#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ba5 s LYS 2 N 0.00 2.30 0.00 2.89 1.02 -1.26 -5.10 119.74 119.60 1ba5 s LYS 2 Ca 0.00 0.15 0.00 0.00 0.02 0.00 0.00 55.97 56.14 1ba5 s LYS 2 Cb 0.00 -2.02 0.00 0.00 -0.52 0.00 0.00 37.83 35.29 1ba5 s LYS 2 CO 0.00 -1.34 0.00 0.54 -0.92 0.00 0.00 175.35 173.63 1ba5 n ARG 3 N -3.13 0.95 -3.20 1.68 1.74 -1.26 -4.77 116.66 108.67 1ba5 n ARG 3 Ca 0.07 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.07 1ba5 n ARG 3 Cb 0.60 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 32.07 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 -0.30 -1.72 -1.54 5.56 6.02 -1.26 -5.01 117.38 119.13 1ba5 n GLN 4 Ca 0.00 1.15 -0.30 0.00 -0.01 0.00 0.00 57.00 57.84 1ba5 n GLN 4 Cb 0.00 -5.61 0.21 0.00 1.02 0.00 0.00 30.24 25.85 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 -3.19 1.49 0.68 -1.58 0.00 -1.26 -5.05 121.76 112.85 1ba5 s ALA 5 Ca 0.22 -1.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.01 1ba5 s ALA 5 Cb -0.03 -2.83 -0.00 0.00 0.00 0.00 0.00 23.12 20.25 1ba5 s ALA 5 CO 0.76 -2.94 1.06 -1.58 0.00 0.00 0.00 175.76 173.06 1ba5 s TRP 6 N -3.47 3.38 0.12 0.00 0.52 -1.26 -5.06 118.94 113.17 1ba5 s TRP 6 Ca 0.72 1.20 -0.12 0.00 0.02 0.00 0.00 56.10 57.93 1ba5 s TRP 6 Cb -0.07 -2.90 -0.06 0.00 -1.15 0.00 0.00 33.47 29.28 1ba5 s TRP 6 CO 0.54 -1.03 0.48 -0.51 0.02 0.00 0.00 176.95 176.45 1ba5 s LEU 7 N -5.34 4.34 0.34 2.99 1.43 -1.26 -4.95 118.68 116.22 1ba5 s LEU 7 Ca 0.57 0.93 0.09 0.00 -1.03 0.00 0.00 54.13 54.70 1ba5 s LEU 7 Cb -0.12 -3.14 0.83 0.00 0.03 0.00 0.00 46.19 43.80 1ba5 s LEU 7 CO 0.53 0.13 1.80 4.11 0.23 0.00 0.00 176.35 183.15 1ba5 h TRP 8 N 3.61 0.93 -0.18 0.29 5.08 -1.99 -0.15 115.95 123.53 1ba5 h TRP 8 Ca -0.49 0.03 -0.01 0.00 1.08 0.00 0.00 58.89 59.50 1ba5 h TRP 8 Cb 1.19 -0.28 -0.01 0.00 -3.00 0.00 0.00 29.16 27.06 1ba5 h TRP 8 CO 0.66 0.22 0.07 1.49 -1.28 0.00 0.00 178.44 179.59 1ba5 h GLU 9 N 0.67 0.27 0.13 0.12 4.57 -1.99 -0.59 114.58 117.76 1ba5 h GLU 9 Ca 0.55 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.67 1ba5 h GLU 9 Cb 0.98 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.53 1ba5 h GLU 9 CO -0.32 0.35 -0.06 0.93 -1.18 0.00 0.00 179.01 178.73 1ba5 h GLU 10 N 0.13 -0.16 -0.40 1.92 5.08 -1.49 -0.25 114.58 119.42 1ba5 h GLU 10 Ca 0.06 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.48 1ba5 h GLU 10 Cb 0.18 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 1ba5 h GLU 10 CO -0.00 -0.04 0.11 -0.44 -1.00 0.00 0.00 179.01 177.63 1ba5 h ASP 11 N -0.24 0.08 0.24 1.42 3.32 -1.05 0.20 116.42 120.39 1ba5 h ASP 11 Ca -0.02 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1ba5 h ASP 11 Cb 0.19 0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1ba5 h ASP 11 CO 0.03 0.08 -0.12 0.50 -1.72 0.00 0.00 179.24 178.01 1ba5 h LYS 12 N 0.26 -0.31 -0.48 3.56 3.64 -0.96 -0.17 116.57 122.10 1ba5 h LYS 12 Ca 0.19 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 1ba5 h LYS 12 Cb 0.20 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 1ba5 h LYS 12 CO -0.22 -0.21 0.24 -0.91 -2.27 0.00 0.00 179.45 176.08 1ba5 h ASN 13 N -0.33 0.60 -0.23 4.20 2.35 -0.69 0.33 115.58 121.81 1ba5 h ASN 13 Ca -0.03 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.62 1ba5 h ASN 13 Cb 0.25 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 1ba5 h ASN 13 CO 0.05 0.51 -0.07 0.25 -1.65 0.00 0.00 177.43 176.52 1ba5 h LEU 14 N 0.67 0.45 -0.01 1.61 5.85 -0.29 0.22 115.31 123.82 1ba5 h LEU 14 Ca 0.17 -0.38 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 1ba5 h LEU 14 Cb 0.06 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 40.97 1ba5 h LEU 14 CO -0.02 0.73 -0.00 -0.09 -0.34 0.00 0.00 178.44 178.71 1ba5 h ARG 15 N 0.17 0.01 -0.23 1.25 2.43 -0.50 -1.26 114.38 116.25 1ba5 h ARG 15 Ca 0.06 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 1ba5 h ARG 15 Cb 0.54 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1ba5 h ARG 15 CO 0.02 0.44 0.03 0.77 -1.51 0.00 0.00 179.97 179.72 1ba5 h SER 16 N -0.41 0.37 0.87 -3.80 0.02 -1.01 -2.04 113.55 107.55 1ba5 h SER 16 Ca 0.00 -0.27 -0.04 0.00 -0.84 0.00 0.00 61.79 60.64 1ba5 h SER 16 Cb 0.43 -0.10 0.01 0.00 0.14 0.00 0.00 62.40 62.88 1ba5 h SER 16 CO 0.00 0.55 -0.45 1.23 -1.14 0.00 0.00 176.83 177.02 1ba5 h GLY 17 N 0.19 -1.30 0.96 -3.77 0.00 -0.59 -1.51 103.07 97.05 1ba5 h GLY 17 Ca 0.07 0.50 0.07 0.00 0.00 0.00 0.00 47.33 47.96 1ba5 h GLY 17 CO 0.01 -0.46 0.52 -2.08 0.00 0.00 0.00 176.54 174.52 1ba5 h VAL 18 N -1.22 1.03 -0.18 4.60 2.07 -1.30 0.92 116.25 122.17 1ba5 h VAL 18 Ca -0.12 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 1ba5 h VAL 18 Cb 0.94 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1ba5 h VAL 18 CO 0.18 0.15 0.10 -0.09 0.02 0.00 0.00 177.57 177.93 1ba5 h ARG 19 N 0.84 0.24 0.38 1.57 9.65 -1.21 0.21 114.38 126.06 1ba5 h ARG 19 Ca 0.34 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 59.18 1ba5 h ARG 19 Cb 0.26 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 1ba5 h ARG 19 CO -0.12 0.23 -0.18 0.87 2.80 0.00 0.00 179.97 183.57 1ba5 h LYS 20 N 0.19 -0.49 -0.22 0.20 1.57 -0.48 -3.36 116.57 113.98 1ba5 h LYS 20 Ca 0.06 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1ba5 h LYS 20 Cb 0.06 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1ba5 h LYS 20 CO -0.01 -0.29 0.08 1.88 -0.57 0.00 0.00 179.45 180.54 1ba5 h TYR 21 N -1.12 0.34 0.00 -1.35 0.05 -0.94 -3.49 116.97 110.46 1ba5 h TYR 21 Ca -0.05 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.70 1ba5 h TYR 21 Cb 0.42 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1ba5 h TYR 21 CO 0.01 0.38 0.00 0.41 -1.05 0.00 0.00 178.16 177.91 1ba5 n GLY 22 N -0.69 3.99 3.54 3.88 0.00 0.72 -5.01 105.19 111.62 1ba5 n GLY 22 Ca -0.03 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 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 -3.82 3.27 0.00 1.61 2.12 -1.23 -3.95 118.70 116.70 1ba5 s GLU 23 Ca 0.00 -0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.12 1ba5 s GLU 23 Cb 0.00 -4.13 0.00 0.00 0.26 0.00 0.00 34.13 30.26 1ba5 s GLU 23 CO 0.00 -1.91 0.00 0.41 -0.54 0.00 0.00 175.26 173.22 1ba5 n GLY 24 N 5.26 0.56 3.78 -1.50 0.00 -1.26 -5.14 105.19 106.89 1ba5 n GLY 24 Ca 0.03 0.01 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1ba5 n GLY 24 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ba5 s ASN 25 N 0.00 7.35 0.00 1.61 3.04 -1.25 -4.96 114.94 120.72 1ba5 s ASN 25 Ca 0.00 1.76 0.00 0.00 0.04 0.00 0.00 52.86 54.66 1ba5 s ASN 25 Cb 0.00 -2.55 0.00 0.00 -1.54 0.00 0.00 41.25 37.16 1ba5 s ASN 25 CO 0.00 0.02 0.00 0.79 -3.04 0.00 0.00 177.10 174.87 1ba5 n TRP 26 N 0.87 0.00 -0.15 0.43 7.02 -1.26 -4.62 117.44 119.72 1ba5 n TRP 26 Ca -0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 57.50 56.43 1ba5 n TRP 26 Cb 0.50 0.13 0.04 0.00 -2.42 0.00 0.00 31.31 29.56 1ba5 n TRP 26 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1ba5 h SER 27 N 0.00 0.36 -0.66 -0.99 0.87 -1.94 -0.64 113.55 110.56 1ba5 h SER 27 Ca 0.00 0.02 0.03 0.00 -1.23 0.00 0.00 61.79 60.61 1ba5 h SER 27 Cb 0.57 -0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.44 1ba5 h SER 27 CO 0.00 0.25 0.41 0.50 -0.53 0.00 0.00 176.83 177.46 1ba5 h LYS 28 N 0.49 0.78 -0.54 2.24 3.64 -2.00 0.43 116.57 121.60 1ba5 h LYS 28 Ca 0.21 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1ba5 h LYS 28 Cb 0.10 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 1ba5 h LYS 28 CO -0.14 0.51 0.35 0.82 -2.27 0.00 0.00 179.45 178.72 1ba5 h ILE 29 N 0.80 1.15 -0.45 2.00 1.08 -1.63 -2.29 117.51 118.18 1ba5 h ILE 29 Ca 0.26 -0.30 -0.04 0.00 -0.39 0.00 0.00 64.86 64.39 1ba5 h ILE 29 Cb 0.02 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 34.13 1ba5 h ILE 29 CO -0.10 0.15 0.12 0.25 -0.69 0.00 0.00 178.15 177.88 1ba5 h LEU 30 N 0.73 0.67 -0.41 1.44 6.46 -0.52 0.20 115.31 123.88 1ba5 h LEU 30 Ca 0.20 -0.22 0.06 0.00 -0.12 0.00 0.00 57.88 57.80 1ba5 h LEU 30 Cb -0.06 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 39.65 1ba5 h LEU 30 CO -0.04 0.71 0.11 -0.07 -0.62 0.00 0.00 178.44 178.53 1ba5 h LEU 31 N 0.59 0.06 0.25 2.25 3.38 -0.61 -3.13 115.31 118.11 1ba5 h LEU 31 Ca 0.14 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 1ba5 h LEU 31 Cb 0.29 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1ba5 h LEU 31 CO -0.00 0.07 -0.12 0.45 0.09 0.00 0.00 178.44 178.93 1ba5 h HIS 32 N 0.25 -0.32 -2.84 1.13 3.86 -1.32 -3.41 115.15 112.51 1ba5 h HIS 32 Ca 0.20 -0.01 -0.69 0.00 -1.16 0.00 0.00 60.37 58.71 1ba5 h HIS 32 Cb 0.22 0.10 -0.19 0.00 1.06 0.00 0.00 27.41 28.61 