#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zg2 s ASN 7 N 0.00 6.68 -0.08 7.83 0.01 -1.26 -4.84 114.94 123.28 1zg2 s ASN 7 Ca 0.00 0.96 0.03 0.00 -0.71 0.00 0.00 52.86 53.14 1zg2 s ASN 7 Cb 0.00 -2.24 0.01 0.00 0.41 0.00 0.00 41.25 39.43 1zg2 s ASN 7 CO 0.00 -0.02 -0.16 -1.00 -1.51 0.00 0.00 177.10 174.41 1zg2 s HIS 8 N -1.71 1.88 -0.02 2.20 3.76 -0.96 -1.30 115.29 119.14 1zg2 s HIS 8 Ca 0.44 -0.75 0.06 0.00 -0.15 0.00 0.00 55.06 54.66 1zg2 s HIS 8 Cb -0.12 -1.32 -0.02 0.00 1.11 0.00 0.00 32.58 32.22 1zg2 s HIS 8 CO 0.20 -0.35 -0.19 0.71 -0.85 0.00 0.00 174.74 174.27 1zg2 s TYR 9 N 0.59 2.54 -0.29 1.40 2.02 0.54 -0.34 117.35 123.81 1zg2 s TYR 9 Ca -0.15 -0.27 -0.07 0.00 -0.37 0.00 0.00 57.07 56.20 1zg2 s TYR 9 Cb -0.16 -1.55 0.00 0.00 -0.40 0.00 0.00 41.96 39.85 1zg2 s TYR 9 CO 0.05 0.12 0.09 0.08 -1.57 0.00 0.00 175.55 174.32 1zg2 s VAL 10 N -0.72 4.08 -0.00 0.71 1.01 0.94 -1.99 120.40 124.43 1zg2 s VAL 10 Ca 0.11 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.51 1zg2 s VAL 10 Cb -0.10 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 1zg2 s VAL 10 CO 0.01 0.09 -0.08 -0.72 0.00 0.00 0.00 175.10 174.40 1zg2 s TYR 11 N 1.52 2.86 -0.23 5.22 1.13 -0.95 -0.35 117.35 126.56 1zg2 s TYR 11 Ca 0.03 -0.06 0.02 0.00 -1.41 0.00 0.00 57.07 55.65 1zg2 s TYR 11 Cb -0.17 -1.61 0.04 0.00 -1.10 0.00 0.00 41.96 39.13 1zg2 s TYR 11 CO 0.03 0.35 -0.14 -1.50 -2.51 0.00 0.00 175.55 171.78 1zg2 s ILE 12 N -0.96 2.17 -0.17 -3.49 2.07 -0.93 -0.41 121.20 119.48 1zg2 s ILE 12 Ca 0.16 -1.33 -0.08 0.00 -1.41 0.00 0.00 60.65 58.00 1zg2 s ILE 12 Cb -0.11 -2.13 -0.04 0.00 0.13 0.00 0.00 42.46 40.31 1zg2 s ILE 12 CO 0.06 0.21 0.09 -0.22 -1.91 0.00 0.00 174.94 173.18 1zg2 s LEU 13 N 1.19 4.03 -0.26 8.50 2.96 -0.01 -2.38 118.68 132.72 1zg2 s LEU 13 Ca -0.03 0.20 -0.19 0.00 -0.22 0.00 0.00 54.13 53.90 1zg2 s LEU 13 Cb -0.17 -2.01 -0.02 0.00 0.50 0.00 0.00 46.19 44.48 1zg2 s LEU 13 CO -0.08 0.23 0.56 -0.70 -1.32 0.00 0.00 176.35 175.04 1zg2 s GLU 14 N 0.02 4.09 0.57 1.98 2.12 0.18 -0.03 118.70 127.63 1zg2 s GLU 14 Ca 0.08 0.41 0.01 0.00 0.36 0.00 0.00 54.97 55.83 1zg2 s GLU 14 Cb -0.12 -3.65 0.04 0.00 0.26 0.00 0.00 34.13 30.67 1zg2 s GLU 14 CO 0.00 -0.37 0.80 0.00 -0.54 0.00 0.00 175.26 175.15 1zg2 h LYS 16 N 0.01 -0.14 -0.74 0.00 3.64 -1.86 -1.18 116.57 116.30 1zg2 h LYS 16 Ca -0.41 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1zg2 h LYS 16 Cb 1.29 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 1zg2 h LYS 16 CO 0.51 -0.09 0.00 -0.25 -2.27 0.00 0.00 179.45 177.35 1zg2 n ASP 17 N -5.44 2.85 0.00 4.20 8.00 -1.26 -4.81 116.55 120.10 1zg2 n ASP 17 Ca 0.05 -2.34 0.00 0.00 0.71 0.00 0.00 54.79 53.21 1zg2 n ASP 17 Cb 0.35 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 1zg2 n ASP 17 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zg2 n GLY 18 N 0.39 0.60 3.56 0.44 0.00 -0.45 -4.98 105.19 104.75 1zg2 n GLY 18 Ca 0.12 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 1zg2 n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zg2 s SER 19 N -2.28 6.14 -0.13 1.61 0.01 -1.25 -4.80 113.70 112.99 1zg2 s SER 19 Ca 0.00 -0.91 -0.29 0.00 1.31 