#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ba5 n LYS 2 N 0.00 -3.90 -4.09 -0.14 4.76 -1.26 -1.77 118.16 111.75 1ba5 n LYS 2 Ca 0.00 0.50 -0.28 0.00 -2.87 0.00 0.00 58.31 55.67 1ba5 n LYS 2 Cb 0.00 -5.27 -0.05 0.00 -1.84 0.00 0.00 35.03 27.87 1ba5 n LYS 2 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1ba5 n ARG 3 N -4.08 -2.45 0.00 1.97 1.74 -1.26 -4.89 116.66 107.69 1ba5 n ARG 3 Ca 0.01 0.29 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 1ba5 n ARG 3 Cb 0.53 -4.23 0.00 0.00 -1.02 0.00 0.00 32.46 27.75 1ba5 n ARG 3 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1ba5 n GLN 4 N -4.46 0.00 -2.17 5.56 6.02 -0.73 -4.77 117.38 116.83 1ba5 n GLN 4 Ca -0.30 0.55 -0.27 0.00 -0.01 0.00 0.00 57.00 56.97 1ba5 n GLN 4 Cb 0.68 -1.45 0.15 0.00 1.02 0.00 0.00 30.24 30.64 1ba5 n GLN 4 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ba5 s ALA 5 N -3.10 2.79 -1.04 -1.58 0.00 -1.26 -4.96 121.76 112.61 1ba5 s ALA 5 Ca 0.00 -1.38 -0.23 0.00 0.00 0.00 0.00 51.96 50.36 1ba5 s ALA 5 Cb 0.00 -2.50 0.03 0.00 0.00 0.00 0.00 23.12 20.65 1ba5 s ALA 5 CO 0.00 -2.05 1.60 -1.58 0.00 0.00 0.00 175.76 173.73 1ba5 s TRP 6 N -3.60 2.40 1.13 0.00 0.52 -1.26 -4.98 118.94 113.14 1ba5 s TRP 6 Ca 0.71 -0.61 -0.14 0.00 0.02 0.00 0.00 56.10 56.07 1ba5 s TRP 6 Cb -0.05 -4.56 0.25 0.00 -1.15 0.00 0.00 33.47 27.97 1ba5 s TRP 6 CO 0.50 -1.86 1.06 -0.51 0.02 0.00 0.00 176.95 176.16 1ba5 s LEU 7 N 6.09 0.93 0.34 2.99 1.43 -1.26 -4.70 118.68 124.50 1ba5 s LEU 7 Ca 0.53 1.19 0.05 0.00 -1.03 0.00 0.00 54.13 54.87 1ba5 s LEU 7 Cb -0.01 -3.15 0.70 0.00 0.03 0.00 0.00 46.19 43.77 1ba5 s LEU 7 CO -0.05 -3.86 1.90 4.11 0.23 0.00 0.00 176.35 178.68 1ba5 h TRP 8 N -2.39 0.89 -0.14 0.29 0.09 -2.00 -1.69 115.95 111.00 1ba5 h TRP 8 Ca -0.56 0.02 -0.02 0.00 0.09 0.00 0.00 58.89 58.42 1ba5 h TRP 8 Cb 1.33 -0.29 -0.00 0.00 0.08 0.00 0.00 29.16 30.28 1ba5 h TRP 8 CO -0.24 0.41 -0.01 1.49 0.09 0.00 0.00 178.44 180.17 1ba5 h GLU 9 N 0.82 0.25 -0.59 0.12 4.22 -1.98 0.37 114.58 117.80 1ba5 h GLU 9 Ca 0.40 -0.08 0.10 0.00 0.08 0.00 0.00 59.36 59.86 1ba5 h GLU 9 Cb 0.44 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.59 1ba5 h GLU 9 CO -0.17 0.50 0.16 0.93 -2.18 0.00 0.00 179.01 178.25 1ba5 h GLU 10 N -0.02 0.30 -0.02 1.92 4.39 -1.66 0.65 114.58 120.13 1ba5 h GLU 10 Ca 0.04 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 1ba5 h GLU 10 Cb 0.39 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1ba5 h GLU 10 CO 0.01 0.20 -0.02 0.22 -1.16 0.00 0.00 179.01 178.25 1ba5 h ASP 11 N 0.31 0.06 -0.20 1.42 3.58 -1.27 -2.51 116.42 117.81 1ba5 h ASP 11 Ca 0.30 -0.48 0.02 0.00 0.42 0.00 0.00 57.03 57.29 1ba5 h ASP 11 Cb 0.42 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.43 1ba5 h ASP 11 CO -0.35 0.53 0.06 0.11 -2.88 0.00 0.00 179.24 176.71 1ba5 h LYS 12 N -0.40 0.15 0.00 0.28 