#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 0.71 0.23 1.96 1.02 -1.26 -2.78 119.74 119.61 2ccx s LYS 2 Ca 0.00 -0.97 0.02 0.00 0.02 0.00 0.00 55.97 55.04 2ccx s LYS 2 Cb 0.00 -0.45 -0.05 0.00 -0.52 0.00 0.00 37.83 36.81 2ccx s LYS 2 CO 0.00 0.08 0.03 0.00 -0.92 0.00 0.00 175.35 174.53 2ccx s ASN 4 N -3.28 5.65 0.00 0.00 0.01 -1.26 -1.85 114.94 114.20 2ccx s ASN 4 Ca 0.30 0.01 0.00 0.00 -0.71 0.00 0.00 52.86 52.47 2ccx s ASN 4 Cb 0.07 -1.55 0.00 0.00 0.41 0.00 0.00 41.25 40.18 2ccx s ASN 4 CO 0.09 0.16 0.00 0.00 -1.51 0.00 0.00 177.10 175.84 2ccx n GLN 5 N 0.32 2.25 -0.53 -0.60 1.13 -1.26 -4.32 117.38 114.36 2ccx n GLN 5 Ca -0.08 0.00 -0.26 0.00 -1.94 0.00 0.00 57.00 54.72 2ccx n GLN 5 Cb 0.52 0.00 0.19 0.00 0.11 0.00 0.00 30.24 31.05 2ccx n GLN 5 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2ccx n LEU 6 N 0.00 -1.61 -0.10 1.08 4.77 -1.26 -4.89 117.00 114.99 2ccx n LEU 6 Ca 0.00 -0.36 -0.09 0.00 -0.03 0.00 0.00 56.01 55.53 2ccx n LEU 6 Cb 0.00 -0.89 -0.01 0.00 -2.33 0.00 0.00 43.42 40.18 2ccx n LEU 6 CO 0.00 -3.39 0.99 -0.29 -1.33 0.00 0.00 177.39 173.37 2ccx h ILE 7 N -2.61 1.11 -4.18 -0.08 2.10 -1.98 -3.43 117.51 108.45 2ccx h ILE 7 Ca -0.40 -0.24 -0.49 0.00 1.08 0.00 0.00 64.86 64.80 2ccx h ILE 7 Cb 1.11 0.67 0.14 0.00 -1.09 0.00 0.00 36.82 37.64 2ccx h ILE 7 CO 0.27 0.11 0.28 -2.16 -1.08 0.00 0.00 178.15 175.57 2ccx s PRO 8 N -6.03 1.69 -1.20 2.19 0.04 -1.26 -4.84 135.00 125.59 2ccx s PRO 8 Ca -0.13 0.94 -0.17 0.00 0.04 0.00 0.00 61.00 61.68 2ccx s PRO 8 Cb 0.10 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.76 2ccx s PRO 8 CO 0.72 -1.97 2.10 -0.35 0.04 0.00 0.00 177.00 177.54 2ccx n PRO 9 N -3.71 2.36 -2.12 0.56 -0.04 -1.26 -4.52 135.00 126.26 2ccx n PRO 9 Ca 0.08 -2.35 -0.28 0.00 -0.04 0.00 0.00 63.50 60.91 2ccx n PRO 9 Cb 0.54 -3.17 0.02 0.00 -0.04 0.00 0.00 33.50 30.85 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 6.80 3.09 -2.42 0.54 3.72 -1.26 -5.04 117.46 122.89 2ccx n PHE 10 Ca 0.51 -2.67 -0.37 0.00 -0.05 0.00 0.00 57.45 54.87 2ccx n PHE 10 Cb 0.40 -0.44 -0.03 0.00 -0.94 0.00 0.00 39.48 38.47 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 -3.65 3.12 0.02 1.38 1.48 -1.26 -4.13 118.94 115.90 2ccx s TRP 11 Ca 