#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zgg h LEU 24 N 0.00 0.46 0.55 -2.12 3.38 -1.99 -1.71 115.31 113.89 2zgg h LEU 24 Ca 0.00 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2zgg h LEU 24 Cb 0.00 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2zgg h LEU 24 CO 0.00 0.24 -0.31 1.23 0.09 0.00 0.00 178.44 179.69 2zgg h GLY 25 N 0.49 -0.86 0.96 0.83 0.00 -1.96 0.21 103.07 102.75 2zgg h GLY 25 Ca 0.38 0.35 0.04 0.00 0.00 0.00 0.00 47.33 48.09 2zgg h GLY 25 CO -0.13 -0.31 0.60 0.50 0.00 0.00 0.00 176.54 177.20 2zgg h LYS 26 N -0.81 1.11 -0.31 4.80 1.57 -1.80 -0.71 116.57 120.41 2zgg h LYS 26 Ca -0.07 -0.07 -0.13 0.00 -1.87 0.00 0.00 60.65 58.52 2zgg h LYS 26 Cb 0.65 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 2zgg h LYS 26 CO 0.08 0.74 -0.32 0.87 -0.57 0.00 0.00 179.45 180.25 2zgg h LYS 27 N 1.15 0.68 -0.43 3.15 1.57 -1.10 -1.74 116.57 119.84 2zgg h LYS 27 Ca 0.37 -0.31 -0.12 0.00 -1.87 0.00 0.00 60.65 58.72 2zgg h LYS 27 Cb 0.03 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2zgg h LYS 27 CO -0.11 0.90 -0.20 1.25 -0.57 0.00 0.00 179.45 180.72 2zgg h LEU 28 N 0.57 0.87 -0.67 2.94 5.85 -0.15 0.60 115.31 125.32 2zgg h LEU 28 Ca 0.07 -0.31 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 2zgg h LEU 28 Cb 0.82 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 2zgg h LEU 28 CO 0.07 1.04 0.21 -0.07 -0.34 0.00 0.00 178.44 179.36 2zgg h LEU 29 N 0.74 0.98 -0.32 2.25 3.38 -1.01 -0.84 115.31 120.49 2zgg h LEU 29 Ca 0.10 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 2zgg h LEU 29 Cb 0.73 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2zgg h LEU 29 CO 0.06 0.92 -0.14 -0.08 0.09 0.00 0.00 178.44 179.29 2zgg h GLU 30 N 0.98 0.66 -0.92 1.13 4.22 -1.08 -1.19 114.58 118.36 2zgg h GLU 30 Ca 0.22 -0.28 -0.01 0.00 0.08 0.00 0.00 59.36 59.36 2zgg h GLU 30 Cb 0.29 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 2zgg h GLU 30 CO -0.01 0.87 0.54 0.00 -2.18 0.00 0.00 179.01 178.23 2zgg h ALA 31 N 0.77 1.21 -0.17 2.92 0.00 -0.67 0.12 119.26 123.43 2zgg h ALA 31 Ca 0.07 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2zgg h ALA 31 Cb 0.67 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2zgg h ALA 31 CO 0.04 0.66 -0.09 0.00 0.00 0.00 0.00 179.25 179.87 2zgg h ALA 32 N 1.31 0.24 -0.74 0.00 0.00 -1.11 -0.60 119.26 118.35 2zgg h ALA 32 Ca 0.33 -0.28 0.08 0.00 0.00 0.00 0.00 54.91 55.04 2zgg h ALA 32 Cb -0.02 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 2zgg h ALA 32 CO -0.06 0.06 0.41 -0.09 0.00 0.00 0.00 179.25 179.58 2zgg h ARG 33 N 0.04 0.70 0.00 0.00 2.43 -0.84 -1.81 114.38 114.91 2zgg h ARG 33 Ca 0.04 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2zgg h ARG 33 Cb 0.57 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2zgg h ARG 33 CO 0.03 0.47 0.00 0.00 -1.51 0.00 0.00 179.97 178.95 2zgg n ALA 34 N -2.37 2.26 -1.84 2.80 0.00 -0.00 -4.78 120.51 116.58 2zgg n ALA 34 Ca 0.11 -0.08 -0.07 0.00 0.00 0.00 0.00 53.44 53.39 