1.79 -0.52 -0.56 116.57 117.30 1ba5 h LYS 12 Ca 0.00 -0.01 -0.07 0.00 -2.18 0.00 0.00 60.65 58.40 1ba5 h LYS 12 Cb 0.51 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.12 1ba5 h LYS 12 CO 0.01 0.10 -0.31 -2.95 -1.08 0.00 0.00 179.45 175.21 1ba5 h ASN 13 N 0.15 0.00 0.57 0.86 7.08 -0.97 0.36 115.58 123.64 1ba5 h ASN 13 Ca 0.09 0.00 -0.03 0.00 -3.08 0.00 0.00 56.30 53.28 1ba5 h ASN 13 Cb 0.06 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 36.31 1ba5 h ASN 13 CO -0.09 0.31 -0.27 0.25 -2.08 0.00 0.00 177.43 175.54 1ba5 h LEU 14 N 0.00 -0.65 -1.54 6.14 5.85 -0.87 -0.02 115.31 124.22 1ba5 h LEU 14 Ca -0.00 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1ba5 h LEU 14 Cb 0.57 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1ba5 h LEU 14 CO 0.04 -0.30 0.08 0.08 -0.34 0.00 0.00 178.44 178.00 1ba5 h ARG 15 N -1.11 0.37 -0.49 1.25 0.11 -1.10 0.46 114.38 113.87 1ba5 h ARG 15 Ca -0.08 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 59.95 1ba5 h ARG 15 Cb 0.59 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.60 1ba5 h ARG 15 CO 0.13 0.34 0.00 0.45 0.10 0.00 0.00 179.97 180.99 1ba5 n SER 16 N -4.40 2.61 -0.01 0.08 2.88 0.11 -3.81 113.62 111.08 1ba5 n SER 16 Ca 0.01 -2.07 -0.05 0.00 -1.33 0.00 0.00 58.87 55.43 1ba5 n SER 16 Cb 0.15 -0.34 -0.02 0.00 -0.75 0.00 0.00 64.21 63.25 1ba5 n SER 16 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ba5 n GLY 17 N 1.12 -0.10 0.32 0.46 0.00 -0.02 -4.46 105.19 102.51 1ba5 n GLY 17 Ca 0.15 -0.04 0.01 0.00 0.00 0.00 0.00 46.02 46.14 1ba5 n GLY 17 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ba5 h VAL 18 N -0.20 1.04 0.00 1.61 2.07 -1.17 0.16 116.25 119.77 1ba5 h VAL 18 Ca -0.10 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1ba5 h VAL 18 Cb 0.84 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1ba5 h VAL 18 CO -0.06 0.18 0.00 -0.09 0.02 0.00 0.00 177.57 177.62 1ba5 h ARG 19 N 0.98 0.00 0.00 1.57 2.43 -1.79 -1.31 114.38 116.26 1ba5 h ARG 19 Ca 0.38 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 1ba5 h ARG 19 Cb 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1ba5 h ARG 19 CO -0.17 0.00 -0.58 1.63 -1.51 0.00 0.00 179.97 179.34 1ba5 n LYS 20 N -2.55 0.40 0.08 0.20 4.01 -0.02 -4.77 118.16 115.50 1ba5 n LYS 20 Ca 0.02 0.37 -0.03 0.00 -0.51 0.00 0.00 58.31 58.15 1ba5 n LYS 20 Cb 0.27 -1.44 -0.02 0.00 -0.51 0.00 0.00 35.03 33.34 1ba5 n LYS 20 CO 0.00 0.00 0.00 1.88 -1.11 0.00 0.00 177.40 178.17 1ba5 h TYR 21 N -0.83 -0.21 0.00 2.13 0.05 -0.87 -3.51 116.97 113.74 1ba5 h TYR 21 Ca 0.00 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1ba5 h TYR 21 Cb 0.58 0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.38 1ba5 h TYR 21 CO -0.25 -0.13 0.00 0.41 -1.05 0.00 0.00 178.16 177.14 1ba5 n GLY 22 N 0.68 3.78 3.57 3.88 0.00 -0.50 -4.96 105.19 111.65 1ba5 n GLY 22 Ca -0.03 