#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bzb s GLU 2 N 0.00 3.90 0.38 2.12 -6.30 -1.26 -4.97 118.70 112.57 2bzb s GLU 2 Ca 0.00 -0.24 0.12 0.00 -2.50 0.00 0.00 54.97 52.35 2bzb s GLU 2 Cb 0.00 -3.68 0.77 0.00 0.00 0.00 0.00 34.13 31.21 2bzb s GLU 2 CO 0.00 -0.27 1.87 0.00 0.02 0.00 0.00 175.26 176.88 2bzb h MET 3 N 8.32 0.08 -0.34 4.30 -0.00 -2.05 -2.63 114.93 122.61 2bzb h MET 3 Ca -0.33 -0.03 -0.11 0.00 -0.00 0.00 0.00 59.70 59.24 2bzb h MET 3 Cb 1.17 -0.01 -0.01 0.00 -0.00 0.00 0.00 31.60 32.76 2bzb h MET 3 CO 0.60 0.36 -0.20 0.78 -0.00 0.00 0.00 176.91 178.45 2bzb h GLY 4 N 0.91 0.80 2.00 -3.00 0.00 -1.99 -0.90 103.07 100.90 2bzb h GLY 4 Ca 0.01 -0.75 -0.09 0.00 0.00 0.00 0.00 47.33 46.50 2bzb h GLY 4 CO 0.04 0.68 -0.43 1.46 0.00 0.00 0.00 176.54 178.29 2bzb h GLN 5 N 0.52 0.00 -0.23 4.80 4.20 -1.96 0.20 115.11 122.63 2bzb h GLN 5 Ca 0.07 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2bzb h GLN 5 Cb 0.75 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 2bzb h GLN 5 CO 0.06 0.43 0.11 1.25 -0.67 0.00 0.00 178.83 180.00 2bzb h LEU 6 N 0.00 0.31 -0.68 1.46 7.12 -1.09 0.13 115.31 122.55 2bzb h LEU 6 Ca -0.00 -0.14 -0.08 0.00 0.13 0.00 0.00 57.88 57.79 2bzb h LEU 6 Cb 0.79 -0.08 -0.03 0.00 -0.53 0.00 0.00 40.66 40.81 2bzb h LEU 6 CO 0.06 0.36 0.13 0.50 -0.13 0.00 0.00 178.44 179.36 2bzb h LYS 7 N 0.24 1.12 -0.94 1.25 3.11 -0.75 -1.24 116.57 119.36 2bzb h LYS 7 Ca 0.08 -0.29 0.00 0.00 -2.81 0.00 0.00 60.65 57.63 2bzb h LYS 7 Cb 0.14 -0.14 -0.05 0.00 -1.00 0.00 0.00 32.23 31.18 2bzb h LYS 7 CO -0.01 1.01 0.60 -0.97 -2.81 0.00 0.00 179.45 177.27 2bzb h ASN 8 N 1.05 1.10 -0.46 4.20 -1.24 -0.23 0.16 115.58 120.16 2bzb h ASN 8 Ca 0.21 -0.05 -0.13 0.00 0.71 0.00 0.00 56.30 57.05 2bzb h ASN 8 Cb 0.42 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.18 2bzb h ASN 8 CO 0.01 0.82 -0.20 0.11 -1.29 0.00 0.00 177.43 176.87 2bzb h LYS 9 N 1.28 0.97 -0.56 6.67 1.57 -0.44 0.30 116.57 126.36 2bzb h LYS 9 Ca 0.34 -0.40 0.05 0.00 -1.87 0.00 0.00 60.65 58.77 2bzb h LYS 9 Cb -0.11 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.11 2bzb h LYS 9 CO -0.07 1.07 0.28 0.82 -0.57 0.00 0.00 179.45 180.99 2bzb h ILE 10 N 0.84 0.93 0.08 1.86 2.04 -0.31 0.36 117.51 123.32 2bzb h ILE 10 Ca 0.11 -0.18 0.01 0.00 1.00 0.00 0.00 64.86 65.80 2bzb h ILE 10 Cb 0.77 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 2bzb h ILE 10 CO 0.06 0.10 -0.14 -0.33 0.00 0.00 0.00 178.15 177.84 2bzb h GLU 11 N 0.53 -0.27 -0.49 2.37 4.39 -0.37 0.18 114.58 120.92 2bzb h GLU 11 Ca 0.25 0.02 0.03 0.00 0.34 0.00 0.00 59.36 60.00 2bzb h GLU 11 Cb 0.18 0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.85 2bzb h GLU 11 CO -0.18 -0.18 0.27 -0.97 -1.16 0.00 0.00 179.01 176.78 2bzb h ASN 12 N -0.28 0.41 -0.34 1.42 -1.24 -0.51 -0.51 115.58 