#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 0.68 0.17 1.96 -2.85 -1.26 -3.44 119.74 115.00 2ccx s LYS 2 Ca 0.00 0.50 0.10 0.00 -1.00 0.00 0.00 55.97 55.57 2ccx s LYS 2 Cb 0.00 0.32 -0.04 0.00 -2.06 0.00 0.00 37.83 36.05 2ccx s LYS 2 CO 0.00 -0.13 -0.23 0.00 0.10 0.00 0.00 175.35 175.10 2ccx s ASN 4 N -2.48 4.00 0.16 0.00 0.01 -1.26 -0.62 114.94 114.74 2ccx s ASN 4 Ca 0.17 0.87 0.04 0.00 -0.71 0.00 0.00 52.86 53.23 2ccx s ASN 4 Cb -0.08 -1.40 -0.04 0.00 0.41 0.00 0.00 41.25 40.14 2ccx s ASN 4 CO 0.08 -2.23 0.18 -1.10 -1.51 0.00 0.00 177.10 172.51 2ccx s GLN 5 N -5.43 3.06 -0.10 -0.60 -1.52 -0.25 -4.44 119.66 110.39 2ccx s GLN 5 Ca 0.63 -0.78 -0.26 0.00 -1.95 0.00 0.00 55.36 52.99 2ccx s GLN 5 Cb -0.13 -2.74 -0.27 0.00 -0.22 0.00 0.00 33.01 29.65 2ccx s GLN 5 CO 0.51 0.50 0.86 1.37 -0.25 0.00 0.00 175.29 178.27 2ccx h LEU 6 N 2.34 0.16 0.00 2.90 8.10 -1.94 -3.37 115.31 123.50 2ccx h LEU 6 Ca -0.48 -0.94 -0.00 0.00 0.11 0.00 0.00 57.88 56.57 2ccx h LEU 6 Cb 1.20 -0.05 -0.00 0.00 -0.44 0.00 0.00 40.66 41.36 2ccx h LEU 6 CO 0.65 1.09 -0.00 0.40 -4.11 0.00 0.00 178.44 176.47 2ccx h ILE 7 N -0.74 0.17 -4.26 0.15 2.04 -1.98 -3.48 117.51 109.42 2ccx h ILE 7 Ca -0.04 -1.13 -0.47 0.00 1.00 0.00 0.00 64.86 64.22 2ccx h ILE 7 Cb 1.17 0.32 0.12 0.00 -0.74 0.00 0.00 36.82 37.70 2ccx h ILE 7 CO 0.05 0.06 0.31 -2.16 0.00 0.00 0.00 178.15 176.41 2ccx s PRO 8 N -1.62 1.41 0.00 2.37 0.04 -1.26 -4.93 135.00 131.02 2ccx s PRO 8 Ca -0.02 0.39 0.24 0.00 0.04 0.00 0.00 61.00 61.65 2ccx s PRO 8 Cb -0.00 -1.86 1.31 0.00 0.04 0.00 0.00 34.50 33.99 2ccx s PRO 8 CO 0.07 -2.03 1.79 -0.35 0.04 0.00 0.00 177.00 176.51 2ccx n PRO 9 N -3.67 0.54 -1.26 0.56 -0.04 -1.26 -4.52 135.00 125.36 2ccx n PRO 9 Ca 0.07 0.03 -0.35 0.00 -0.04 0.00 0.00 63.50 63.21 2ccx n PRO 9 Cb 0.58 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.65 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 -1.14 0.95 -3.76 0.54 3.72 -1.26 -4.85 117.46 111.65 2ccx n PHE 10 Ca 0.15 0.39 -0.13 0.00 -0.05 0.00 0.00 57.45 57.81 2ccx n PHE 10 Cb 0.13 -2.10 -0.09 0.00 -0.94 0.00 0.00 39.48 36.49 2ccx n PHE 10 CO 0.00 0.00 0.00 1.67 -0.05 0.00 0.00 176.76 178.38 2ccx s TRP 11 N -1.94 -0.19 -0.01 1.38 1.48 -1.26 -1.09 118.94 117.32 