2zgg n ALA 34 Cb 0.23 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.21 2zgg n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zgg n GLY 35 N 1.34 0.35 3.42 0.00 0.00 -0.47 -4.96 105.19 104.87 2zgg n GLY 35 Ca 0.06 -0.62 -0.44 0.00 0.00 0.00 0.00 46.02 45.02 2zgg n GLY 35 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2zgg s GLN 36 N -3.81 3.99 0.53 1.61 -0.21 -0.36 -4.85 119.66 116.57 2zgg s GLN 36 Ca 0.00 -2.58 0.19 0.00 0.02 0.00 0.00 55.36 52.99 2zgg s GLN 36 Cb 0.00 -4.86 1.38 0.00 1.00 0.00 0.00 33.01 30.53 2zgg s GLN 36 CO 0.00 -1.60 2.17 0.38 -2.12 0.00 0.00 175.29 174.12 2zgg h ASP 37 N 7.39 0.00 -0.62 5.90 2.03 -1.93 -0.98 116.42 128.21 2zgg h ASP 37 Ca 0.24 0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 56.48 2zgg h ASP 37 Cb 0.91 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.39 2zgg h ASP 37 CO 1.12 0.00 0.19 -2.24 -1.03 0.00 0.00 179.24 177.28 2zgg h ASP 38 N 0.00 0.93 0.26 4.15 2.03 -1.97 -0.33 116.42 121.49 2zgg h ASP 38 Ca 0.00 -0.17 -0.22 0.00 -0.73 0.00 0.00 57.03 55.91 2zgg h ASP 38 Cb 0.00 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 38.26 2zgg h ASP 38 CO -0.00 0.88 -0.89 -0.33 -1.03 0.00 0.00 179.24 177.86 2zgg h GLU 39 N 0.96 0.46 -0.56 4.15 5.08 -1.61 -3.05 114.58 120.00 2zgg h GLU 39 Ca 0.21 -0.46 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 2zgg h GLU 39 Cb 0.29 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 2zgg h GLU 39 CO -0.01 1.10 0.26 0.28 -1.00 0.00 0.00 179.01 179.65 2zgg h VAL 40 N 0.27 1.21 -0.32 3.13 2.07 -0.79 -0.55 116.25 121.27 2zgg h VAL 40 Ca -0.07 -0.60 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 2zgg h VAL 40 Cb 1.52 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 2zgg h VAL 40 CO 0.16 0.24 0.19 0.03 0.02 0.00 0.00 177.57 178.20 2zgg h ARG 41 N 0.77 0.44 -0.25 1.57 3.08 -1.12 -1.22 114.38 117.64 2zgg h ARG 41 Ca 0.19 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.17 2zgg h ARG 41 Cb 0.13 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2zgg h ARG 41 CO -0.02 0.34 0.02 0.82 -1.07 0.00 0.00 179.97 180.06 2zgg h ILE 42 N 0.41 1.24 -0.69 2.04 2.04 -1.42 -1.41 117.51 119.72 2zgg h ILE 42 Ca 0.11 -0.83 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 2zgg h ILE 42 Cb 0.03 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 2zgg h ILE 42 CO -0.02 0.26 0.33 -0.07 0.00 0.00 0.00 178.15 178.65 2zgg h LEU 43 N 0.22 0.90 -0.34 1.44 3.38 -1.00 -1.22 115.31 118.68 2zgg h LEU 43 Ca 0.07 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2zgg h LEU 43 Cb 0.37 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2zgg h LEU 43 CO 0.01 0.79 0.01 0.24 0.09 0.00 0.00 178.44 179.57 2zgg h MET 44 N 0.96 0.60 0.00 1.13 2.86 -1.20 0.17 114.93 119.45 2zgg h MET 44 Ca 0.24 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2zgg h MET 44 Cb 0.12 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.73 2zgg h MET 44 CO -0.03 0.71 0.00 0.00 1.06 0.00 0.00 176.91 178.65 2zgg h ALA 45 N 0.86 1.00 -0.58 6.32 0.00 -1.06 -1.17 119.26 124.64 2zgg h ALA 45 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2zgg h ALA 45 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2zgg h ALA 45 CO 0.02 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.36 2zgg n ASN 46 N -2.51 4.44 0.00 0.00 3.02 -0.48 -4.95 115.26 114.78 2zgg n ASN 46 Ca -0.01 -2.44 0.00 0.00 -0.03 0.00 0.00 54.58 52.11 2zgg n ASN 46 Cb 0.12 -0.