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 44.92 1ba5 n GLY 22 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ba5 s GLU 23 N -2.41 3.16 0.00 1.61 2.12 -1.24 -2.28 118.70 119.66 1ba5 s GLU 23 Ca 0.00 -1.25 0.00 0.00 0.36 0.00 0.00 54.97 54.08 1ba5 s GLU 23 Cb 0.00 -5.32 0.00 0.00 0.26 0.00 0.00 34.13 29.07 1ba5 s GLU 23 CO 0.00 -3.02 0.00 0.41 -0.54 0.00 0.00 175.26 172.11 1ba5 n GLY 24 N 6.08 0.46 2.08 -1.50 0.00 -1.26 -5.02 105.19 106.03 1ba5 n GLY 24 Ca 0.43 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.28 1ba5 n GLY 24 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ba5 n ASN 25 N 0.00 5.93 -0.11 1.61 4.13 -0.96 -4.55 115.26 121.30 1ba5 n ASN 25 Ca 0.00 -2.53 -0.09 0.00 1.68 0.00 0.00 54.58 53.64 1ba5 n ASN 25 Cb 0.00 -1.44 -0.01 0.00 -1.54 0.00 0.00 39.78 36.79 1ba5 n ASN 25 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 1ba5 h TRP 26 N 3.36 0.50 -0.41 3.10 4.06 -1.96 -0.89 115.95 123.71 1ba5 h TRP 26 Ca 0.32 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.25 1ba5 h TRP 26 Cb 1.26 -0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 29.25 1ba5 h TRP 26 CO 1.79 0.44 0.26 0.66 -3.56 0.00 0.00 178.44 178.03 1ba5 h SER 27 N 0.43 0.49 -0.33 -3.49 4.64 -1.99 -0.12 113.55 113.17 1ba5 h SER 27 Ca 0.12 -0.03 0.02 0.00 -0.47 0.00 0.00 61.79 61.43 1ba5 h SER 27 Cb 0.12 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1ba5 h SER 27 CO -0.01 0.37 0.16 0.50 -0.87 0.00 0.00 176.83 176.98 1ba5 h LYS 28 N 0.55 0.33 -0.61 4.77 1.63 -1.86 -0.45 116.57 120.93 1ba5 h LYS 28 Ca 0.15 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.93 1ba5 h LYS 28 Cb -0.03 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.49 1ba5 h LYS 28 CO -0.03 0.22 0.40 0.82 -3.45 0.00 0.00 179.45 177.41 1ba5 h ILE 29 N 0.34 1.16 -0.73 2.00 2.04 -0.86 -0.68 117.51 120.78 1ba5 h ILE 29 Ca 0.14 -0.30 0.05 0.00 1.00 0.00 0.00 64.86 65.74 1ba5 h ILE 29 Cb 0.05 0.27 -0.05 0.00 -0.74 0.00 0.00 36.82 36.35 1ba5 h ILE 29 CO -0.09 0.16 0.44 0.25 0.00 0.00 0.00 178.15 178.91 1ba5 h LEU 30 N 0.83 0.70 -0.15 1.44 7.12 -0.38 0.27 115.31 125.13 1ba5 h LEU 30 Ca 0.22 0.01 -0.03 0.00 0.13 0.00 0.00 57.88 58.22 1ba5 h LEU 30 Cb -0.08 -0.13 -0.00 0.00 -0.53 0.00 0.00 40.66 39.91 1ba5 h LEU 30 CO -0.05 0.46 -0.03 -0.07 -0.13 0.00 0.00 178.44 178.62 1ba5 h LEU 31 N 0.83 0.28 0.02 2.25 3.38 -0.55 -3.38 115.31 118.14 1ba5 h LEU 31 Ca 0.31 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1ba5 h LEU 31 Cb 0.11 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1ba5 h LEU 31 CO -0.15 0.58 -0.01 0.45 0.09 0.00 0.00 178.44 179.40 1ba5 h HIS 32 N -0.02 -0.02 -3.94 1.13 3.86 -0.87 -3.46 115.15 111.83 1ba5 h HIS 32 Ca 0.04 -0.00 -0.48 0.00 -1.16 0.00 0.00 60.37 58.77 1ba5 h HIS 32 Cb 0.45 0.01 0.01 0.00 1.06 0.00 0.00 27.41 28.94 1ba5 h HIS 32 CO 0.05 -0.01 0.40 