#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 0.00 -4.16 5.56 2.85 -1.26 -5.14 118.16 116.01 1ba5 n LYS 2 Ca 0.00 0.00 -0.16 0.00 -1.05 0.00 0.00 58.31 57.10 1ba5 n LYS 2 Cb 0.00 0.00 -0.11 0.00 -0.65 0.00 0.00 35.03 34.27 1ba5 n LYS 2 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1ba5 s ARG 3 N -0.90 0.79 -1.19 -1.58 0.52 -1.26 -5.07 118.95 110.25 1ba5 s ARG 3 Ca 0.00 -1.03 -0.20 0.00 -0.52 0.00 0.00 55.73 53.98 1ba5 s ARG 3 Cb 0.00 -0.60 0.03 0.00 0.52 0.00 0.00 34.95 34.90 1ba5 s ARG 3 CO 0.00 0.11 1.72 -1.14 0.02 0.00 0.00 175.30 176.02 1ba5 s GLN 4 N -2.24 3.55 0.00 3.54 2.00 -1.26 -4.79 119.66 120.46 1ba5 s GLN 4 Ca 0.00 -1.56 0.00 0.00 -2.00 0.00 0.00 55.36 51.81 1ba5 s GLN 4 Cb -0.06 -5.42 0.00 0.00 0.80 0.00 0.00 33.01 28.33 1ba5 s GLN 4 CO 0.01 -2.62 0.00 0.00 -0.50 0.00 0.00 175.29 172.18 1ba5 n ALA 5 N 9.90 0.00 -2.84 1.58 0.00 -1.26 -4.95 120.51 122.94 1ba5 n ALA 5 Ca 0.44 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.79 1ba5 n ALA 5 Cb 0.47 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.86 1ba5 n ALA 5 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1ba5 s TRP 6 N 0.00 0.04 0.22 0.00 0.52 -1.26 -4.99 118.94 113.46 1ba5 s TRP 6 Ca 0.00 -0.40 -0.16 0.00 0.02 0.00 0.00 56.10 55.55 1ba5 s TRP 6 Cb 0.00 0.11 0.02 0.00 -1.15 0.00 0.00 33.47 32.45 1ba5 s TRP 6 CO 0.00 -0.68 0.52 -0.48 0.02 0.00 0.00 176.95 176.33 1ba5 s LEU 7 N -2.86 0.15 0.28 2.99 2.34 -1.26 -5.05 118.68 115.26 1ba5 s LEU 7 Ca 0.07 -0.63 0.01 0.00 0.06 0.00 0.00 54.13 53.64 1ba5 s LEU 7 Cb 0.03 2.07 0.67 0.00 -0.56 0.00 0.00 46.19 48.40 1ba5 s LEU 7 CO -0.08 -1.10 1.65 -0.50 -1.06 0.00 0.00 176.35 175.26 1ba5 h TRP 8 N 2.21 0.34 0.34 3.48 6.55 -2.03 -1.79 115.95 125.05 1ba5 h TRP 8 Ca -0.27 0.05 -0.00 0.00 0.95 0.00 0.00 58.89 59.62 1ba5 h TRP 8 Cb 1.26 -0.01 -0.03 0.00 -0.86 0.00 0.00 29.16 29.51 1ba5 h TRP 8 CO 0.38 -0.19 -0.52 0.93 -1.05 0.00 0.00 178.44 177.99 1ba5 h GLU 9 N 0.22 -0.87 -0.39 0.49 5.08 -1.99 0.22 114.58 117.33 1ba5 h GLU 9 Ca 0.53 0.06 0.06 0.00 -1.00 0.00 0.00 59.36 59.01 1ba5 h GLU 9 Cb 1.05 0.20 -0.05 0.00 0.50 0.00 0.00 28.75 30.44 1ba5 h GLU 9 CO -0.64 -0.58 0.08 0.93 -1.00 0.00 0.00 179.01 177.80 1ba5 h GLU 10 N -0.90 0.20 -0.51 2.33 5.08 -1.71 -1.10 114.58 117.97 1ba5 h GLU 10 Ca -0.04 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1ba5 h GLU 10 Cb 0.83 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.01 1ba5 h GLU 10 CO -0.16 0.13 0.34 -0.44 -1.00 0.00 0.00 179.01 177.88 1ba5 h ASP 11 N 0.21 0.50 0.49 1.42 3.32 -0.98 0.89 116.42 122.27 1ba5 h ASP 11 Ca 0.19 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 1ba5 h ASP 11 Cb 0.23 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1ba5 h ASP 11 CO -0.25 0.35 -0.24 0.50 -1.72 0.00 0.00 179.24 177.88 1ba5 h LYS 12 N 0.58 -0.63 0.00 3.56 3.64 0.67 -2.20 116.57 122.19 1ba5 h LYS 12 Ca 0.20 0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.60 1ba5 h LYS 12 Cb 0.09 0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1ba5 h LYS 12 CO -0.05 -0.34 -0.13 -2.95 -2.27 0.00 0.00 179.45 173.71 1ba5 h ASN 13 N -1.04 0.00 -0.12 4.20 -1.07 -1.25 -2.10 115.58 114.21 1ba5 h ASN 13 Ca -0.07 0.00 -0.00 0.00 0.07 0.00 0.00 56.30 56.30 1ba5 h ASN 13 Cb 0.59 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.83 1ba5 h ASN 13 CO 0.11 0.13 0.06 0.25 0.07 0.00 0.00 177.43 178.05 1ba5 h LEU 14 N 0.00 0.16 0.04 6.14 5.85 -0.75 0.12 115.31 126.86 1ba5 h LEU 14 Ca -0.00 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.60 1ba5 h LEU 14 Cb 0.42 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 1ba5 h LEU 14 CO 0.02 0.24 -0.10 -0.09 -0.34 0.00 0.00 178.44 178.17 1ba5 h ARG 15 N 0.06 -0.18 0.58 1.25 2.43 -0.73 -0.12 114.38 117.67 1ba5 h ARG 15 Ca 0.04 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1ba5 h ARG 15 Cb 0.13 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1ba5 h ARG 15 CO -0.00 -0.12 -0.44 1.03 -1.51 0.00 0.00 179.97 178.93 1ba5 h SER 16 N -0.19 -1.14 0.55 -3.80 0.87 -1.37 -2.04 113.55 106.41 1ba5 h SER 16 Ca 0.02 0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 1ba5 h SER 16 Cb 0.21 0.36 -0.02 0.00 -0.44 0.00 0.00 62.40 62.51 1ba5 h SER 16 CO -0.07 -0.64 -0.45 1.23 -0.53 0.00 0.00 176.83 176.37 1ba5 h GLY 17 N -0.99 -1.14 0.43 5.77 0.00 -0.89 0.75 103.07 107.00 1ba5 h GLY 17 Ca -0.07 0.51 0.06 0.00 0.00 0.00 0.00 47.33 47.84 1ba5 h GLY 17 CO 0.02 -0.37 -0.02 -2.08 0.00 0.00 0.00 176.54 174.09 1ba5 h VAL 18 N -0.98 0.73 -0.19 4.60 2.07 -1.05 0.60 116.25 122.03 1ba5 h VAL 18 Ca -0.06 -0.02 -0.17 0.00 0.82 0.00 0.00 66.70 67.26 1ba5 h VAL 18 Cb 0.83 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1ba5 h VAL 18 CO -0.01 0.01 -0.58 -0.09 0.02 0.00 0.00 177.57 176.92 1ba5 h ARG 19 N 0.07 0.60 0.18 1.57 9.65 -1.31 0.44 114.38 125.57 1ba5 h ARG 19 Ca 0.16 -0.39 -0.01 0.00 -1.10 0.00 0.00 59.98 58.64 1ba5 h ARG 19 Cb 0.23 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 1ba5 h ARG 19 CO -0.29 1.01 -0.09 -0.22 2.80 0.00 0.00 179.97 183.18 1ba5 h LYS 20 N 0.45 -0.23 0.10 0.20 3.64 -0.41 -3.35 116.57 116.97 1ba5 h LYS 20 Ca 0.00 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1ba5 h LYS 20 Cb 1.14 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1ba5 h LYS 20 CO 0.11 0.15 -0.05 1.88 -2.27 0.00 0.00 179.45 179.27 1ba5 h TYR 21 N -0.69 -0.13 0.00 1.91 0.05 -0.98 -3.50 116.97 113.63 1ba5 h TYR 21 Ca -0.02 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1ba5 h TYR 21 Cb 0.49 0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.27 1ba5 h TYR 21 CO 0.06 0.39 0.00 0.41 -1.05 0.00 0.00 178.16 177.96 1ba5 n GLY 22 N 