#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 1.07 0.01 -0.14 2.85 -1.26 -4.98 118.16 115.71 1ba5 n LYS 2 Ca 0.00 -1.53 -0.12 0.00 -1.05 0.00 0.00 58.31 55.61 1ba5 n LYS 2 Cb 0.00 0.04 0.01 0.00 -0.65 0.00 0.00 35.03 34.44 1ba5 n LYS 2 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 177.40 177.26 1ba5 h ARG 3 N 1.67 0.58 -5.97 -1.58 1.12 -2.09 -3.41 114.38 104.70 1ba5 h ARG 3 Ca -0.34 -0.43 -0.52 0.00 -1.11 0.00 0.00 59.98 57.58 1ba5 h ARG 3 Cb 1.28 0.07 -0.02 0.00 -0.01 0.00 0.00 29.97 31.30 1ba5 h ARG 3 CO -0.11 1.05 1.42 -1.14 -3.11 0.00 0.00 179.97 178.08 1ba5 s GLN 4 N -3.83 2.75 0.28 0.20 0.74 -1.26 -4.89 119.66 113.65 1ba5 s GLN 4 Ca -0.08 1.21 -0.20 0.00 0.05 0.00 0.00 55.36 56.34 1ba5 s GLN 4 Cb 0.10 -4.38 0.02 0.00 1.10 0.00 0.00 33.01 29.85 1ba5 s GLN 4 CO 0.86 -2.56 0.69 0.00 -0.55 0.00 0.00 175.29 173.73 1ba5 s ALA 5 N 9.19 -1.06 0.42 1.58 0.00 -1.26 -5.18 121.76 125.45 1ba5 s ALA 5 Ca 0.82 -0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.39 1ba5 s ALA 5 Cb -0.19 0.87 -0.00 0.00 0.00 0.00 0.00 23.12 23.80 1ba5 s ALA 5 CO 0.27 -1.01 0.62 -1.58 0.00 0.00 0.00 175.76 174.06 1ba5 s TRP 6 N -3.85 3.18 0.18 0.00 0.52 -1.26 -5.10 118.94 112.60 1ba5 s TRP 6 Ca 0.13 0.10 -0.02 0.00 0.02 0.00 0.00 56.10 56.33 1ba5 s TRP 6 Cb -0.05 -2.24 -0.04 0.00 -1.15 0.00 0.00 33.47 29.99 1ba5 s TRP 6 CO 0.08 -0.28 0.13 -0.48 0.02 0.00 0.00 176.95 176.41 1ba5 s LEU 7 N -4.46 1.32 0.30 2.99 -0.00 -1.26 -5.04 118.68 112.53 1ba5 s LEU 7 Ca 0.48 -1.28 0.06 0.00 -0.00 0.00 0.00 54.13 53.39 1ba5 s LEU 7 Cb -0.10 0.46 0.79 0.00 -0.00 0.00 0.00 46.19 47.34 1ba5 s LEU 7 CO 0.36 -0.82 1.72 4.11 -0.00 0.00 0.00 176.35 181.72 1ba5 h TRP 8 N 2.68 0.86 0.72 3.48 0.09 -2.00 -1.33 115.95 120.45 1ba5 h TRP 8 Ca -0.35 0.04 -0.03 0.00 0.09 0.00 0.00 58.89 58.64 1ba5 h TRP 8 Cb 1.23 -0.23 -0.00 0.00 0.08 0.00 0.00 29.16 30.24 1ba5 h TRP 8 CO 0.38 0.04 -0.46 0.93 0.09 0.00 0.00 178.44 179.42 1ba5 h GLU 9 N 0.52 -1.07 -0.50 0.12 4.39 -1.98 0.67 114.58 116.72 1ba5 h GLU 9 Ca 0.60 0.07 0.02 0.00 0.34 0.00 0.00 59.36 60.39 1ba5 h GLU 9 Cb 1.11 0.24 -0.03 0.00 -0.10 0.00 0.00 28.75 29.97 1ba5 h GLU 9 CO -0.48 -0.71 0.30 0.93 -1.16 0.00 0.00 179.01 177.88 1ba5 h GLU 10 N -1.11 0.59 0.53 2.33 5.08 -1.76 0.75 114.58 120.98 1ba5 h GLU 10 Ca -0.10 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1ba5 h GLU 10 Cb 0.90 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1ba5 h GLU 10 CO 0.09 0.39 -0.27 -0.44 -1.00 0.00 0.00 179.01 177.77 1ba5 h ASP 11 N 0.60 -0.65 -0.10 1.42 3.32 -1.17 0.26 116.42 120.10 1ba5 h ASP 11 Ca 0.20 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.29 1ba5 h ASP 11 Cb 0.01 0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1ba5 h ASP 11 CO -0.09 -0.45 -0.01 0.50 -1.72 0.00 0.00 179.24 177.47 1ba5 h LYS 12 N -0.74 