0.00 0.00 55.95 56.06 1zg2 s SER 19 Cb 0.00 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.65 1zg2 s SER 19 CO 0.00 -1.83 1.16 0.26 0.41 0.00 0.00 173.24 173.25 1zg2 s TRP 20 N 6.14 3.15 -0.40 2.43 0.51 -1.26 -2.20 118.94 127.32 1zg2 s TRP 20 Ca 0.47 1.25 -0.14 0.00 -2.12 0.00 0.00 56.10 55.56 1zg2 s TRP 20 Cb -0.04 -3.39 0.02 0.00 -0.81 0.00 0.00 33.47 29.25 1zg2 s TRP 20 CO 0.01 -1.13 0.27 -0.47 -0.51 0.00 0.00 176.95 175.12 1zg2 s TYR 21 N 2.76 3.24 -0.80 -1.98 5.04 0.95 -4.85 117.35 121.71 1zg2 s TYR 21 Ca 0.52 -0.67 -0.22 0.00 -2.44 0.00 0.00 57.07 54.26 1zg2 s TYR 21 Cb -0.21 -2.55 0.08 0.00 0.35 0.00 0.00 41.96 39.63 1zg2 s TYR 21 CO 0.16 -0.60 1.11 0.99 -1.34 0.00 0.00 175.55 175.87 1zg2 s THR 22 N 1.65 4.35 0.47 4.34 2.01 -1.26 -0.83 115.64 126.37 1zg2 s THR 22 Ca 0.04 -0.75 0.06 0.00 0.31 0.00 0.00 61.69 61.35 1zg2 s THR 22 Cb -0.19 -4.78 -0.02 0.00 0.01 0.00 0.00 72.50 67.52 1zg2 s THR 22 CO 0.09 -1.57 0.23 -0.83 -0.69 0.00 0.00 174.62 171.85 1zg2 s GLY 23 N 3.84 2.45 -0.04 4.40 0.00 0.45 -4.97 107.32 113.45 1zg2 s GLY 23 Ca 0.30 -1.59 0.02 0.00 0.00 0.00 0.00 44.72 43.45 1zg2 s GLY 23 CO 0.01 -1.96 -0.09 -0.47 0.00 0.00 0.00 173.10 170.60 1zg2 s TYR 24 N -2.69 2.85 -0.08 1.90 5.04 -1.26 -2.23 117.35 120.89 1zg2 s TYR 24 Ca 0.34 -0.05 -0.15 0.00 -2.44 0.00 0.00 57.07 54.77 1zg2 s TYR 24 Cb 0.02 -1.65 0.03 0.00 0.35 0.00 0.00 41.96 40.70 1zg2 s TYR 24 CO 0.19 0.30 0.37 0.99 -1.34 0.00 0.00 175.55 176.07 1zg2 s THR 25 N -0.85 0.03 0.80 4.34 2.01 -0.84 -4.97 115.64 116.16 1zg2 s THR 25 Ca 0.14 -0.23 -0.13 0.00 0.31 0.00 0.00 61.69 61.77 1zg2 s THR 25 Cb -0.11 -0.61 0.19 0.00 0.01 0.00 0.00 72.50 71.99 1zg2 s THR 25 CO 0.03 -0.13 0.83 0.41 -0.69 0.00 0.00 174.62 175.07 1zg2 n THR 26 N 1.97 0.00 -2.08 -0.82 -1.04 -1.26 -0.34 114.28 110.71 1zg2 n THR 26 Ca -0.18 -0.47 -0.37 0.00 -2.04 0.00 0.00 64.05 61.00 1zg2 n THR 26 Cb 0.57 -1.35 0.01 0.00 -1.82 0.00 0.00 70.33 67.74 1zg2 n THR 26 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 1zg2 s ASP 27 N -3.89 5.69 0.61 8.00 1.47 -0.42 -4.41 116.67 123.72 1zg2 s ASP 27 Ca 0.51 2.43 0.35 0.00 1.18 0.00 0.00 52.55 57.02 1zg2 s ASP 27 Cb -0.04 -2.61 1.97 0.00 -0.34 0.00 0.00 42.92 41.90 1zg2 s ASP 27 CO 0.38 -1.26 2.26 0.58 0.68 0.00 0.00 175.17 177.81 1zg2 h VAL 28 N 1.50 0.32 -0.69 2.11 2.07 -1.94 -2.11 116.25 117.50 1zg2 h VAL 28 Ca -0.50 -0.11 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1zg2 h VAL 28 Cb 1.27 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 1zg2 h VAL 28 CO 0.58 0.02 0.18 -0.78 0.02 0.00 0.00 177.57 177.59 1zg2 h ASP 29 N 0.00 1.02 -0.91 0.57 3.58 -1.99 0.43 116.42 119.12 1zg2 h ASP 29 Ca -0.00 -0.20 0.02 0.00 0.42 0.00 0.00 57.03 57.27 1zg2 h ASP 29 Cb 0.08 -0.27 -0.05 0.00 1.72 0.00 0.00 39.33 40.81 1zg2 h ASP 29 CO 0.00 0.97 0.60 -0.09 -2.88 0.00 0.00 179.24 177.84 1zg2 h ARG 30 N 1.04 1.15 -0.01 0.28 2.43 -1.75 -2.05 114.38 115.47 1zg2 h ARG 30 Ca 0.22 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1zg2 h ARG 30 Cb 0.34 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1zg2 h ARG 30 CO -0.00 0.76 -0.06 0.00 -1.51 0.00 0.00 179.97 179.16 