0.51 1.60 -0.21 0.00 -1.06 0.00 0.00 56.10 56.94 2ccx s TRP 11 Cb 0.42 -3.24 0.05 0.00 -1.16 0.00 0.00 33.47 29.53 2ccx s TRP 11 CO -0.10 -1.00 0.48 -1.59 -4.06 0.00 0.00 176.95 170.69 2ccx s LYS 12 N -2.53 0.95 0.51 3.25 -2.85 -0.77 -4.99 119.74 113.31 2ccx s LYS 12 Ca 0.59 -0.19 -0.21 0.00 -1.00 0.00 0.00 55.97 55.17 2ccx s LYS 12 Cb -0.25 0.43 -0.06 0.00 -2.06 0.00 0.00 37.83 35.89 2ccx s LYS 12 CO 0.31 -0.32 1.19 0.99 0.10 0.00 0.00 175.35 177.62 2ccx s THR 13 N -2.09 2.92 0.45 3.79 2.01 -1.26 -1.24 115.64 120.23 2ccx s THR 13 Ca -0.07 0.64 -0.22 0.00 0.31 0.00 0.00 61.69 62.35 2ccx s THR 13 Cb -0.01 -3.30 -0.09 0.00 0.01 0.00 0.00 72.50 69.11 2ccx s THR 13 CO 0.01 -0.05 1.04 0.00 -0.69 0.00 0.00 174.62 174.93 2ccx s PRO 15 N -2.95 3.63 0.37 0.00 0.04 -1.26 -4.94 135.00 129.89 2ccx s PRO 15 Ca 0.64 1.36 -0.27 0.00 0.04 0.00 0.00 61.00 62.77 2ccx s PRO 15 Cb -0.19 -2.07 -0.12 0.00 0.04 0.00 0.00 34.50 32.17 2ccx s PRO 15 CO 0.23 -0.58 1.29 1.17 0.04 0.00 0.00 177.00 179.15 2ccx n LYS 16 N -1.25 2.10 0.00 4.56 4.81 -1.26 -1.20 118.16 125.92 2ccx n LYS 16 Ca 0.09 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 58.27 2ccx n LYS 16 Cb 0.52 -2.36 0.00 0.00 0.02 0.00 0.00 35.03 33.21 2ccx n LYS 16 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ccx n GLY 17 N 0.77 2.63 3.64 3.14 0.00 -1.26 -5.01 105.19 109.09 2ccx n GLY 17 Ca 0.05 -0.61 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 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 0.00 4.14 -0.34 1.61 1.02 -0.34 -4.69 119.74 121.14 2ccx s LYS 18 Ca 0.00 0.59 0.15 0.00 0.02 0.00 0.00 55.97 56.74 2ccx s LYS 18 Cb 0.00 -3.63 0.44 0.00 -0.52 0.00 0.00 37.83 34.12 2ccx s LYS 18 CO 0.00 -0.38 1.07 0.09 -0.92 0.00 0.00 175.35 175.21 2ccx n ASN 19 N 5.57 0.43 -4.76 2.83 3.02 -1.14 -4.24 115.26 116.97 2ccx n ASN 19 Ca -0.00 -2.64 -0.25 0.00 -0.03 0.00 0.00 54.58 51.66 2ccx n ASN 19 Cb 0.49 -0.06 -0.07 0.00 -0.61 0.00 0.00 39.78 39.53 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 -3.14 3.11 -0.04 3.41 1.43 -0.61 -4.87 118.68 117.96 2ccx s LEU 20 Ca 0.26 -1.07 0.05 0.00 -1.03 0.00 0.00 54.13 52.33 2ccx s LEU 20 Cb 0.44 -1.46 -0.01 0.00 0.03 0.00 0.00 46.19 45.19 2ccx s LEU 20 CO 0.00 -0.58 -0.20 