#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 3.38 -0.05 3.23 -2.85 -1.26 -1.90 119.74 120.28 1ccq s LYS 2 Ca 0.00 -0.65 -0.03 0.00 -1.00 0.00 0.00 55.97 54.29 1ccq s LYS 2 Cb 0.00 -2.83 -0.04 0.00 -2.06 0.00 0.00 37.83 32.90 1ccq s LYS 2 CO 0.00 -0.01 0.10 0.00 0.10 0.00 0.00 175.35 175.53 1ccq s LYS 4 N -1.39 2.30 0.00 0.00 1.02 -1.26 -1.98 119.74 118.43 1ccq s LYS 4 Ca 0.19 -1.84 0.00 0.00 0.02 0.00 0.00 55.97 54.34 1ccq s LYS 4 Cb -0.12 -2.08 -0.00 0.00 -0.52 0.00 0.00 37.83 35.12 1ccq s LYS 4 CO 0.09 -0.25 0.00 1.63 -0.92 0.00 0.00 175.35 175.90 1ccq n LYS 5 N -1.42 1.43 -2.81 1.68 4.01 -0.91 -4.24 118.16 115.91 1ccq n LYS 5 Ca -0.01 -0.03 -0.20 0.00 -0.51 0.00 0.00 58.31 57.56 1ccq n LYS 5 Cb 0.64 0.01 0.05 0.00 -0.51 0.00 0.00 35.03 35.22 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 3.29 0.21 -0.35 1.02 -1.26 -4.70 118.68 116.88 1ccq s LEU 6 Ca 0.00 -0.36 -0.28 0.00 0.02 0.00 0.00 54.13 53.52 1ccq s LEU 6 Cb 0.00 -2.40 -0.17 0.00 0.02 0.00 0.00 46.19 43.64 1ccq s LEU 6 CO 0.00 -1.22 0.54 0.55 0.02 0.00 0.00 176.35 176.25 1ccq n VAL 7 N -2.28 1.99 -0.99 -1.59 3.14 -1.26 -4.51 118.33 112.83 1ccq n VAL 7 Ca 0.11 -0.50 -0.09 0.00 -2.96 0.00 0.00 64.34 60.89 1ccq n VAL 7 Cb 0.60 -0.06 0.07 0.00 -1.06 0.00 0.00 33.84 33.39 1ccq n VAL 7 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1ccq n PRO 8 N 0.99 -1.04 -1.96 1.45 -0.04 -1.26 -5.01 135.00 128.12 1ccq n PRO 8 Ca 0.17 -0.61 -0.41 0.00 -0.04 0.00 0.00 63.50 62.62 1ccq n PRO 8 Cb 0.26 -0.48 -0.03 0.00 -0.04 0.00 0.00 33.50 33.21 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 0.00 3.44 -0.06 1.53 0.20 -1.26 -4.92 118.68 117.60 1ccq s LEU 9 Ca 0.23 1.03 -0.03 0.00 0.69 0.00 0.00 54.13 56.06 1ccq s LEU 9 Cb -0.01 -3.16 0.04 0.00 -0.43 0.00 0.00 46.19 42.63 1ccq s LEU 9 CO 0.17 -2.00 0.14 0.12 -0.29 0.00 0.00 176.35 174.49 1ccq s PHE 10 N 7.96 -0.15 0.02 5.38 2.19 -1.26 -5.11 117.98 127.02 1ccq s PHE 10 Ca 0.78 0.45 0.05 0.00 0.33 0.00 0.00 56.93 58.54 1ccq s PHE 10 Cb -0.20 -0.09 -0.02 0.00 -1.31 0.00 0.00 43.02 41.40 1ccq s PHE 10 CO 0.29 -0.16 -0.14 -1.54 1.83 0.00 0.00 175.22 175.51 1ccq s SER 11 N 1.15 1.63 -0.10 6.13 1.04 -1.26 -2.13 113.70 120.16 1ccq s SER 11 Ca -0.09 -0.39 -0.07 0.00 0.48 0.00 0.00 55.95 55.88 1ccq s SER 11 Cb -0.11 -0.13 0.03 0.00 0.10 0.00 0.00 66.02 65.91 1ccq s SER 11 CO -0.06 0.07 0.24 -0.75 0.98 0.00 0.00 173.24 173.73 1ccq s LYS 12 N -0.88 0.25 -0.14 4.02 2.47 -0.84 -5.04 119.74 119.58 1ccq s LYS 12 Ca 0.03 0.41 -0.27 0.00 -1.56 0.00 0.00 55.97 54.58 1ccq s LYS 12 Cb -0.07 0.03 -0.01 0.00 -1.46 0.00 0.00 37.83 36.32 1ccq s LYS 12 CO 0.01 -0.09 0.90 0.99 0.16 0.00 0.00 175.35 177.32 1ccq s THR 13 N 0.59 4.84 -0.48 3.43 2.01 -1.26 -1.71 115.64 123.06 1ccq s THR 13 Ca -0.04 1.81 -0.34 0.00 0.31 0.00 0.00 61.69 63.43 1ccq s THR 13 Cb -0.05 -4.21 -0.13 0.00 0.01 0.00 0.00 72.50 68.12 1ccq s THR 13 CO -0.03 0.03 2.31 0.00 -0.69 0.00 0.00 174.62 176.23 1ccq s PRO 15 N 6.99 0.23 0.10 0.00 0.04 -1.26 -4.82 135.00 136.28 1ccq s PRO 15 Ca 1.13 -0.06 -0.36 0.00 0.04 0.00 0.00 61.00 61.75 1ccq s PRO 15 Cb -0.85 -1.76 -0.16 0.00 0.04 0.00 0.00 34.50 31.76 1ccq s PRO 15 CO 0.46 -2.75 1.36 0.00 0.04 0.00 0.00 177.00 176.11 1ccq n ALA 16 N -4.08 -0.68 0.00 8.56 0.00 -1.26 -1.67 120.51 121.38 1ccq n ALA 16 Ca 0.12 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.06 1ccq n ALA 16 Cb 0.59 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.94 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 2.59 3.19 3.55 0.00 0.00 -1.26 -5.05 105.19 108.21 1ccq n GLY 17 Ca 0.18 -1.02 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 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 3.51 -0.00 1.61 3.01 -0.67 -4.27 119.74 122.92 1ccq s LYS 18 Ca 0.00 -0.48 0.00 0.00 -1.01 0.00 0.00 55.97 54.48 1ccq s LYS 18 Cb 0.00 -2.89 0.01 0.00 -1.01 0.00 0.00 37.83 33.93 1ccq s LYS 18 CO 0.00 0.36 0.66 0.09 0.51 0.00 0.00 175.35 176.97 1ccq n ASN 19 N 3.17 0.48 -4.21 2.83 4.13 -1.01 -4.30 115.26 116.36 1ccq n ASN 19 Ca -0.18 -1.33 -0.12 0.00 1.68 0.00 0.00 54.58 54.63 1ccq n ASN 19 Cb 0.53 -0.02 -0.10 0.00 -1.54 0.00 0.00 39.78 38.64 1ccq n ASN 19 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1ccq s LEU 20 N -0.28 2.43 -0.17 3.41 1.43 -0.98 -4.86 118.68 119.67 1ccq s LEU 20 Ca 0.01 -1.04 -0.01 0.00 -1.03 0.00 0.00 54.13 52.05 1ccq s LEU 20 Cb 0.01 -0.14 -0.01 0.00 0.03 0.00 0.00 46.19 46.08 1ccq s LEU 20 CO 0.00 -0.45 -0.11 0.00 0.23 0.00 0.00 176.35 176.02 1ccq s TYR 22 N 0.85 3.52 -0.06 0.00 -0.85 -0.41 -2.56 117.35 117.84 1ccq s TYR 22 Ca -0.03 0.44 -0.01 0.00 -0.52 0.00 0.00 57.07 56.95 1ccq s TYR 22 Cb -0.15 -1.89 0.03 0.00 0.38 0.00 0.00 41.96 40.32 1ccq s TYR 22 CO 0.00 0.68 0.01 0.21 -1.52 0.00 0.00 175.55 174.93 1ccq s LYS 23 N -1.19 0.48 -0.17 -3.49 2.36 -0.98 -2.38 119.74 114.37 1ccq s LYS 23 Ca 0.17 0.13 -0.05 0.00 -2.55 0.00 0.00 55.97 53.67 1ccq s LYS 23 Cb -0.12 -0.83 -0.03 0.00 -1.05 0.00 0.00 37.83 35.79 1ccq s LYS 23 CO 0.07 -0.27 0.00 1.41 1.55 0.00 0.00 175.35 178.11 1ccq s MET 24 N 1.82 3.79 0.30 4.03 -2.45 -0.98 -2.41 119.30 123.40 1ccq s MET 24 Ca 0.02 -0.45 -0.01 0.00 -1.25 0.00 0.00 55.69 54.00 1ccq s MET 24 Cb -0.12 -3.04 -0.02 0.00 1.25 0.00 0.00 34.83 32.90 1ccq s MET 24 CO -0.04 0.25 0.36 -0.59 1.05 0.00 0.00 175.02 176.04 1ccq s PHE 25 N 0.39 1.15 -0.14 4.11 -0.71 -1.06 -1.90 117.98 119.82 1ccq s PHE 25 Ca -0.01 -1.32 -0.20 0.00 -1.04 0.00 0.00 56.93 54.36 1ccq s PHE 25 Cb -0.13 -0.29 -0.04 0.00 -1.21 0.00 0.00 43.02 41.35 1ccq s PHE 25 CO 0.02 -0.95 0.56 -1.64 -1.34 0.00 0.00 175.22 171.87 1ccq s MET 26 N -3.51 4.30 -0.80 1.99 -1.94 -1.26 -2.32 119.30 115.76 1ccq s MET 26 Ca 0.34 0.56 -0.25 0.00 -1.71 0.00 0.00 55.69 54.62 1ccq s MET 26 Cb 0.02 -3.49 -0.20 0.00 2.01 0.00 0.00 34.83 33.17 1ccq s MET 26 CO 0.19 -0.00 1.90 0.28 -0.01 0.00 0.00 175.02 177.37 1ccq n VAL 27 N 4.07 1.13 0.00 -6.03 0.31 -0.98 -2.09 118.33 114.74 1ccq n VAL 27 Ca -0.04 -1.09 0.00 0.00 -0.01 0.00 0.00 64.34 63.20 1ccq n VAL 27 Cb 0.51 -2.15 0.00 0.00 -0.91 0.00 0.00 33.84 31.29 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 12.38 0.00 -3.74 3.52 0.00 -1.26 -5.01 120.51 126.40 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 -0.12 0.00 0.00 0.00 0.00 19.45 19.77 1ccq n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ccq s ALA 29 N -1.06 2.88 -0.50 0.00 0.00 -0.89 -4.98 121.76 117.21 1ccq s ALA 29 Ca 0.00 -3.24 -0.06 0.00 0.00 0.00 0.00 51.96 48.66 1ccq s ALA 29 Cb 0.00 -1.97 -0.15 0.00 0.00 0.00 0.00 23.12 21.00 1ccq s ALA 29 CO 0.00 -2.05 2.70 -0.35 0.00 0.00 0.00 175.76 176.05 1ccq n PRO 30 N 2.52 2.03 0.00 0.00 -0.04 -1.26 -2.92 135.00 135.32 1ccq n PRO 30 Ca 0.20 -1.17 0.00 0.00 -0.04 0.00 0.00 63.50 62.49 1ccq n PRO 30 Cb 0.38 -2.17 0.00 0.00 -0.04 0.00 0.00 33.50 31.67 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 3.16 -0.23 -3.42 0.54 -0.00 -1.26 -5.04 115.22 108.96 1ccq n HIS 31 Ca 0.43 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.72 1ccq n HIS 31 Cb 0.48 0.25 -0.09 0.00 -0.00 0.00 0.00 29.99 30.62 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 -1.49 5.23 1.10 3.57 1.01 -1.15 -5.07 120.40 123.61 1ccq s VAL 32 Ca 0.00 -0.71 -0.19 0.00 0.00 0.00 0.00 61.98 61.08 1ccq s VAL 32 Cb 0.00 -3.99 0.27 0.00 0.00 0.00 0.00 36.38 32.65 1ccq s VAL 32 CO 0.00 -0.39 1.22 -0.81 0.00 0.00 0.00 175.10 175.12 1ccq n PRO 33 N 5.24 -2.20 0.01 2.72 -0.04 -1.26 -4.62 135.00 134.84 1ccq n PRO 33 Ca -0.11 -1.91 0.00 0.00 -0.04 0.00 0.00 63.50 61.44 1ccq n PRO 33 Cb 0.46 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 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 -4.34 0.05 -4.28 0.52 0.31 -0.80 -4.99 118.33 104.80 1ccq n VAL 34 Ca 0.16 0.02 -0.17 0.00 -0.01 0.00 0.00 64.34 64.33 1ccq n VAL 34 Cb 0.58 -0.95 -0.10 0.00 -0.91 0.00 0.00 33.84 32.46 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 -2.00 1.13 -0.28 5.55 1.02 -1.03 -4.96 119.74 119.17 1ccq s LYS 35 Ca 0.00 -1.41 -0.16 0.00 0.02 0.00 0.00 55.97 54.42 1ccq s LYS 35 Cb 0.00 -0.90 0.08 0.00 -0.52 0.00 0.00 37.83 36.49 1ccq s LYS 35 CO 0.00 0.15 0.71 1.03 -0.92 0.00 0.00 175.35 176.32 1ccq s ARG 36 N -3.27 0.69 0.10 1.68 0.52 -1.26 -2.32 118.95 115.09 1ccq s ARG 36 Ca 0.15 1.19 -0.06 0.00 -0.52 0.00 0.00 55.73 56.49 1ccq s ARG 36 Cb -0.02 0.14 0.02 0.00 0.52 0.00 0.00 34.95 35.62 1ccq s ARG 36 CO 0.04 -0.14 0.29 0.41 0.02 0.00 0.00 175.30 175.91 1ccq n GLY 37 N 4.25 1.40 3.93 -3.53 0.00 -1.00 -4.53 105.19 105.70 1ccq n GLY 37 Ca -0.20 -1.05 -0.25 0.00 0.00 0.00 0.00 46.02 44.53 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 -2.73 0.00 -0.17 0.00 2.07 -0.69 -4.69 121.20 114.98 1ccq s ILE 39 Ca 0.50 -0.08 -0.12 0.00 -1.41 0.00 0.00 60.65 59.54 1ccq s ILE 39 Cb -0.10 -1.09 -0.07 0.00 0.13 0.00 0.00 42.46 41.33 1ccq s ILE 39 CO 0.42 0.00 -0.27 -0.67 -1.91 0.00 0.00 174.94 172.51 1ccq n ASP 40 N -0.35 1.58 -4.30 4.50 2.03 -1.26 -2.31 116.55 116.43 1ccq n ASP 40 Ca -0.14 0.27 -0.33 0.00 0.52 0.00 0.00 54.79 55.10 1ccq n ASP 40 Cb 0.64 -0.63 -0.15 0.00 -0.72 0.00 0.00 41.12 40.26 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 -2.50 2.93 -0.03 5.18 -7.23 -1.26 -4.68 120.40 112.80 1ccq s VAL 41 Ca -0.26 -0.68 -0.30 0.00 -1.81 0.00 0.00 61.98 58.93 1ccq s VAL 41 Cb 0.08 -2.26 -0.06 0.00 0.56 0.00 0.00 36.38 34.70 1ccq s VAL 41 CO 0.35 0.50 1.64 0.00 -0.31 0.00 0.00 175.10 177.28 1ccq s PRO 43 N 3.66 0.52 0.74 0.00 0.04 -1.26 -5.05 135.00 133.66 1ccq s PRO 43 Ca 0.73 0.06 -0.11 0.00 0.04 0.00 0.00 61.00 61.71 1ccq s PRO 43 Cb -0.34 -1.79 0.03 0.00 0.04 0.00 0.00 34.50 32.44 1ccq s PRO 43 CO 0.30 -2.57 1.09 0.21 0.04 0.00 0.00 177.00 176.07 1ccq s LYS 44 N -5.45 2.59 0.29 4.56 2.20 -1.26 -4.92 119.74 117.76 1ccq s LYS 44 Ca 0.68 0.62 0.08 0.00 -0.36 0.00 0.00 55.97 56.99 1ccq s LYS 44 Cb -0.11 -1.98 -0.04 0.00 -1.51 0.00 0.00 37.83 34.19 1ccq s LYS 44 CO 0.54 -1.26 0.15 -1.12 -0.36 0.00 0.00 175.35 173.30 1ccq s SER 45 N -4.08 5.01 0.43 1.43 0.01 -1.26 -4.69 113.70 110.56 1ccq s SER 45 Ca 0.59 -0.53 0.02 0.00 1.31 0.00 0.00 55.95 57.35 1ccq s SER 45 Cb -0.13 -1.01 -0.01 0.00 0.21 0.00 0.00 66.02 65.08 1ccq s SER 45 CO 0.53 -0.15 0.09 -1.54 0.41 0.00 0.00 173.24 172.58 1ccq n SER 46 N -1.13 2.03 0.09 2.44 3.41 -0.55 -5.03 113.62 114.89 1ccq n SER 46 Ca -0.05 -3.12 0.12 0.00 -0.26 0.00 0.00 58.87 55.56 1ccq n SER 46 Cb 0.59 0.75 0.24 0.00 -0.26 0.00 0.00 64.21 65.53 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 4.07 -2.01 -3.38 115.31 115.02 1ccq h LEU 47 Ca -0.35 -0.10 0.00 0.00 0.08 