0.02 -0.84 3.56 3.64 -0.76 -2.70 116.57 118.76 1ba5 h LYS 12 Ca -0.07 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1ba5 h LYS 12 Cb 0.57 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.34 1ba5 h LYS 12 CO 0.11 0.01 0.54 -0.97 -2.27 0.00 0.00 179.45 176.87 1ba5 h ASN 13 N 0.02 0.90 -0.40 4.20 -1.24 -0.74 -2.78 115.58 115.54 1ba5 h ASN 13 Ca 0.05 -0.01 0.08 0.00 0.71 0.00 0.00 56.30 57.13 1ba5 h ASN 13 Cb 0.06 -0.20 -0.07 0.00 0.73 0.00 0.00 38.32 38.83 1ba5 h ASN 13 CO -0.09 0.62 -0.06 0.25 -1.29 0.00 0.00 177.43 176.86 1ba5 h LEU 14 N 1.06 -0.30 -0.40 0.34 6.46 -0.15 0.18 115.31 122.50 1ba5 h LEU 14 Ca 0.33 0.11 0.02 0.00 -0.12 0.00 0.00 57.88 58.22 1ba5 h LEU 14 Cb -0.00 0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.11 1ba5 h LEU 14 CO -0.11 -0.10 0.22 0.03 -0.62 0.00 0.00 178.44 177.86 1ba5 h ARG 15 N 0.04 0.44 -0.08 1.25 3.08 -1.40 0.14 114.38 117.85 1ba5 h ARG 15 Ca 0.19 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 1ba5 h ARG 15 Cb 0.29 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1ba5 h ARG 15 CO -0.38 0.29 -0.15 1.03 -1.07 0.00 0.00 179.97 179.69 1ba5 h SER 16 N 0.45 0.12 0.00 7.04 0.87 -1.16 -2.84 113.55 118.03 1ba5 h SER 16 Ca 0.16 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 1ba5 h SER 16 Cb 0.03 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1ba5 h SER 16 CO -0.09 0.29 -0.00 1.23 -0.53 0.00 0.00 176.83 177.73 1ba5 h GLY 17 N 0.66 0.00 -0.42 5.77 0.00 0.23 -3.36 103.07 105.94 1ba5 h GLY 17 Ca 0.02 0.00 0.31 0.00 0.00 0.00 0.00 47.33 47.66 1ba5 h GLY 17 CO 0.02 0.00 0.65 -2.08 0.00 0.00 0.00 176.54 175.14 1ba5 h VAL 18 N -0.09 0.39 -0.42 4.60 2.07 -0.85 0.19 116.25 122.13 1ba5 h VAL 18 Ca 0.00 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1ba5 h VAL 18 Cb 0.00 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.75 1ba5 h VAL 18 CO 0.00 0.07 0.15 0.08 0.02 0.00 0.00 177.57 177.89 1ba5 h ARG 19 N 0.36 0.59 0.00 1.57 0.11 -1.68 0.15 114.38 115.48 1ba5 h ARG 19 Ca 0.69 -0.08 -0.34 0.00 0.10 0.00 0.00 59.98 60.34 1ba5 h ARG 19 Cb 1.68 -0.11 -0.07 0.00 1.11 0.00 0.00 29.97 32.59 1ba5 h ARG 19 CO -0.45 0.50 -2.34 0.36 0.10 0.00 0.00 179.97 178.14 1ba5 n LYS 20 N -4.36 0.76 0.08 0.08 2.85 0.13 -4.40 118.16 113.30 1ba5 n LYS 20 Ca 0.03 -0.02 -0.08 0.00 -1.05 0.00 0.00 58.31 57.19 1ba5 n LYS 20 Cb 0.15 -1.51 -0.06 0.00 -0.65 0.00 0.00 35.03 32.97 1ba5 n LYS 20 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 177.40 179.23 1ba5 h TYR 21 N 0.00 0.16 0.00 5.58 -1.99 -0.73 -3.50 116.97 116.48 1ba5 h TYR 21 Ca -0.51 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.12 1ba5 h TYR 21 Cb 2.16 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 40.88 1ba5 h TYR 21 CO 0.00 0.99 0.00 0.41 -0.00 0.00 0.00 178.16 179.56 1ba5 n GLY 22 N 1.12 0.43 3.06 3.88 0.00 0.52 -4.65 105.19 109.54 1ba5 n GLY 22 Ca -0.02 -1.