114.53 2bzb h ASN 12 Ca 0.02 0.02 -0.08 0.00 0.71 0.00 0.00 56.30 56.96 2bzb h ASN 12 Cb 0.30 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.27 2bzb h ASN 12 CO -0.08 0.29 -0.12 0.50 -1.29 0.00 0.00 177.43 176.73 2bzb h LYS 13 N 0.53 0.68 -0.25 6.67 1.63 -0.01 0.68 116.57 126.50 2bzb h LYS 13 Ca 0.20 -0.28 0.05 0.00 -0.85 0.00 0.00 60.65 59.78 2bzb h LYS 13 Cb 0.07 -0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 31.62 2bzb h LYS 13 CO -0.12 0.87 -0.06 -0.22 -3.45 0.00 0.00 179.45 176.47 2bzb h LYS 14 N 0.46 0.00 -0.71 1.90 3.64 -0.39 -0.53 116.57 120.94 2bzb h LYS 14 Ca 0.08 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 2bzb h LYS 14 Cb 0.64 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.43 2bzb h LYS 14 CO 0.04 0.00 0.18 0.87 -2.27 0.00 0.00 179.45 178.28 2bzb h LYS 15 N 0.00 1.14 -0.62 1.90 1.57 -0.85 0.46 116.57 120.16 2bzb h LYS 15 Ca 0.12 -0.27 0.07 0.00 -1.87 0.00 0.00 60.65 58.70 2bzb h LYS 15 Cb 0.18 -0.15 -0.06 0.00 0.08 0.00 0.00 32.23 32.28 2bzb h LYS 15 CO -0.25 0.99 0.30 0.93 -0.57 0.00 0.00 179.45 180.85 2bzb h GLU 16 N 1.08 0.53 -0.37 3.15 5.08 -0.38 -2.04 114.58 121.63 2bzb h GLU 16 Ca 0.23 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 2bzb h GLU 16 Cb 0.36 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2bzb h GLU 16 CO 0.00 0.35 -0.12 1.25 -1.00 0.00 0.00 179.01 179.49 2bzb h LEU 17 N 0.55 0.74 -1.08 1.33 7.12 -0.45 -2.51 115.31 121.01 2bzb h LEU 17 Ca 0.29 -0.38 0.05 0.00 0.13 0.00 0.00 57.88 57.98 2bzb h LEU 17 Cb 0.26 -0.20 -0.06 0.00 -0.53 0.00 0.00 40.66 40.13 2bzb h LEU 17 CO -0.23 0.95 0.62 0.40 -0.13 0.00 0.00 178.44 180.06 2bzb h ILE 18 N 0.53 1.11 -0.76 4.05 2.04 -0.53 0.29 117.51 124.23 2bzb h ILE 18 Ca 0.09 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 2bzb h ILE 18 Cb 0.64 -0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 2bzb h ILE 18 CO 0.04 0.21 0.39 1.56 0.00 0.00 0.00 178.15 180.35 2bzb h GLN 19 N 1.14 1.09 -0.00 2.37 4.20 -1.16 0.27 115.11 123.02 2bzb h GLN 19 Ca 0.40 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 2bzb h GLN 19 Cb 0.12 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.70 2bzb h GLN 19 CO -0.14 0.83 0.00 -0.07 -0.67 0.00 0.00 178.83 178.78 2bzb h LEU 20 N 1.07 0.01 -1.17 1.46 -0.00 -0.57 -1.02 115.31 115.09 2bzb h LEU 20 Ca 0.26 -0.13 -0.08 0.00 -0.00 0.00 0.00 57.88 57.93 2bzb h LEU 20 Cb 0.09 -0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.73 2bzb h LEU 20 CO -0.04 0.14 -0.28 -0.37 -0.00 0.00 0.00 178.44 177.89 2bzb h VAL 21 N -0.13 1.25 -0.38 1.22 -1.51 -0.92 -2.79 116.25 112.99 2bzb h VAL 21 Ca 0.00 -1.17 -0.10 0.00 -1.23 0.00 0.00 66.70 64.20 2bzb h VAL 21 Cb 0.13 1.46 -0.02 0.00 -2.13 0.00 0.00 31.29 30.74 2bzb h VAL 21 CO -0.00 0.35 -0.18 0.00 -1.23 0.00 0.00 177.57 176.51 2bzb h ALA 