#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 5.68 -0.74 7.83 -0.87 -1.26 -4.90 114.94 120.68 1zg2 s ASN 7 Ca 0.00 -1.30 -0.20 0.00 -1.57 0.00 0.00 52.86 49.80 1zg2 s ASN 7 Cb 0.00 -2.00 0.11 0.00 -0.02 0.00 0.00 41.25 39.33 1zg2 s ASN 7 CO 0.00 -0.48 0.93 -1.00 -2.57 0.00 0.00 177.10 173.98 1zg2 s HIS 8 N 1.48 2.98 -0.37 2.20 3.76 -1.16 -4.15 115.29 120.03 1zg2 s HIS 8 Ca 0.02 -1.03 -0.11 0.00 -0.15 0.00 0.00 55.06 53.79 1zg2 s HIS 8 Cb -0.22 -4.18 0.02 0.00 1.11 0.00 0.00 32.58 29.31 1zg2 s HIS 8 CO 0.04 -1.46 0.21 0.71 -0.85 0.00 0.00 174.74 173.39 1zg2 s TYR 9 N 2.98 3.23 -0.37 1.40 2.02 -0.86 -0.85 117.35 124.91 1zg2 s TYR 9 Ca 0.22 -0.86 -0.25 0.00 -0.37 0.00 0.00 57.07 55.81 1zg2 s TYR 9 Cb -0.15 -2.44 0.01 0.00 -0.40 0.00 0.00 41.96 38.99 1zg2 s TYR 9 CO 0.01 -0.61 0.88 0.08 -1.57 0.00 0.00 175.55 174.34 1zg2 s VAL 10 N 1.57 4.63 -0.06 0.71 1.01 0.11 -0.58 120.40 127.80 1zg2 s VAL 10 Ca 0.03 1.07 0.01 0.00 0.00 0.00 0.00 61.98 63.09 1zg2 s VAL 10 Cb -0.19 -4.29 -0.03 0.00 0.00 0.00 0.00 36.38 31.87 1zg2 s VAL 10 CO 0.07 -0.51 -0.07 -0.72 0.00 0.00 0.00 175.10 173.87 1zg2 s TYR 11 N 3.35 2.93 -0.30 5.22 -0.85 -0.40 0.23 117.35 127.53 1zg2 s TYR 11 Ca 0.36 0.01 0.03 0.00 -0.52 0.00 0.00 57.07 56.95 1zg2 s TYR 11 Cb -0.12 -1.70 0.08 0.00 0.38 0.00 0.00 41.96 40.60 1zg2 s TYR 11 CO 0.18 0.34 -0.01 -1.50 -1.52 0.00 0.00 175.55 173.04 1zg2 s ILE 12 N -0.83 2.02 -0.17 -3.49 2.07 -0.90 -2.33 121.20 117.57 1zg2 s ILE 12 Ca 0.13 -1.89 -0.09 0.00 -1.41 0.00 0.00 60.65 57.38 1zg2 s ILE 12 Cb -0.11 -2.35 -0.05 0.00 0.13 0.00 0.00 42.46 40.08 1zg2 s ILE 12 CO 0.02 -0.36 0.15 -0.76 -1.91 0.00 0.00 174.94 172.08 1zg2 s LEU 13 N 1.09 4.27 -0.53 8.50 1.43 -0.49 -1.66 118.68 131.29 1zg2 s LEU 13 Ca 0.02 0.34 -0.25 0.00 -1.03 0.00 0.00 54.13 53.21 1zg2 s LEU 13 Cb -0.19 -2.11 0.04 0.00 0.03 0.00 0.00 46.19 43.95 1zg2 s LEU 13 CO -0.08 0.25 1.00 -0.70 0.23 0.00 0.00 176.35 177.04 1zg2 s GLU 14 N -0.08 3.43 0.75 1.70 2.12 0.31 0.12 118.70 127.05 1zg2 s GLU 14 Ca 0.11 -0.03 -0.11 0.00 0.36 0.00 0.00 54.97 55.30 1zg2 s GLU 14 Cb -0.12 -4.01 0.04 0.00 0.26 0.00 0.00 34.13 30.31 1zg2 s GLU 14 CO 0.01 -1.46 1.08 0.00 -0.54 0.00 0.00 175.26 174.34 1zg2 h LYS 16 N -0.93 0.30 -0.00 0.00 3.64 -1.88 0.65 116.57 118.36 1zg2 h LYS 16 Ca -0.45 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1zg2 h LYS 16 Cb 1.24 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1zg2 