1zg2 h ARG 31 N 1.19 0.06 -0.25 0.20 2.47 -1.17 -2.34 114.38 114.53 1zg2 h ARG 31 Ca 0.35 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 59.02 1zg2 h ARG 31 Cb -0.06 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.26 1zg2 h ARG 31 CO -0.10 0.72 0.14 0.97 0.56 0.00 0.00 179.97 182.25 1zg2 h ILE 32 N -0.59 1.12 -0.73 2.04 2.10 -0.23 -2.36 117.51 118.87 1zg2 h ILE 32 Ca -0.00 -0.31 -0.02 0.00 1.08 0.00 0.00 64.86 65.61 1zg2 h ILE 32 Cb 0.73 0.87 -0.03 0.00 -1.09 0.00 0.00 36.82 37.30 1zg2 h ILE 32 CO 0.01 0.11 0.37 0.50 -1.08 0.00 0.00 178.15 178.07 1zg2 h LYS 33 N 0.29 1.02 -0.76 2.19 3.64 -1.47 -2.13 116.57 119.34 1zg2 h LYS 33 Ca 0.09 -0.12 0.06 0.00 -1.27 0.00 0.00 60.65 59.41 1zg2 h LYS 33 Cb 0.06 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 31.64 1zg2 h LYS 33 CO -0.01 0.77 0.50 -0.22 -2.27 0.00 0.00 179.45 178.21 1zg2 h LYS 34 N 1.02 0.80 -0.29 1.90 3.64 -0.94 0.33 116.57 123.03 1zg2 h LYS 34 Ca 0.25 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.50 1zg2 h LYS 34 Cb 0.06 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1zg2 h LYS 34 CO -0.04 0.53 -0.18 0.45 -2.27 0.00 0.00 179.45 177.94 1zg2 h HIS 35 N 0.82 0.74 -0.43 1.91 3.86 -0.91 -1.92 115.15 119.21 1zg2 h HIS 35 Ca 0.33 -0.19 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 1zg2 h HIS 35 Cb 0.24 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.52 1zg2 h HIS 35 CO -0.00 0.89 0.22 0.00 0.86 0.00 0.00 177.93 179.90 1zg2 h ALA 36 N 0.74 1.58 -0.10 2.45 0.00 -0.64 -0.96 119.26 122.34 1zg2 h ALA 36 Ca 0.06 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1zg2 h ALA 36 Cb 0.71 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1zg2 h ALA 36 CO 0.05 0.35 -0.40 0.77 0.00 0.00 0.00 179.25 180.01 1zg2 h SER 37 N 0.60 0.23 1.76 0.00 0.02 -0.18 -2.85 113.55 113.12 1zg2 h SER 37 Ca 0.15 -0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 1zg2 h SER 37 Cb 0.04 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1zg2 h SER 37 CO -0.02 0.61 -0.22 1.23 -1.14 0.00 0.00 176.83 177.28 1zg2 h GLY 38 N 1.21 0.00 0.00 -3.77 0.00 -0.45 -3.47 103.07 96.58 1zg2 h GLY 38 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1zg2 h GLY 38 CO 0.06 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.88 1zg2 n LYS 39 N -3.16 0.00 0.06 4.80 5.02 -0.47 -4.09 118.16 120.32 1zg2 n LYS 39 Ca 0.03 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.29 1zg2 n LYS 39 Cb 0.62 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.61 1zg2 n LYS 39 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1zg2 h GLY 40 N 0.00 -0.18 -5.57 0.72 0.00 -1.91 -3.47 103.07 92.65 1zg2 h GLY 40 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 1zg2 h GLY 40 CO 0.00 -0.07 -0.99 0.00 0.00 0.00 0.00 176.54 175.49 1zg2 n ALA 41 N -2.18 -2.97 -1.77 3.60 0.00 -1.26 -4.92 120.51 111.02 1zg2 n ALA 41 Ca -0.02 0.36 -0.39 0.00 0.00 0.00 0.00 53.44 53.39 1zg2 n ALA 41 Cb 0.07 -0.96 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 1zg2 n ALA 41 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1zg2 s LYS 42 N -1.48 4.45 -0.71 0.00 1.02 -1.26 -4.93 119.74 116.83 1zg2 s LYS 42 Ca 