22 N 1.51 0.96 0.00 5.19 0.00 -0.20 -2.05 119.26 124.66 2bzb h ALA 22 Ca 0.03 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2bzb h ALA 22 Cb 0.60 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2bzb h ALA 22 CO 0.04 0.61 0.00 0.07 0.00 0.00 0.00 179.25 179.97 2bzb h ARG 23 N 0.65 0.00 -0.44 0.00 0.11 -1.08 -3.15 114.38 110.47 2bzb h ARG 23 Ca 0.10 0.00 0.05 0.00 0.10 0.00 0.00 59.98 60.23 2bzb h ARG 23 Cb 0.66 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.70 2bzb h ARG 23 CO 0.05 0.00 0.19 1.25 0.10 0.00 0.00 179.97 181.55 2bzb h HIS 24 N 0.00 0.34 0.00 4.08 2.76 -1.09 -3.45 115.15 117.78 2bzb h HIS 24 Ca 0.00 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 2bzb h HIS 24 Cb 0.74 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.61 2bzb h HIS 24 CO 0.00 0.15 0.00 0.41 -1.30 0.00 0.00 177.93 177.19 2bzb n GLY 25 N -1.24 -0.22 3.71 5.26 0.00 -1.19 -5.13 105.19 106.37 2bzb n GLY 25 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2bzb n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bzb n LEU 26 N 0.00 3.66 -4.75 0.99 4.32 -1.22 -5.00 117.00 115.00 2bzb n LEU 26 Ca 0.00 1.21 -0.29 0.00 -0.02 0.00 0.00 56.01 56.91 2bzb n LEU 26 Cb 0.00 -1.50 0.16 0.00 -1.62 0.00 0.00 43.42 40.46 2bzb n LEU 26 CO 0.00 -0.42 0.70 -1.81 -1.22 0.00 0.00 177.39 174.64 2bzb s ASP 27 N -0.28 3.04 0.14 -1.43 1.11 -1.26 -4.81 116.67 113.18 2bzb s ASP 27 Ca 0.55 0.94 -0.18 0.00 0.18 0.00 0.00 52.55 54.04 2bzb s ASP 27 Cb -0.56 -1.47 -0.03 0.00 1.07 0.00 0.00 42.92 41.93 2bzb s ASP 27 CO 0.62 -2.84 1.79 0.45 1.18 0.00 0.00 175.17 176.37 2bzb h HIS 28 N -1.70 0.37 -0.33 4.23 3.86 -1.98 -1.66 115.15 117.94 2bzb h HIS 28 Ca -0.51 0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 58.66 2bzb h HIS 28 Cb 1.32 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 29.65 2bzb h HIS 28 CO -0.01 0.24 -0.02 0.38 0.86 0.00 0.00 177.93 179.38 2bzb h ASP 29 N 0.40 0.49 -0.45 2.45 2.03 -2.00 -2.79 116.42 116.55 2bzb h ASP 29 Ca 0.11 -0.10 -0.04 0.00 -0.73 0.00 0.00 57.03 56.27 2bzb h ASP 29 Cb -0.04 -0.13 -0.02 0.00 -0.83 0.00 0.00 39.33 38.32 2bzb h ASP 29 CO -0.02 0.57 0.14 0.11 -1.03 0.00 0.00 179.24 179.00 2bzb h LYS 30 N 0.49 0.70 -0.90 4.15 1.79 -1.69 0.42 116.57 121.53 2bzb h LYS 30 Ca 0.10 -0.15 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 2bzb h LYS 30 Cb 0.35 -0.10 -0.04 0.00 -1.58 0.00 0.00 32.23 30.86 2bzb h LYS 30 CO 0.01 0.68 0.52 0.28 -1.08 0.00 0.00 179.45 179.86 2bzb h VAL 31 N 0.58 1.25 0.32 0.50 2.07 -1.09 0.22 116.25 120.10 2bzb h VAL 31 Ca 0.14 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 2bzb h VAL 31 Cb 0.27 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 2bzb h VAL 31 CO -0.00 0.27 -0.15 -0.07 0.02 0.00 0.00 177.57 177.64 2bzb h LEU 32 N 1.25 -0.36 -0.93 2.57 3.38 -1.25 -0.68 