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 1ba5 n GLY 22 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ba5 n GLU 23 N 0.81 2.59 0.08 1.61 1.02 -1.26 -3.95 120.64 121.54 1ba5 n GLU 23 Ca 0.00 -2.61 0.00 0.00 -0.02 0.00 0.00 57.16 54.53 1ba5 n GLU 23 Cb 0.00 -3.30 0.00 0.00 -0.02 0.00 0.00 31.44 28.12 1ba5 n GLU 23 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ba5 n GLY 24 N 4.60 -1.83 2.69 0.62 0.00 -1.26 -5.00 105.19 105.02 1ba5 n GLY 24 Ca 0.50 0.43 -0.42 0.00 0.00 0.00 0.00 46.02 46.53 1ba5 n GLY 24 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ba5 n ASN 25 N -2.80 4.81 0.26 1.61 2.04 -1.25 -4.65 115.26 115.27 1ba5 n ASN 25 Ca 0.00 -2.87 0.11 0.00 -0.44 0.00 0.00 54.58 51.39 1ba5 n ASN 25 Cb 0.00 -1.61 0.70 0.00 -2.53 0.00 0.00 39.78 36.34 1ba5 n ASN 25 CO 0.00 0.00 0.00 -0.50 -0.44 0.00 0.00 177.26 176.32 1ba5 h TRP 26 N 5.79 0.00 0.70 -2.53 4.06 -1.95 -2.87 115.95 119.15 1ba5 h TRP 26 Ca 0.58 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.50 1ba5 h TRP 26 Cb 0.58 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.74 1ba5 h TRP 26 CO 1.48 0.12 -0.42 0.66 -3.56 0.00 0.00 178.44 176.72 1ba5 h SER 27 N 0.00 -1.06 -0.44 -3.49 4.64 -1.99 -1.56 113.55 109.65 1ba5 h SER 27 Ca -0.00 0.06 0.08 0.00 -0.47 0.00 0.00 61.79 61.46 1ba5 h SER 27 Cb 0.29 0.31 -0.07 0.00 -0.31 0.00 0.00 62.40 62.62 1ba5 h SER 27 CO 0.02 -0.66 -0.01 0.11 -0.87 0.00 0.00 176.83 175.42 1ba5 h LYS 28 N -1.05 0.10 -0.34 4.77 1.57 -1.91 0.21 116.57 119.91 1ba5 h LYS 28 Ca -0.09 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.76 1ba5 h LYS 28 Cb 0.85 -0.02 -0.08 0.00 0.08 0.00 0.00 32.23 33.06 1ba5 h LYS 28 CO 0.09 0.07 -0.18 0.82 -0.57 0.00 0.00 179.45 179.68 1ba5 h ILE 29 N 0.10 0.47 -0.32 1.86 2.04 -1.40 -0.46 117.51 119.81 1ba5 h ILE 29 Ca 0.22 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.99 1ba5 h ILE 29 Cb 0.32 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 1ba5 h ILE 29 CO -0.37 0.00 -0.16 0.25 0.00 0.00 0.00 178.15 177.87 1ba5 h LEU 30 N -0.13 0.56 0.02 1.44 5.85 -0.53 -2.64 115.31 119.88 1ba5 h LEU 30 Ca 0.17 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1ba5 h LEU 30 Cb 0.40 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1ba5 h LEU 30 CO -0.42 0.74 -0.01 0.25 -0.34 0.00 0.00 178.44 178.66 1ba5 h LEU 31 N 0.51 -0.02 -5.82 2.25 7.12 0.96 -3.40 115.31 116.92 1ba5 h LEU 31 Ca 0.09 -0.13 -0.45 0.00 0.13 0.00 0.00 57.88 57.51 1ba5 h LEU 31 Cb 0.57 0.00 -0.35 0.00 -0.53 0.00 0.00 40.66 40.35 1ba5 h LEU 31 CO 0.04 0.12 -1.04 0.00 -0.13 0.00 0.00 178.44 177.43 1ba5 n HIS 32 N -5.04 -0.54 -2.71 1.25 1.44 -0.52 -4.93 115.22 104.18 1ba5 n HIS 32 Ca -0.08 -3.43 -0.08 0.00 -2.01 0.00 0.00 57.72 52.13 1ba5 n HIS 32 Cb 0.10 -0.03 0.10 0.00 0.12 0.00 0.00 29.99 30.28 