0.66 4.28 3.57 3.88 0.00 0.14 -4.99 105.19 112.73 1ba5 n GLY 22 Ca -0.08 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.66 2.80 0.00 1.61 2.12 -1.17 -2.36 118.70 119.04 1ba5 s GLU 23 Ca 0.00 -1.03 0.00 0.00 0.36 0.00 0.00 54.97 54.30 1ba5 s GLU 23 Cb 0.00 -5.24 0.00 0.00 0.26 0.00 0.00 34.13 29.15 1ba5 s GLU 23 CO 0.00 -3.44 0.00 0.41 -0.54 0.00 0.00 175.26 171.69 1ba5 n GLY 24 N 6.14 0.35 3.78 -1.50 0.00 -1.26 -5.14 105.19 107.55 1ba5 n GLY 24 Ca 0.43 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 46.07 1ba5 n GLY 24 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ba5 s ASN 25 N 0.00 6.91 0.33 1.61 -0.87 -1.00 -4.93 114.94 117.00 1ba5 s ASN 25 Ca 0.00 2.07 0.00 0.00 -1.57 0.00 0.00 52.86 53.36 1ba5 s ASN 25 Cb 0.00 -2.59 0.00 0.00 -0.02 0.00 0.00 41.25 38.64 1ba5 s ASN 25 CO 0.00 -0.38 0.00 0.79 -2.57 0.00 0.00 177.10 174.94 1ba5 n TRP 26 N 0.26 -2.98 -0.06 2.20 7.02 -1.26 -4.77 117.44 117.84 1ba5 n TRP 26 Ca 0.03 0.67 -0.10 0.00 -1.02 0.00 0.00 57.50 57.08 1ba5 n TRP 26 Cb 0.49 1.20 -0.03 0.00 -2.42 0.00 0.00 31.31 30.54 1ba5 n TRP 26 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1ba5 h SER 27 N 0.00 0.26 -0.69 -0.99 4.64 -1.92 -0.12 113.55 114.74 1ba5 h SER 27 Ca 0.00 -0.01 0.07 0.00 -0.47 0.00 0.00 61.79 61.38 1ba5 h SER 27 Cb 0.00 -0.07 -0.06 0.00 -0.31 0.00 0.00 62.40 61.96 1ba5 h SER 27 CO 0.00 0.20 0.37 0.50 -0.87 0.00 0.00 176.83 177.03 1ba5 h LYS 28 N 0.31 0.64 -0.60 4.77 3.64 -1.98 -1.04 116.57 122.31 1ba5 h LYS 28 Ca 0.08 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1ba5 h LYS 28 Cb -0.03 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 1ba5 h LYS 28 CO -0.02 0.43 0.25 0.82 -2.27 0.00 0.00 179.45 178.66 1ba5 h ILE 29 N 0.66 1.22 -0.47 2.00 2.04 -1.73 -1.95 117.51 119.28 1ba5 h ILE 29 Ca 0.32 -0.68 0.04 0.00 1.00 0.00 0.00 64.86 65.54 1ba5 h ILE 29 Cb 0.26 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 1ba5 h ILE 29 CO -0.22 0.27 0.31 0.25 0.00 0.00 0.00 178.15 178.76 1ba5 h LEU 30 N 0.83 0.41 -0.47 1.44 6.46 0.04 0.28 115.31 124.29 1ba5 h LEU 30 Ca 0.20 -0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.86 1ba5 h LEU 30 Cb 0.18 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 40.00 1ba5 h LEU 30 CO -0.02 0.28 -0.08 0.25 -0.62 0.00 0.00 178.44 178.24 1ba5 h LEU 31 N 0.47 0.89 0.00 2.25 5.85 -0.47 -3.38 115.31 120.93 1ba5 h LEU 31 Ca 0.20 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1ba5 h LEU 31 Cb 0.19 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1ba5 h LEU 31 CO -0.05 1.03 -0.01 0.45 -0.34 0.00 0.00 178.44 179.53 1ba5 h HIS 32 N 0.74 0.00 -3.72 1.25 3.86 -0.87 -3.46 115.15 112.95 1ba5 h HIS 32 Ca 0.12 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 58.84 1ba5 h HIS 32 Cb 0.63 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.07 