115.31 119.28 2bzb h LEU 32 Ca 0.32 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 2bzb h LEU 32 Cb -0.02 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2bzb h LEU 32 CO -0.06 -0.04 0.56 -0.07 0.09 0.00 0.00 178.44 178.93 2bzb h LEU 33 N -0.71 1.11 0.04 1.67 3.38 -0.71 -0.84 115.31 119.25 2bzb h LEU 33 Ca -0.04 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 2bzb h LEU 33 Cb 0.49 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2bzb h LEU 33 CO 0.07 0.85 -0.02 0.15 0.09 0.00 0.00 178.44 179.59 2bzb h PHE 34 N 1.28 -0.05 -0.74 1.13 3.57 -0.54 -0.40 116.94 121.20 2bzb h PHE 34 Ca 0.33 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.85 2bzb h PHE 34 Cb -0.06 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.66 2bzb h PHE 34 CO 0.00 0.11 0.49 0.66 -2.23 0.00 0.00 178.31 177.34 2bzb h SER 35 N -0.19 0.83 0.02 0.41 4.64 -0.49 0.22 113.55 118.98 2bzb h SER 35 Ca -0.01 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2bzb h SER 35 Cb 0.18 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2bzb h SER 35 CO 0.01 0.59 -0.01 0.03 -0.87 0.00 0.00 176.83 176.58 2bzb h ARG 36 N 0.98 -0.03 -0.35 4.77 3.08 -0.97 -1.24 114.38 120.61 2bzb h ARG 36 Ca 0.28 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.21 2bzb h ARG 36 Cb -0.07 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 2bzb h ARG 36 CO -0.07 0.32 -0.25 0.22 -1.07 0.00 0.00 179.97 179.12 2bzb h ASP 37 N -0.38 0.84 -0.19 7.04 1.82 -0.72 -1.46 116.42 123.36 2bzb h ASP 37 Ca -0.00 -0.44 0.02 0.00 -0.39 0.00 0.00 57.03 56.22 2bzb h ASP 37 Cb 0.36 -0.23 -0.02 0.00 0.68 0.00 0.00 39.33 40.12 2bzb h ASP 37 CO 0.01 1.09 0.06 0.25 -1.61 0.00 0.00 179.24 179.04 2bzb h LEU 38 N 0.58 0.07 -0.60 2.28 5.85 -0.61 0.20 115.31 123.08 2bzb h LEU 38 Ca 0.07 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2bzb h LEU 38 Cb 0.82 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 2bzb h LEU 38 CO 0.07 0.07 0.33 -0.78 -0.34 0.00 0.00 178.44 177.79 2bzb h ASP 39 N 0.15 0.75 -0.82 1.25 3.58 -1.09 -0.18 116.42 120.06 2bzb h ASP 39 Ca 0.08 -0.09 -0.04 0.00 0.42 0.00 0.00 57.03 57.40 2bzb h ASP 39 Cb 0.05 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 40.88 2bzb h ASP 39 CO -0.09 0.62 0.35 0.50 -2.88 0.00 0.00 179.24 177.74 2bzb h LYS 40 N 0.81 1.21 -0.66 0.28 3.64 -0.91 0.17 116.57 121.12 2bzb h LYS 40 Ca 0.21 -0.21 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 2bzb h LYS 40 Cb 0.04 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.63 2bzb h LYS 40 CO -0.03 0.96 0.14 1.25 -2.27 0.00 0.00 179.45 179.50 2bzb h LEU 41 N 1.19 1.02 0.29 5.20 5.85 -0.00 -0.13 115.31 128.72 2bzb h LEU 41 Ca 0.28 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2bzb h LEU 41 Cb 0.19 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2bzb h LEU 41 CO -0.03 1.00 -0.14 0.40 -0.34 0.00 0.00 178.44 179.33 2bzb h ILE 42 N 0.99 0.73 -0.75 4.05 2.04 -0.44 -2.75 117.51 121.39 2bzb h ILE 42 Ca 0.20 -0.51 0.13 0.00 1.00 0.00 0.00 64.86 65.69 2bzb h ILE 42 Cb 0.39 1.