0.71 0.86 0.00 0.00 177.93 179.94 1ba5 s TYR 33 N -1.49 3.34 0.18 2.45 1.51 0.92 -5.00 117.35 119.26 1ba5 s TYR 33 Ca -0.00 1.66 -0.30 0.00 -1.01 0.00 0.00 57.07 57.42 1ba5 s TYR 33 Cb 0.00 -3.10 -0.08 0.00 -0.11 0.00 0.00 41.96 38.67 1ba5 s TYR 33 CO 0.01 -0.50 1.27 0.15 -1.11 0.00 0.00 175.55 175.37 1ba5 s LYS 34 N -2.39 4.42 0.09 -0.62 -0.14 -1.26 -4.40 119.74 115.44 1ba5 s LYS 34 Ca 0.56 1.98 -0.12 0.00 -1.36 0.00 0.00 55.97 57.03 1ba5 s LYS 34 Cb -0.22 -3.22 0.01 0.00 -1.68 0.00 0.00 37.83 32.72 1ba5 s LYS 34 CO 0.27 -0.21 0.28 -0.06 -0.76 0.00 0.00 175.35 174.87 1ba5 s PHE 35 N 0.18 -0.01 0.00 3.18 0.08 -1.26 -4.92 117.98 115.23 1ba5 s PHE 35 Ca 0.56 -0.34 0.00 0.00 0.12 0.00 0.00 56.93 57.27 1ba5 s PHE 35 Cb -0.35 0.07 0.00 0.00 -0.57 0.00 0.00 43.02 42.17 1ba5 s PHE 35 CO 0.37 -0.59 0.00 -1.71 -0.10 0.00 0.00 175.22 173.19 1ba5 n ASN 36 N -0.02 0.00 -3.53 1.36 2.85 -1.26 -4.91 115.26 109.74 1ba5 n ASN 36 Ca -0.16 0.00 -0.40 0.00 -0.11 0.00 0.00 54.58 53.91 1ba5 n ASN 36 Cb 0.62 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.63 1ba5 n ASN 36 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1ba5 n ASN 37 N 0.00 5.99 -4.20 1.20 4.13 -1.26 -4.84 115.26 116.28 1ba5 n ASN 37 Ca 0.00 -2.71 -0.41 0.00 1.68 0.00 0.00 54.58 53.15 1ba5 n ASN 37 Cb 0.00 -1.59 -0.08 0.00 -1.54 0.00 0.00 39.78 36.57 1ba5 n ASN 37 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1ba5 s ARG 38 N 2.80 2.55 0.73 3.52 1.81 -1.26 -5.08 118.95 124.02 1ba5 s ARG 38 Ca 0.57 -1.93 -0.15 0.00 -1.72 0.00 0.00 55.73 52.51 1ba5 s ARG 38 Cb 0.16 -3.92 0.04 0.00 -0.45 0.00 0.00 34.95 30.78 1ba5 s ARG 38 CO -0.07 -1.19 1.20 0.99 -0.68 0.00 0.00 175.30 175.55 1ba5 s THR 39 N 1.06 2.32 0.23 0.02 2.01 -1.26 -4.71 115.64 115.31 1ba5 s THR 39 Ca 0.08 0.16 -0.07 0.00 0.31 0.00 0.00 61.69 62.17 1ba5 s THR 39 Cb -0.24 -2.72 0.18 0.00 0.01 0.00 0.00 72.50 69.73 1ba5 s THR 39 CO -0.02 -0.09 1.76 0.28 -0.69 0.00 0.00 174.62 175.87 1ba5 h SER 40 N -0.33 0.39 -0.25 3.53 0.02 -1.98 0.49 113.55 115.42 1ba5 h SER 40 Ca -0.47 0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 60.50 1ba5 h SER 40 Cb 1.29 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.83 1ba5 h SER 40 CO 0.50 0.21 0.01 1.62 -1.14 0.00 0.00 176.83 178.03 1ba5 h VAL 41 N 0.54 1.20 -0.20 2.27 3.04 -1.98 0.11 116.25 121.23 1ba5 h VAL 41 Ca 0.36 -0.79 -0.05 0.00 -1.01 0.00 0.00 66.70 65.20 1ba5 h VAL 41 Cb 0.42 0.92 -0.01 0.00 -2.01 0.00 0.00 31.29 30.62 1ba5 h VAL 41 CO -0.30 0.27 -0.07 -0.03 -1.01 0.00 0.00 177.57 176.43 1ba5 h MET 42 N 0.53 0.40 -0.62 4.17 -1.53 -1.34 -0.06 114.93 116.48 1ba5 h MET 42 Ca 0.12 -0.17 -0.00 0.00 -3.44 0.00 0.00 59.70 56.21 1ba5 h MET 42 Cb 0.33 -0.02 -0.03 0.00 -0.55 0.00 0.00 31.60 31.33 1ba5 h MET 42 CO 0.01 0.68 0.37 -0.07 0.14 0.00 0.00 176.91 178.04 1ba5 h LEU 43 N 0.10 0.75 -0.47 3.39 