0.02 1.70 -0.26 0.00 0.02 0.00 0.00 55.97 57.45 1zg2 s LYS 42 Cb -0.00 -2.95 -0.01 0.00 -0.52 0.00 0.00 37.83 34.35 1zg2 s LYS 42 CO 0.53 0.07 1.76 1.52 -0.92 0.00 0.00 175.35 178.31 1zg2 s TYR 43 N -1.34 1.84 -0.43 3.18 1.13 -1.26 -4.93 117.35 115.54 1zg2 s TYR 43 Ca 0.50 0.53 -0.03 0.00 -1.41 0.00 0.00 57.07 56.65 1zg2 s TYR 43 Cb -0.28 -4.20 0.11 0.00 -1.10 0.00 0.00 41.96 36.49 1zg2 s TYR 43 CO 0.36 -2.14 0.23 0.95 -2.51 0.00 0.00 175.55 172.44 1zg2 s THR 44 N 8.50 3.37 0.60 -3.49 -4.23 -1.26 -5.10 115.64 114.04 1zg2 s THR 44 Ca 0.61 -2.10 -0.06 0.00 -1.18 0.00 0.00 61.69 58.96 1zg2 s THR 44 Cb -0.10 -3.30 0.01 0.00 1.34 0.00 0.00 72.50 70.45 1zg2 s THR 44 CO 0.14 -0.71 0.92 -0.13 -0.54 0.00 0.00 174.62 174.30 1zg2 s ARG 45 N 1.08 2.92 0.00 3.99 0.52 -1.26 -5.10 118.95 121.09 1zg2 s ARG 45 Ca 0.09 0.04 0.00 0.00 -0.52 0.00 0.00 55.73 55.34 1zg2 s ARG 45 Cb -0.23 -2.25 0.00 0.00 0.52 0.00 0.00 34.95 32.99 1zg2 s ARG 45 CO -0.04 -0.73 0.00 0.41 0.02 0.00 0.00 175.30 174.96 1zg2 n GLY 46 N -2.62 0.60 0.29 -3.53 0.00 -1.26 -5.07 105.19 93.59 1zg2 n GLY 46 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1zg2 n GLY 46 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1zg2 n ARG 47 N 0.00 0.00 0.00 1.61 3.00 -1.26 -5.15 116.66 114.86 1zg2 n ARG 47 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1zg2 n ARG 47 Cb 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 32.46 32.20 1zg2 n ARG 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1zg2 n GLY 48 N 2.37 -0.18 3.77 5.14 0.00 -1.26 -4.90 105.19 110.13 1zg2 n GLY 48 Ca 0.00 -2.27 -0.31 0.00 0.00 0.00 0.00 46.02 43.44 1zg2 n GLY 48 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1zg2 s PRO 49 N -0.53 2.19 -0.38 1.61 0.02 -1.26 -4.78 135.00 131.87 1zg2 s PRO 49 Ca 0.00 1.05 -0.00 0.00 0.02 0.00 0.00 61.00 62.07 1zg2 s PRO 49 Cb 0.00 -1.90 0.11 0.00 0.02 0.00 0.00 34.50 32.73 1zg2 s PRO 49 CO 0.00 -1.65 0.14 -0.06 -0.33 0.00 0.00 177.00 175.10 1zg2 s PHE 50 N -2.94 3.66 -0.21 6.54 0.08 -1.26 -4.41 117.98 119.43 1zg2 s PHE 50 Ca 0.61 -2.64 0.01 0.00 0.12 0.00 0.00 56.93 55.03 1zg2 s PHE 50 Cb -0.17 -3.11 0.03 0.00 -0.57 0.00 0.00 43.02 39.21 1zg2 s PHE 50 CO 0.56 -0.96 -0.16 1.03 -0.10 0.00 0.00 175.22 175.59 1zg2 s ARG 51 N 1.05 2.75 -0.45 0.44 0.52 -0.99 -4.99 118.95 117.28 1zg2 s ARG 51 Ca 0.09 -1.00 -0.28 0.00 -0.52 0.00 0.00 55.73 54.03 1zg2 s ARG 51 Cb -0.21 -2.71 0.03 0.00 0.52 0.00 0.00 34.95 32.57 1zg2 s ARG 51 CO -0.06 -0.34 1.05 -1.17 0.02 0.00 0.00 175.30 174.81 1zg2 s LEU 52 N 1.24 3.80 -0.13 2.53 2.96 -1.26 0.52 118.68 128.34 1zg2 s LEU 52 Ca 0.00 0.42 -0.28 0.00 -0.22 0.00 0.00 54.13 54.05 1zg2 s LEU 52 Cb -0.15 -3.42 -0.26 0.00 0.50 0.00 0.00 46.19 42.85 1zg2 s LEU 52 CO -0.10 -1.13 0.80 0.58 -1.32 0.00 0.00 176.35 175.19 1zg2 h VAL 53 N 6.11 1.76 -2.74 1.68 2.07 -1.84 -3.48 116.25 119.81 1zg2 h VAL 53 Ca -0.23 -2.32 0.06 0.00 0.82 0.00 0.00 66.70 65.03 1zg2 h VAL 53 Cb 1.07 3.33 -0.10 0.00 -1.52 0.00 0.00 31.29 34.06 1zg2 h VAL 53 CO 1.08 0.61 0.32 0.00 0.02 0.00 0.00 177.57 179.60 1zg2 s ALA 54 N -2.32 -1.56 -0.10 1.67 0.00 -1.24 -5.05 121.76 113.16 1zg2 s ALA 