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 2bzb h ILE 42 CO 0.01 0.10 0.49 0.78 0.00 0.00 0.00 178.15 179.53 2bzb h ASN 43 N -0.67 0.47 -0.05 1.72 2.35 -0.58 0.29 115.58 119.10 2bzb h ASN 43 Ca -0.04 0.02 0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2bzb h ASN 43 Cb 0.47 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 2bzb h ASN 43 CO 0.07 0.26 0.01 0.50 -1.65 0.00 0.00 177.43 176.61 2bzb h LYS 44 N 0.51 0.03 0.04 0.81 3.64 -0.86 0.22 116.57 120.96 2bzb h LYS 44 Ca 0.36 -0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.52 2bzb h LYS 44 Cb 0.70 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 2bzb h LYS 44 CO -0.12 0.02 -1.00 0.74 -2.27 0.00 0.00 179.45 176.82 2bzb h PHE 45 N 0.04 0.33 0.00 1.91 -1.00 -0.92 -3.12 116.94 114.18 2bzb h PHE 45 Ca 0.02 -0.21 -0.07 0.00 2.81 0.00 0.00 57.97 60.53 2bzb h PHE 45 Cb 0.02 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.54 2bzb h PHE 45 CO -0.10 1.07 -0.32 0.52 -1.61 0.00 0.00 178.31 177.88 2bzb h MET 46 N 0.09 0.00 -0.22 1.51 2.86 -0.36 -3.46 114.93 115.35 2bzb h MET 46 Ca -0.07 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.48 2bzb h MET 46 Cb 1.67 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 33.29 2bzb h MET 46 CO 0.15 0.32 -0.09 -1.71 1.06 0.00 0.00 176.91 176.65 2bzb n ASN 47 N -3.37 -4.41 -4.62 1.22 5.15 0.77 -4.95 115.26 105.05 2bzb n ASN 47 Ca 0.01 0.12 -0.43 0.00 -0.60 0.00 0.00 54.58 53.68 2bzb n ASN 47 Cb 0.53 -2.33 -0.03 0.00 -0.53 0.00 0.00 39.78 37.42 2bzb n ASN 47 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2bzb s VAL 48 N -1.89 4.55 -0.02 3.44 -7.23 -1.14 -4.78 120.40 113.33 2bzb s VAL 48 Ca 0.00 1.42 0.02 0.00 -1.81 0.00 0.00 61.98 61.61 2bzb s VAL 48 Cb 0.00 -4.36 0.04 0.00 0.56 0.00 0.00 36.38 32.61 2bzb s VAL 48 CO 0.00 -0.51 0.81 0.29 -0.31 0.00 0.00 175.10 175.38 2bzb n LYS 49 N 6.82 0.70 -4.36 4.82 5.02 -1.26 -4.84 118.16 125.06 2bzb n LYS 49 Ca 0.09 -1.08 -0.23 0.00 -2.02 0.00 0.00 58.31 55.07 2bzb n LYS 49 Cb 0.48 -0.71 -0.11 0.00 -0.02 0.00 0.00 35.03 34.66 2bzb n LYS 49 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 2bzb s ASP 50 N -0.82 2.89 -0.31 4.39 -4.77 -1.26 -5.06 116.67 111.73 2bzb s ASP 50 Ca 0.04 -0.86 0.13 0.00 -3.30 0.00 0.00 52.55 48.56 2bzb s ASP 50 Cb 0.03 -0.18 0.47 0.00 -1.09 0.00 0.00 42.92 42.15 2bzb s ASP 50 CO 0.00 0.01 1.11 2.29 0.70 0.00 0.00 175.17 179.28 2bzb n LYS 51 N 0.30 2.59 -0.01 2.11 2.85 -1.26 -4.88 118.16 119.86 2bzb n LYS 51 Ca -0.13 -3.88 -0.00 0.00 -1.05 0.00 0.00 58.31 53.25 2bzb n LYS 51 Cb 0.57 -1.90 0.00 0.00 -0.65 0.00 0.00 35.03 