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.76 2zgg n ASN 46 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2zgg n GLY 47 N 0.91 0.78 3.71 7.41 0.00 -0.44 -5.03 105.19 112.52 2zgg n GLY 47 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 2zgg n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zgg n ALA 48 N -0.83 1.79 -2.61 4.61 0.00 0.50 -4.93 120.51 119.04 2zgg n ALA 48 Ca 0.00 0.38 -0.43 0.00 0.00 0.00 0.00 53.44 53.39 2zgg n ALA 48 Cb 0.00 -2.36 -0.02 0.00 0.00 0.00 0.00 19.45 17.07 2zgg n ALA 48 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2zgg s ASP 49 N 0.26 6.69 0.00 0.00 2.15 -1.26 -4.70 116.67 119.82 2zgg s ASP 49 Ca 0.64 0.58 0.12 0.00 0.43 0.00 0.00 52.55 54.32 2zgg s ASP 49 Cb -0.57 -2.54 0.55 0.00 -0.30 0.00 0.00 42.92 40.06 2zgg s ASP 49 CO 0.52 -1.16 1.36 1.33 -0.17 0.00 0.00 175.17 177.04 2zgg n VAL 50 N 6.61 1.01 1.36 1.11 0.24 -1.26 -1.68 118.33 125.72 2zgg n VAL 50 Ca 0.12 0.25 0.13 0.00 -2.04 0.00 0.00 64.34 62.80 2zgg n VAL 50 Cb 0.49 -1.04 0.44 0.00 -1.47 0.00 0.00 33.84 32.25 2zgg n VAL 50 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2zgg n ALA 51 N -1.43 2.55 -1.51 2.33 0.00 -1.26 -4.47 120.51 116.72 2zgg n ALA 51 Ca 0.04 -0.50 -0.37 0.00 0.00 0.00 0.00 53.44 52.60 2zgg n ALA 51 Cb 0.13 -1.10 0.05 0.00 0.00 0.00 0.00 19.45 18.53 2zgg n ALA 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zgg n ALA 52 N 0.37 -0.44 -2.76 0.00 0.00 -0.68 -4.94 120.51 112.07 2zgg n ALA 52 Ca 0.18 -0.05 -0.16 0.00 0.00 0.00 0.00 53.44 53.40 2zgg n ALA 52 Cb 0.39 -2.00 -0.13 0.00 0.00 0.00 0.00 19.45 17.71 2zgg n ALA 52 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2zgg s LYS 53 N -2.64 0.65 0.00 0.00 1.02 -1.26 -4.05 119.74 113.46 2zgg s LYS 53 Ca 0.73 -0.64 0.00 0.00 0.02 0.00 0.00 55.97 56.08 2zgg s LYS 53 Cb -0.41 -0.56 0.00 0.00 -0.52 0.00 0.00 37.83 36.34 2zgg s LYS 53 CO 0.50 0.13 0.00 -0.40 -0.92 0.00 0.00 175.35 174.66 2zgg n ASP 54 N 1.94 0.00 0.26 2.83 5.68 -0.17 -4.87 116.55 122.21 2zgg n ASP 54 Ca -0.19 -0.52 0.16 0.00 -0.50 0.00 0.00 54.79 53.74 2zgg n ASP 54 Cb 0.55 0.00 0.88 0.00 -1.14 0.00 0.00 41.12 41.41 2zgg n ASP 54 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2zgg h LYS 55 N 0.00 0.00 -0.46 0.11 1.79 -2.02 -1.69 116.57 114.31 2zgg h LYS 55 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2zgg h LYS 55 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2zgg h LYS 55 CO 0.00 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 178.46 2zgg n ASN 56 N -3.82 4.56 -0.45 