#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ccx s LYS 2 N 0.00 0.60 0.16 1.96 1.02 -1.26 -1.32 119.74 120.90 2ccx s LYS 2 Ca 0.00 -0.56 -0.12 0.00 0.02 0.00 0.00 55.97 55.31 2ccx s LYS 2 Cb 0.00 -0.50 0.01 0.00 -0.52 0.00 0.00 37.83 36.81 2ccx s LYS 2 CO 0.00 0.12 0.35 0.00 -0.92 0.00 0.00 175.35 174.90 2ccx s ASN 4 N -2.91 7.21 0.02 0.00 0.01 -1.26 -1.64 114.94 116.38 2ccx s ASN 4 Ca 0.11 2.23 0.06 0.00 -0.71 0.00 0.00 52.86 54.56 2ccx s ASN 4 Cb 0.02 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 39.04 2ccx s ASN 4 CO -0.04 -0.18 -0.19 -1.10 -1.51 0.00 0.00 177.10 174.08 2ccx s GLN 5 N -1.58 1.37 0.50 -0.60 -0.21 -1.26 -4.30 119.66 113.58 2ccx s GLN 5 Ca 0.46 -0.81 0.00 0.00 0.02 0.00 0.00 55.36 55.03 2ccx s GLN 5 Cb -0.30 -1.41 0.00 0.00 1.00 0.00 0.00 33.01 32.30 2ccx s GLN 5 CO 0.39 0.37 0.00 1.28 -2.12 0.00 0.00 175.29 175.21 2ccx n LEU 6 N 2.14 0.00 0.25 2.90 4.77 -1.01 -4.15 117.00 121.90 2ccx n LEU 6 Ca -0.16 0.52 -0.15 0.00 -0.03 0.00 0.00 56.01 56.19 2ccx n LEU 6 Cb 0.54 -1.62 -0.08 0.00 -2.33 0.00 0.00 43.42 39.93 2ccx n LEU 6 CO 0.23 -1.25 0.56 0.40 -1.33 0.00 0.00 177.39 176.00 2ccx h ILE 7 N -0.45 0.48 -4.33 -0.08 2.04 -1.91 -3.47 117.51 109.80 2ccx h ILE 7 Ca 0.01 -0.35 -0.51 0.00 1.00 0.00 0.00 64.86 65.01 2ccx h ILE 7 Cb 0.44 0.63 0.10 0.00 -0.74 0.00 0.00 36.82 37.26 2ccx h ILE 7 CO 0.00 0.06 0.36 -2.16 0.00 0.00 0.00 178.15 176.41 2ccx s PRO 8 N -5.10 2.74 -1.15 2.37 0.04 -1.26 -4.89 135.00 127.74 2ccx s PRO 8 Ca -0.15 0.96 -0.19 0.00 0.04 0.00 0.00 61.00 61.66 2ccx s PRO 8 Cb 0.03 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 2ccx s PRO 8 CO 0.55 -1.24 1.97 -0.35 0.04 0.00 0.00 177.00 177.96 2ccx n PRO 9 N -3.23 2.23 -0.04 0.56 -0.04 -1.26 -4.32 135.00 128.90 2ccx n PRO 9 Ca 0.08 -2.47 -0.20 0.00 -0.04 0.00 0.00 63.50 60.87 2ccx n PRO 9 Cb 0.54 -3.30 -0.13 0.00 -0.04 0.00 0.00 33.50 30.57 2ccx n PRO 9 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2ccx h PHE 10 N 7.68 0.22 -1.30 0.54 0.04 -1.91 -3.51 116.94 118.70 2ccx h PHE 10 Ca 0.43 -0.16 0.13 0.00 2.80 0.00 0.00 57.97 61.16 2ccx h PHE 10 Cb 0.76 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.87 2ccx h PHE 10 CO 1.33 1.45 -0.17 -2.67 -0.60 0.00 0.00 178.31 177.66 2ccx n TRP 11 N -4.19 -2.36 -3.56 -0.55 