1ba5 h HIS 32 CO 0.05 0.00 0.25 0.71 0.86 0.00 0.00 177.93 179.80 1ba5 s TYR 33 N -1.06 3.75 0.17 2.45 2.02 0.88 -5.04 117.35 120.53 1ba5 s TYR 33 Ca -0.00 1.66 -0.23 0.00 -0.37 0.00 0.00 57.07 58.13 1ba5 s TYR 33 Cb 0.00 -2.82 -0.08 0.00 -0.40 0.00 0.00 41.96 38.67 1ba5 s TYR 33 CO 0.00 0.33 0.74 0.21 -1.57 0.00 0.00 175.55 175.26 1ba5 s LYS 34 N -1.78 4.43 0.31 -0.62 2.47 -1.26 -4.23 119.74 119.06 1ba5 s LYS 34 Ca 0.45 1.03 0.03 0.00 -1.56 0.00 0.00 55.97 55.92 1ba5 s LYS 34 Cb -0.20 -3.14 -0.04 0.00 -1.46 0.00 0.00 37.83 32.99 1ba5 s LYS 34 CO 0.24 0.53 0.15 -0.06 0.16 0.00 0.00 175.35 176.36 1ba5 s PHE 35 N -1.26 1.63 -0.28 4.03 0.40 -1.26 -4.90 117.98 116.34 1ba5 s PHE 35 Ca 0.37 -1.32 -0.04 0.00 -0.60 0.00 0.00 56.93 55.34 1ba5 s PHE 35 Cb -0.21 -0.92 0.02 0.00 0.51 0.00 0.00 43.02 42.43 1ba5 s PHE 35 CO 0.24 -0.45 0.01 -0.80 0.70 0.00 0.00 175.22 174.91 1ba5 s ASN 36 N -3.40 4.75 -1.69 1.36 0.01 -1.26 -4.71 114.94 110.00 1ba5 s ASN 36 Ca 0.35 -0.87 -0.11 0.00 -0.71 0.00 0.00 52.86 51.51 1ba5 s ASN 36 Cb 0.05 -1.77 0.11 0.00 0.41 0.00 0.00 41.25 40.06 1ba5 s ASN 36 CO 0.17 -0.18 0.34 -0.46 -1.51 0.00 0.00 177.10 175.46 1ba5 n ASN 37 N 4.75 -0.64 -4.92 -1.22 6.94 -1.26 -4.94 115.26 113.97 1ba5 n ASN 37 Ca -0.15 -1.23 -0.26 0.00 -0.02 0.00 0.00 54.58 52.92 1ba5 n ASN 37 Cb 0.47 -1.80 0.03 0.00 -2.36 0.00 0.00 39.78 36.13 1ba5 n ASN 37 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1ba5 s ARG 38 N -7.24 2.84 0.00 -3.83 3.00 -1.26 -5.06 118.95 107.40 1ba5 s ARG 38 Ca 0.41 -0.07 0.00 0.00 0.00 0.00 0.00 55.73 56.06 1ba5 s ARG 38 Cb -0.24 -2.28 0.00 0.00 0.00 0.00 0.00 34.95 32.44 1ba5 s ARG 38 CO 1.00 -0.74 0.00 2.41 0.00 0.00 0.00 175.30 177.97 1ba5 n THR 39 N -2.59 0.00 0.12 0.02 -1.04 -1.26 -5.10 114.28 104.44 1ba5 n THR 39 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 1ba5 n THR 39 Cb 0.58 -0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.09 1ba5 n THR 39 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1ba5 n SER 40 N -0.32 -1.50 -0.33 8.00 7.64 -1.26 -4.71 113.62 121.15 1ba5 n SER 40 Ca 0.00 0.46 0.07 0.00 1.01 0.00 0.00 58.87 60.41 1ba5 n SER 40 Cb 0.00 1.56 0.26 0.00 -1.01 0.00 0.00 64.21 65.02 1ba5 n SER 40 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1ba5 h VAL 41 N 0.00 0.96 -0.97 0.44 2.07 -1.99 -0.33 116.25 116.43 1ba5 h VAL 41 Ca 0.00 -0.33 0.13 0.00 0.82 0.00 0.00 66.70 67.32 1ba5 h VAL 41 Cb 0.00 -0.08 -0.08 0.00 -1.52 0.00 0.00 31.29 29.60 1ba5 h VAL 41 CO 0.00 0.18 0.61 0.24 0.02 0.00 0.00 177.57 178.62 1ba5 h MET 42 N 0.96 0.87 0.17 1.57 2.07 -1.99 -0.30 114.93 118.29 1ba5 h MET 42 Ca 0.45 -0.05 -0.26 0.00 -2.07 0.00 0.00 59.70 57.77 1ba5 h MET 42 Cb 0.42 -0.20 0.03 0.00 -1.87 0.00 0.00 31.60 29.98 1ba5 h MET 42 CO -0.21 0.58 -1.12 -0.07 1.07 0.00 0.00 176.91 177.16 1ba5 