#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 1.98 0.08 1.47 1.02 -1.26 -1.79 119.74 121.24 1ccq s LYS 2 Ca 0.00 -1.65 0.02 0.00 0.02 0.00 0.00 55.97 54.37 1ccq s LYS 2 Cb 0.00 -3.29 -0.04 0.00 -0.52 0.00 0.00 37.83 33.98 1ccq s LYS 2 CO 0.00 -0.86 0.13 0.00 -0.92 0.00 0.00 175.35 173.70 1ccq s LYS 4 N -2.51 3.10 0.00 0.00 1.02 -1.26 -1.84 119.74 118.25 1ccq s LYS 4 Ca 0.31 -0.96 0.00 0.00 0.02 0.00 0.00 55.97 55.35 1ccq s LYS 4 Cb -0.12 -2.68 0.00 0.00 -0.52 0.00 0.00 37.83 34.51 1ccq s LYS 4 CO 0.24 0.39 0.00 1.63 -0.92 0.00 0.00 175.35 176.70 1ccq n LYS 5 N -1.28 2.00 -2.44 1.68 4.76 -0.99 -4.39 118.16 117.50 1ccq n LYS 5 Ca -0.08 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.12 1ccq n LYS 5 Cb 0.58 0.00 0.08 0.00 -1.84 0.00 0.00 35.03 33.85 1ccq n LYS 5 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1ccq s LEU 6 N 0.00 3.00 0.22 -0.35 1.02 -1.26 -4.61 118.68 116.71 1ccq s LEU 6 Ca 0.00 0.03 -0.31 0.00 0.02 0.00 0.00 54.13 53.87 1ccq s LEU 6 Cb 0.00 -2.61 -0.15 0.00 0.02 0.00 0.00 46.19 43.45 1ccq s LEU 6 CO 0.00 -1.62 1.07 0.55 0.02 0.00 0.00 176.35 176.37 1ccq n VAL 7 N -2.77 1.40 -1.69 -1.59 3.14 -1.26 -4.13 118.33 111.43 1ccq n VAL 7 Ca 0.11 -0.35 -0.31 0.00 -2.96 0.00 0.00 64.34 60.82 1ccq n VAL 7 Cb 0.60 -0.87 0.04 0.00 -1.06 0.00 0.00 33.84 32.55 1ccq n VAL 7 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1ccq s PRO 8 N -0.88 3.05 -0.11 1.45 0.04 -1.26 -5.04 135.00 132.25 1ccq s PRO 8 Ca 0.67 1.00 -0.29 0.00 0.04 0.00 0.00 61.00 62.42 1ccq s PRO 8 Cb -0.79 -2.00 -0.07 0.00 0.04 0.00 0.00 34.50 31.68 1ccq s PRO 8 CO 0.55 -1.01 2.12 -0.11 0.04 0.00 0.00 177.00 178.59 1ccq n LEU 9 N -2.86 3.66 -3.73 -3.56 0.00 -1.26 -4.88 117.00 104.37 1ccq n LEU 9 Ca 0.08 0.51 -0.13 0.00 0.00 0.00 0.00 56.01 56.47 1ccq n LEU 9 Cb 0.53 -1.54 -0.13 0.00 0.00 0.00 0.00 43.42 42.28 1ccq n LEU 9 CO 0.54 -0.30 -0.13 0.12 0.00 0.00 0.00 177.39 177.61 1ccq s PHE 10 N 6.64 -0.31 0.14 1.96 2.19 -1.26 -5.06 117.98 122.28 1ccq s PHE 10 Ca 0.96 0.75 -0.14 0.00 0.33 0.00 0.00 56.93 58.83 1ccq s PHE 10 Cb -0.38 0.03 -0.07 0.00 -1.31 0.00 0.00 43.02 41.29 1ccq s PHE 10 CO 0.38 -0.23 0.54 -1.54 1.83 0.00 0.00 175.22 176.21 1ccq s SER 11 N 1.27 6.83 -0.17 6.13 1.04 -1.26 -2.35 113.70 125.18 1ccq s SER 11 Ca -0.09 1.07 -0.11 0.00 0.48 0.00 0.00 55.95 57.30 1ccq s SER 11 Cb -0.11 -2.29 0.05 0.00 0.10 0.00 0.00 66.02 63.78 1ccq s SER 11 CO -0.08 0.11 0.43 -0.75 0.98 0.00 0.00 173.24 173.93 1ccq s LYS 12 N -1.92 0.44 -0.24 4.02 2.47 -0.77 -5.00 119.74 118.74 1ccq s LYS 12 Ca 0.37 0.75 -0.23 0.00 -1.56 0.00 0.00 55.97 55.30 1ccq s LYS 12 Cb -0.15 0.06 -0.01 0.00 -1.46 0.00 0.00 37.83 36.27 1ccq s LYS 12 