 0.00 55.97 54.16 1ccq s LYS 18 Cb 0.00 -2.31 0.00 0.00 -1.01 0.00 0.00 37.83 34.51 1ccq s LYS 18 CO 0.00 0.45 0.56 0.09 0.51 0.00 0.00 175.35 176.96 1ccq n ASN 19 N 2.78 0.55 -4.13 2.83 3.02 -0.85 -4.24 115.26 115.23 1ccq n ASN 19 Ca -0.17 -1.25 -0.09 0.00 -0.03 0.00 0.00 54.58 53.04 1ccq n ASN 19 Cb 0.52 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.59 1ccq n ASN 19 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ccq s LEU 20 N -0.25 2.20 -0.10 3.41 1.43 -0.97 -4.93 118.68 119.46 1ccq s LEU 20 Ca 0.00 -1.09 -0.01 0.00 -1.03 0.00 0.00 54.13 51.99 1ccq s LEU 20 Cb 0.00 0.20 -0.03 0.00 0.03 0.00 0.00 46.19 46.39 1ccq s LEU 20 CO 0.00 -0.64 -0.04 0.00 0.23 0.00 0.00 176.35 175.90 1ccq s TYR 22 N -0.38 2.61 -0.20 0.00 -0.85 -0.83 -2.12 117.35 115.59 1ccq s TYR 22 Ca 0.06 -0.27 -0.05 0.00 -0.52 0.00 0.00 57.07 56.30 1ccq s TYR 22 Cb -0.12 -1.61 0.07 0.00 0.38 0.00 0.00 41.96 40.68 1ccq s TYR 22 CO 0.02 0.10 0.10 -1.59 -1.52 0.00 0.00 175.55 172.66 1ccq s LYS 23 N -0.63 0.09 -0.12 -3.49 -2.85 -0.93 -2.23 119.74 109.59 1ccq s LYS 23 Ca 0.09 -0.18 -0.07 0.00 -1.00 0.00 0.00 55.97 54.81 1ccq s LYS 23 Cb -0.11 -1.66 -0.04 0.00 -2.06 0.00 0.00 37.83 33.96 1ccq s LYS 23 CO 0.01 -0.75 0.15 1.41 0.10 0.00 0.00 175.35 176.26 1ccq s MET 24 N 2.13 3.48 0.26 1.78 1.75 -0.54 -2.47 119.30 125.69 1ccq s MET 24 Ca 0.04 -0.11 -0.03 0.00 -1.25 0.00 0.00 55.69 54.33 1ccq s MET 24 Cb -0.16 -3.20 -0.02 0.00 2.84 0.00 0.00 34.83 34.29 1ccq s MET 24 CO -0.16 0.76 0.31 -0.59 -0.65 0.00 0.00 175.02 174.70 1ccq s PHE 25 N -0.99 1.04 -0.06 4.11 -0.71 -0.96 -1.61 117.98 118.79 1ccq s PHE 25 Ca 0.15 -1.25 -0.19 0.00 -1.04 0.00 0.00 56.93 54.60 1ccq s PHE 25 Cb -0.12 -0.30 -0.05 0.00 -1.21 0.00 0.00 43.02 41.35 1ccq s PHE 25 CO 0.04 -0.87 0.54 -1.64 -1.34 0.00 0.00 175.22 171.95 1ccq s MET 26 N -3.77 4.31 -0.65 1.99 -1.94 -1.26 -1.62 119.30 116.36 1ccq s MET 26 Ca 0.33 0.59 -0.25 0.00 -1.71 0.00 0.00 55.69 54.66 1ccq s MET 26 Cb 0.03 -3.39 -0.22 0.00 2.01 0.00 0.00 34.83 33.26 1ccq s MET 26 CO 0.15 0.27 1.85 1.55 -0.01 0.00 0.00 175.02 178.83 1ccq n VAL 27 N 3.19 1.14 0.00 -6.03 3.14 -1.06 -2.23 118.33 116.48 1ccq n VAL 27 Ca -0.07 -1.05 0.00 0.00 -2.96 0.00 0.00 64.34 60.26 1ccq n VAL 27 Cb 0.51 -2.17 0.00 0.00 -1.06 0.00 0.00 33.84 31.12 1ccq n VAL 27 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ccq n ALA 28 N 10.26 0.00 -3.84 1.55 0.00 -1.26 -5.02 120.51 122.20 1ccq n ALA 