2ccx s TRP 11 Ca 0.73 0.28 0.01 0.00 -1.06 0.00 0.00 56.10 56.07 2ccx s TRP 11 Cb -0.32 0.10 0.00 0.00 -1.16 0.00 0.00 33.47 32.09 2ccx s TRP 11 CO 0.50 -0.38 -0.04 0.15 -4.06 0.00 0.00 176.95 173.12 2ccx s LYS 12 N -1.28 0.41 0.29 3.25 1.02 0.21 -4.94 119.74 118.70 2ccx s LYS 12 Ca -0.13 -0.14 -0.29 0.00 0.02 0.00 0.00 55.97 55.42 2ccx s LYS 12 Cb -0.05 -0.42 -0.10 0.00 -0.52 0.00 0.00 37.83 36.74 2ccx s LYS 12 CO 0.04 0.07 1.30 0.99 -0.92 0.00 0.00 175.35 176.83 2ccx s THR 13 N 0.07 2.90 0.44 2.17 2.01 -1.26 -1.02 115.64 120.95 2ccx s THR 13 Ca -0.00 0.85 -0.23 0.00 0.31 0.00 0.00 61.69 62.62 2ccx s THR 13 Cb -0.04 -3.54 -0.08 0.00 0.01 0.00 0.00 72.50 68.85 2ccx s THR 13 CO -0.00 0.18 1.08 0.00 -0.69 0.00 0.00 174.62 175.19 2ccx s PRO 15 N -2.76 2.96 0.30 0.00 0.04 -1.26 -4.93 135.00 129.35 2ccx s PRO 15 Ca 0.62 1.08 -0.30 0.00 0.04 0.00 0.00 61.00 62.44 2ccx s PRO 15 Cb -0.22 -1.99 -0.11 0.00 0.04 0.00 0.00 34.50 32.22 2ccx s PRO 15 CO 0.27 -1.09 1.53 0.21 0.04 0.00 0.00 177.00 177.96 2ccx s LYS 16 N -4.69 4.16 0.00 4.56 2.20 -1.26 -1.19 119.74 123.52 2ccx s LYS 16 Ca 0.60 2.50 0.00 0.00 -0.36 0.00 0.00 55.97 58.72 2ccx s LYS 16 Cb -0.15 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.13 2ccx s LYS 16 CO 0.49 -0.55 0.00 0.41 -0.36 0.00 0.00 175.35 175.34 2ccx n GLY 17 N 1.79 1.00 2.90 5.54 0.00 -1.26 -5.03 105.19 110.12 2ccx n GLY 17 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 2ccx n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ccx s LYS 18 N -0.63 1.49 -0.38 1.61 1.02 -0.33 -4.41 119.74 118.12 2ccx s LYS 18 Ca 0.00 -0.33 0.12 0.00 0.02 0.00 0.00 55.97 55.78 2ccx s LYS 18 Cb 0.00 -1.72 0.38 0.00 -0.52 0.00 0.00 37.83 35.97 2ccx s LYS 18 CO 0.00 -0.32 0.91 0.09 -0.92 0.00 0.00 175.35 175.11 2ccx n ASN 19 N 4.92 0.20 -4.79 2.83 4.13 -1.19 -4.19 115.26 117.18 2ccx n ASN 19 Ca -0.12 -3.01 -0.24 0.00 1.68 0.00 0.00 54.58 52.89 2ccx n ASN 19 Cb 0.49 -0.02 -0.06 0.00 -1.54 0.00 0.00 39.78 38.66 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 -2.64 3.10 -0.12 3.41 1.43 -0.17 -4.89 118.68 118.80 2ccx s LEU 20 Ca 0.32 -1.05 0.02 0.00 -1.03 0.00 0.00 54.13 52.39 2ccx s LEU 20 Cb 0.37 -1.52 0.01 0.00 0.03 0.00 0.00 46.19 45.08 2ccx s LEU 20 CO -0.05 -0.64 -0.18 0.00 0.23 0.00 0.00 176.35 175.71 2ccx s TYR 22 N 0.95 2.27 0.02 0.00 1.13 -0.77 -2.69 117.35 118.26 2ccx s TYR 22 Ca -0.06 -0.80 0.04 0.00 -1.41 0.00 0.00 57.07 54.84 2ccx s TYR 22 Cb -0.15 -1.62 -0.02 0.00 -1.10 0.00 0.00 41.96 39.08 2ccx s TYR 22 CO -0.02 0.29 -0.14 0.21 -2.51 0.00 0.00 175.55 173.38 2ccx s LYS 23 N -3.77 1.00 -0.08 -3.49 2.20 -0.99 -3.40 119.74 111.21 2ccx s LYS 23 Ca 0.31 -0.62 0.00 0.00 -0.36 0.00 0.00 55.97 55.30 2ccx s LYS 23 Cb 0.08 -0.99 0.02 0.00 -1.51 0.00 0.00 37.83 35.43 2ccx s LYS 23 CO 0.15 0.26 -0.06 1.41 -0.36 0.00 0.00 175.35 176.75 2ccx s MET 24 N -0.74 1.21 0.35 4.03 -2.45 -1.26 -3.43 119.30 117.01 2ccx s MET 24 Ca 0.03 -0.18 -0.04 0.00 -1.25 0.00 0.00 55.69 54.25 2ccx s MET 24 Cb -0.07 -1.23 0.02 0.00 1.25 0.00 0.00 34.83 34.80 2ccx s MET 24 CO 0.00 -0.16 0.53 2.41 1.05 0.00 0.00 175.02 178.86 2ccx n THR 25 N 4.48 0.00 -2.68 10.11 -1.04 -0.45 -3.55 114.28 121.15 2ccx n THR 25 Ca -0.17 -1.63 -0.41 0.00 -2.04 0.00 0.00 64.05 59.80 2ccx n THR 25 Cb 0.51 1.07 -0.05 0.00 -1.82 0.00 0.00 70.33 70.03 2ccx n THR 25 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 2ccx s MET 26 N -2.67 4.74 0.19 -2.82 -1.94 -1.26 0.10 119.30 115.64 2ccx s MET 26 Ca 0.27 1.54 0.02 0.00 -1.71 0.00 0.00 55.69 55.81 2ccx s MET 26 Cb -0.02 -3.31 0.09 0.00 2.01 0.00 0.00 34.83 33.61 2ccx s MET 26 CO 0.19 0.31 1.45 -0.09 -0.01 0.00 0.00 175.02 176.87 2ccx h ARG 27 N 4.79 0.25 -0.04 2.03 2.43 -1.31 -3.03 114.38 119.50 2ccx h ARG 27 Ca -0.44 -0.22 -0.15 0.00 -0.81 0.00 0.00 59.98 58.36 2ccx h ARG 27 Cb 1.21 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.79 2ccx h ARG 27 CO 0.70 0.90 -0.63 0.00 -1.51 0.00 0.00 179.97 179.42 2ccx h ALA 28 N 1.04 0.86 -0.05 2.80 0.00 -1.81 -3.43 119.26 118.67 2ccx h ALA 28 Ca -0.03 -0.56 -0.06 0.00 0.00 0.00 0.00 54.91 54.26 2ccx h ALA 28 Cb 1.34 -0.09 -0.14 0.00 0.00 0.00 0.00 17.79 18.90 2ccx h ALA 28 CO 0.12 0.76 -0.09 0.00 0.00 0.00 0.00 179.25 180.04 2ccx n ALA 29 N -2.45 -3.48 -0.91 0.00 0.00 -1.25 -5.05 120.51 107.36 2ccx n ALA 29 Ca -0.02 -0.29 -0.28 0.00 0.00 0.00 0.00 53.44 52.84 2ccx n ALA 29 Cb 0.63 -3.12 -0.02 0.00 0.00 0.00 0.00 19.45 16.93 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 1.78 