4.27 -1.26 -4.92 117.44 104.88 2ccx n TRP 11 Ca -0.25 0.57 -0.13 0.00 -3.89 0.00 0.00 57.50 53.80 2ccx n TRP 11 Cb 0.76 -1.02 -0.05 0.00 -1.36 0.00 0.00 31.31 29.64 2ccx n TRP 11 CO 0.00 0.00 0.00 0.21 -2.29 0.00 0.00 177.69 175.61 2ccx s LYS 12 N -1.08 0.75 -0.01 -2.67 2.20 -0.65 -4.58 119.74 113.71 2ccx s LYS 12 Ca 0.00 0.20 -0.30 0.00 -0.36 0.00 0.00 55.97 55.51 2ccx s LYS 12 Cb 0.00 0.36 -0.05 0.00 -1.51 0.00 0.00 37.83 36.62 2ccx s LYS 12 CO 0.00 -0.23 1.40 0.99 -0.36 0.00 0.00 175.35 177.15 2ccx s THR 13 N -1.09 3.74 -0.03 3.43 2.01 -1.26 -2.73 115.64 119.71 2ccx s THR 13 Ca -0.05 1.11 -0.30 0.00 0.31 0.00 0.00 61.69 62.77 2ccx s THR 13 Cb -0.00 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 2ccx s THR 13 CO 0.04 -0.01 1.08 0.00 -0.69 0.00 0.00 174.62 175.05 2ccx s PRO 15 N 1.54 2.67 0.10 0.00 0.04 -1.25 -4.62 135.00 133.48 2ccx s PRO 15 Ca 0.53 1.16 -0.31 0.00 0.04 0.00 0.00 61.00 62.43 2ccx s PRO 15 Cb -0.23 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.28 2ccx s PRO 15 CO 0.24 -1.33 1.52 0.21 0.04 0.00 0.00 177.00 177.68 2ccx s LYS 16 N -4.68 4.25 0.00 4.56 2.47 -1.26 -1.39 119.74 123.69 2ccx s LYS 16 Ca 0.62 2.22 0.00 0.00 -1.56 0.00 0.00 55.97 57.24 2ccx s LYS 16 Cb -0.17 -3.36 0.00 0.00 -1.46 0.00 0.00 37.83 32.84 2ccx s LYS 16 CO 0.51 -0.59 0.00 0.41 0.16 0.00 0.00 175.35 175.84 2ccx n GLY 17 N 3.73 0.77 2.25 5.54 0.00 -1.26 -4.95 105.19 111.28 2ccx n GLY 17 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 2ccx n GLY 17 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2ccx n LYS 18 N -2.04 1.13 -1.80 1.61 4.81 -0.49 -4.66 118.16 116.71 2ccx n LYS 18 Ca 0.00 -3.53 -0.10 0.00 -0.87 0.00 0.00 58.31 53.81 2ccx n LYS 18 Cb 0.00 -1.49 0.07 0.00 0.02 0.00 0.00 35.03 33.63 2ccx n LYS 18 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2ccx n ASN 19 N 1.08 3.22 -4.61 3.14 4.13 -0.94 -3.79 115.26 117.48 2ccx n ASN 19 Ca 0.23 -3.31 -0.36 0.00 1.68 0.00 0.00 54.58 52.83 2ccx n ASN 19 Cb 0.53 -0.41 -0.10 0.00 -1.54 0.00 0.00 39.78 38.26 2ccx n ASN 19 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2ccx s LEU 20 N -3.24 3.85 -0.38 3.41 1.43 0.12 -4.82 118.68 119.05 2ccx s LEU 20 Ca 0.42 0.04 -0.23 0.00 -1.03 0.00 0.00 54.13 53.33 2ccx s LEU 20 Cb 0.38 -2.01 0.01 0.00 0.03 0.00 