1ba5 n HIS 32 CO 0.00 0.00 0.00 0.98 -2.81 0.00 0.00 176.34 174.51 1ba5 n TYR 33 N 0.63 -2.54 -2.93 -1.40 9.36 -0.99 -4.93 117.16 114.35 1ba5 n TYR 33 Ca 0.21 -1.95 -0.01 0.00 3.32 0.00 0.00 57.90 59.47 1ba5 n TYR 33 Cb 0.63 1.60 -0.01 0.00 -0.63 0.00 0.00 39.34 40.93 1ba5 n TYR 33 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1ba5 n LYS 34 N -0.10 -2.16 -3.69 2.98 5.02 -1.26 -4.90 118.16 114.04 1ba5 n LYS 34 Ca 0.00 1.92 -0.14 0.00 -2.02 0.00 0.00 58.31 58.08 1ba5 n LYS 34 Cb 0.77 -3.01 -0.09 0.00 -0.02 0.00 0.00 35.03 32.68 1ba5 n LYS 34 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1ba5 s PHE 35 N -0.99 -0.48 0.00 2.13 0.08 -1.26 -4.81 117.98 112.65 1ba5 s PHE 35 Ca -0.05 1.07 0.00 0.00 0.12 0.00 0.00 56.93 58.08 1ba5 s PHE 35 Cb 0.00 0.20 0.00 0.00 -0.57 0.00 0.00 43.02 42.65 1ba5 s PHE 35 CO 0.38 -0.33 0.00 -1.71 -0.10 0.00 0.00 175.22 173.45 1ba5 n ASN 36 N 2.23 0.00 -3.54 1.36 2.85 -1.26 -4.90 115.26 112.01 1ba5 n ASN 36 Ca -0.16 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 53.91 1ba5 n ASN 36 Cb 0.57 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.57 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 6.25 -4.74 1.20 3.02 -1.26 -4.89 115.26 114.83 1ba5 n ASN 37 Ca 0.00 -2.73 -0.24 0.00 -0.03 0.00 0.00 54.58 51.58 1ba5 n ASN 37 Cb 0.00 -1.60 -0.07 0.00 -0.61 0.00 0.00 39.78 37.50 1ba5 n ASN 37 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1ba5 s ARG 38 N 2.55 2.31 0.07 3.52 1.81 -1.26 -5.07 118.95 122.88 1ba5 s ARG 38 Ca 0.57 -1.67 0.01 0.00 -1.72 0.00 0.00 55.73 52.92 1ba5 s ARG 38 Cb 0.16 -2.11 -0.04 0.00 -0.45 0.00 0.00 34.95 32.52 1ba5 s ARG 38 CO -0.07 -0.01 -0.05 0.99 -0.68 0.00 0.00 175.30 175.48 1ba5 s THR 39 N -2.50 0.47 0.28 0.02 2.01 -1.26 -5.03 115.64 109.62 1ba5 s THR 39 Ca 0.40 -1.62 0.01 0.00 0.31 0.00 0.00 61.69 60.79 1ba5 s THR 39 Cb 0.00 -1.28 0.27 0.00 0.01 0.00 0.00 72.50 71.50 1ba5 s THR 39 CO 0.23 -0.77 1.72 0.77 -0.69 0.00 0.00 174.62 175.87 1ba5 h SER 40 N 3.49 0.37 -0.31 3.53 4.64 -1.99 0.43 113.55 123.71 1ba5 h SER 40 Ca -0.35 0.13 0.02 0.00 -0.47 0.00 0.00 61.79 61.13 1ba5 h SER 40 Cb 1.17 0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.33 1ba5 h SER 40 CO 0.58 0.07 0.16 0.58 -0.87 0.00 0.00 176.83 177.35 1ba5 h VAL 41 N 0.46 1.00 -0.50 0.95 2.07 -1.99 -0.12 116.25 118.11 1ba5 h VAL 41 Ca 0.51 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.88 1ba5 h VAL 41 Cb 0.89 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1ba5 h VAL 41 CO -0.47 0.06 0.17 0.24 0.02 0.00 0.00 177.57 177.59 1ba5 h MET 42 N 0.33 0.77 -0.24 1.57 2.07 -1.42 -0.52 114.93 117.48 1ba5 h MET 42 Ca 0.13 -0.15 0.03 0.00 -2.07 0.00 0.00 59.70 57.63 1ba5 h MET 42 Cb 0.04 -0.12 -0.03 0.00 -1.87 0.00 0.00 31.60 29.62 1ba5 h MET 42 CO -0.08 0.70 0.06 -0.07 1.07 0.00 0.00 176.91 178.59 