h LEU 43 N 0.90 0.69 0.55 1.22 4.07 -1.46 -3.01 115.31 118.28 1ba5 h LEU 43 Ca 0.49 -0.90 -0.02 0.00 0.08 0.00 0.00 57.88 57.53 1ba5 h LEU 43 Cb 0.57 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.08 1ba5 h LEU 43 CO -0.25 1.54 -0.38 0.11 -1.08 0.00 0.00 178.44 178.37 1ba5 h LYS 44 N -0.04 -0.87 -0.61 1.13 1.57 -0.57 -0.56 116.57 116.62 1ba5 h LYS 44 Ca -0.19 0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1ba5 h LYS 44 Cb 1.86 0.20 -0.05 0.00 0.08 0.00 0.00 32.23 34.32 1ba5 h LYS 44 CO 0.21 -0.58 0.33 -0.44 -0.57 0.00 0.00 179.45 178.41 1ba5 h ASP 45 N -0.90 0.50 0.72 0.86 3.32 -1.22 0.42 116.42 120.12 1ba5 h ASP 45 Ca -0.06 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 1ba5 h ASP 45 Cb 0.75 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.22 1ba5 h ASP 45 CO 0.04 0.33 -0.42 0.03 -1.72 0.00 0.00 179.24 177.50 1ba5 h ARG 46 N 0.63 -1.02 -0.37 3.56 2.47 -1.37 -1.98 114.38 116.30 1ba5 h ARG 46 Ca 0.27 0.07 0.01 0.00 -1.26 0.00 0.00 59.98 59.07 1ba5 h ARG 46 Cb 0.15 0.23 -0.02 0.00 -1.65 0.00 0.00 29.97 28.68 1ba5 h ARG 46 CO -0.16 -0.68 0.22 2.35 0.56 0.00 0.00 179.97 182.25 1ba5 h TRP 47 N -1.06 0.41 -0.79 3.04 -0.00 -0.92 0.20 115.95 116.83 1ba5 h TRP 47 Ca -0.09 0.01 0.17 0.00 -0.00 0.00 0.00 58.89 58.98 1ba5 h TRP 47 Cb 0.85 -0.13 -0.11 0.00 -0.00 0.00 0.00 29.16 29.77 1ba5 h TRP 47 CO -0.08 0.24 0.28 -0.09 -0.00 0.00 0.00 178.44 178.79 1ba5 h ARG 48 N 0.45 0.37 0.00 2.65 9.65 -0.81 -0.48 114.38 126.21 1ba5 h ARG 48 Ca 0.15 -0.02 -0.05 0.00 -1.10 0.00 0.00 59.98 58.95 1ba5 h ARG 48 Cb -0.00 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.49 1ba5 h ARG 48 CO -0.07 0.24 -0.37 1.15 2.80 0.00 0.00 179.97 183.73 1ba5 h THR 49 N 0.38 0.92 -0.99 0.20 2.02 -0.95 -3.39 112.91 111.10 1ba5 h THR 49 Ca 0.45 -1.81 0.10 0.00 0.77 0.00 0.00 66.41 65.92 1ba5 h THR 49 Cb 0.76 1.85 -0.08 0.00 -1.74 0.00 0.00 68.15 68.95 1ba5 h THR 49 CO -0.47 0.31 0.63 -0.03 0.37 0.00 0.00 175.52 176.33 1ba5 h MET 50 N -1.00 1.02 0.00 6.66 1.85 -0.51 -1.62 114.93 121.33 1ba5 h MET 50 Ca -0.08 -0.06 0.00 0.00 -0.61 0.00 0.00 59.70 58.95 1ba5 h MET 50 Cb 0.77 -0.23 0.00 0.00 0.43 0.00 0.00 31.60 32.57 1ba5 h MET 50 CO -0.05 0.68 0.00 0.36 -0.40 0.00 0.00 176.91 177.50 1ba5 n LYS 51 N -4.56 0.55 -0.03 0.39 2.85 -0.20 -3.20 118.16 113.96 1ba5 n LYS 51 Ca 0.17 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 57.31 1ba5 n LYS 51 Cb 0.29 -1.50 -0.11 0.00 -0.65 0.00 0.00 35.03 33.06 1ba5 n LYS 51 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 1ba5 h LYS 52 N 0.00 -0.03 0.00 -1.58 1.63 -1.48 -3.51 116.57 111.60 1ba5 h LYS 52 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1ba5 h LYS 52 Cb 0.01 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.64 1ba5 h LYS 52 CO 0.00 0.65 0.00 1.28 -3.45 0.00 0.00 179.45 177.93