28 Ca 0.47 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.63 1ccq n ALA 28 Cb 0.43 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.76 1ccq n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ccq n ALA 29 N -1.42 3.51 -0.94 0.00 0.00 -0.95 -4.97 120.51 115.75 1ccq n ALA 29 Ca 0.00 -4.57 -0.26 0.00 0.00 0.00 0.00 53.44 48.61 1ccq n ALA 29 Cb 0.00 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.39 1ccq n ALA 29 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ccq n PRO 30 N 1.80 2.55 0.00 0.00 -0.04 -1.26 -2.98 135.00 135.08 1ccq n PRO 30 Ca 0.21 -1.59 0.00 0.00 -0.04 0.00 0.00 63.50 62.08 1ccq n PRO 30 Cb 0.36 -2.47 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 1ccq n PRO 30 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1ccq n HIS 31 N 3.69 -1.17 -3.61 0.54 -0.00 -1.26 -5.08 115.22 108.33 1ccq n HIS 31 Ca 0.54 0.00 -0.38 0.00 -0.00 0.00 0.00 57.72 57.89 1ccq n HIS 31 Cb 0.27 0.39 -0.11 0.00 -0.00 0.00 0.00 29.99 30.54 1ccq n HIS 31 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1ccq s VAL 32 N -1.78 5.32 0.95 3.57 1.01 -1.16 -5.08 120.40 123.23 1ccq s VAL 32 Ca 0.00 0.18 -0.16 0.00 0.00 0.00 0.00 61.98 62.00 1ccq s VAL 32 Cb 0.00 -3.52 0.23 0.00 0.00 0.00 0.00 36.38 33.08 1ccq s VAL 32 CO 0.00 0.27 1.05 -0.81 0.00 0.00 0.00 175.10 175.61 1ccq n PRO 33 N 4.87 -1.97 0.08 2.72 -0.04 -1.26 -4.73 135.00 134.68 1ccq n PRO 33 Ca -0.14 -1.64 0.00 0.00 -0.04 0.00 0.00 63.50 61.68 1ccq n PRO 33 Cb 0.52 -1.29 0.00 0.00 -0.04 0.00 0.00 33.50 32.69 1ccq n PRO 33 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1ccq n VAL 34 N -4.05 0.65 -4.80 0.52 0.31 -0.63 -4.97 118.33 105.36 1ccq n VAL 34 Ca 0.14 0.22 -0.30 0.00 -0.01 0.00 0.00 64.34 64.38 1ccq n VAL 34 Cb 0.50 -1.08 -0.17 0.00 -0.91 0.00 0.00 33.84 32.18 1ccq n VAL 34 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1ccq s LYS 35 N -1.90 2.60 -0.10 5.55 1.02 -1.02 -5.01 119.74 120.87 1ccq s LYS 35 Ca 0.00 -0.71 -0.01 0.00 0.02 0.00 0.00 55.97 55.27 1ccq s LYS 35 Cb 0.00 -2.07 0.03 0.00 -0.52 0.00 0.00 37.83 35.27 1ccq s LYS 35 CO 0.00 0.05 -0.02 1.03 -0.92 0.00 0.00 175.35 175.49 1ccq s ARG 36 N 0.66 0.92 0.00 1.68 0.52 -1.26 -1.46 118.95 120.01 1ccq s ARG 36 Ca -0.12 -0.10 0.00 0.00 -0.52 0.00 0.00 55.73 54.99 1ccq s ARG 36 Cb -0.16 -1.34 0.00 0.00 0.52 0.00 0.00 34.95 33.96 1ccq s ARG 36 CO 0.03 -0.34 0.00 0.41 0.02 0.00 0.00 175.30 175.42 1ccq n GLY 37 N 5.06 3.96 