0.00 0.23 0.00 0.00 176.35 175.81 2ccx s TYR 22 N -0.08 1.04 -0.09 0.00 1.13 -0.87 -1.48 117.35 116.99 2ccx s TYR 22 Ca -0.02 -0.85 -0.00 0.00 -1.41 0.00 0.00 57.07 54.78 2ccx s TYR 22 Cb -0.12 -0.56 0.02 0.00 -1.10 0.00 0.00 41.96 40.20 2ccx s TYR 22 CO 0.02 -0.06 -0.05 0.21 -2.51 0.00 0.00 175.55 173.16 2ccx s LYS 23 N -3.80 1.19 -0.50 -3.49 2.20 -1.08 -3.34 119.74 110.93 2ccx s LYS 23 Ca 0.14 -0.14 -0.16 0.00 -0.36 0.00 0.00 55.97 55.44 2ccx s LYS 23 Cb 0.04 -1.32 0.08 0.00 -1.51 0.00 0.00 37.83 35.12 2ccx s LYS 23 CO -0.03 -0.24 0.47 1.41 -0.36 0.00 0.00 175.35 176.60 2ccx s MET 24 N 1.65 3.01 0.50 4.03 -2.45 -0.03 -2.44 119.30 123.57 2ccx s MET 24 Ca 0.02 -1.33 0.07 0.00 -1.25 0.00 0.00 55.69 53.20 2ccx s MET 24 Cb -0.13 -4.16 0.02 0.00 1.25 0.00 0.00 34.83 31.81 2ccx s MET 24 CO -0.06 -1.14 0.42 0.99 1.05 0.00 0.00 175.02 176.29 2ccx s THR 25 N 1.86 2.03 0.12 10.11 2.01 0.48 -0.84 115.64 131.41 2ccx s THR 25 Ca 0.06 -1.41 -0.07 0.00 0.31 0.00 0.00 61.69 60.58 2ccx s THR 25 Cb -0.24 -2.44 -0.06 0.00 0.01 0.00 0.00 72.50 69.77 2ccx s THR 25 CO 0.07 0.00 0.40 -0.04 -0.69 0.00 0.00 174.62 174.36 2ccx s MET 26 N -4.26 3.69 0.06 4.92 -1.94 -1.26 -0.40 119.30 120.11 2ccx s MET 26 Ca 0.41 0.05 -0.16 0.00 -1.71 0.00 0.00 55.69 54.29 2ccx s MET 26 Cb -0.02 -2.89 -0.22 0.00 2.01 0.00 0.00 34.83 33.71 2ccx s MET 26 CO 0.25 0.49 1.19 -0.09 -0.01 0.00 0.00 175.02 176.85 2ccx h ARG 27 N 3.16 0.63 -0.12 2.03 1.12 -0.92 -2.91 114.38 117.38 2ccx h ARG 27 Ca -0.47 -0.63 -0.04 0.00 -1.11 0.00 0.00 59.98 57.72 2ccx h ARG 27 Cb 1.18 0.17 -0.01 0.00 -0.01 0.00 0.00 29.97 31.30 2ccx h ARG 27 CO 0.70 1.24 -0.13 0.00 -3.11 0.00 0.00 179.97 178.67 2ccx h ALA 28 N 0.41 1.57 -0.13 2.80 0.00 -1.80 -3.41 119.26 118.71 2ccx h ALA 28 Ca -0.10 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 2ccx h ALA 28 Cb 1.51 -0.07 -0.14 0.00 0.00 0.00 0.00 17.79 19.08 2ccx h ALA 28 CO 0.17 0.31 -0.18 0.00 0.00 0.00 0.00 179.25 179.55 2ccx n ALA 29 N -2.49 -3.10 -0.86 0.00 0.00 -1.26 -5.05 120.51 107.75 2ccx n ALA 29 Ca -0.01 -0.47 -0.26 0.00 0.00 0.00 0.00 53.44 52.70 2ccx n ALA 29 Cb 0.25 -2.76 -0.02 0.00 0.00 0.00 0.00 19.45 16.92 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 1.93 