54 Ca -0.18 0.33 -0.04 0.00 0.00 0.00 0.00 51.96 52.07 1zg2 s ALA 54 Cb -0.02 0.74 0.05 0.00 0.00 0.00 0.00 23.12 23.88 1zg2 s ALA 54 CO 0.70 -0.87 0.20 0.99 0.00 0.00 0.00 175.76 176.78 1zg2 s THR 55 N -3.58 -0.22 -0.21 0.00 2.01 -1.26 -2.19 115.64 110.20 1zg2 s THR 55 Ca 0.06 0.26 -0.06 0.00 0.31 0.00 0.00 61.69 62.26 1zg2 s THR 55 Cb -0.02 -0.34 -0.03 0.00 0.01 0.00 0.00 72.50 72.12 1zg2 s THR 55 CO -0.04 0.11 0.04 0.26 -0.69 0.00 0.00 174.62 174.30 1zg2 s TRP 56 N 1.90 3.12 -0.25 4.92 0.51 0.53 -4.94 118.94 124.74 1zg2 s TRP 56 Ca -0.02 -0.24 -0.11 0.00 -2.12 0.00 0.00 56.10 53.61 1zg2 s TRP 56 Cb -0.12 -2.12 -0.05 0.00 -0.81 0.00 0.00 33.47 30.37 1zg2 s TRP 56 CO -0.07 -0.12 0.17 0.00 -0.51 0.00 0.00 176.95 176.42 1zg2 s ALA 57 N 0.92 3.59 -0.15 0.98 0.00 -1.26 -0.04 121.76 125.80 1zg2 s ALA 57 Ca 0.03 -0.93 -0.00 0.00 0.00 0.00 0.00 51.96 51.06 1zg2 s ALA 57 Cb -0.14 -2.36 0.03 0.00 0.00 0.00 0.00 23.12 20.65 1zg2 s ALA 57 CO 0.02 -0.27 -0.07 -0.06 0.00 0.00 0.00 175.76 175.38 1zg2 s PHE 58 N 1.21 1.71 -1.53 0.00 0.08 0.54 -4.99 117.98 114.99 1zg2 s PHE 58 Ca 0.08 -1.00 0.16 0.00 0.12 0.00 0.00 56.93 56.29 1zg2 s PHE 58 Cb -0.14 -1.33 0.84 0.00 -0.57 0.00 0.00 43.02 41.82 1zg2 s PHE 58 CO 0.06 -0.59 1.45 -2.30 -0.10 0.00 0.00 175.22 173.74 1zg2 n PRO 59 N 4.88 0.28 -4.64 0.24 -0.02 -1.26 -2.26 135.00 132.22 1zg2 n PRO 59 Ca -0.13 0.11 -0.33 0.00 -2.02 0.00 0.00 63.50 61.13 1zg2 n PRO 59 Cb 0.49 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.34 1zg2 n PRO 59 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1zg2 s SER 60 N -2.47 4.36 0.41 2.55 0.15 -1.26 -4.82 113.70 112.62 1zg2 s SER 60 Ca 0.17 -0.22 0.09 0.00 0.70 0.00 0.00 55.95 56.70 1zg2 s SER 60 Cb 0.11 -1.58 0.88 0.00 -1.71 0.00 0.00 66.02 63.72 1zg2 s SER 60 CO 0.24 0.20 2.00 0.07 1.20 0.00 0.00 173.24 176.94 1zg2 h LYS 61 N 6.46 0.31 0.10 5.44 2.10 -1.89 -2.17 116.57 126.93 1zg2 h LYS 61 Ca -0.31 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.29 1zg2 h LYS 61 Cb 1.20 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 32.47 1zg2 h LYS 61 CO 0.58 0.32 -0.05 1.49 -2.00 0.00 0.00 179.45 179.78 1zg2 h GLU 62 N 0.31 -0.13 -0.71 0.07 4.57 -1.96 -0.01 114.58 116.72 1zg2 h GLU 62 Ca 0.07 0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.23 1zg2 h GLU 62 Cb 0.17 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 1zg2 h GLU 62 CO 0.00 0.04 0.29 0.93 -1.18 0.00 0.00 179.01 179.10 1zg2 h GLU 63 N -0.29 1.05 -0.16 1.92 5.08 -1.94 -0.66 114.58 119.58 1zg2 h GLU 63 Ca -0.01 -0.18 0.01 0.00 -1.00 0.00 0.00 59.36 58.17 1zg2 h GLU 63 Cb 0.24 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1zg2 h GLU 63 CO 0.02 0.86 0.08 0.00 -1.00 0.00 0.00 179.01 178.97 1zg2 h ALA 64 N 1.14 0.19 -0.44 3.43 0.00 -1.11 0.27 119.26 122.73 1zg2 h ALA 64 Ca 0.24 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1zg2 h ALA 64 Cb 0.19 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1zg2 h ALA 64 CO -0.02 -0.35 -0.02 0.52 0.00 0.00 0.00 179.25 179.38 1zg2 h MET 65 N 0.17 0.79 -0.14 0.00 2.86 -0.85 -2.80 114.93 114.97 1zg2 h MET 65 Ca 0.06 -0.26 -0.07 0.00 -2.06 0.00 0.00 59.70 