h LYS 16 CO 0.57 0.23 -0.01 -0.40 -2.27 0.00 0.00 179.45 177.58 1zg2 n ASP 17 N -4.47 0.03 0.00 4.20 5.75 -1.26 -4.87 116.55 115.93 1zg2 n ASP 17 Ca 0.00 -0.46 0.00 0.00 -0.01 0.00 0.00 54.79 54.32 1zg2 n ASP 17 Cb 0.10 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 1zg2 n ASP 17 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1zg2 n GLY 18 N 1.19 0.81 3.64 6.12 0.00 0.22 -5.06 105.19 112.11 1zg2 n GLY 18 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.36 6.63 -0.08 1.61 0.01 -1.25 -4.81 113.70 113.45 1zg2 s SER 19 Ca 0.00 0.76 -0.30 0.00 1.31 0.00 0.00 55.95 57.73 1zg2 s SER 19 Cb 0.00 -2.34 -0.03 0.00 0.21 0.00 0.00 66.02 63.86 1zg2 s SER 19 CO 0.00 -0.33 1.16 0.26 0.41 0.00 0.00 173.24 174.74 1zg2 s TRP 20 N 2.27 3.24 -0.59 2.43 0.51 -1.26 -0.86 118.94 124.68 1zg2 s TRP 20 Ca 0.27 1.28 -0.21 0.00 -2.12 0.00 0.00 56.10 55.33 1zg2 s TRP 20 Cb -0.16 -3.38 0.07 0.00 -0.81 0.00 0.00 33.47 29.20 1zg2 s TRP 20 CO 0.09 -1.10 0.81 -0.47 -0.51 0.00 0.00 176.95 175.77 1zg2 s TYR 21 N 2.28 2.86 -0.36 -1.98 5.04 0.33 -4.83 117.35 120.69 1zg2 s TYR 21 Ca 0.54 -0.57 -0.11 0.00 -2.44 0.00 0.00 57.07 54.49 1zg2 s TYR 21 Cb -0.23 -4.01 0.02 0.00 0.35 0.00 0.00 41.96 38.09 1zg2 s TYR 21 CO 0.20 -1.37 0.20 0.99 -1.34 0.00 0.00 175.55 174.24 1zg2 s THR 22 N 3.36 4.65 -0.10 4.34 2.01 -1.26 -1.40 115.64 127.23 1zg2 s THR 22 Ca 0.19 -0.72 -0.30 0.00 0.31 0.00 0.00 61.69 61.17 1zg2 s THR 22 Cb -0.19 -3.53 0.12 0.00 0.01 0.00 0.00 72.50 68.91 1zg2 s THR 22 CO 0.11 -0.16 0.97 -0.83 -0.69 0.00 0.00 174.62 174.02 1zg2 s GLY 23 N 1.58 -0.35 0.01 4.40 0.00 -0.99 -5.04 107.32 106.94 1zg2 s GLY 23 Ca 0.03 1.61 0.02 0.00 0.00 0.00 0.00 44.72 46.38 1zg2 s GLY 23 CO 0.07 0.74 0.01 -2.52 0.00 0.00 0.00 173.10 171.39 1zg2 s TYR 24 N -1.94 3.08 -0.12 1.90 1.13 -1.26 -1.28 117.35 118.86 1zg2 s TYR 24 Ca 0.01 0.08 -0.07 0.00 -1.41 0.00 0.00 57.07 55.68 1zg2 s TYR 24 Cb -0.01 -1.66 -0.04 0.00 -1.10 0.00 0.00 41.96 39.15 1zg2 s TYR 24 CO -0.03 0.47 0.15 -0.08 -2.51 0.00 0.00 175.55 173.55 1zg2 s THR 25 N -1.12 5.49 -0.42 -3.49 -1.32 0.25 -4.92 115.64 110.11 1zg2 s THR 25 Ca 0.21 0.23 0.09 0.00 -1.21 0.00 0.00 61.69 61.00 1zg2 s THR 25 Cb -0.12 -3.41 0.35 0.00 -1.51 0.00 0.00 72.50 67.81 1zg2 s THR 25 CO 0.12 0.61 1.05 0.41 -2.21 0.00 0.00 174.62 174.59 1zg2 n THR 26 N 2.09 0.02 -4.07 5.08 -1.04 -1.26 -2.03 114.28 113.07 1zg2 n THR 26 Ca -0.20 -2.32 -0.12 0.00 -2.04 0.00 