0.00 46.19 44.61 2ccx s LEU 20 CO -0.02 0.10 0.77 0.00 0.23 0.00 0.00 176.35 177.43 2ccx s TYR 22 N 3.09 3.23 -0.20 0.00 1.13 -0.88 -0.79 117.35 122.93 2ccx s TYR 22 Ca 0.30 -0.05 -0.03 0.00 -1.41 0.00 0.00 57.07 55.88 2ccx s TYR 22 Cb -0.13 -1.49 0.06 0.00 -1.10 0.00 0.00 41.96 39.30 2ccx s TYR 22 CO 0.18 0.50 0.06 0.21 -2.51 0.00 0.00 175.55 173.99 2ccx s LYS 23 N -3.64 0.49 -1.01 -3.49 2.20 -0.54 -2.80 119.74 110.95 2ccx s LYS 23 Ca 0.33 -0.38 -0.18 0.00 -0.36 0.00 0.00 55.97 55.38 2ccx s LYS 23 Cb -0.09 -1.99 0.13 0.00 -1.51 0.00 0.00 37.83 34.37 2ccx s LYS 23 CO 0.26 -0.69 1.24 1.41 -0.36 0.00 0.00 175.35 177.21 2ccx s MET 24 N 1.92 3.72 0.48 4.03 -2.45 -1.26 -2.56 119.30 123.19 2ccx s MET 24 Ca 0.01 -1.91 -0.03 0.00 -1.25 0.00 0.00 55.69 52.51 2ccx s MET 24 Cb -0.17 -5.00 -0.01 0.00 1.25 0.00 0.00 34.83 30.90 2ccx s MET 24 CO -0.11 -1.82 0.75 0.95 1.05 0.00 0.00 175.02 175.84 2ccx s THR 25 N 2.65 4.30 0.12 10.11 -4.23 -0.72 -0.92 115.64 126.93 2ccx s THR 25 Ca 0.37 -0.17 -0.07 0.00 -1.18 0.00 0.00 61.69 60.64 2ccx s THR 25 Cb -0.04 -3.63 -0.06 0.00 1.34 0.00 0.00 72.50 70.12 2ccx s THR 25 CO -0.07 -0.54 0.39 -0.04 -0.54 0.00 0.00 174.62 173.82 2ccx s MET 26 N -4.69 3.68 0.10 3.99 -1.94 -1.26 -0.21 119.30 118.96 2ccx s MET 26 Ca 0.48 0.03 -0.13 0.00 -1.71 0.00 0.00 55.69 54.37 2ccx s MET 26 Cb -0.10 -2.90 -0.16 0.00 2.01 0.00 0.00 34.83 33.68 2ccx s MET 26 CO 0.42 0.50 1.30 -0.09 -0.01 0.00 0.00 175.02 177.14 2ccx h ARG 27 N 3.20 0.79 0.00 2.03 1.12 -1.04 -2.86 114.38 117.62 2ccx h ARG 27 Ca -0.47 -0.63 -0.09 0.00 -1.11 0.00 0.00 59.98 57.67 2ccx h ARG 27 Cb 1.18 0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 31.25 2ccx h ARG 27 CO 0.70 1.24 -0.42 0.00 -3.11 0.00 0.00 179.97 178.38 2ccx h ALA 28 N 0.55 1.26 -0.10 2.80 0.00 -1.81 -3.41 119.26 118.55 2ccx h ALA 28 Ca -0.05 -0.38 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 2ccx h ALA 28 Cb 1.38 -0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.96 2ccx h ALA 28 CO 0.16 0.52 -0.20 0.00 0.00 0.00 0.00 179.25 179.72 2ccx n ALA 29 N -2.44 -2.93 -0.84 0.00 0.00 -1.26 -5.05 120.51 108.00 2ccx n ALA 29 Ca -0.02 -0.58 -0.26 0.00 0.00 0.00 0.00 53.44 52.59 2ccx n ALA 29 Cb 0.45 -2.63 -0.02 0.00 0.00 0.00 0.00 19.45 17.25 2ccx n ALA 29 