2.16 0.05 0.00 -0.04 -1.15 -4.30 135.00 133.51 2ccx n PRO 30 Ca 0.04 -1.65 -0.20 0.00 -0.04 0.00 0.00 63.50 61.66 2ccx n PRO 30 Cb 0.69 -2.60 -0.14 0.00 -0.04 0.00 0.00 33.50 31.40 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 6.47 0.31 -5.61 0.54 4.05 -1.97 -3.46 114.93 115.26 2ccx h MET 31 Ca 0.52 -0.52 -0.58 0.00 -0.28 0.00 0.00 59.70 58.83 2ccx h MET 31 Cb 0.28 0.19 -0.09 0.00 -0.80 0.00 0.00 31.60 31.19 2ccx h MET 31 CO 1.59 1.19 -0.19 0.08 0.23 0.00 0.00 176.91 179.82 2ccx s VAL 32 N -2.59 5.21 -0.40 -5.77 1.01 -1.26 -5.03 120.40 111.56 2ccx s VAL 32 Ca -0.14 0.81 -0.28 0.00 0.00 0.00 0.00 61.98 62.37 2ccx s VAL 32 Cb 0.06 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 2ccx s VAL 32 CO 0.84 0.32 1.63 -2.16 0.00 0.00 0.00 175.10 175.72 2ccx s PRO 33 N 0.79 3.36 0.00 2.72 0.04 -1.26 -4.71 135.00 135.94 2ccx s PRO 33 Ca 0.22 1.09 0.00 0.00 0.04 0.00 0.00 61.00 62.35 2ccx s PRO 33 Cb -0.15 -4.14 0.00 0.00 0.04 0.00 0.00 34.50 30.25 2ccx s PRO 33 CO 0.08 -1.83 0.00 0.28 0.04 0.00 0.00 177.00 175.57 2ccx n VAL 34 N 7.23 0.00 0.00 -0.36 0.31 -1.26 -4.99 118.33 119.26 2ccx n VAL 34 Ca 0.19 0.32 0.00 0.00 -0.01 0.00 0.00 64.34 64.84 2ccx n VAL 34 Cb 0.48 -1.06 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 2ccx n VAL 34 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2ccx n LYS 35 N -1.65 0.00 -1.47 5.55 3.00 -1.23 -5.09 118.16 117.27 2ccx n LYS 35 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 58.31 58.50 2ccx n LYS 35 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 34.96 2ccx n LYS 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2ccx n ARG 36 N -2.28 -3.15 0.00 1.64 5.12 -1.26 -4.96 116.66 111.77 2ccx n ARG 36 Ca 0.00 2.33 0.00 0.00 -1.93 0.00 0.00 57.85 58.25 2ccx n ARG 36 Cb 0.00 -3.77 0.00 0.00 -1.16 0.00 0.00 32.46 27.53 2ccx n ARG 36 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ccx n GLY 37 N -4.33 0.34 3.63 -0.13 0.00 -1.22 -4.91 105.19 98.58 2ccx n GLY 37 Ca -0.03 -1.92 -0.28 0.00 0.00 0.00 0.00 46.02 43.79 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 -1.53 0.09 -0.05 0.00 2.07 -1.21 -4.93 121.20 115.64 2ccx s ILE 39 Ca 0.25 -1.35 -0.15 0.00 -1.41 0.00 0.00 60.65 58.00 2ccx s ILE 39 Cb -0.10 -1.71 -0.09 