0.86 3.02 -1.26 -4.92 115.26 113.24 2zgg n ASN 56 Ca -0.01 -2.75 -0.06 0.00 -0.03 0.00 0.00 54.58 51.73 2zgg n ASN 56 Cb 0.20 -0.56 -0.03 0.00 -0.61 0.00 0.00 39.78 38.78 2zgg n ASN 56 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2zgg n GLY 57 N 0.33 0.81 3.72 7.41 0.00 -0.63 -1.92 105.19 114.91 2zgg n GLY 57 Ca 0.23 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 2zgg n GLY 57 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2zgg s SER 58 N -2.63 7.33 0.58 1.61 0.01 -1.26 -4.43 113.70 114.91 2zgg s SER 58 Ca 0.00 1.59 -0.00 0.00 1.31 0.00 0.00 55.95 58.85 2zgg s SER 58 Cb 0.00 -2.53 0.04 0.00 0.21 0.00 0.00 66.02 63.73 2zgg s SER 58 CO 0.00 -0.13 0.82 0.42 0.41 0.00 0.00 173.24 174.76 2zgg s THR 59 N 0.49 2.66 0.31 1.44 -4.23 -1.26 -1.00 115.64 114.05 2zgg s THR 59 Ca 0.46 -0.57 0.04 0.00 -1.18 0.00 0.00 61.69 60.45 2zgg s THR 59 Cb -0.21 -3.03 0.30 0.00 1.34 0.00 0.00 72.50 70.90 2zgg s THR 59 CO 0.26 -0.02 1.85 -0.65 -0.54 0.00 0.00 174.62 175.52 2zgg h PRO 60 N -0.06 0.85 -0.36 3.99 0.11 -1.78 -1.08 132.00 133.67 2zgg h PRO 60 Ca -0.43 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 65.66 2zgg h PRO 60 Cb 1.30 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 2zgg h PRO 60 CO 0.54 0.56 0.17 1.25 -0.21 0.00 0.00 178.00 180.31 2zgg h LEU 61 N 0.87 0.23 -0.41 2.35 5.85 -1.94 -0.46 115.31 121.81 2zgg h LEU 61 Ca 0.47 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.21 2zgg h LEU 61 Cb 0.56 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2zgg h LEU 61 CO -0.23 0.17 0.26 0.45 -0.34 0.00 0.00 178.44 178.75 2zgg h HIS 62 N 0.34 0.54 -0.44 1.25 3.86 -1.58 -0.75 115.15 118.37 2zgg h HIS 62 Ca 0.15 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.27 2zgg h HIS 62 Cb 0.08 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 2zgg h HIS 62 CO -0.11 0.37 -0.10 -0.07 0.86 0.00 0.00 177.93 178.87 2zgg h LEU 63 N 0.55 0.85 -0.70 2.43 3.38 -1.12 0.42 115.31 121.11 2zgg h LEU 63 Ca 0.15 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 2zgg h LEU 63 Cb -0.02 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 2zgg h LEU 63 CO -0.03 1.02 0.28 0.00 0.09 0.00 0.00 178.44 179.80 2zgg h ALA 64 N 0.86 0.91 -0.24 1.53 0.00 -1.04 -2.15 119.26 119.13 2zgg h ALA 64 Ca 0.11 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2zgg h ALA 64 Cb 0.64 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2zgg h ALA 64 CO 0.04 0.53 -0.04 0.00 0.00 0.00 0.00 179.25 179.78 2zgg h ALA 65 N 1.13 0.33 -0.61 0.00 0.00 -0.84 0.47 119.26 119.74 2zgg h ALA 65 Ca 0.23 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2zgg h ALA 65 Cb 0.21 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2zgg h ALA 65 CO -0.02 0.11 0.41 0.00 0.00 0.00 0.00 179.25 179.75 2zgg h ARG 66 N 0.20 0.52 -0.66 0.00 3.08 0.02 -0.68 114.38 116.87 2zgg h ARG 66 Ca 0.06 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2zgg h ARG 66 Cb 0.49 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.42 