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2ccx n PRO 30 N 1.82 2.17 0.08 0.00 -0.04 -1.08 -4.32 135.00 133.63 2ccx n PRO 30 Ca 0.06 -1.57 -0.23 0.00 -0.04 0.00 0.00 63.50 61.73 2ccx n PRO 30 Cb 0.67 -2.53 -0.15 0.00 -0.04 0.00 0.00 33.50 31.44 2ccx n PRO 30 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 2ccx h MET 31 N 6.36 0.39 -4.61 0.54 4.05 -1.97 -3.46 114.93 116.23 2ccx h MET 31 Ca 0.52 -0.67 -0.54 0.00 -0.28 0.00 0.00 59.70 58.72 2ccx h MET 31 Cb 0.22 0.25 -0.34 0.00 -0.80 0.00 0.00 31.60 30.93 2ccx h MET 31 CO 1.53 1.32 -0.82 0.08 0.23 0.00 0.00 176.91 179.25 2ccx s VAL 32 N -2.52 1.28 -0.38 -5.77 1.01 -1.26 -5.08 120.40 107.68 2ccx s VAL 32 Ca -0.14 -0.53 -0.28 0.00 0.00 0.00 0.00 61.98 61.03 2ccx s VAL 32 Cb 0.03 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 2ccx s VAL 32 CO 0.86 0.39 1.98 -2.16 0.00 0.00 0.00 175.10 176.17 2ccx s PRO 33 N 0.86 3.00 0.07 2.72 0.04 -1.26 -4.52 135.00 135.90 2ccx s PRO 33 Ca -0.10 1.40 0.06 0.00 0.04 0.00 0.00 61.00 62.40 2ccx s PRO 33 Cb -0.15 -4.32 -0.23 0.00 0.04 0.00 0.00 34.50 29.84 2ccx s PRO 33 CO 0.01 -2.26 1.08 -0.24 0.04 0.00 0.00 177.00 175.63 2ccx h VAL 34 N 7.01 1.43 0.00 -0.36 3.04 -1.41 -3.41 116.25 122.55 2ccx h VAL 34 Ca -0.32 -3.16 0.00 0.00 -1.01 0.00 0.00 66.70 62.21 2ccx h VAL 34 Cb 1.19 2.74 0.00 0.00 -2.01 0.00 0.00 31.29 33.22 2ccx h VAL 34 CO 1.07 0.84 -0.15 0.29 -1.01 0.00 0.00 177.57 178.60 2ccx n LYS 35 N -3.30 0.00 -1.24 4.17 5.02 -1.26 -4.91 118.16 116.63 2ccx n LYS 35 Ca -0.06 0.00 0.17 0.00 -2.02 0.00 0.00 58.31 56.39 2ccx n LYS 35 Cb 0.98 -0.48 -0.05 0.00 -0.02 0.00 0.00 35.03 35.47 2ccx n LYS 35 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2ccx n ARG 36 N -3.42 -2.56 -2.37 1.97 1.74 -1.26 -2.41 116.66 108.35 2ccx n ARG 36 Ca 0.00 1.75 0.00 0.00 -0.77 0.00 0.00 57.85 58.83 2ccx n ARG 36 Cb 0.08 -3.10 0.00 0.00 -1.02 0.00 0.00 32.46 28.42 2ccx n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ccx n GLY 37 N -3.86 -0.61 3.89 -0.13 0.00 -1.12 -4.83 105.19 98.52 2ccx n GLY 37 Ca -0.00 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 44.15 2ccx n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ccx s ILE 39 N -1.21 0.00 -0.09 0.00 2.07 0.89 -4.90 121.20 117.97 2ccx s ILE 39 Ca 0.22 -1.97 -0.07 0.00 -1.41 0.00 0.00 