0.00 0.13 0.00 0.00 42.46 40.70 2ccx s ILE 39 CO 0.17 -0.40 0.61 -2.24 -1.91 0.00 0.00 174.94 171.16 2ccx h ASP 40 N 2.62 -0.36 -3.05 4.50 2.03 -1.92 -0.40 116.42 119.84 2ccx h ASP 40 Ca -0.33 -0.06 -0.47 0.00 -0.73 0.00 0.00 57.03 55.44 2ccx h ASP 40 Cb 1.22 0.09 -0.14 0.00 -0.83 0.00 0.00 39.33 39.67 2ccx h ASP 40 CO 0.51 0.11 -0.73 0.54 -1.03 0.00 0.00 179.24 178.64 2ccx s VAL 41 N -3.15 1.82 -0.43 4.15 0.11 -1.26 -4.60 120.40 117.04 2ccx s VAL 41 Ca -0.08 -2.23 -0.43 0.00 -2.93 0.00 0.00 61.98 56.31 2ccx s VAL 41 Cb 0.01 -2.13 -0.18 0.00 -1.53 0.00 0.00 36.38 32.55 2ccx s VAL 41 CO 0.26 -0.53 1.86 0.00 -3.33 0.00 0.00 175.10 173.35 2ccx s PRO 43 N 4.34 0.99 0.19 0.00 0.04 -1.26 -5.07 135.00 134.24 2ccx s PRO 43 Ca 1.08 0.84 0.09 0.00 0.04 0.00 0.00 61.00 63.05 2ccx s PRO 43 Cb -1.31 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 31.41 2ccx s PRO 43 CO 0.70 -2.43 -0.06 0.15 0.04 0.00 0.00 177.00 175.39 2ccx s LYS 44 N -4.88 2.17 0.29 4.56 3.01 -1.26 -4.81 119.74 118.81 2ccx s LYS 44 Ca 0.64 -1.26 0.03 0.00 -1.01 0.00 0.00 55.97 54.36 2ccx s LYS 44 Cb -0.19 -2.20 -0.03 0.00 -1.01 0.00 0.00 37.83 34.40 2ccx s LYS 44 CO 0.58 0.43 0.45 -1.12 0.51 0.00 0.00 175.35 176.19 2ccx s SER 45 N -3.00 6.31 0.29 2.83 0.01 -1.26 -4.89 113.70 113.99 2ccx s SER 45 Ca 0.27 0.26 -0.08 0.00 1.31 0.00 0.00 55.95 57.71 2ccx s SER 45 Cb -0.08 -1.95 -0.00 0.00 0.21 0.00 0.00 66.02 64.20 2ccx s SER 45 CO 0.17 -0.17 0.46 -0.94 0.41 0.00 0.00 173.24 173.17 2ccx s SER 46 N -3.96 0.30 0.13 2.44 1.04 -0.77 -5.01 113.70 107.87 2ccx s SER 46 Ca 0.37 -1.19 -0.02 0.00 0.48 0.00 0.00 55.95 55.60 2ccx s SER 46 Cb -0.09 0.61 -0.09 0.00 0.10 0.00 0.00 66.02 66.55 2ccx s SER 46 CO 0.32 -1.20 1.31 0.25 0.98 0.00 0.00 173.24 174.90 2ccx h LEU 47 N 2.22 0.41 0.22 2.42 7.12 -2.02 -3.31 115.31 122.38 2ccx h LEU 47 Ca -0.28 -0.35 -0.01 0.00 0.13 0.00 0.00 57.88 57.37 2ccx h LEU 47 Cb 1.25 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 41.25 2ccx h LEU 47 CO 0.39 1.16 -0.11 -0.07 -0.13 0.00 0.00 178.44 179.68 2ccx h LEU 48 N 0.17 -0.25 -8.69 2.25 3.38 -1.97 -3.41 115.31 106.78 2ccx h LEU 48 Ca -0.07 -0.24 -0.64 0.00 0.09 0.00 0.00 57.88 57.02 2ccx h LEU 48 Cb 1.60 0.07 -0.23 0.00 0.09 0.00 0.00 40.66 