2zgg h ARG 66 CO 0.02 0.35 0.00 0.09 -1.07 0.00 0.00 179.97 179.36 2zgg n ASN 67 N -4.48 4.38 -3.35 7.04 3.02 -0.83 -4.96 115.26 116.08 2zgg n ASN 67 Ca 0.09 -2.36 -0.24 0.00 -0.03 0.00 0.00 54.58 52.04 2zgg n ASN 67 Cb 0.28 -0.55 0.05 0.00 -0.61 0.00 0.00 39.78 38.95 2zgg n ASN 67 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2zgg n GLY 68 N 1.17 -0.53 3.42 7.41 0.00 -0.26 -4.94 105.19 111.46 2zgg n GLY 68 Ca 0.24 0.18 -0.44 0.00 0.00 0.00 0.00 46.02 46.00 2zgg n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2zgg s HIS 69 N -3.23 3.78 0.33 1.61 3.76 0.07 -4.85 115.29 116.76 2zgg s HIS 69 Ca 0.45 -2.34 0.03 0.00 -0.15 0.00 0.00 55.06 53.05 2zgg s HIS 69 Cb -0.21 -4.15 0.63 0.00 1.11 0.00 0.00 32.58 29.97 2zgg s HIS 69 CO 0.56 -1.24 1.92 -0.07 -0.85 0.00 0.00 174.74 175.06 2zgg h LEU 70 N 8.65 0.80 -0.72 0.89 3.38 -1.92 -1.10 115.31 125.28 2zgg h LEU 70 Ca 0.27 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.17 2zgg h LEU 70 Cb 0.87 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 2zgg h LEU 70 CO 1.17 0.50 0.07 -0.33 0.09 0.00 0.00 178.44 179.94 2zgg h GLU 71 N 0.90 1.05 -0.19 1.13 4.39 -1.98 -1.61 114.58 118.27 2zgg h GLU 71 Ca 0.38 -0.29 -0.17 0.00 0.34 0.00 0.00 59.36 59.61 2zgg h GLU 71 Cb 0.30 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2zgg h GLU 71 CO -0.14 0.98 -0.59 0.28 -1.16 0.00 0.00 179.01 178.38 2zgg h VAL 72 N 0.98 1.32 -0.40 3.13 2.07 -1.69 -2.15 116.25 119.51 2zgg h VAL 72 Ca 0.19 -1.85 0.04 0.00 0.82 0.00 0.00 66.70 65.90 2zgg h VAL 72 Cb 0.46 1.81 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 2zgg h VAL 72 CO 0.02 0.58 0.17 0.58 0.02 0.00 0.00 177.57 178.93 2zgg h VAL 73 N 0.46 0.93 -0.44 2.57 2.07 -1.01 0.60 116.25 121.42 2zgg h VAL 73 Ca -0.00 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 2zgg h VAL 73 Cb 1.16 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 2zgg h VAL 73 CO 0.11 0.06 0.21 0.11 0.02 0.00 0.00 177.57 178.09 2zgg h LYS 74 N 0.35 0.64 -0.58 1.57 1.57 -1.21 -0.52 116.57 118.39 2zgg h LYS 74 Ca 0.18 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2zgg h LYS 74 Cb 0.12 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 2zgg h LYS 74 CO -0.15 0.55 0.37 -0.07 -0.57 0.00 0.00 179.45 179.57 2zgg h LEU 75 N 0.58 0.67 -0.52 2.94 3.38 -0.95 -0.68 115.31 120.72 2zgg h LEU 75 Ca 0.15 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 2zgg h LEU 75 Cb 0.12 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2zgg h LEU 75 CO -0.02 0.50 0.17 -0.07 0.09 0.00 0.00 178.44 179.12 2zgg h LEU 76 N 0.78 0.75 -0.30 1.67 3.38 -0.66 -1.56 115.31 119.38 2zgg h LEU 76 Ca 0.21 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2zgg h LEU 76 Cb -0.06 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2zgg h LEU 76 CO -0.04 0.75 0.19 -0.07 0.09 0.00 0.00 178.44 179.36 2zgg h LEU 77 N 0.71 0.33 -2.16 1.67 3.38 -0.73 -1.27 115.31 117.23 2zgg h LEU 77 Ca 0.17 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 