1ba5 h HIS 32 CO -0.18 -0.20 0.29 0.71 0.86 0.00 0.00 177.93 179.41 1ba5 s TYR 33 N -2.65 2.97 -0.07 2.45 2.02 0.70 -5.02 117.35 117.75 1ba5 s TYR 33 Ca -0.05 -0.96 -0.30 0.00 -0.37 0.00 0.00 57.07 55.40 1ba5 s TYR 33 Cb 0.00 -4.10 -0.06 0.00 -0.40 0.00 0.00 41.96 37.41 1ba5 s TYR 33 CO 0.15 -1.39 1.71 0.15 -1.57 0.00 0.00 175.55 174.60 1ba5 s LYS 34 N 2.89 4.09 0.66 -0.62 1.02 -1.19 -4.19 119.74 122.40 1ba5 s LYS 34 Ca 0.16 2.17 0.05 0.00 0.02 0.00 0.00 55.97 58.37 1ba5 s LYS 34 Cb -0.20 -4.03 0.12 0.00 -0.52 0.00 0.00 37.83 33.20 1ba5 s LYS 34 CO 0.05 -0.97 0.91 -0.06 -0.92 0.00 0.00 175.35 174.36 1ba5 s PHE 35 N 4.41 1.32 0.00 3.18 0.08 -1.26 -4.99 117.98 120.71 1ba5 s PHE 35 Ca 0.76 -0.57 0.00 0.00 0.12 0.00 0.00 56.93 57.24 1ba5 s PHE 35 Cb -0.33 -2.56 0.00 0.00 -0.57 0.00 0.00 43.02 39.56 1ba5 s PHE 35 CO 0.31 -1.49 0.47 -1.71 -0.10 0.00 0.00 175.22 172.70 1ba5 n ASN 36 N -2.55 0.00 -2.80 1.36 2.85 -1.26 -4.76 115.26 108.10 1ba5 n ASN 36 Ca 0.16 0.61 -0.10 0.00 -0.11 0.00 0.00 54.58 55.14 1ba5 n ASN 36 Cb 0.61 -0.32 0.06 0.00 1.24 0.00 0.00 39.78 41.37 1ba5 n ASN 36 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1ba5 n ASN 37 N -1.47 -0.83 -4.22 1.20 5.15 -1.26 -5.07 115.26 108.76 1ba5 n ASN 37 Ca 0.00 -3.01 -0.42 0.00 -0.60 0.00 0.00 54.58 50.55 1ba5 n ASN 37 Cb 0.00 0.67 -0.06 0.00 -0.53 0.00 0.00 39.78 39.85 1ba5 n ASN 37 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1ba5 s ARG 38 N -0.97 2.94 -1.29 1.20 0.52 -1.26 -5.01 118.95 115.08 1ba5 s ARG 38 Ca 0.27 -2.28 -0.16 0.00 -0.52 0.00 0.00 55.73 53.04 1ba5 s ARG 38 Cb 0.37 -4.06 0.10 0.00 0.52 0.00 0.00 34.95 31.88 1ba5 s ARG 38 CO -0.05 -1.23 1.70 0.25 0.02 0.00 0.00 175.30 175.99 1ba5 n THR 39 N 4.10 4.01 0.00 0.02 -2.24 -1.26 -4.67 114.28 114.23 1ba5 n THR 39 Ca 0.05 -4.20 0.00 0.00 -2.27 0.00 0.00 64.05 57.63 1ba5 n THR 39 Cb 0.42 -2.40 0.00 0.00 -2.10 0.00 0.00 70.33 66.25 1ba5 n THR 39 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ba5 n SER 40 N 7.34 0.00 -0.30 3.42 3.41 -1.26 -3.82 113.62 122.41 1ba5 n SER 40 Ca 0.46 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 59.19 1ba5 n SER 40 Cb 0.44 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.68 1ba5 n SER 40 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1ba5 h VAL 41 N 0.00 0.48 -0.38 -3.33 2.07 -1.99 0.17 116.25 113.26 1ba5 h VAL 41 Ca 0.00 -0.13 0.04 0.00 0.82 0.00 0.00 66.70 67.43 1ba5 h VAL 41 Cb 0.00 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 29.80 1ba5 h VAL 41 CO 0.00 0.07 0.15 0.24 0.02 0.00 0.00 177.57 178.05 1ba5 h MET 42 N 0.38 0.31 -0.30 1.57 2.07 -1.87 -0.01 114.93 117.09 1ba5 h MET 42 Ca 0.53 -0.02 -0.01 0.00 -2.07 0.00 0.00 59.70 58.14 1ba5 h MET 42 Cb 0.99 -0.07 -0.01 0.00 -1.87 0.00 0.00 31.60 30.64 1ba5 h MET 42 CO -0.52 0.21 0.17 -0.07 1.07 0.00 0.00 176.91 177.76 1ba5 h