CO 0.19 -0.13 0.77 0.99 0.16 0.00 0.00 175.35 177.33 1ccq s THR 13 N 1.07 4.88 -0.19 3.43 2.01 -1.26 -1.75 115.64 123.82 1ccq s THR 13 Ca -0.07 1.44 -0.40 0.00 0.31 0.00 0.00 61.69 62.97 1ccq s THR 13 Cb -0.07 -4.06 -0.17 0.00 0.01 0.00 0.00 72.50 68.21 1ccq s THR 13 CO -0.09 -0.04 1.57 0.00 -0.69 0.00 0.00 174.62 175.36 1ccq s PRO 15 N 2.40 -0.05 0.13 0.00 0.04 -1.26 -4.84 135.00 131.43 1ccq s PRO 15 Ca 0.95 -0.15 -0.35 0.00 0.04 0.00 0.00 61.00 61.49 1ccq s PRO 15 Cb -1.11 -1.74 -0.15 0.00 0.04 0.00 0.00 34.50 31.53 1ccq s PRO 15 CO 0.62 -2.91 1.48 0.00 0.04 0.00 0.00 177.00 176.22 1ccq n ALA 16 N -4.18 0.43 0.00 8.56 0.00 -1.26 -1.81 120.51 122.24 1ccq n ALA 16 Ca 0.13 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1ccq n ALA 16 Cb 0.59 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.81 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 3.02 3.16 3.55 0.00 0.00 -1.26 -5.05 105.19 108.62 1ccq n GLY 17 Ca 0.17 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.82 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 2.86 0.00 1.61 3.01 -0.75 -4.34 119.74 122.13 1ccq s LYS 18 Ca 0.00 -0.56 0.00 0.00 -1.01 0.00 0.00 55.97 54.40 1ccq s LYS 18 Cb 0.00 -2.61 0.00 0.00 -1.01 0.00 0.00 37.83 34.21 1ccq s LYS 18 CO 0.00 0.59 0.75 0.09 0.51 0.00 0.00 175.35 177.29 1ccq n ASN 19 N 2.44 0.00 -4.15 2.83 3.02 -1.03 -4.25 115.26 114.12 1ccq n ASN 19 Ca -0.18 -1.56 -0.11 0.00 -0.03 0.00 0.00 54.58 52.70 1ccq n ASN 19 Cb 0.53 -0.11 -0.10 0.00 -0.61 0.00 0.00 39.78 39.48 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 0.00 2.46 -0.12 3.41 1.43 -0.93 -4.87 118.68 120.06 1ccq s LEU 20 Ca 0.00 -0.92 -0.02 0.00 -1.03 0.00 0.00 54.13 52.16 1ccq s LEU 20 Cb 0.00 -0.11 -0.03 0.00 0.03 0.00 0.00 46.19 46.08 1ccq s LEU 20 CO 0.00 -0.41 -0.04 0.00 0.23 0.00 0.00 176.35 176.13 1ccq s TYR 22 N -0.21 2.83 -0.17 0.00 -0.85 -0.53 -2.18 117.35 116.25 1ccq s TYR 22 Ca 0.04 -0.06 -0.05 0.00 -0.52 0.00 0.00 57.07 56.48 1ccq s TYR 22 Cb -0.13 -1.67 0.06 0.00 0.38 0.00 0.00 41.96 40.61 1ccq s TYR 22 CO 0.02 0.27 0.11 0.21 -1.52 0.00 0.00 175.55 174.64 1ccq s LYS 23 N -0.80 0.07 -0.10 -3.49 2.36 -0.96 -2.29 119.74 114.53 1ccq s LYS 23 Ca 0.12 -0.02 -0.06 0.00 -2.55 0.00 0.00 55.97 53.46 1ccq s LYS 23 Cb -0.11 -1.70 -0.04 0.00 -1.05 0.00 0.00 37.83 34.94 1ccq s LYS 23 CO 0.01 -0.66 0.13 1.41 1.55 0.00 0.00 175.35 177.80 1ccq s MET 24 N 2.17 3.39 0.29 4.03 -2.45 -0.85 -2.41 119.30 123.46 1ccq s MET 24 Ca 0.03 -0.18 -0.06 0.00 -1.25 0.00 0.00 55.69 54.23 1ccq s MET 24 Cb -0.16 -3.14 -0.01 0.00 1.25 0.00 0.00 34.83 32.78 1ccq s MET 24 CO -0.09 0.76 0.43 -0.59 1.05 0.00 0.00 175.02 176.57 1ccq s PHE 25 N -1.04 0.82 -0.07 4.11 -0.71 -1.03 -1.66 117.98 118.39 1ccq s PHE 25 Ca 0.16 -1.10 -0.17 0.00 -1.04 0.00 0.00 56.93 54.78 1ccq s PHE 25 Cb -0.12 -0.05 -0.05 0.00 -1.21 0.00 0.00 43.02 41.59 1ccq s PHE 25 CO 0.05 -1.01 0.46 -1.64 -1.34 0.00 0.00 175.22 171.74 1ccq s MET 26 N -3.57 4.23 -0.96 1.99 -1.94 -1.26 -1.92 119.30 115.87 1ccq s MET 26 Ca 0.29 0.46 -0.23 0.00 -1.71 0.00 0.00 55.69 54.49 1ccq s MET 26 Cb 0.01 -3.37 -0.15 0.00 2.01 0.00 0.00 34.83 33.33 1ccq s MET 26 CO 0.15 0.33 1.92 0.28 -0.01 0.00 0.00 175.02 177.69 1ccq n VAL 27 N 3.04 1.58 0.00 -6.03 0.31 -1.00 -2.30 118.33 113.93 1ccq n VAL 27 Ca -0.09 -1.55 0.00 0.00 -0.01 0.00 0.00 64.34 62.69 1ccq n VAL 27 Cb 0.52 -2.19 0.00 0.00 -0.91 0.00 0.00 33.84 31.26 1ccq n VAL 27 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ccq n ALA 28 N 12.31 0.00 -3.84 3.52 0.00 -1.26 -5.03 120.51 126.21 1ccq n ALA 28 Ca 0.46 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.62 1ccq n ALA 28 Cb 0.44 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.78 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 -0.86 3.51 -0.87 0.00 0.00 -0.97 -4.97 120.51 116.34 1ccq n ALA 29 Ca 0.00 -4.57 -0.20 0.00 0.00 0.00 0.00 53.44 48.68 1ccq n ALA 29 Cb 0.00 -1.02 -0.07 0.00 0.00 0.00 0.00 19.45 18.36 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 1.82 2.18 0.00 0.00 -0.04 -1.26 -2.85 135.00 134.84 1ccq n PRO 30 Ca 0.21 -1.29 0.00 0.00 -0.04 0.00 0.00 63.50 62.38 1ccq n PRO 30 Cb 0.36 -2.26 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 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 3.32 -0.92 -3.52 0.54 -0.00 -1.26 -5.07 115.22 108.30 1ccq n HIS 31 Ca 0.46 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.78 1ccq n HIS 31 Cb 0.42 0.30 -0.10 0.00 -0.00 0.00 0.00 29.99 30.60 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 -1.60 5.28 0.67 3.57 1.01 -1.13 -5.08 120.40 123.11 1ccq s VAL 32 Ca 0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 61.98 61.71 1ccq s VAL 32 Cb 0.00 -3.71 0.16 0.00 0.00 0.00 0.00 36.38 32.83 1ccq s VAL 32 CO 0.00 0.01 0.73 -0.81 0.00 0.00 0.00 175.10 175.03 1ccq n PRO 33 N 5.13 -1.53 0.06 2.72 -0.04 -1.26 -4.69 135.00 135.39 1ccq n PRO 33 Ca -0.12 -1.15 0.00 0.00 -0.04 0.00 0.00 63.50 62.18 1ccq n PRO 33 Cb 0.50 -0.91 0.00 0.00 -0.04 0.00 0.00 33.50 33.05 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 -3.51 0.31 -4.29 0.52 0.31 -0.66 -4.97 118.33 106.03 1ccq n VAL 34 Ca 0.10 0.10 -0.28 0.00 -0.01 0.00 0.00 64.34 64.25 1ccq n VAL 34 Cb 0.35 -0.74 -0.10 0.00 -0.91 0.00 0.00 33.84 32.44 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 -1.57 1.98 -0.25 5.55 1.02 -1.00 -5.01 119.74 120.47 1ccq s LYS 35 Ca 0.00 -1.23 -0.14 0.00 0.02 0.00 0.00 55.97 54.62 1ccq s LYS 35 Cb 0.00 -2.15 0.07 0.00 -0.52 0.00 0.00 37.83 35.23 1ccq s LYS 35 CO 0.00 0.45 0.61 1.03 -0.92 0.00 0.00 175.35 176.52 1ccq s ARG 36 N -2.58 0.62 0.00 1.68 3.00 -1.26 -2.01 118.95 118.39 1ccq s ARG 36 Ca 0.23 1.10 0.00 0.00 0.00 0.00 0.00 55.73 57.05 1ccq s ARG 36 Cb -0.09 0.09 0.00 0.00 0.00 0.00 0.00 34.95 34.95 1ccq s ARG 36 CO 0.14 -0.15 0.00 0.41 0.00 0.00 0.00 175.30 175.69 1ccq n GLY 37 N 4.29 1.97 3.96 -3.53 0.00 -0.97 -4.47 105.19 106.44 1ccq n GLY 37 Ca -0.21 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 44.81 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 -2.43 0.00 -0.17 0.00 2.07 -0.58 -4.71 121.20 115.37 1ccq s ILE 39 Ca 0.46 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.60 1ccq s ILE 39 Cb -0.10 -1.00 -0.07 0.00 0.13 0.00 0.00 42.46 41.42 1ccq s ILE 39 CO 0.36 0.00 -0.25 -0.90 -1.91 0.00 0.00 174.94 172.23 1ccq n ASP 40 N -0.13 1.47 -4.44 4.50 5.75 -1.26 -2.18 116.55 120.26 1ccq n ASP 40 Ca -0.13 0.25 -0.35 0.00 -0.01 0.00 0.00 54.79 54.55 1ccq n ASP 40 Cb 0.62 -0.59 -0.13 0.00 -1.03 0.00 0.00 41.12 39.99 1ccq n ASP 40 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1ccq s VAL 41 N -2.43 3.88 -0.07 2.12 0.11 -1.26 -4.74 120.40 118.00 1ccq s VAL 41 Ca -0.26 -0.34 -0.30 0.00 -2.93 0.00 0.00 61.98 58.15 1ccq s VAL 41 Cb 0.09 -2.75 -0.05 0.00 -1.53 0.00 0.00 36.38 32.14 1ccq s VAL 41 CO 0.34 0.44 1.56 0.00 -3.33 0.00 0.00 175.10 174.11 1ccq s PRO 43 N 3.81 1.78 0.85 0.00 0.04 -1.26 -5.06 135.00 135.16 1ccq s PRO 43 Ca 0.69 0.52 -0.13 0.00 0.04 0.00 0.00 61.00 62.12 1ccq s PRO 43 Cb -0.31 -1.89 0.11 0.00 0.04 0.00 0.00 34.50 32.45 1ccq s PRO 43 CO 0.26 -1.81 1.22 0.21 0.04 0.00 0.00 177.00 176.92 1ccq s LYS 44 N -5.20 1.61 0.21 4.56 2.20 -1.26 -4.93 119.74 116.93 1ccq s LYS 44 Ca 0.62 -0.04 0.08 0.00 -0.36 0.00 0.00 55.97 56.26 1ccq s LYS 44 Cb -0.14 -1.93 -0.04 0.00 -1.51 0.00 0.00 37.83 34.21 1ccq s LYS 44 CO 0.54 -1.81 0.04 -1.12 -0.36 0.00 0.00 175.35 172.64 1ccq s SER 45 N -4.66 4.90 0.34 1.43 0.01 -1.26 -4.60 113.70 109.86 1ccq s SER 45 Ca 0.65 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.50 1ccq s SER 45 Cb -0.09 -1.07 -0.00 0.00 0.21 0.00 0.00 66.02 65.07 1ccq s SER 45 CO 0.50 0.04 0.01 -1.54 0.41 0.00 0.00 173.24 172.66 1ccq n SER 46 N -0.52 2.82 0.13 2.44 3.41 -0.58 -5.01 113.62 116.31 1ccq n SER 46 Ca -0.08 -2.51 0.12 0.00 -0.26 0.00 0.00 58.87 56.13 1ccq n SER 46 Cb 0.57 0.28 0.14 0.00 -0.26 0.00 0.00 64.21 64.94 1ccq n SER 46 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1ccq h LEU 47 N 0.00 0.00 0.00 1.04 3.38 -2.03 -3.39 115.31 114.31 1ccq h LEU 47 Ca -0.28 