60.65 57.43 2ccx s ILE 39 Cb -0.12 -2.48 -0.05 0.00 0.13 0.00 0.00 42.46 39.94 2ccx s ILE 39 CO 0.13 -0.01 0.27 0.44 -1.91 0.00 0.00 174.94 173.86 2ccx h ASP 40 N 2.60 -0.12 -3.40 4.50 3.32 -1.85 0.50 116.42 121.97 2ccx h ASP 40 Ca -0.35 -0.10 -0.47 0.00 0.02 0.00 0.00 57.03 56.12 2ccx h ASP 40 Cb 1.25 0.03 -0.16 0.00 0.22 0.00 0.00 39.33 40.67 2ccx h ASP 40 CO 0.52 0.41 -0.75 0.54 -1.72 0.00 0.00 179.24 178.24 2ccx s VAL 41 N -2.13 1.74 -0.41 -1.35 0.11 -1.26 -4.56 120.40 112.53 2ccx s VAL 41 Ca -0.04 -2.05 -0.41 0.00 -2.93 0.00 0.00 61.98 56.55 2ccx s VAL 41 Cb -0.00 -1.92 -0.16 0.00 -1.53 0.00 0.00 36.38 32.77 2ccx s VAL 41 CO 0.14 -0.47 2.03 0.00 -3.33 0.00 0.00 175.10 173.48 2ccx s PRO 43 N 5.35 2.43 -0.24 0.00 0.04 -1.26 -4.95 135.00 136.35 2ccx s PRO 43 Ca 1.11 1.37 -0.12 0.00 0.04 0.00 0.00 61.00 63.41 2ccx s PRO 43 Cb -1.21 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 31.37 2ccx s PRO 43 CO 0.62 -1.54 0.22 0.15 0.04 0.00 0.00 177.00 176.49 2ccx s LYS 44 N -4.37 4.06 0.51 4.56 3.01 -1.26 -4.86 119.74 121.38 2ccx s LYS 44 Ca 0.66 -0.18 -0.23 0.00 -1.01 0.00 0.00 55.97 55.21 2ccx s LYS 44 Cb -0.21 -3.57 -0.06 0.00 -1.01 0.00 0.00 37.83 32.98 2ccx s LYS 44 CO 0.48 -0.03 1.36 -1.54 0.51 0.00 0.00 175.35 176.12 2ccx s SER 45 N 1.24 5.53 0.00 2.83 1.04 -1.26 -4.80 113.70 118.29 2ccx s SER 45 Ca 0.10 2.76 0.00 0.00 0.48 0.00 0.00 55.95 59.29 2ccx s SER 45 Cb -0.14 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.34 2ccx s SER 45 CO 0.07 -1.39 0.00 -1.54 0.98 0.00 0.00 173.24 171.35 2ccx n SER 46 N -0.73 0.00 0.03 7.02 3.41 -0.18 -5.01 113.62 118.16 2ccx n SER 46 Ca 0.09 -0.87 -0.19 0.00 -0.26 0.00 0.00 58.87 57.63 2ccx n SER 46 Cb 0.44 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.28 2ccx n SER 46 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2ccx h LEU 47 N 0.00 0.75 0.00 1.04 7.12 -2.03 -3.34 115.31 118.84 2ccx h LEU 47 Ca 0.00 -0.76 -0.27 0.00 0.13 0.00 0.00 57.88 56.98 2ccx h LEU 47 Cb 0.00 -0.23 -0.05 0.00 -0.53 0.00 0.00 40.66 39.85 2ccx h LEU 47 CO 0.00 1.41 -1.74 0.00 -0.13 0.00 0.00 178.44 177.98 2ccx n LEU 48 N -4.01 0.74 -4.33 2.25 -0.00 -1.26 -4.58 117.00 105.81 2ccx n LEU 48 Ca -0.11 0.35 -0.31 0.00 -0.00 0.00 0.00 56.01 55.94 2ccx n LEU 48 Cb 0.80 0.19 -0.15 0.00 -0.00 