1ba5 h LEU 43 N 0.67 0.04 0.54 1.22 4.07 -0.62 0.02 115.31 121.26 1ba5 h LEU 43 Ca 0.16 0.03 -0.03 0.00 0.08 0.00 0.00 57.88 58.13 1ba5 h LEU 43 Cb 0.24 0.04 0.01 0.00 1.08 0.00 0.00 40.66 42.03 1ba5 h LEU 43 CO -0.01 0.05 -0.26 0.11 -1.08 0.00 0.00 178.44 177.25 1ba5 h LYS 44 N 0.16 -0.70 -0.00 1.13 1.57 -0.79 -0.30 116.57 117.64 1ba5 h LYS 44 Ca 0.11 0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.97 1ba5 h LYS 44 Cb 0.10 0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 1ba5 h LYS 44 CO -0.14 -0.47 -0.25 0.22 -0.57 0.00 0.00 179.45 178.25 1ba5 h ASP 45 N -0.73 -0.74 -0.00 0.86 3.58 -0.93 0.38 116.42 118.83 1ba5 h ASP 45 Ca -0.07 0.10 0.01 0.00 0.42 0.00 0.00 57.03 57.48 1ba5 h ASP 45 Cb 0.56 0.30 -0.01 0.00 1.72 0.00 0.00 39.33 41.91 1ba5 h ASP 45 CO 0.12 -0.32 -0.03 0.03 -2.88 0.00 0.00 179.24 176.16 1ba5 h ARG 46 N -0.39 -0.05 -0.42 0.28 2.47 -0.98 -2.48 114.38 112.82 1ba5 h ARG 46 Ca 0.06 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.80 1ba5 h ARG 46 Cb 0.47 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.78 1ba5 h ARG 46 CO -0.22 -0.03 0.28 2.35 0.56 0.00 0.00 179.97 182.91 1ba5 h TRP 47 N -0.05 0.50 -0.58 3.04 -0.00 -0.77 0.06 115.95 118.15 1ba5 h TRP 47 Ca 0.01 0.01 0.12 0.00 -0.00 0.00 0.00 58.89 59.03 1ba5 h TRP 47 Cb 0.07 -0.17 -0.10 0.00 -0.00 0.00 0.00 29.16 28.96 1ba5 h TRP 47 CO -0.11 0.31 -0.05 -0.09 -0.00 0.00 0.00 178.44 178.50 1ba5 h ARG 48 N 0.53 0.07 0.13 2.65 2.43 -0.43 0.17 114.38 119.94 1ba5 h ARG 48 Ca 0.16 -0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 58.98 1ba5 h ARG 48 Cb -0.00 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1ba5 h ARG 48 CO -0.04 0.05 -1.84 0.00 -1.51 0.00 0.00 179.97 176.63 1ba5 h THR 49 N 0.07 0.76 -0.09 0.20 1.03 -1.53 -3.35 112.91 110.00 1ba5 h THR 49 Ca 0.29 -2.38 0.03 0.00 -0.01 0.00 0.00 66.41 64.34 1ba5 h THR 49 Cb 0.46 2.58 -0.00 0.00 -1.07 0.00 0.00 68.15 70.12 1ba5 h THR 49 CO -0.53 0.84 0.13 -0.03 -0.01 0.00 0.00 175.52 175.92 1ba5 h MET 50 N -0.01 0.00 -0.89 0.00 4.05 -0.75 0.41 114.93 117.74 1ba5 h MET 50 Ca -0.39 0.00 0.23 0.00 -0.28 0.00 0.00 59.70 59.27 1ba5 h MET 50 Cb 1.99 0.00 -0.13 0.00 -0.80 0.00 0.00 31.60 32.65 1ba5 h MET 50 CO 0.09 0.00 0.33 -0.22 0.23 0.00 0.00 176.91 177.34 1ba5 h LYS 51 N 0.00 0.29 0.00 0.39 3.64 -0.80 -3.24 116.57 116.85 1ba5 h LYS 51 Ca 0.04 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1ba5 h LYS 51 Cb 0.30 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1ba5 h LYS 51 CO -0.00 0.19 -0.27 0.36 -2.27 0.00 0.00 179.45 177.45 1ba5 n LYS 52 N -5.14 0.00 -0.78 1.90 0.00 -0.98 -5.14 118.16 108.03 1ba5 n LYS 52 Ca 0.22 -0.61 0.00 0.00 -0.00 0.00 0.00 58.31 57.93 1ba5 n LYS 52 Cb 0.69 -0.33 0.00 0.00 -0.00 0.00 0.00 35.03 35.39 1ba5 n LYS 52 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29