LEU 43 N 0.32 0.37 0.74 1.22 3.38 -1.02 -1.70 115.31 118.62 1ba5 h LEU 43 Ca 0.17 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1ba5 h LEU 43 Cb 0.13 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1ba5 h LEU 43 CO -0.16 0.35 -0.43 0.50 0.09 0.00 0.00 178.44 178.79 1ba5 h LYS 44 N 0.37 -1.05 -0.29 1.13 3.64 -0.64 0.11 116.57 119.84 1ba5 h LYS 44 Ca 0.11 0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.58 1ba5 h LYS 44 Cb 0.05 0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 1ba5 h LYS 44 CO -0.02 -0.70 0.14 0.22 -2.27 0.00 0.00 179.45 176.82 1ba5 h ASP 45 N -1.09 0.21 -0.46 4.20 3.58 -1.01 -0.48 116.42 121.37 1ba5 h ASP 45 Ca -0.10 0.01 -0.14 0.00 0.42 0.00 0.00 57.03 57.23 1ba5 h ASP 45 Cb 0.87 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.89 1ba5 h ASP 45 CO 0.11 0.16 -0.25 0.03 -2.88 0.00 0.00 179.24 176.41 1ba5 h ARG 46 N 0.30 0.98 -0.66 0.28 2.47 -1.31 -2.95 114.38 113.49 1ba5 h ARG 46 Ca 0.12 -0.44 -0.01 0.00 -1.26 0.00 0.00 59.98 58.39 1ba5 h ARG 46 Cb 0.04 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.31 1ba5 h ARG 46 CO -0.08 1.11 0.38 2.35 0.56 0.00 0.00 179.97 184.29 1ba5 h TRP 47 N 0.82 0.88 -0.58 3.04 2.91 -0.50 -0.46 115.95 122.07 1ba5 h TRP 47 Ca 0.10 -0.01 0.12 0.00 1.13 0.00 0.00 58.89 60.23 1ba5 h TRP 47 Cb 0.84 -0.29 -0.09 0.00 -0.51 0.00 0.00 29.16 29.11 1ba5 h TRP 47 CO 0.06 0.61 0.03 -0.09 -1.03 0.00 0.00 178.44 178.01 1ba5 h ARG 48 N 0.89 0.14 -0.27 2.65 2.43 -0.93 0.49 114.38 119.78 1ba5 h ARG 48 Ca 0.23 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.34 1ba5 h ARG 48 Cb -0.00 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1ba5 h ARG 48 CO -0.04 0.09 -0.05 1.15 -1.51 0.00 0.00 179.97 179.61 1ba5 h THR 49 N 0.14 1.28 0.00 0.20 2.02 -1.30 -2.85 112.91 112.40 1ba5 h THR 49 Ca 0.30 -1.05 -0.01 0.00 0.77 0.00 0.00 66.41 66.41 1ba5 h THR 49 Cb 0.47 1.41 -0.00 0.00 -1.74 0.00 0.00 68.15 68.29 1ba5 h THR 49 CO -0.47 0.33 -0.06 0.24 0.37 0.00 0.00 175.52 175.93 1ba5 h MET 50 N 0.28 0.00 -0.05 6.66 2.86 0.10 -2.48 114.93 122.30 1ba5 h MET 50 Ca 0.07 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 1ba5 h MET 50 Cb 0.52 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.18 1ba5 h MET 50 CO 0.02 0.06 -0.01 0.87 1.06 0.00 0.00 176.91 178.92 1ba5 h LYS 51 N 0.00 0.10 -3.13 1.72 1.79 0.16 -3.24 116.57 113.97 1ba5 h LYS 51 Ca -0.00 -0.04 -0.72 0.00 -2.18 0.00 0.00 60.65 57.71 1ba5 h LYS 51 Cb 0.26 -0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 30.82 1ba5 h LYS 51 CO 0.01 0.44 2.76 1.17 -1.08 0.00 0.00 179.45 182.74 1ba5 n LYS 52 N -4.84 3.89 0.00 3.15 4.81 -0.93 -5.11 118.16 119.13 1ba5 n LYS 52 Ca -0.07 -3.06 0.09 0.00 -0.87 0.00 0.00 58.31 54.40 1ba5 n LYS 52 Cb 0.22 -2.84 0.55 0.00 0.02 0.00 0.00 35.03 32.98 1ba5 n LYS 52 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04