2zgg h LEU 77 Cb 0.26 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2zgg h LEU 77 CO -0.01 0.24 -0.02 -0.33 0.09 0.00 0.00 178.44 178.41 2zgg h GLU 78 N 0.39 0.00 -0.06 1.13 5.08 -0.99 0.61 114.58 120.74 2zgg h GLU 78 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2zgg h GLU 78 Cb -0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2zgg h GLU 78 CO -0.03 0.02 0.00 0.00 -1.00 0.00 0.00 179.01 178.00 2zgg n ALA 79 N -2.43 2.56 -0.29 3.43 0.00 -0.56 -4.88 120.51 118.34 2zgg n ALA 79 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2zgg n ALA 79 Cb 0.11 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2zgg n ALA 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zgg n GLY 80 N 0.84 0.85 3.71 0.00 0.00 0.21 -4.99 105.19 105.81 2zgg n GLY 80 Ca 0.12 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2zgg n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zgg n ALA 81 N -1.13 1.67 -2.14 4.61 0.00 -0.73 -4.86 120.51 117.93 2zgg n ALA 81 Ca 0.00 0.37 -0.41 0.00 0.00 0.00 0.00 53.44 53.40 2zgg n ALA 81 Cb 0.00 -2.33 -0.03 0.00 0.00 0.00 0.00 19.45 17.10 2zgg n ALA 81 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2zgg s ASP 82 N -0.00 5.70 0.64 0.00 2.15 -1.26 -4.80 116.67 119.10 2zgg s ASP 82 Ca 0.59 0.58 0.41 0.00 0.43 0.00 0.00 52.55 54.56 2zgg s ASP 82 Cb -0.56 -2.53 2.19 0.00 -0.30 0.00 0.00 42.92 41.72 2zgg s ASP 82 CO 0.57 -1.99 2.30 1.62 -0.17 0.00 0.00 175.17 177.50 2zgg h VAL 83 N 6.71 0.06 -0.24 1.11 3.04 -1.97 -2.61 116.25 122.35 2zgg h VAL 83 Ca -0.28 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.30 2zgg h VAL 83 Cb 1.14 1.10 0.00 0.00 -2.01 0.00 0.00 31.29 31.52 2zgg h VAL 83 CO 1.16 0.01 0.00 0.59 -1.01 0.00 0.00 177.57 178.31 2zgg n ASN 84 N -3.16 2.99 -4.62 3.17 3.02 -1.26 -4.37 115.26 111.02 2zgg n ASN 84 Ca -0.02 -1.93 -0.44 0.00 -0.03 0.00 0.00 54.58 52.15 2zgg n ASN 84 Cb 0.12 -0.15 -0.02 0.00 -0.61 0.00 0.00 39.78 39.12 2zgg n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2zgg n ALA 85 N 1.23 0.23 -2.60 5.41 0.00 -0.98 -4.83 120.51 118.96 2zgg n ALA 85 Ca 0.17 0.39 -0.33 0.00 0.00 0.00 0.00 53.44 53.67 2zgg n ALA 85 Cb 0.56 -2.10 -0.12 0.00 0.00 0.00 0.00 19.45 17.78 2zgg n ALA 85 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2zgg s GLN 86 N -1.42 2.76 0.00 0.00 -0.21 -1.26 -4.15 119.66 115.37 2zgg s GLN 86 Ca 0.60 -0.61 0.00 0.00 0.02 0.00 0.00 55.36 55.37 2zgg s GLN 86 Cb -0.68 -2.54 0.00 0.00 1.00 0.00 0.00 33.01 30.80 2zgg s GLN 86 CO 0.59 0.59 0.00 -0.40 -2.12 0.00 0.00 175.29 173.95 2zgg n ASP 87 N 2.42 0.00 0.29 5.90 5.68 -0.27 -4.81 116.55 125.76 2zgg n ASP 87 Ca -0.18 -0.42 0.17 0.00 -0.50 0.00 0.00 54.79 53.86 2zgg n ASP 87 Cb 0.53 0.00 0.84 0.00 -1.14 0.00 0.00 41.12 41.35 2zgg n ASP 87 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2zgg h LYS 88 N 0.00 0.00 -0.49 0.11 2.10 -1.61 -0.99 116.57 115.68 2zgg h LYS 88 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2zgg h LYS 88 