57.37 1zg2 h MET 65 Cb 0.01 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 1zg2 h MET 65 CO -0.04 0.87 -0.19 -0.09 1.06 0.00 0.00 176.91 178.52 1zg2 h ARG 66 N 0.63 0.37 0.25 1.72 2.43 -0.90 -1.97 114.38 116.92 1zg2 h ARG 66 Ca 0.12 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1zg2 h ARG 66 Cb 0.53 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1zg2 h ARG 66 CO 0.03 0.79 -0.14 2.35 -1.51 0.00 0.00 179.97 181.49 1zg2 h TRP 67 N -0.02 -0.36 -0.23 2.20 7.01 -0.52 -0.62 115.95 123.42 1zg2 h TRP 67 Ca 0.02 -0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.03 1zg2 h TRP 67 Cb 0.74 0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.91 1zg2 h TRP 67 CO 0.09 -0.22 0.10 1.49 -2.79 0.00 0.00 178.44 177.11 1zg2 h GLU 68 N -0.37 0.22 -0.28 2.65 4.81 -1.55 -1.84 114.58 118.21 1zg2 h GLU 68 Ca -0.03 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.25 1zg2 h GLU 68 Cb 0.30 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.56 1zg2 h GLU 68 CO 0.04 0.14 -0.15 -0.92 -0.73 0.00 0.00 179.01 177.39 1zg2 h TYR 69 N 0.22 -0.38 0.18 0.92 3.20 -1.16 0.60 116.97 120.56 1zg2 h TYR 69 Ca 0.09 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.99 1zg2 h TYR 69 Cb 0.04 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.52 1zg2 h TYR 69 CO -0.10 -0.22 -0.09 1.49 -1.64 0.00 0.00 178.16 177.59 1zg2 h GLU 70 N -0.12 -0.24 -0.82 1.82 4.81 -0.79 -2.02 114.58 117.22 1zg2 h GLU 70 Ca 0.15 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1zg2 h GLU 70 Cb 0.34 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 1zg2 h GLU 70 CO -0.36 -0.16 0.43 0.28 -0.73 0.00 0.00 179.01 178.47 1zg2 h VAL 71 N -0.25 1.25 -0.09 0.32 2.07 -1.11 -1.49 116.25 116.94 1zg2 h VAL 71 Ca -0.02 -0.64 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 1zg2 h VAL 71 Cb 0.20 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1zg2 h VAL 71 CO 0.03 0.28 -0.04 0.11 0.02 0.00 0.00 177.57 177.97 1zg2 h LYS 72 N 1.16 0.12 -0.30 1.57 1.57 -0.61 -2.08 116.57 118.00 1zg2 h LYS 72 Ca 0.29 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1zg2 h LYS 72 Cb 0.06 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1zg2 h LYS 72 CO -0.04 0.18 0.00 0.72 -0.57 0.00 0.00 179.45 179.74 1zg2 n HIS 73 N -4.41 0.38 -2.54 -1.35 8.25 -0.63 -4.92 115.22 110.00 1zg2 n HIS 73 Ca -0.02 -0.19 -0.31 0.00 -0.26 0.00 0.00 57.72 56.95 1zg2 n HIS 73 Cb 0.17 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.25 1zg2 n HIS 73 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1zg2 s LEU 74 N -1.53 3.66 0.68 2.41 1.43 -0.79 -5.07 118.68 119.48 1zg2 s LEU 74 Ca 0.36 1.32 -0.12 0.00 -1.03 0.00 0.00 54.13 54.66 1zg2 s LEU 74 Cb 0.21 -4.25 0.00 0.00 0.03 0.00 0.00 46.19 42.18 1zg2 s LEU 74 CO 0.30 -0.54 1.06 -0.55 0.23 0.00 0.00 176.35 176.84 1zg2 s SER 75 N -3.33 5.40 0.37 2.29 0.15 -1.26 -4.81 113.70 112.50 1zg2 s SER 75 Ca 0.54 1.66 0.08 0.00 0.70 0.00 0.00 55.95 58.94 1zg2 s SER 75 Cb -0.10 -2.50 0.80 0.00 -1.71 0.00 0.00 66.02 62.51 1zg2 s SER 75 CO 0.35 -1.43 1.92 -0.09 1.20 0.00 0.00 173.24 175.19 1zg2 h ARG 76 N -0.54 0.67 -0.83 5.44 2.43 -1.97 -0.51 114.38 119.08 1zg2 h ARG 