2.21 0.09 0.00 -0.04 -1.10 -4.30 135.00 133.80 2ccx n PRO 30 Ca 0.07 -1.60 -0.21 0.00 -0.04 0.00 0.00 63.50 61.72 2ccx n PRO 30 Cb 0.67 -2.55 -0.15 0.00 -0.04 0.00 0.00 33.50 31.42 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 6.34 0.38 -4.54 0.54 4.05 -1.97 -3.46 114.93 116.26 2ccx h MET 31 Ca 0.53 -0.64 -0.52 0.00 -0.28 0.00 0.00 59.70 58.79 2ccx h MET 31 Cb 0.23 0.24 -0.34 0.00 -0.80 0.00 0.00 31.60 30.94 2ccx h MET 31 CO 1.54 1.28 -0.81 0.08 0.23 0.00 0.00 176.91 179.23 2ccx s VAL 32 N -2.60 1.14 -0.29 -5.77 1.01 -1.26 -5.10 120.40 107.53 2ccx s VAL 32 Ca -0.11 -0.48 -0.29 0.00 0.00 0.00 0.00 61.98 61.10 2ccx s VAL 32 Cb 0.06 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 2ccx s VAL 32 CO 0.88 0.36 1.64 -2.16 0.00 0.00 0.00 175.10 175.81 2ccx s PRO 33 N 0.69 3.61 0.03 2.72 0.04 -1.26 -4.42 135.00 136.41 2ccx s PRO 33 Ca -0.14 1.45 0.03 0.00 0.04 0.00 0.00 61.00 62.38 2ccx s PRO 33 Cb -0.16 -4.08 -0.25 0.00 0.04 0.00 0.00 34.50 30.05 2ccx s PRO 33 CO 0.03 -1.52 0.97 -0.24 0.04 0.00 0.00 177.00 176.28 2ccx h VAL 34 N 6.42 1.29 -3.40 -0.36 3.04 -1.35 -3.44 116.25 118.44 2ccx h VAL 34 Ca -0.32 -2.98 -0.41 0.00 -1.01 0.00 0.00 66.70 61.97 2ccx h VAL 34 Cb 1.15 2.73 -0.35 0.00 -2.01 0.00 0.00 31.29 32.81 2ccx h VAL 34 CO 1.03 0.81 -0.77 -0.54 -1.01 0.00 0.00 177.57 177.09 2ccx s LYS 35 N -2.64 0.72 0.06 4.17 3.01 -1.20 -5.05 119.74 118.80 2ccx s LYS 35 Ca -0.05 -0.03 0.04 0.00 -1.01 0.00 0.00 55.97 54.92 2ccx s LYS 35 Cb 0.08 -0.85 -0.03 0.00 -1.01 0.00 0.00 37.83 36.02 2ccx s LYS 35 CO 0.84 -0.15 -0.12 1.03 0.51 0.00 0.00 175.35 177.46 2ccx s ARG 36 N 1.24 0.72 0.00 1.68 1.81 -1.26 -0.85 118.95 122.28 2ccx s ARG 36 Ca -0.06 -0.88 0.00 0.00 -1.72 0.00 0.00 55.73 53.07 2ccx s ARG 36 Cb -0.14 -0.64 0.00 0.00 -0.45 0.00 0.00 34.95 33.72 2ccx s ARG 36 CO -0.02 0.14 0.00 0.41 -0.68 0.00 0.00 175.30 175.15 2ccx n GLY 37 N 1.37 -0.25 3.83 -3.53 0.00 -1.21 -4.66 105.19 100.73 2ccx n GLY 37 Ca -0.22 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 44.55 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 -1.97 0.07 -0.05 0.00 2.07 -1.21 -4.94 121.20 115.17 2ccx s ILE 39 Ca 0.32 -1.14 -0.18 0.00 -1.41 0.00 0.00 60.65 58.24 2ccx s ILE 39 Cb -0.09 -1.63 -0.13 0.00 0.13 0.00 0.00 42.46 40.74 2ccx s ILE 39 CO 0.25 -0.32 0.75 0.44 -1.91 0.00 0.00 174.94 174.15 2ccx h ASP 40 N 2.48 -0.23 -3.31 4.50 5.19 -1.92 -1.58 116.42 121.55 2ccx h ASP 40 Ca -0.32 -0.26 -0.46 0.00 -0.62 0.00 0.00 57.03 55.37 2ccx h ASP 40 Cb 1.23 0.06 -0.15 0.00 0.18 0.00 0.00 39.33 40.65 2ccx h ASP 40 CO 0.47 0.31 -0.75 0.54 -3.12 0.00 0.00 179.24 176.69 2ccx s VAL 41 N -3.22 1.74 -0.40 -1.35 0.11 -1.26 -4.59 120.40 111.43 2ccx s VAL 41 Ca -0.11 -2.13 -0.42 0.00 -2.93 0.00 0.00 61.98 56.40 2ccx s VAL 41 Cb 0.00 -1.98 -0.17 0.00 -1.53 0.00 0.00 36.38 32.71 2ccx s VAL 41 CO 0.39 -0.53 1.90 0.00 -3.33 0.00 0.00 175.10 173.54 2ccx s PRO 43 N 4.59 2.32 -0.05 0.00 0.04 -1.26 -5.05 135.00 135.60 2ccx s PRO 43 Ca 1.08 1.32 0.05 0.00 0.04 0.00 0.00 61.00 63.49 2ccx s PRO 43 Cb -1.23 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 31.41 2ccx s PRO 43 CO 0.66 -1.61 -0.20 0.21 0.04 0.00 0.00 177.00 176.10 2ccx s LYS 44 N -4.53 2.02 0.95 4.56 2.20 -1.26 -4.76 119.74 118.92 2ccx s LYS 44 Ca 0.65 -0.71 -0.11 0.00 -0.36 0.00 0.00 55.97 55.43 2ccx s LYS 44 Cb -0.20 -1.75 0.16 0.00 -1.51 0.00 0.00 37.83 34.53 2ccx s LYS 44 CO 0.50 0.30 1.10 -1.12 -0.36 0.00 0.00 175.35 175.77 2ccx s SER 45 N -0.06 2.78 0.00 1.43 0.01 -1.26 -4.73 113.70 111.86 2ccx s SER 45 Ca -0.03 1.82 0.00 0.00 1.31 0.00 0.00 55.95 59.05 2ccx s SER 45 Cb -0.12 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2ccx s SER 45 CO 0.02 -3.13 0.00 -1.54 0.41 0.00 0.00 173.24 169.01 2ccx n SER 46 N -4.23 0.00 0.02 2.44 3.41 0.11 -4.95 113.62 110.43 2ccx n SER 46 Ca 0.08 -0.09 -0.18 0.00 -0.26 0.00 0.00 58.87 58.42 2ccx n SER 46 Cb 0.53 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.37 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 0.62 0.00 1.04 7.12 -2.03 -3.35 115.31 118.72 2ccx h LEU 47 Ca 0.00 -0.77 -0.34 0.00 0.13 0.00 0.00 57.88 56.91 2ccx h LEU 47 Cb 0.00 -0.19 -0.06 0.00 -0.53 0.00 0.00 40.66 39.88 2ccx h LEU 47 CO 0.00 1.31 -2.11 0.00 -0.13 0.00 0.00 178.44 177.51 2ccx n LEU 48 N -4.12 0.41 -4.78 2.25 -0.00 -1.26 -4.59 117.00 104.91 2ccx n LEU 48 Ca -0.11 0.17 -0.32 0.00 -0.00 0.00 0.00 56.01 55.75 2ccx n LEU 48 Cb 0.74 0.34 -0.07 0.00 -0.00 0.00 0.00 43.42 44.43 