3.97 -3.53 0.00 -0.95 -4.07 105.19 109.63 1ccq n GLY 37 Ca -0.09 -0.96 -0.20 0.00 0.00 0.00 0.00 46.02 44.77 1ccq n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ccq s ILE 39 N -2.08 0.02 -0.24 0.00 2.07 -0.64 -4.72 121.20 115.61 1ccq s ILE 39 Ca 0.39 -0.16 -0.16 0.00 -1.41 0.00 0.00 60.65 59.31 1ccq s ILE 39 Cb -0.09 -1.00 -0.11 0.00 0.13 0.00 0.00 42.46 41.40 1ccq s ILE 39 CO 0.30 -0.09 -0.29 -0.67 -1.91 0.00 0.00 174.94 172.28 1ccq n ASP 40 N 0.25 1.94 -4.36 4.50 2.03 -1.25 -2.00 116.55 117.65 1ccq n ASP 40 Ca -0.18 0.36 -0.33 0.00 0.52 0.00 0.00 54.79 55.17 1ccq n ASP 40 Cb 0.61 -0.82 -0.15 0.00 -0.72 0.00 0.00 41.12 40.05 1ccq n ASP 40 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1ccq s VAL 41 N -2.58 2.78 -0.30 5.18 -7.23 -1.26 -4.62 120.40 112.36 1ccq s VAL 41 Ca -0.34 -0.78 -0.29 0.00 -1.81 0.00 0.00 61.98 58.76 1ccq s VAL 41 Cb 0.11 -2.12 -0.00 0.00 0.56 0.00 0.00 36.38 34.93 1ccq s VAL 41 CO 0.47 0.55 1.37 0.00 -0.31 0.00 0.00 175.10 177.18 1ccq s PRO 43 N 4.34 0.10 0.83 0.00 0.04 -1.26 -5.06 135.00 133.99 1ccq s PRO 43 Ca 0.59 -0.10 -0.11 0.00 0.04 0.00 0.00 61.00 61.43 1ccq s PRO 43 Cb -0.18 -1.75 0.12 0.00 0.04 0.00 0.00 34.50 32.73 1ccq s PRO 43 CO 0.25 -2.83 1.17 0.21 0.04 0.00 0.00 177.00 175.84 1ccq s LYS 44 N -5.55 1.51 0.28 4.56 2.20 -1.26 -4.94 119.74 116.54 1ccq s LYS 44 Ca 0.70 -0.32 0.08 0.00 -0.36 0.00 0.00 55.97 56.07 1ccq s LYS 44 Cb -0.09 -2.02 -0.04 0.00 -1.51 0.00 0.00 37.83 34.18 1ccq s LYS 44 CO 0.54 -1.78 0.11 -1.12 -0.36 0.00 0.00 175.35 172.74 1ccq s SER 45 N -4.69 4.93 0.43 1.43 0.01 -1.26 -4.56 113.70 109.98 1ccq s SER 45 Ca 0.66 -0.53 0.03 0.00 1.31 0.00 0.00 55.95 57.42 1ccq s SER 45 Cb -0.08 -1.01 -0.01 0.00 0.21 0.00 0.00 66.02 65.13 1ccq s SER 45 CO 0.49 -0.09 0.11 -1.54 0.41 0.00 0.00 173.24 172.62 1ccq n SER 46 N -1.06 1.71 0.05 2.44 3.41 -0.59 -5.00 113.62 114.58 1ccq n SER 46 Ca -0.06 -3.17 0.13 0.00 -0.26 0.00 0.00 58.87 55.51 1ccq n SER 46 Cb 0.59 0.88 0.33 0.00 -0.26 0.00 0.00 64.21 65.75 1ccq n SER 46 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ccq n LEU 47 N 0.00 0.58 -0.03 1.04 4.77 -1.26 -4.27 117.00 117.82 1ccq n LEU 47 Ca -0.09 0.34 -0.03 0.00 -0.03 0.00 0.00 56.01 56.20 1ccq n LEU 47 Cb 0.61 -0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 1ccq n LEU 47 CO 0.32 -0.05 -0.22 -0.11 -1.33 0.00 0.00 177.39 176.01 1ccq n LEU 48 N -1.94 0.71 -4.64 2.23 0.00 -1.26 -4.74 117.00 107.35 