0.00 0.00 43.42 44.26 2ccx n LEU 48 CO 0.52 0.34 -0.56 -0.63 -0.00 0.00 0.00 177.39 177.06 2ccx s ILE 49 N -2.67 2.14 -0.26 1.47 1.01 -1.25 -0.50 121.20 121.13 2ccx s ILE 49 Ca -0.05 -1.16 0.00 0.00 0.00 0.00 0.00 60.65 59.44 2ccx s ILE 49 Cb 0.08 -1.77 0.08 0.00 0.01 0.00 0.00 42.46 40.86 2ccx s ILE 49 CO 0.82 0.52 0.02 -0.75 0.00 0.00 0.00 174.94 175.56 2ccx s LYS 50 N -0.79 1.15 0.50 2.79 2.20 0.71 -1.01 119.74 125.30 2ccx s LYS 50 Ca 0.11 -1.03 -0.11 0.00 -0.36 0.00 0.00 55.97 54.58 2ccx s LYS 50 Cb -0.10 -2.40 -0.06 0.00 -1.51 0.00 0.00 37.83 33.76 2ccx s LYS 50 CO -0.00 -0.77 0.89 0.71 -0.36 0.00 0.00 175.35 175.82 2ccx s TYR 51 N 1.48 3.52 -0.07 4.03 2.02 -1.26 -1.76 117.35 125.31 2ccx s TYR 51 Ca 0.02 1.17 0.02 0.00 -0.37 0.00 0.00 57.07 57.90 2ccx s TYR 51 Cb -0.18 -2.57 0.01 0.00 -0.40 0.00 0.00 41.96 38.82 2ccx s TYR 51 CO -0.13 -0.35 -0.12 1.41 -1.57 0.00 0.00 175.55 174.79 2ccx s MET 52 N -4.42 1.72 0.03 -0.62 -2.45 -1.06 -4.89 119.30 107.60 2ccx s MET 52 Ca 0.53 -0.40 -0.01 0.00 -1.25 0.00 0.00 55.69 54.56 2ccx s MET 52 Cb -0.10 -1.46 -0.04 0.00 1.25 0.00 0.00 34.83 34.47 2ccx s MET 52 CO 0.40 -0.02 0.19 0.00 1.05 0.00 0.00 175.02 176.64 2ccx s ASN 55 N -3.06 -0.14 -0.11 0.00 4.22 -1.26 -0.75 114.94 113.83 2ccx s ASN 55 Ca 0.15 -1.92 -0.29 0.00 -2.14 0.00 0.00 52.86 48.67 2ccx s ASN 55 Cb -0.05 1.02 0.07 0.00 1.28 0.00 0.00 41.25 43.56 2ccx s ASN 55 CO 0.10 -0.14 0.68 0.42 -2.04 0.00 0.00 177.10 176.12 2ccx s THR 56 N 0.92 0.00 0.05 0.54 -4.23 -1.26 -5.03 115.64 106.63 2ccx s THR 56 Ca 0.26 -0.01 -0.31 0.00 -1.18 0.00 0.00 61.69 60.44 2ccx s THR 56 Cb -0.03 -0.99 -0.10 0.00 1.34 0.00 0.00 72.50 72.72 2ccx s THR 56 CO -0.08 -0.01 1.90 0.59 -0.54 0.00 0.00 174.62 176.48 2ccx n ASN 57 N 1.45 3.94 -3.90 3.99 4.13 -1.26 -1.70 115.26 121.91 2ccx n ASN 57 Ca -0.18 0.95 -0.30 0.00 1.68 0.00 0.00 54.58 56.74 2ccx n ASN 57 Cb 0.56 -1.50 0.03 0.00 -1.54 0.00 0.00 39.78 37.33 2ccx n ASN 57 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2ccx n LYS 58 N 6.54 -5.46 -0.03 3.52 4.76 -0.00 -4.89 118.16 122.60 2ccx n LYS 58 Ca 0.20 0.60 -0.09 0.00 -2.87 0.00 0.00 58.31 56.14 2ccx n LYS 58 Cb 0.37 -5.46 -0.03 0.00 -1.84 0.00 0.00 35.03 28.07 2ccx n LYS 58 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03