76 Ca -0.44 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 58.66 1zg2 h ARG 76 Cb 1.21 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.57 1zg2 h ARG 76 CO 0.57 0.45 0.43 -0.09 -1.51 0.00 0.00 179.97 179.81 1zg2 h ARG 77 N 0.70 1.18 0.00 0.20 2.43 -1.98 0.44 114.38 117.35 1zg2 h ARG 77 Ca 0.37 -0.16 -0.22 0.00 -0.81 0.00 0.00 59.98 59.17 1zg2 h ARG 77 Cb 0.51 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 1zg2 h ARG 77 CO -0.15 0.89 -1.14 -0.22 -1.51 0.00 0.00 179.97 177.85 1zg2 h LYS 78 N 1.17 0.00 -0.34 0.20 3.64 -1.72 0.86 116.57 120.39 1zg2 h LYS 78 Ca 0.29 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.64 1zg2 h LYS 78 Cb 0.08 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1zg2 h LYS 78 CO -0.04 0.79 0.08 -0.22 -2.27 0.00 0.00 179.45 177.79 1zg2 h LYS 79 N 0.00 0.54 -0.52 1.90 3.64 -0.68 0.85 116.57 122.30 1zg2 h LYS 79 Ca -0.08 -0.13 -0.12 0.00 -1.27 0.00 0.00 60.65 59.05 1zg2 h LYS 79 Cb 1.78 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.51 1zg2 h LYS 79 CO 0.11 0.59 -0.15 1.49 -2.27 0.00 0.00 179.45 179.22 1zg2 h GLU 80 N 0.39 1.01 -0.43 1.90 4.81 -0.14 -2.81 114.58 119.30 1zg2 h GLU 80 Ca 0.11 -0.40 0.08 0.00 -0.13 0.00 0.00 59.36 59.02 1zg2 h GLU 80 Cb 0.29 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.55 1zg2 h GLU 80 CO 0.00 1.08 -0.01 0.37 -0.73 0.00 0.00 179.01 179.72 1zg2 h GLN 81 N 0.89 0.09 -0.55 1.92 4.15 -0.62 0.73 115.11 121.72 1zg2 h GLN 81 Ca 0.13 -0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.58 1zg2 h GLN 81 Cb 0.73 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.36 1zg2 h GLN 81 CO 0.06 0.06 0.36 1.25 -1.93 0.00 0.00 178.83 178.63 1zg2 h LEU 82 N 0.10 0.51 0.12 -2.39 6.46 -0.59 -0.19 115.31 119.32 1zg2 h LEU 82 Ca 0.21 -0.00 -0.29 0.00 -0.12 0.00 0.00 57.88 57.68 1zg2 h LEU 82 Cb 0.31 -0.12 0.02 0.00 -0.73 0.00 0.00 40.66 40.14 1zg2 h LEU 82 CO -0.36 0.35 -1.26 0.58 -0.62 0.00 0.00 178.44 177.12 1zg2 h VAL 83 N 0.59 1.41 0.00 1.05 2.07 -1.12 -3.12 116.25 117.13 1zg2 h VAL 83 Ca 0.23 -2.83 -0.03 0.00 0.82 0.00 0.00 66.70 64.90 1zg2 h VAL 83 Cb 0.16 2.87 -0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1zg2 h VAL 83 CO -0.06 0.84 -0.12 0.28 0.02 0.00 0.00 177.57 178.52 1zg2 h SER 84 N 0.14 0.00 0.74 0.57 0.02 0.08 -0.61 113.55 114.50 1zg2 h SER 84 Ca -0.16 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.77 1zg2 h SER 84 Cb 1.96 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.50 1zg2 h SER 84 CO 0.22 0.12 -0.08 -0.07 -1.14 0.00 0.00 176.83 175.88 1zg2 h LEU 85 N 0.00 0.00 -5.90 5.07 3.38 -1.01 -3.31 115.31 113.54 1zg2 h LEU 85 Ca -0.00 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.31 1zg2 h LEU 85 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1zg2 h LEU 85 CO 0.02 0.08 2.99 1.17 0.09 0.00 0.00 178.44 182.78 1zg2 n LYS 86 N -3.27 2.57 -0.02 1.13 4.81 -0.24 -4.37 118.16 118.77 1zg2 n LYS 86 Ca -0.00 -2.23 0.13 0.00 -0.87 0.00 0.00 58.31 55.34 1zg2 n LYS 86 Cb 0.29 -3.03 0.40 0.00 0.02 0.00 0.00 35.03 32.71 1zg2 n LYS 86 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1zg2 n GLY 87 N 4.09 0.33 1.36 3.14 0.00 -1.25 -5.07 