#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 0.03 1.96 1.02 -1.26 -3.92 119.74 118.17 2ccx s LYS 2 Ca 0.00 -0.65 0.04 0.00 0.02 0.00 0.00 55.97 55.38 2ccx s LYS 2 Cb 0.00 -0.48 -0.02 0.00 -0.52 0.00 0.00 37.83 36.81 2ccx s LYS 2 CO 0.00 0.11 -0.12 0.00 -0.92 0.00 0.00 175.35 174.42 2ccx s ASN 4 N -0.91 2.97 0.04 0.00 0.01 -1.26 -0.73 114.94 115.06 2ccx s ASN 4 Ca 0.01 1.88 0.08 0.00 -0.71 0.00 0.00 52.86 54.11 2ccx s ASN 4 Cb -0.07 -2.44 -0.03 0.00 0.41 0.00 0.00 41.25 39.12 2ccx s ASN 4 CO 0.01 -3.02 -0.22 -1.10 -1.51 0.00 0.00 177.10 171.26 2ccx s GLN 5 N -4.71 1.48 1.43 -0.60 -0.21 -1.00 -4.39 119.66 111.65 2ccx s GLN 5 Ca 0.65 -0.96 0.00 0.00 0.02 0.00 0.00 55.36 55.07 2ccx s GLN 5 Cb -0.21 -1.60 0.00 0.00 1.00 0.00 0.00 33.01 32.20 2ccx s GLN 5 CO 0.59 0.41 0.00 1.28 -2.12 0.00 0.00 175.29 175.45 2ccx n LEU 6 N 1.87 0.00 0.19 2.90 4.77 -1.26 -3.98 117.00 121.50 2ccx n LEU 6 Ca -0.17 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.66 2ccx n LEU 6 Cb 0.53 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.54 2ccx n LEU 6 CO 0.23 -0.26 0.71 0.40 -1.33 0.00 0.00 177.39 177.15 2ccx h ILE 7 N 0.00 0.69 -4.25 -0.08 2.04 -1.99 -3.46 117.51 110.46 2ccx h ILE 7 Ca 0.00 -0.15 -0.47 0.00 1.00 0.00 0.00 64.86 65.24 2ccx h ILE 7 Cb 0.00 0.77 0.12 0.00 -0.74 0.00 0.00 36.82 36.98 2ccx h ILE 7 CO 0.00 0.03 0.31 -2.16 0.00 0.00 0.00 178.15 176.33 2ccx s PRO 8 N -5.79 1.50 -1.15 2.37 0.04 -1.26 -4.89 135.00 125.83 2ccx s PRO 8 Ca -0.15 0.44 -0.08 0.00 0.04 0.00 0.00 61.00 61.25 2ccx s PRO 8 Cb 0.04 -1.87 -0.07 0.00 0.04 0.00 0.00 34.50 32.65 2ccx s PRO 8 CO 0.62 -1.98 2.37 -0.35 0.04 0.00 0.00 177.00 177.70 2ccx n PRO 9 N -3.64 2.58 -1.86 0.56 -0.04 -1.26 -4.26 135.00 127.07 2ccx n PRO 9 Ca 0.07 -1.74 -0.40 0.00 -0.04 0.00 0.00 63.50 61.39 2ccx n PRO 9 Cb 0.58 -2.60 -0.01 0.00 -0.04 0.00 0.00 33.50 31.43 2ccx n PRO 9 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2ccx n PHE 10 N 4.22 2.57 -2.89 0.54 3.01 -1.26 -4.95 117.46 118.71 2ccx n PHE 10 Ca 0.56 -2.88 -0.33 0.00 1.01 0.00 0.00 57.45 55.80 2ccx n PHE 10 Cb 0.18 -1.97 -0.07 0.00 -0.01 0.00 0.00 39.48 37.61 2ccx n PHE 10 CO 0.00 0.00 0.00 1.67 1.01 0.00 0.00 176.76 179.44 2ccx s TRP 11 N -0.46 3.37 0.19 1.38 1.48 -1.26 -2.38 118.94 121.25 2ccx s TRP 11 Ca 0.57 1.54 0.06 0.00 -1.06 0.00 0.00 56.10 57.21 2ccx s TRP 11 Cb 0.18 -2.79 -0.05 0.00 -1.16 0.00 0.00 33.47 29.66 2ccx s TRP 11 CO -0.09 -0.03 -0.12 0.15 -4.06 0.00 0.00 176.95 172.81 2ccx s LYS 12 N -3.01 1.24 -0.07 3.25 -0.14 0.09 -4.93 119.74 116.18 2ccx s LYS 12 Ca 0.59 -1.56 -0.10 0.00 -1.36 0.00 0.00 55.97 53.55 2ccx s LYS 12 Cb -0.10 -0.91 -0.05 0.00 -1.68 0.00 0.00 37.83 35.09 2ccx s LYS 12 CO 0.15 0.12 0.24 0.99 -0.76 0.00 0.00 175.35 176.09 2ccx s THR 13 N -3.13 5.33 0.04 2.17 2.01 -1.26 -1.63 115.64 119.17 2ccx s THR 13 Ca 0.21 0.43 -0.00 0.00 0.31 0.00 0.00 61.69 62.64 2ccx s THR 13 Cb 0.01 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 2ccx s THR 13 CO 0.05 0.59 0.18 0.00 -0.69 0.00 0.00 174.62 174.75 2ccx s PRO 15 N -2.29 4.54 -0.37 0.00 0.04 -1.26 -4.92 135.00 130.75 2ccx s PRO 15 Ca 0.31 1.89 -0.28 0.00 0.04 0.00 0.00 61.00 62.97 2ccx s PRO 15 Cb -0.13 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.18 2ccx s PRO 15 CO 0.24 0.04 2.02 0.21 0.04 0.00 0.00 177.00 179.54 2ccx s LYS 16 N -1.01 2.97 0.00 4.56 2.47 -1.26 -1.06 119.74 126.42 2ccx s LYS 16 Ca 0.48 1.45 0.00 0.00 -1.56 0.00 0.00 55.97 56.35 2ccx s LYS 16 Cb -0.33 -4.34 0.00 0.00 -1.46 0.00 0.00 37.83 31.70 2ccx s LYS 16 CO 0.41 -2.29 0.00 0.41 0.16 0.00 0.00 175.35 174.04 2ccx n GLY 17 N 5.65 1.01 2.76 5.54 0.00 -1.26 -5.10 105.19 113.78 2ccx n GLY 17 Ca 0.27 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.11 2ccx n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ccx s LYS 18 N 0.00 -0.02 -0.16 1.61 -2.85 -0.22 -4.43 119.74 113.67 2ccx s LYS 18 Ca 0.00 0.38 0.17 0.00 -1.00 0.00 0.00 55.97 55.52 2ccx s LYS 18 Cb 0.00 -0.36 0.37 0.00 -2.06 0.00 0.00 37.83 35.78 2ccx s LYS 18 CO 0.00 -0.27 1.20 0.09 0.10 0.00 0.00 175.35 176.47 2ccx n ASN 19 N 4.92 0.24 -4.24 0.03 3.02 0.14 -4.39 115.26 114.98 2ccx n ASN 19 Ca -0.12 -2.05 -0.34 0.00 -0.03 0.00 0.00 54.58 52.04 2ccx n ASN 19 Cb 0.50 -0.02 -0.15 0.00 -0.61 0.00 0.00 39.78 39.50 2ccx n ASN 19 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2ccx s LEU 20 N -2.09 2.50 -0.38 3.41 1.43 0.29 -4.81 118.68 119.03 2ccx s LEU 20 Ca 0.20 -0.49 -0.22 0.00 -1.03 0.00 0.00 54.13 52.59 2ccx s LEU 20 Cb 0.31 -1.58 0.01 0.00 0.03 0.00 0.00 46.19 44.95 2ccx s LEU 20 CO -0.09 0.04 0.73 0.00 0.23 0.00 0.00 176.35 177.26 2ccx s TYR 22 N 2.99 3.47 0.17 0.00 -0.85 -0.28 -2.65 117.35 120.19 2ccx s TYR 22 Ca 0.28 0.12 0.08 0.00 -0.52 0.00 0.00 57.07 57.04 2ccx s TYR 22 Cb -0.13 -1.69 -0.04 0.00 0.38 0.00 0.00 41.96 40.47 2ccx s TYR 22 CO 0.17 0.34 -0.18 -1.59 -1.52 0.00 0.00 175.55 172.77 2ccx s LYS 23 N -4.03 1.27 -0.30 -3.49 -2.85 -0.05 -3.76 119.74 106.53 2ccx s LYS 23 Ca 0.36 -1.41 -0.02 0.00 -1.00 0.00 0.00 55.97 53.90 2ccx s LYS 23 Cb -0.09 -1.32 0.10 0.00 -2.06 0.00 0.00 37.83 34.45 2ccx s LYS 23 CO 0.31 0.27 0.10 1.41 0.10 0.00 0.00 175.35 177.54 2ccx s MET 24 N -2.82 0.56 0.18 1.78 1.75 -1.19 -2.00 119.30 117.56 2ccx s MET 24 Ca 0.16 -0.88 0.01 0.00 -1.25 0.00 0.00 55.69 53.73 2ccx s MET 24 Cb -0.06 -1.77 0.01 0.00 2.84 0.00 0.00 34.83 35.85 2ccx s MET 24 CO 0.07 -0.97 0.05 0.25 -0.65 0.00 0.00 175.02 173.77 2ccx n THR 25 N 4.97 0.00 -4.24 10.11 -2.24 0.61 -0.60 114.28 122.89 2ccx n THR 25 Ca -0.04 -0.80 -0.31 0.00 -2.27 0.00 0.00 64.05 60.63 2ccx n THR 25 Cb 0.42 -0.02 -0.09 0.00 -2.10 0.00 0.00 70.33 68.55 2ccx n THR 25 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2ccx s MET 26 N -2.69 2.63 0.25 -0.78 -1.94 -1.26 0.00 119.30 115.51 2ccx s MET 26 Ca 0.04 -0.74 0.09 0.00 -1.71 0.00 0.00 55.69 53.38 2ccx s MET 26 Cb -0.00 -2.58 0.27 0.00 2.01 0.00 0.00 34.83 34.53 2ccx s MET 26 CO 0.03 0.58 1.56 0.07 -0.01 0.00 0.00 175.02 177.25 2ccx h ARG 27 N 3.95 0.02 0.00 2.03 0.11 -1.84 -1.72 114.38 116.93 2ccx h ARG 27 Ca -0.48 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 59.57 2ccx h ARG 27 Cb 1.17 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.25 2ccx h ARG 27 CO 0.58 0.68 -0.57 0.00 0.10 0.00 0.00 179.97 180.76 2ccx h ALA 28 N 1.31 0.73 0.00 0.08 0.00 -1.91 -3.41 119.26 116.05 2ccx h ALA 28 Ca -0.01 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.64 2ccx h ALA 28 Cb 1.19 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.85 2ccx h ALA 28 CO 0.09 0.07 -0.41 0.00 0.00 0.00 0.00 179.25 179.00 2ccx n ALA 29 N -2.16 -1.56 -0.84 0.00 0.00 -1.23 -5.03 120.51 109.68 2ccx n ALA 29 Ca 0.01 -1.27 -0.26 0.00 0.00 0.00 0.00 53.44 51.93 2ccx n ALA 29 Cb 0.56 -1.56 -0.02 