42.18 2ccx h LEU 48 CO 0.16 0.26 -0.67 -0.63 0.09 0.00 0.00 178.44 177.65 2ccx s ILE 49 N -3.32 3.87 -0.01 1.22 1.09 -1.25 -1.03 121.20 121.78 2ccx s ILE 49 Ca -0.11 -0.35 -0.15 0.00 -1.10 0.00 0.00 60.65 58.94 2ccx s ILE 49 Cb 0.01 -2.74 -0.06 0.00 -1.06 0.00 0.00 42.46 38.61 2ccx s ILE 49 CO 0.39 0.44 0.42 -0.75 -0.10 0.00 0.00 174.94 175.34 2ccx s LYS 50 N 0.95 3.99 0.07 2.79 2.20 0.11 -1.85 119.74 128.00 2ccx s LYS 50 Ca 0.01 0.43 -0.14 0.00 -0.36 0.00 0.00 55.97 55.91 2ccx s LYS 50 Cb -0.14 -3.25 0.02 0.00 -1.51 0.00 0.00 37.83 32.95 2ccx s LYS 50 CO 0.02 0.62 0.31 0.71 -0.36 0.00 0.00 175.35 176.65 2ccx s TYR 51 N -0.86 -0.09 0.23 4.03 2.02 -1.26 -1.33 117.35 120.08 2ccx s TYR 51 Ca 0.24 -0.12 -0.22 0.00 -0.37 0.00 0.00 57.07 56.60 2ccx s TYR 51 Cb -0.17 0.11 0.04 0.00 -0.40 0.00 0.00 41.96 41.54 2ccx s TYR 51 CO 0.13 -0.55 0.75 0.00 -1.57 0.00 0.00 175.55 174.30 2ccx s MET 52 N -3.00 1.58 0.25 -0.62 0.23 -1.22 -4.92 119.30 111.59 2ccx s MET 52 Ca -0.02 -0.83 0.03 0.00 -1.03 0.00 0.00 55.69 53.84 2ccx s MET 52 Cb 0.01 0.57 -0.05 0.00 -1.53 0.00 0.00 34.83 33.82 2ccx s MET 52 CO -0.06 -0.72 0.04 0.00 -2.03 0.00 0.00 175.02 172.25 2ccx s ASN 55 N -3.21 1.26 -0.05 0.00 4.22 -1.26 -2.73 114.94 113.17 2ccx s ASN 55 Ca 0.18 -1.64 -0.29 0.00 -2.14 0.00 0.00 52.86 48.97 2ccx s ASN 55 Cb -0.02 0.50 0.10 0.00 1.28 0.00 0.00 41.25 43.11 2ccx s ASN 55 CO 0.04 -0.26 0.84 0.42 -2.04 0.00 0.00 177.10 176.10 2ccx s THR 56 N 1.38 0.00 -0.21 0.54 -4.23 -1.26 -5.05 115.64 106.81 2ccx s THR 56 Ca 0.17 0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.40 2ccx s THR 56 Cb -0.16 -1.00 -0.05 0.00 1.34 0.00 0.00 72.50 72.63 2ccx s THR 56 CO -0.02 0.00 2.22 0.59 -0.54 0.00 0.00 174.62 176.87 2ccx n ASN 57 N 0.42 3.29 -3.26 3.99 4.13 -1.26 -2.64 115.26 119.93 2ccx n ASN 57 Ca -0.13 0.22 -0.23 0.00 1.68 0.00 0.00 54.58 56.12 2ccx n ASN 57 Cb 0.59 -1.56 0.06 0.00 -1.54 0.00 0.00 39.78 37.34 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 8.72 -6.38 0.07 3.52 5.02 0.23 -4.91 118.16 124.43 2ccx n LYS 58 Ca 0.30 0.86 -0.21 0.00 -2.02 0.00 0.00 58.31 57.24 2ccx n LYS 58 Cb 0.45 -5.79 -0.13 0.00 -0.02 0.00 0.00 35.03 29.54 2ccx n LYS 58 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88