105.19 107.79 1zg2 n GLY 87 Ca 0.55 -0.51 0.18 0.00 0.00 0.00 0.00 46.02 46.24 1zg2 n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zg2 n GLY 88 N 1.22 -2.48 0.13 -0.02 0.00 -1.26 -3.71 105.19 99.07 1zg2 n GLY 88 Ca 0.18 -1.13 -0.02 0.00 0.00 0.00 0.00 46.02 45.04 1zg2 n GLY 88 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zg2 h PRO 89 N -1.29 0.00 0.00 1.61 0.13 -1.97 -3.39 132.00 127.09 1zg2 h PRO 89 Ca -0.06 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.05 1zg2 h PRO 89 Cb 1.27 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 1zg2 h PRO 89 CO 0.04 0.66 -0.04 2.48 -0.23 0.00 0.00 178.00 180.91 1zg2 n TYR 90 N -3.69 0.00 0.00 1.56 4.11 -1.26 -5.06 117.16 112.81 1zg2 n TYR 90 Ca -0.01 -0.07 0.00 0.00 -0.00 0.00 0.00 57.90 57.82 1zg2 n TYR 90 Cb 0.67 0.28 0.00 0.00 -0.00 0.00 0.00 39.34 40.29 1zg2 n TYR 90 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 1zg2 n GLU 91 N 0.00 0.00 0.00 -3.48 4.71 -1.24 -3.75 120.64 116.87 1zg2 n GLU 91 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.11 1zg2 n GLU 91 Cb 0.51 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.94 1zg2 n GLU 91 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1zg2 n ASN 92 N 1.49 0.00 -1.63 1.62 0.23 -1.26 -4.95 115.26 110.76 1zg2 n ASN 92 Ca 0.00 0.00 -0.12 0.00 -0.53 0.00 0.00 54.58 53.93 1zg2 n ASN 92 Cb 0.00 0.11 -0.04 0.00 -2.08 0.00 0.00 39.78 37.77 1zg2 n ASN 92 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1zg2 n THR 93 N -1.54 -0.15 0.62 5.53 -2.24 -1.25 -4.73 114.28 110.53 1zg2 n THR 93 Ca 0.00 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.85 1zg2 n THR 93 Cb 0.00 -1.30 0.02 0.00 -2.10 0.00 0.00 70.33 66.95 1zg2 n THR 93 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1zg2 n THR 94 N -2.20 0.00 -0.85 4.28 -1.04 -1.26 -4.96 114.28 108.25 1zg2 n THR 94 Ca -0.13 -0.41 0.00 0.00 -2.04 0.00 0.00 64.05 61.48 1zg2 n THR 94 Cb 0.45 1.22 0.00 0.00 -1.82 0.00 0.00 70.33 70.18 1zg2 n THR 94 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1zg2 n LYS 95 N 0.19 -0.54 0.00 -2.82 4.81 -1.26 -4.29 118.16 114.25 1zg2 n LYS 95 Ca 0.07 0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.64 1zg2 n LYS 95 Cb 0.32 -3.87 0.00 0.00 0.02 0.00 0.00 35.03 31.50 1zg2 n LYS 95 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1zg2 n LEU 96 N 0.00 0.00 -0.94 3.14 4.77 -1.26 -4.61 117.00 118.10 1zg2 n LEU 96 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 1zg2 n LEU 96 Cb 0.13 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 1zg2 n LEU 96 CO 0.00 0.00 -0.12 -1.20 -1.33 0.00 0.00 177.39 174.74 1zg2 n SER 97 N 1.96 -5.09 -4.32 -1.43 7.64 -1.26 -4.98 113.62 106.15 1zg2 n SER 97 Ca 0.00 0.30 -0.33 0.00 1.01 0.00 0.00 58.87 59.86 1zg2 n SER 97 Cb 0.00 -3.67 -0.15 0.00 -1.01 0.00 0.00 64.21 59.38 1zg2 n SER 97 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1zg2 s THR 98 N -2.25 2.77 0.00 0.44 -1.32 -1.26 -5.29 115.64 108.72 1zg2 s THR 98 Ca 0.00 -0.76 0.00 0.00 -1.21 0.00 0.00 61.69 59.72 1zg2 s THR 98 Cb 0.00 -2.14 0.00 0.00 -1.51 0.00 0.00 72.50 68.85 1zg2 s THR 98 CO 0.00 0.53 0.00 1.07 -2.21 0.00 0.00 174.62 174.01