2ccx n LEU 48 CO 0.49 0.46 -0.25 -0.63 -0.00 0.00 0.00 177.39 177.46 2ccx s ILE 49 N -2.54 4.68 -0.16 1.47 -1.09 -1.26 -0.40 121.20 121.90 2ccx s ILE 49 Ca -0.08 -0.51 0.00 0.00 -2.23 0.00 0.00 60.65 57.84 2ccx s ILE 49 Cb 0.07 -3.17 0.03 0.00 -1.58 0.00 0.00 42.46 37.81 2ccx s ILE 49 CO 0.83 0.29 -0.13 -0.75 -1.23 0.00 0.00 174.94 173.95 2ccx s LYS 50 N -1.92 2.17 0.31 2.79 2.47 0.47 -0.71 119.74 125.33 2ccx s LYS 50 Ca 0.25 -0.64 0.08 0.00 -1.56 0.00 0.00 55.97 54.10 2ccx s LYS 50 Cb -0.12 -2.19 -0.04 0.00 -1.46 0.00 0.00 37.83 34.03 2ccx s LYS 50 CO 0.16 -0.30 0.16 0.71 0.16 0.00 0.00 175.35 176.25 2ccx s TYR 51 N 1.47 2.81 0.06 4.03 2.02 -1.26 -0.39 117.35 126.09 2ccx s TYR 51 Ca 0.03 -0.30 -0.08 0.00 -0.37 0.00 0.00 57.07 56.36 2ccx s TYR 51 Cb -0.14 -1.57 -0.01 0.00 -0.40 0.00 0.00 41.96 39.84 2ccx s TYR 51 CO -0.10 0.37 0.15 0.00 -1.57 0.00 0.00 175.55 174.40 2ccx s MET 52 N -3.86 0.71 0.15 -0.62 0.23 -1.02 -4.68 119.30 110.21 2ccx s MET 52 Ca 0.37 -0.82 0.06 0.00 -1.03 0.00 0.00 55.69 54.27 2ccx s MET 52 Cb -0.05 0.29 -0.04 0.00 -1.53 0.00 0.00 34.83 33.50 2ccx s MET 52 CO 0.24 -0.20 -0.14 0.00 -2.03 0.00 0.00 175.02 172.88 2ccx s ASN 55 N -3.13 0.14 -0.18 0.00 4.22 -1.26 -2.27 114.94 112.47 2ccx s ASN 55 Ca 0.23 -1.88 -0.28 0.00 -2.14 0.00 0.00 52.86 48.78 2ccx s ASN 55 Cb -0.02 0.88 0.10 0.00 1.28 0.00 0.00 41.25 43.49 2ccx s ASN 55 CO 0.15 -0.17 0.89 0.42 -2.04 0.00 0.00 177.10 176.35 2ccx s THR 56 N 0.99 0.00 -0.26 0.54 -4.23 -1.26 -5.05 115.64 106.37 2ccx s THR 56 Ca 0.24 0.00 -0.32 0.00 -1.18 0.00 0.00 61.69 60.43 2ccx s THR 56 Cb -0.05 -1.00 -0.09 0.00 1.34 0.00 0.00 72.50 72.70 2ccx s THR 56 CO -0.08 0.00 2.17 0.59 -0.54 0.00 0.00 174.62 176.76 2ccx n ASN 57 N 1.38 2.77 -3.21 3.99 4.13 -1.26 -2.27 115.26 120.78 2ccx n ASN 57 Ca -0.13 0.39 -0.23 0.00 1.68 0.00 0.00 54.58 56.29 2ccx n ASN 57 Cb 0.57 -1.40 0.04 0.00 -1.54 0.00 0.00 39.78 37.45 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 8.24 -5.48 -0.23 3.52 5.02 0.31 -4.88 118.16 124.65 2ccx n LYS 58 Ca 0.34 0.85 -0.08 0.00 -2.02 0.00 0.00 58.31 57.40 2ccx n LYS 58 Cb 0.33 -5.74 0.04 0.00 -0.02 0.00 0.00 35.03 29.63 2ccx n LYS 58 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88