33.05 2bzb n LYS 51 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 2bzb n VAL 52 N -0.52 0.53 -0.14 0.58 0.24 -1.26 -3.82 118.33 113.94 2bzb n VAL 52 Ca 0.26 -0.02 -0.10 0.00 -2.04 0.00 0.00 64.34 62.44 2bzb n VAL 52 Cb 0.83 -0.75 -0.01 0.00 -1.47 0.00 0.00 33.84 32.44 2bzb n VAL 52 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 2bzb h HIS 53 N 0.03 0.76 -3.30 6.34 6.17 -2.00 -3.38 115.15 119.77 2bzb h HIS 53 Ca 0.00 -0.13 -0.51 0.00 0.71 0.00 0.00 60.37 60.44 2bzb h HIS 53 Cb 0.77 -0.20 -0.39 0.00 2.52 0.00 0.00 27.41 30.11 2bzb h HIS 53 CO 0.01 0.77 -0.77 0.21 0.71 0.00 0.00 177.93 178.86 2bzb s LYS 54 N -5.05 0.86 -0.93 5.26 2.47 -1.25 -5.08 119.74 116.02 2bzb s LYS 54 Ca -0.13 -0.36 -0.22 0.00 -1.56 0.00 0.00 55.97 53.70 2bzb s LYS 54 Cb 0.10 -1.88 0.07 0.00 -1.46 0.00 0.00 37.83 34.66 2bzb s LYS 54 CO 0.79 -0.52 1.31 -0.51 0.16 0.00 0.00 175.35 176.57 2bzb s LEU 55 N 1.81 3.93 0.01 5.43 1.02 -1.26 -4.65 118.68 124.97 2bzb s LEU 55 Ca 0.00 -1.45 -0.19 0.00 0.02 0.00 0.00 54.13 52.52 2bzb s LEU 55 Cb -0.16 -2.51 -0.28 0.00 0.02 0.00 0.00 46.19 43.26 2bzb s LEU 55 CO -0.07 -1.43 1.04 -0.08 0.02 0.00 0.00 176.35 175.83 2bzb h GLU 56 N 9.56 0.46 -4.85 1.70 4.22 -1.97 -3.38 114.58 120.31 2bzb h GLU 56 Ca 0.09 -0.61 -0.69 0.00 0.08 0.00 0.00 59.36 58.23 2bzb h GLU 56 Cb 1.02 0.20 -0.19 0.00 0.50 0.00 0.00 28.75 30.28 2bzb h GLU 56 CO 1.31 1.25 -0.00 -1.01 -2.18 0.00 0.00 179.01 178.37 2bzb s HIS 57 N -2.91 3.07 -0.19 0.92 3.76 -1.26 -4.89 115.29 113.79 2bzb s HIS 57 Ca -0.12 -0.62 -0.04 0.00 -0.15 0.00 0.00 55.06 54.13 2bzb s HIS 57 Cb 0.03 -3.52 -0.22 0.00 1.11 0.00 0.00 32.58 29.99 2bzb s HIS 57 CO 0.87 -1.02 0.09 1.58 -0.85 0.00 0.00 174.74 175.41 2bzb n HIS 58 N 6.04 0.70 -0.02 1.40 -0.00 -1.26 -4.62 115.22 117.47 2bzb n HIS 58 Ca -0.08 0.16 -0.01 0.00 0.46 0.00 0.00 57.72 58.25 2bzb n HIS 58 Cb 0.45 -1.09 -0.00 0.00 -0.12 0.00 0.00 29.99 29.23 2bzb n HIS 58 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 2bzb h HIS 59 N -0.04 -0.04 -4.20 1.57 6.17 -1.96 -3.48 115.15 113.17 2bzb h HIS 59 Ca -0.49 -0.00 -0.13 0.00 0.71 0.00 0.00 60.37 60.46 2bzb h HIS 59 Cb 1.94 0.01 -0.15 0.00 2.52 0.00 0.00 27.41 31.73 2bzb h HIS 59 CO 0.05 -0.03 -0.61 -1.01 0.71 0.00 0.00 177.93 177.05 2bzb s HIS 60 N -1.55 0.53 0.33 5.26 3.76 -1.26 -5.14 115.29 117.22 2bzb s HIS 60 Ca -0.01 -1.02 -0.26 0.00 -0.15 0.00 0.00 55.06 53.62 2bzb s HIS 60 Cb 0.00 -0.34 -0.10 0.00 1.11 0.00 0.00 32.58 33.25 2bzb s HIS 60 CO 0.02 -0.45 0.98 -1.01 -0.85 0.00 0.00 174.74 173.43 2bzb s HIS 61 N -3.94 3.61 0.00 1.40 0.09 -1.26 -4.74 115.29 110.44 2bzb s HIS 61 Ca 0.11 1.75 0.00 0.00 -0.00 0.00 0.00 55.06 56.92 2bzb s HIS 61 Cb 0.07 -3.00 0.00 0.00 -0.00 0.00 0.00 32.58 29.65 2bzb s HIS 61 CO -0.07 -0.02 0.42 1.58 -0.00 0.00 0.00 174.74 176.65