0.00 0.00 0.00 0.00 19.45 18.44 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 1.32 2.16 0.04 0.00 -0.04 -0.65 -4.10 135.00 133.73 2ccx n PRO 30 Ca 0.07 -1.57 -0.22 0.00 -0.04 0.00 0.00 63.50 61.74 2ccx n PRO 30 Cb 0.66 -2.54 -0.14 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 6.38 0.31 -4.24 0.54 4.05 -1.96 -3.47 114.93 116.53 2ccx h MET 31 Ca 0.52 -0.53 -0.44 0.00 -0.28 0.00 0.00 59.70 58.96 2ccx h MET 31 Cb 0.23 0.20 -0.33 0.00 -0.80 0.00 0.00 31.60 30.89 2ccx h MET 31 CO 1.53 1.25 -0.79 0.08 0.23 0.00 0.00 176.91 179.22 2ccx s VAL 32 N -2.51 0.75 -0.35 -5.77 1.01 -1.26 -5.09 120.40 107.18 2ccx s VAL 32 Ca -0.18 -0.26 -0.28 0.00 0.00 0.00 0.00 61.98 61.26 2ccx s VAL 32 Cb 0.04 -0.73 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 2ccx s VAL 32 CO 0.81 0.27 1.74 -2.16 0.00 0.00 0.00 175.10 175.75 2ccx s PRO 33 N 0.75 3.36 -0.09 2.72 0.04 -1.26 -4.60 135.00 135.92 2ccx s PRO 33 Ca -0.12 1.33 -0.20 0.00 0.04 0.00 0.00 61.00 62.05 2ccx s PRO 33 Cb -0.14 -4.17 -0.28 0.00 0.04 0.00 0.00 34.50 29.94 2ccx s PRO 33 CO 0.02 -1.83 0.68 0.28 0.04 0.00 0.00 177.00 176.19 2ccx h VAL 34 N 6.75 1.28 -2.62 -0.36 2.07 -1.23 -3.45 116.25 118.68 2ccx h VAL 34 Ca -0.32 -2.44 -0.60 0.00 0.82 0.00 0.00 66.70 64.16 2ccx h VAL 34 Cb 1.16 2.93 -0.16 0.00 -1.52 0.00 0.00 31.29 33.70 2ccx h VAL 34 CO 1.05 0.67 -0.77 -0.54 0.02 0.00 0.00 177.57 178.00 2ccx s LYS 35 N -2.43 1.56 0.11 1.57 -0.14 -1.25 -4.99 119.74 114.18 2ccx s LYS 35 Ca -0.18 -1.66 -0.14 0.00 -1.36 0.00 0.00 55.97 52.63 2ccx s LYS 35 Cb 0.02 -1.68 0.03 0.00 -1.68 0.00 0.00 37.83 34.52 2ccx s LYS 35 CO 0.77 0.33 0.34 1.03 -0.76 0.00 0.00 175.35 177.06 2ccx s ARG 36 N -3.26 1.01 0.00 1.68 0.52 -1.26 -3.16 118.95 114.48 2ccx s ARG 36 Ca 0.26 -0.77 0.00 0.00 -0.52 0.00 0.00 55.73 54.69 2ccx s ARG 36 Cb -0.05 0.44 0.00 0.00 0.52 0.00 0.00 34.95 35.85 2ccx s ARG 36 CO 0.12 -0.38 0.00 0.41 0.02 0.00 0.00 175.30 175.47 2ccx n GLY 37 N -0.18 -2.11 3.78 -3.53 0.00 -1.25 -4.91 105.19 97.00 2ccx n GLY 37 Ca -0.16 -1.25 -0.30 0.00 0.00 0.00 0.00 46.02 44.31 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 -3.10 0.00 -0.03 0.00 2.07 0.14 -4.83 121.20 115.45 2ccx s ILE 39 Ca 0.62 -1.28 -0.10 0.00 -1.41 0.00 0.00 60.65 58.47 2ccx s