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2zgg h LYS 88 CO 0.00 0.06 0.00 1.19 -2.00 0.00 0.00 179.45 178.70 2zgg n PHE 89 N -3.33 0.65 -1.49 0.07 3.01 -1.26 -4.91 117.46 110.19 2zgg n PHE 89 Ca -0.01 -0.33 -0.09 0.00 1.01 0.00 0.00 57.45 58.03 2zgg n PHE 89 Cb 0.22 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.66 2zgg n PHE 89 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2zgg n GLY 90 N 1.41 0.81 3.86 1.37 0.00 -0.38 -5.01 105.19 107.26 2zgg n GLY 90 Ca 0.19 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 2zgg n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2zgg s LYS 91 N -3.19 3.65 0.62 1.61 1.02 -1.26 -4.69 119.74 117.51 2zgg s LYS 91 Ca 0.00 0.09 -0.00 0.00 0.02 0.00 0.00 55.97 56.07 2zgg s LYS 91 Cb 0.00 -3.21 0.07 0.00 -0.52 0.00 0.00 37.83 34.17 2zgg s LYS 91 CO 0.00 0.73 0.87 0.95 -0.92 0.00 0.00 175.35 176.98 2zgg s THR 92 N -1.00 2.45 0.40 2.17 -4.23 -1.26 -1.11 115.64 113.06 2zgg s THR 92 Ca 0.18 -0.59 0.09 0.00 -1.18 0.00 0.00 61.69 60.20 2zgg s THR 92 Cb -0.14 -2.86 0.19 0.00 1.34 0.00 0.00 72.50 71.04 2zgg s THR 92 CO 0.08 0.00 1.96 0.00 -0.54 0.00 0.00 174.62 176.12 2zgg h ALA 93 N -0.21 1.59 -0.12 3.99 0.00 -1.76 -1.59 119.26 121.16 2zgg h ALA 93 Ca -0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.34 2zgg h ALA 93 Cb 1.29 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 2zgg h ALA 93 CO 0.49 0.30 0.03 0.35 0.00 0.00 0.00 179.25 180.43 2zgg h PHE 94 N 0.28 0.20 -0.81 0.00 3.57 -1.87 -1.07 116.94 117.23 2zgg h PHE 94 Ca 0.06 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.64 2zgg h PHE 94 Cb 0.25 -0.06 -0.07 0.00 2.79 0.00 0.00 35.95 38.86 2zgg h PHE 94 CO 0.00 0.34 0.46 -0.44 -2.23 0.00 0.00 178.31 176.44 2zgg h ASP 95 N -0.00 0.64 -0.11 0.41 3.32 -1.73 -0.36 116.42 118.59 2zgg h ASP 95 Ca 0.04 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2zgg h ASP 95 Cb 0.24 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2zgg h ASP 95 CO -0.00 0.36 0.05 0.40 -1.72 0.00 0.00 179.24 178.33 2zgg h ILE 96 N 0.76 1.13 -0.41 0.35 2.04 -1.08 0.44 117.51 120.75 2zgg h ILE 96 Ca 0.39 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.92 2zgg h ILE 96 Cb 0.38 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2zgg h ILE 96 CO -0.26 0.11 0.27 0.77 0.00 0.00 0.00 178.15 179.05 2zgg h SER 97 N 0.05 0.38 -0.04 1.72 4.64 -0.33 0.21 113.55 120.17 2zgg h SER 97 Ca 0.04 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.31 2zgg h SER 97 Cb 0.13 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2zgg h SER 97 CO -0.00 0.26 -0.13 0.40 -0.87 0.00 0.00 176.83 176.49 2zgg h ILE 98 N 0.44 1.46 -0.92 0.95 1.08 -0.78 0.18 117.51 119.91 2zgg h ILE 98 Ca 0.17 -1.55 0.09 0.00 -0.39 0.00 0.00 64.86 63.17 2zgg h ILE 98 Cb 0.11 2.37 -0.07 0.00 -3.07 0.00 0.00 36.82 36.17 2zgg h ILE 98 CO -0.04 0.42 0.60 0.44 -0.69 0.00 0.00 178.15 178.88 2zgg h ASP 99 N -0.39 0.88 0.82 1.72 3.32 0.24 -1.33 116.42 121.68 2zgg h ASP 99 Ca -0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2zgg h ASP 99 Cb 0.76 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.14 2zgg h ASP 99 CO 0.03 0.53 -0.08 0.59 -1.72 0.00 0.00 179.24 178.59 2zgg n ASN 100 N -4.52 0.10 -1.90 6.45 5.03 0.61 -4.92 115.26 116.11 2zgg n ASN 100 Ca 0.15 0.23 -0.15 0.00 0.87 0.00 0.00 54.58 55.68 2zgg n ASN 100 Cb 0.27 -0.33 0.01 0.00 -1.02 0.00 0.00 39.78 38.71 2zgg n ASN 100 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2zgg n GLY 101 N 1.45 -0.16 3.38 7.41 0.00 -0.50 -4.94 105.19 111.83 2zgg n GLY 101 Ca 0.08 -0.22 -0.46 0.00 0.00 0.00 0.00 46.02 45.42 2zgg n GLY 101 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2zgg s ASN 102 N -2.63 6.70 0.23 1.61 3.84 0.54 -4.89 114.94 120.35 2zgg s ASN 102 Ca 0.12 -2.42 -0.06 0.00 0.21 0.00 0.00 52.86 50.71 2zgg s ASN 102 Cb -0.05 -2.28 0.33 0.00 -0.55 0.00 0.00 41.25 38.69 2zgg s ASN 102 CO 0.15 -0.77 1.81 -0.08 -2.79 0.00 0.00 177.10 175.42 2zgg h GLU 103 N 8.22 0.73 -0.59 0.43 4.81 -1.92 0.60 114.58 126.86 2zgg h GLU 103 Ca 0.12 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2zgg h GLU 103 Cb 1.04 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.22 2zgg h GLU 103 CO 0.90 0.48 0.38 -0.44 -0.73 0.00 0.00 179.01 179.60 2zgg h ASP 104 N 0.75 0.69 0.10 1.04 3.32 -1.96 -1.07 116.42 119.30 2zgg h ASP 104 Ca 0.36 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.37 2zgg h ASP 104 Cb 0.28 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2zgg h ASP 104 CO -0.22 0.52 -0.05 0.25 -1.72 0.00 0.00 179.24 178.02 2zgg h LEU 105 N 0.80 -0.12 -0.93 1.55 6.46 -1.78 -2.93 115.31 118.36 2zgg h LEU 105 Ca 0.21 -0.30 0.20 0.00 -0.12 0.00 0.00 57.88 57.87 2zgg h LEU 105 Cb -0.06 0.03 -0.11 0.00 -0.73 0.00 0.00 40.66 39.79 2zgg h LEU 105 CO -0.04 0.25 0.49 0.00 -0.62 0.00 0.00 178.44 178.52 2zgg h ALA 106 N 0.33 1.51 -0.72 1.25 0.00 -0.76 -0.62 119.26 120.26 2zgg h ALA 106 Ca -0.01 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2zgg h ALA 106 Cb 0.41 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 2zgg h ALA 106 CO 0.02 -0.20 0.45 1.49 0.00 0.00 0.00 179.25 181.02 2zgg h GLU 107 N 0.57 0.85 -0.01 0.00 4.22 -1.08 0.27 114.58 119.41 2zgg h GLU 107 Ca 0.56 -0.05 -0.12 0.00 0.08 0.00 0.00 59.36 59.82 2zgg h GLU 107 Cb 0.95 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 2zgg h GLU 107 CO -0.44 0.57 -0.56 0.82 -2.18 0.00 0.00 179.01 177.21 2zgg h ILE 108 N 0.88 1.40 0.00 2.32 2.04 -0.97 -3.25 117.51 119.92 2zgg h ILE 108 Ca 0.29 -1.92 0.00 0.00 1.00 0.00 0.00 64.86 64.23 2zgg h ILE 108 Cb 0.02 2.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.13 2zgg h ILE 108 CO -0.11 0.55 -0.85 0.18 0.00 0.00 0.00 178.15 177.92 2zgg n LEU 109 N -3.87 0.77 0.00 1.44 4.77 -0.61 -5.09 117.00 114.40 2zgg n LEU 109 Ca -0.01 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2zgg n LEU 109 Cb 0.57 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2zgg n LEU 109 CO 0.41 0.18 0.18 0.00 -1.33 0.00 0.00 177.39 176.84