3.38 -0.70 -0.01 115.31 121.76 1ba5 h LEU 43 Ca 0.05 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1ba5 h LEU 43 Cb 0.54 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1ba5 h LEU 43 CO 0.02 0.59 0.27 0.50 0.09 0.00 0.00 178.44 179.92 1ba5 h LYS 44 N 0.85 0.64 -0.27 1.13 3.64 -0.85 -0.64 116.57 121.06 1ba5 h LYS 44 Ca 0.22 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1ba5 h LYS 44 Cb -0.02 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1ba5 h LYS 44 CO -0.04 0.49 0.09 0.22 -2.27 0.00 0.00 179.45 177.93 1ba5 h ASP 45 N 0.62 0.39 -0.33 4.20 3.58 -0.61 0.15 116.42 124.42 1ba5 h ASP 45 Ca 0.17 -0.20 0.02 0.00 0.42 0.00 0.00 57.03 57.44 1ba5 h ASP 45 Cb 0.02 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 40.94 1ba5 h ASP 45 CO -0.03 0.48 0.18 0.03 -2.88 0.00 0.00 179.24 177.02 1ba5 h ARG 46 N 0.27 0.36 -0.66 0.28 2.47 -0.83 -0.26 114.38 116.01 1ba5 h ARG 46 Ca 0.09 -0.02 -0.08 0.00 -1.26 0.00 0.00 59.98 58.70 1ba5 h ARG 46 Cb 0.23 -0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.45 1ba5 h ARG 46 CO -0.00 0.24 0.09 2.35 0.56 0.00 0.00 179.97 183.21 1ba5 h TRP 47 N 0.37 1.17 -0.35 3.04 2.91 -0.97 -1.73 115.95 120.39 1ba5 h TRP 47 Ca 0.14 -0.17 0.02 0.00 1.13 0.00 0.00 58.89 60.00 1ba5 h TRP 47 Cb 0.03 -0.32 -0.02 0.00 -0.51 0.00 0.00 29.16 28.34 1ba5 h TRP 47 CO -0.09 0.99 0.20 -0.09 -1.03 0.00 0.00 178.44 178.42 1ba5 h ARG 48 N 1.03 0.40 -0.51 2.65 2.43 -0.17 0.30 114.38 120.51 1ba5 h ARG 48 Ca 0.20 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.38 1ba5 h ARG 48 Cb 0.46 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 1ba5 h ARG 48 CO 0.02 0.27 0.29 1.15 -1.51 0.00 0.00 179.97 180.18 1ba5 h THR 49 N 0.41 1.02 -0.46 0.20 2.02 -0.83 -1.19 112.91 114.09 1ba5 h THR 49 Ca 0.14 -0.20 -0.05 0.00 0.77 0.00 0.00 66.41 67.07 1ba5 h THR 49 Cb 0.01 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 66.80 1ba5 h THR 49 CO -0.07 0.10 0.08 -0.03 0.37 0.00 0.00 175.52 175.97 1ba5 h MET 50 N 0.57 0.70 -0.67 6.66 4.05 -0.65 -0.55 114.93 125.04 1ba5 h MET 50 Ca 0.21 -0.14 -0.02 0.00 -0.28 0.00 0.00 59.70 59.47 1ba5 h MET 50 Cb 0.05 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 30.72 1ba5 h MET 50 CO -0.11 0.66 0.35 -0.22 0.23 0.00 0.00 176.91 177.82 1ba5 h LYS 51 N 0.68 0.94 -0.05 0.39 3.64 0.50 -2.84 116.57 119.82 1ba5 h LYS 51 Ca 0.15 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1ba5 h LYS 51 Cb 0.31 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1ba5 h LYS 51 CO 0.00 0.73 -0.00 -0.22 -2.27 0.00 0.00 179.45 177.69 1ba5 h LYS 52 N 0.92 0.10 0.00 1.90 3.64 -0.75 -3.51 116.57 118.86 1ba5 h LYS 52 Ca 0.23 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1ba5 h LYS 52 Cb 0.07 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1ba5 h LYS 52 CO -0.03 0.39 0.00 -0.11 -2.27 0.00 0.00 179.45 177.42