ILE 39 Cb -0.15 -2.35 -0.06 0.00 0.13 0.00 0.00 42.46 40.03 2ccx s ILE 39 CO 0.55 0.00 0.52 -0.78 -1.91 0.00 0.00 174.94 173.32 2ccx h ASP 40 N 2.13 -0.32 -3.06 4.50 3.58 -1.87 0.15 116.42 121.53 2ccx h ASP 40 Ca -0.26 0.01 -0.50 0.00 0.42 0.00 0.00 57.03 56.70 2ccx h ASP 40 Cb 1.25 0.08 -0.15 0.00 1.72 0.00 0.00 39.33 42.23 2ccx h ASP 40 CO 0.34 0.01 -0.75 0.54 -2.88 0.00 0.00 179.24 176.50 2ccx s VAL 41 N -2.82 1.93 -0.32 2.25 0.11 -1.26 -4.54 120.40 115.75 2ccx s VAL 41 Ca -0.06 -2.19 -0.40 0.00 -2.93 0.00 0.00 61.98 56.40 2ccx s VAL 41 Cb 0.01 -2.06 -0.16 0.00 -1.53 0.00 0.00 36.38 32.64 2ccx s VAL 41 CO 0.17 -0.48 1.81 0.00 -3.33 0.00 0.00 175.10 173.27 2ccx s PRO 43 N 3.99 4.31 0.24 0.00 0.04 -1.26 -5.00 135.00 137.32 2ccx s PRO 43 Ca 1.02 2.11 -0.25 0.00 0.04 0.00 0.00 61.00 63.92 2ccx s PRO 43 Cb -1.11 -3.24 -0.09 0.00 0.04 0.00 0.00 34.50 30.11 2ccx s PRO 43 CO 0.65 -0.46 0.84 0.21 0.04 0.00 0.00 177.00 178.29 2ccx s LYS 44 N 1.10 4.53 0.64 4.56 2.20 -1.26 -4.68 119.74 126.82 2ccx s LYS 44 Ca 0.65 1.18 -0.18 0.00 -0.36 0.00 0.00 55.97 57.26 2ccx s LYS 44 Cb -0.38 -3.01 -0.02 0.00 -1.51 0.00 0.00 37.83 32.92 2ccx s LYS 44 CO 0.30 0.42 1.27 -1.12 -0.36 0.00 0.00 175.35 175.87 2ccx s SER 45 N -1.44 4.72 0.23 1.43 0.01 -1.26 -4.65 113.70 112.73 2ccx s SER 45 Ca 0.43 2.56 0.04 0.00 1.31 0.00 0.00 55.95 60.29 2ccx s SER 45 Cb -0.20 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.40 2ccx s SER 45 CO 0.25 -1.92 0.13 -1.54 0.41 0.00 0.00 173.24 170.57 2ccx n SER 46 N -1.86 0.34 -0.02 2.44 3.41 0.34 -4.92 113.62 113.36 2ccx n SER 46 Ca 0.15 -2.33 -0.16 0.00 -0.26 0.00 0.00 58.87 56.27 2ccx n SER 46 Cb 0.49 0.82 -0.12 0.00 -0.26 0.00 0.00 64.21 65.14 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 0.30 0.00 1.04 7.12 -2.02 -3.33 115.31 118.41 2ccx h LEU 47 Ca -0.17 -0.79 -0.11 0.00 0.13 0.00 0.00 57.88 56.94 2ccx h LEU 47 Cb 0.73 -0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 40.76 2ccx h LEU 47 CO 0.26 1.05 -0.92 0.17 -0.13 0.00 0.00 178.44 178.87 2ccx h LEU 48 N -0.43 0.00 -7.69 2.25 -0.00 -1.98 -3.43 115.31 104.03 2ccx h LEU 48 Ca -0.05 0.00 -0.39 0.00 -0.00 0.00 0.00 57.88 57.44 2ccx h LEU 48 Cb 1.11 0.00 -0.34 0.00 -0.00 0.00 0.00 40.66 41.43 2ccx h LEU 48 