1ccq n LEU 48 Ca 0.05 0.19 -0.35 0.00 0.00 0.00 0.00 56.01 55.91 1ccq n LEU 48 Cb 0.40 -0.60 -0.10 0.00 0.00 0.00 0.00 43.42 43.12 1ccq n LEU 48 CO 0.33 -0.44 -0.29 0.68 0.00 0.00 0.00 177.39 177.67 1ccq s VAL 49 N -1.64 4.42 -0.26 1.96 -7.23 -1.26 -2.56 120.40 113.83 1ccq s VAL 49 Ca -0.09 -0.19 -0.05 0.00 -1.81 0.00 0.00 61.98 59.84 1ccq s VAL 49 Cb 0.01 -2.92 -0.00 0.00 0.56 0.00 0.00 36.38 34.03 1ccq s VAL 49 CO 0.14 0.54 0.02 -0.54 -0.31 0.00 0.00 175.10 174.95 1ccq s LYS 50 N -0.26 3.25 -0.35 4.82 -0.14 -0.64 -1.54 119.74 124.88 1ccq s LYS 50 Ca 0.06 -0.73 -0.12 0.00 -1.36 0.00 0.00 55.97 53.83 1ccq s LYS 50 Cb -0.12 -3.19 0.00 0.00 -1.68 0.00 0.00 37.83 32.85 1ccq s LYS 50 CO 0.02 -0.31 0.22 0.71 -0.76 0.00 0.00 175.35 175.23 1ccq s TYR 51 N 1.49 3.22 -0.17 3.18 2.02 -1.26 -2.27 117.35 123.56 1ccq s TYR 51 Ca 0.04 -0.58 -0.01 0.00 -0.37 0.00 0.00 57.07 56.15 1ccq s TYR 51 Cb -0.16 -2.45 -0.00 0.00 -0.40 0.00 0.00 41.96 38.94 1ccq s TYR 51 CO -0.00 -0.51 -0.12 0.08 -1.57 0.00 0.00 175.55 173.43 1ccq s VAL 52 N 1.64 2.89 0.24 0.71 1.01 -1.03 -4.71 120.40 121.15 1ccq s VAL 52 Ca 0.04 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.41 1ccq s VAL 52 Cb -0.18 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 1ccq s VAL 52 CO 0.08 0.49 0.25 0.00 0.00 0.00 0.00 175.10 175.92 1ccq n ASN 55 N 0.76 5.58 -4.04 0.00 0.23 -1.26 -2.29 115.26 114.23 1ccq n ASN 55 Ca -0.19 -3.73 -0.08 0.00 -0.53 0.00 0.00 54.58 50.05 1ccq n ASN 55 Cb 0.58 -0.70 -0.10 0.00 -2.08 0.00 0.00 39.78 37.48 1ccq n ASN 55 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 1ccq s THR 56 N -5.02 0.17 0.47 5.53 -4.23 -1.26 -5.01 115.64 106.29 1ccq s THR 56 Ca 0.48 -1.44 -0.23 0.00 -1.18 0.00 0.00 61.69 59.32 1ccq s THR 56 Cb 0.35 -1.01 -0.07 0.00 1.34 0.00 0.00 72.50 73.11 1ccq s THR 56 CO -0.22 -0.79 1.21 -1.81 -0.54 0.00 0.00 174.62 172.47 1ccq s ASP 57 N -2.33 6.00 -1.51 3.99 1.01 -1.26 -3.03 116.67 119.55 1ccq s ASP 57 Ca -0.02 2.41 -0.04 0.00 0.71 0.00 0.00 52.55 55.61 1ccq s ASP 57 Cb 0.01 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.33 1ccq s ASP 57 CO -0.06 -1.04 0.09 1.17 0.21 0.00 0.00 175.17 175.54 1ccq n LYS 58 N -0.55 -0.97 -0.14 8.23 4.81 -0.98 -4.82 118.16 123.74 1ccq n LYS 58 Ca 0.08 0.10 -0.28 0.00 -0.87 0.00 0.00 58.31 57.34 1ccq n LYS 58 Cb 0.47 -3.51 -0.10 0.00 0.02 0.00 0.00 35.03 31.91 1ccq n LYS 58 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57