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1ccq h LEU 47 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1ccq h LEU 47 CO 0.47 0.02 -0.26 -0.11 0.09 0.00 0.00 178.44 178.65 1ccq n LEU 48 N -2.65 0.64 -4.90 1.67 7.94 -1.26 -4.86 117.00 113.59 1ccq n LEU 48 Ca 0.03 0.25 -0.32 0.00 -1.11 0.00 0.00 56.01 54.85 1ccq n LEU 48 Cb 0.51 -0.60 -0.05 0.00 0.53 0.00 0.00 43.42 43.80 1ccq n LEU 48 CO 0.36 -0.46 0.01 -0.69 -1.11 0.00 0.00 177.39 175.50 1ccq s VAL 49 N -1.54 5.19 -0.14 1.96 1.01 -1.26 -2.39 120.40 123.23 1ccq s VAL 49 Ca -0.07 0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1ccq s VAL 49 Cb 0.01 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.79 1ccq s VAL 49 CO 0.11 0.10 -0.13 -0.54 0.00 0.00 0.00 175.10 174.64 1ccq s LYS 50 N -2.48 2.18 -0.17 2.72 1.02 -0.81 -1.53 119.74 120.67 1ccq s LYS 50 Ca 0.38 -0.51 -0.07 0.00 0.02 0.00 0.00 55.97 55.80 1ccq s LYS 50 Cb -0.12 -2.03 -0.04 0.00 -0.52 0.00 0.00 37.83 35.12 1ccq s LYS 50 CO 0.23 -0.24 0.06 0.71 -0.92 0.00 0.00 175.35 175.19 1ccq s TYR 51 N 1.52 3.26 -0.08 3.18 2.02 -1.26 -2.46 117.35 123.53 1ccq s TYR 51 Ca 0.05 0.11 0.00 0.00 -0.37 0.00 0.00 57.07 56.86 1ccq s TYR 51 Cb -0.13 -2.03 0.02 0.00 -0.40 0.00 0.00 41.96 39.42 1ccq s TYR 51 CO -0.10 0.23 -0.06 0.08 -1.57 0.00 0.00 175.55 174.13 1ccq s VAL 52 N 0.12 0.78 0.22 0.71 1.01 -1.01 -4.78 120.40 117.45 1ccq s VAL 52 Ca 0.05 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 61.91 1ccq s VAL 52 Cb -0.12 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 1ccq s VAL 52 CO 0.01 0.31 0.16 0.00 0.00 0.00 0.00 175.10 175.57 1ccq n ASN 55 N 2.12 7.09 -4.13 0.00 6.94 -1.26 -2.19 115.26 123.83 1ccq n ASN 55 Ca -0.16 -3.81 -0.12 0.00 -0.02 0.00 0.00 54.58 50.46 1ccq n ASN 55 Cb 0.57 -0.95 -0.11 0.00 -2.36 0.00 0.00 39.78 36.93 1ccq n ASN 55 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1ccq s THR 56 N -5.09 0.71 0.49 5.53 -4.23 -1.26 -5.01 115.64 106.77 1ccq s THR 56 Ca 0.53 -1.55 -0.21 0.00 -1.18 0.00 0.00 61.69 59.28 1ccq s THR 56 Cb 0.44 -1.22 -0.07 0.00 1.34 0.00 0.00 72.50 72.99 1ccq s THR 56 CO -0.31 -0.61 1.10 -1.81 -0.54 0.00 0.00 174.62 172.45 1ccq s ASP 57 N -2.36 6.16 -1.62 3.99 1.01 -1.26 -3.24 116.67 119.35 1ccq s ASP 57 Ca 0.02 2.11 -0.06 0.00 0.71 0.00 0.00 52.55 55.33 1ccq s ASP 57 Cb -0.02 -2.58 0.06 0.00 1.01 0.00 0.00 42.92 41.39 1ccq s ASP 57 CO -0.02 -0.92 0.23 0.29 0.21 0.00 0.00 175.17 174.97 1ccq n LYS 58 N -0.83 -1.33 -0.14 8.23 4.01 -1.01 -4.81 118.16 122.28 1ccq n LYS 58 Ca 0.09 0.16 -0.26 0.00 -0.51 0.00 0.00 58.31 57.79 1ccq n LYS 58 Cb 0.51 -4.05 -0.10 0.00 -0.51 0.00 0.00 35.03 30.88 1ccq n LYS 58 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29