0.00 0.00 57.88 57.51 1ccq h LEU 47 Cb 1.20 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.94 1ccq h LEU 47 CO 0.56 0.05 -0.30 -0.11 -1.08 0.00 0.00 178.44 177.56 1ccq n LEU 48 N -2.30 0.79 -4.72 1.67 7.94 -1.26 -4.79 117.00 114.33 1ccq n LEU 48 Ca 0.04 0.30 -0.34 0.00 -1.11 0.00 0.00 56.01 54.90 1ccq n LEU 48 Cb 0.45 -0.64 -0.08 0.00 0.53 0.00 0.00 43.42 43.68 1ccq n LEU 48 CO 0.34 -0.45 -0.28 0.54 -1.11 0.00 0.00 177.39 176.43 1ccq s VAL 49 N -1.64 4.50 -0.06 1.96 0.11 -1.26 -2.32 120.40 121.68 1ccq s VAL 49 Ca -0.09 -0.31 0.04 0.00 -2.93 0.00 0.00 61.98 58.70 1ccq s VAL 49 Cb 0.01 -2.96 -0.02 0.00 -1.53 0.00 0.00 36.38 31.89 1ccq s VAL 49 CO 0.13 0.51 -0.20 -0.54 -3.33 0.00 0.00 175.10 171.67 1ccq s LYS 50 N -1.22 2.61 -0.37 1.54 1.02 -0.98 -1.48 119.74 120.86 1ccq s LYS 50 Ca 0.17 -0.80 0.03 0.00 0.02 0.00 0.00 55.97 55.38 1ccq s LYS 50 Cb -0.12 -2.30 0.11 0.00 -0.52 0.00 0.00 37.83 35.00 1ccq s LYS 50 CO 0.07 0.46 0.10 0.71 -0.92 0.00 0.00 175.35 175.76 1ccq s TYR 51 N -0.33 3.68 -0.20 3.18 1.51 -1.26 -2.57 117.35 121.36 1ccq s TYR 51 Ca 0.02 -2.94 -0.11 0.00 -1.01 0.00 0.00 57.07 53.03 1ccq s TYR 51 Cb -0.13 -2.97 -0.05 0.00 -0.11 0.00 0.00 41.96 38.71 1ccq s TYR 51 CO 0.02 -0.93 0.18 0.08 -1.11 0.00 0.00 175.55 173.80 1ccq s VAL 52 N 0.80 5.37 0.10 0.71 1.01 -1.01 -4.83 120.40 122.55 1ccq s VAL 52 Ca 0.11 0.29 0.07 0.00 0.00 0.00 0.00 61.98 62.46 1ccq s VAL 52 Cb -0.20 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 1ccq s VAL 52 CO -0.07 0.40 -0.12 0.00 0.00 0.00 0.00 175.10 175.32 1ccq n ASN 55 N 1.69 6.86 -4.20 0.00 6.94 -1.26 -2.52 115.26 122.77 1ccq n ASN 55 Ca -0.22 -3.80 -0.17 0.00 -0.02 0.00 0.00 54.58 50.37 1ccq n ASN 55 Cb 0.56 -0.89 -0.11 0.00 -2.36 0.00 0.00 39.78 36.97 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 -5.11 1.12 0.37 5.53 -4.23 -1.26 -5.08 115.64 106.98 1ccq s THR 56 Ca 0.53 -1.59 -0.26 0.00 -1.18 0.00 0.00 61.69 59.19 1ccq s THR 56 Cb 0.44 -1.35 -0.09 0.00 1.34 0.00 0.00 72.50 72.84 1ccq s THR 56 CO -0.28 -0.43 1.19 -1.81 -0.54 0.00 0.00 174.62 172.75 1ccq s ASP 57 N -2.28 6.64 -1.49 3.99 1.01 -1.26 -3.18 116.67 120.10 1ccq s ASP 57 Ca 0.05 2.40 -0.06 0.00 0.71 0.00 0.00 52.55 55.66 1ccq s ASP 57 Cb -0.05 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.26 1ccq s ASP 57 CO 0.02 -0.60 0.13 0.29 0.21 0.00 0.00 175.17 175.22 1ccq n LYS 58 N 0.32 -0.92 -0.13 8.23 5.02 -1.15 -4.82 118.16 124.72 1ccq n LYS 58 Ca 0.03 0.10 -0.20 0.00 -2.02 0.00 0.00 58.31 56.22 1ccq n LYS 58 Cb 0.45 -3.44 -0.12 0.00 -0.02 0.00 0.00 35.03 31.90 1ccq n LYS 58 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88