CO 0.07 0.41 -0.76 -0.63 -0.00 0.00 0.00 178.44 177.52 2ccx s ILE 49 N -3.03 0.43 -0.36 0.15 1.01 -1.25 -4.72 121.20 113.42 2ccx s ILE 49 Ca 0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.50 2ccx s ILE 49 Cb 0.08 -0.48 0.03 0.00 0.01 0.00 0.00 42.46 42.10 2ccx s ILE 49 CO 0.77 0.20 0.18 -0.75 0.00 0.00 0.00 174.94 175.35 2ccx s LYS 50 N 0.99 2.85 0.22 2.79 2.47 0.10 -0.50 119.74 128.65 2ccx s LYS 50 Ca -0.10 -1.06 0.01 0.00 -1.56 0.00 0.00 55.97 53.26 2ccx s LYS 50 Cb -0.14 -3.66 -0.04 0.00 -1.46 0.00 0.00 37.83 32.53 2ccx s LYS 50 CO -0.01 -0.66 0.39 0.71 0.16 0.00 0.00 175.35 175.94 2ccx s TYR 51 N 1.53 3.48 0.06 4.03 2.02 -1.26 -0.29 117.35 126.92 2ccx s TYR 51 Ca 0.02 0.23 -0.06 0.00 -0.37 0.00 0.00 57.07 56.88 2ccx s TYR 51 Cb -0.19 -1.77 -0.01 0.00 -0.40 0.00 0.00 41.96 39.59 2ccx s TYR 51 CO 0.06 0.37 0.12 -1.64 -1.57 0.00 0.00 175.55 172.90 2ccx s MET 52 N -3.60 0.70 0.12 -0.62 -1.94 -0.85 -4.45 119.30 108.67 2ccx s MET 52 Ca 0.37 -0.90 0.05 0.00 -1.71 0.00 0.00 55.69 53.49 2ccx s MET 52 Cb -0.10 0.28 -0.04 0.00 2.01 0.00 0.00 34.83 36.97 2ccx s MET 52 CO 0.30 -0.19 -0.11 0.00 -0.01 0.00 0.00 175.02 175.01 2ccx s ASN 55 N -3.05 -0.08 -0.07 0.00 2.20 -1.26 -2.34 114.94 110.34 2ccx s ASN 55 Ca 0.15 -1.99 -0.29 0.00 -0.94 0.00 0.00 52.86 49.78 2ccx s ASN 55 Cb -0.05 0.95 0.10 0.00 -2.00 0.00 0.00 41.25 40.25 2ccx s ASN 55 CO 0.10 -0.14 0.84 0.42 -2.94 0.00 0.00 177.10 175.38 2ccx s THR 56 N 0.85 0.00 -0.38 0.54 -4.23 -1.26 -5.08 115.64 106.08 2ccx s THR 56 Ca 0.27 0.00 -0.32 0.00 -1.18 0.00 0.00 61.69 60.46 2ccx s THR 56 Cb -0.03 -1.00 -0.10 0.00 1.34 0.00 0.00 72.50 72.71 2ccx s THR 56 CO -0.09 0.00 2.27 0.59 -0.54 0.00 0.00 174.62 176.85 2ccx n ASN 57 N 0.48 2.28 -3.27 3.99 3.02 -1.26 -2.45 115.26 118.05 2ccx n ASN 57 Ca -0.13 0.22 -0.23 0.00 -0.03 0.00 0.00 54.58 54.40 2ccx n ASN 57 Cb 0.59 -1.35 0.05 0.00 -0.61 0.00 0.00 39.78 38.46 2ccx n ASN 57 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2ccx n LYS 58 N 8.46 -5.94 0.17 3.52 5.02 0.23 -4.91 118.16 124.71 2ccx n LYS 58 Ca 0.40 0.86 -0.08 0.00 -2.02 0.00 0.00 58.31 57.46 2ccx n LYS 58 Cb 0.31 -5.79 -0.04 0.00 -0.02 0.00 0.00 35.03 29.49 2ccx n LYS 58 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88