0.00 64.05 59.38 1zg2 n THR 26 Cb 0.55 0.96 -0.11 0.00 -1.82 0.00 0.00 70.33 69.91 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 -1.65 0.84 0.62 8.00 -4.77 -1.26 -4.86 116.67 113.59 1zg2 s ASP 27 Ca 0.27 -0.64 0.37 0.00 -3.30 0.00 0.00 52.55 49.25 1zg2 s ASP 27 Cb 0.33 0.06 2.05 0.00 -1.09 0.00 0.00 42.92 44.27 1zg2 s ASP 27 CO -0.06 -0.27 2.27 1.62 0.70 0.00 0.00 175.17 179.43 1zg2 h VAL 28 N 4.19 0.22 0.00 2.11 3.04 -2.01 -1.36 116.25 122.45 1zg2 h VAL 28 Ca -0.35 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 1zg2 h VAL 28 Cb 1.19 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 31.57 1zg2 h VAL 28 CO 0.46 0.02 0.00 0.47 -1.01 0.00 0.00 177.57 177.50 1zg2 n ASP 29 N -3.36 0.00 -0.01 3.17 8.00 -1.26 -3.10 116.55 119.98 1zg2 n ASP 29 Ca -0.03 0.26 -0.09 0.00 0.71 0.00 0.00 54.79 55.65 1zg2 n ASP 29 Cb 0.12 -0.39 -0.03 0.00 -0.02 0.00 0.00 41.12 40.80 1zg2 n ASP 29 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1zg2 h ARG 30 N 0.00 -0.11 -0.06 -1.24 2.43 -1.66 -0.13 114.38 113.61 1zg2 h ARG 30 Ca 0.00 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1zg2 h ARG 30 Cb 0.24 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1zg2 h ARG 30 CO 0.00 -0.07 -0.04 0.00 -1.51 0.00 0.00 179.97 178.34 1zg2 h ARG 31 N -0.12 0.13 -0.41 0.20 3.08 -1.78 -2.55 114.38 112.93 1zg2 h ARG 31 Ca 0.09 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1zg2 h ARG 31 Cb 0.25 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1zg2 h ARG 31 CO -0.22 0.55 0.21 0.97 -1.07 0.00 0.00 179.97 180.41 1zg2 h ILE 32 N -0.29 1.14 -0.23 2.04 2.10 -1.69 0.14 117.51 120.72 1zg2 h ILE 32 Ca 0.01 -0.37 0.00 0.00 1.08 0.00 0.00 64.86 65.58 1zg2 h ILE 32 Cb 0.52 0.60 -0.01 0.00 -1.09 0.00 0.00 36.82 36.84 1zg2 h ILE 32 CO 0.01 0.16 0.15 0.11 -1.08 0.00 0.00 178.15 177.49 1zg2 h LYS 33 N 0.58 0.31 -0.73 2.19 1.57 -0.92 -0.50 116.57 119.06 1zg2 h LYS 33 Ca 0.15 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1zg2 h LYS 33 Cb 0.04 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.25 1zg2 h LYS 33 CO -0.02 0.22 0.42 -0.22 -0.57 0.00 0.00 179.45 179.28 1zg2 h LYS 34 N 0.30 1.00 -0.29 3.15 1.63 -0.83 -0.66 116.57 120.87 1zg2 h LYS 34 Ca 0.08 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 59.78 1zg2 h LYS 34 Cb -0.01 -0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 31.40 1zg2 h LYS 34 CO -0.02 0.72 0.16 1.25 -3.45 0.00 0.00 179.45 178.11 1zg2 h HIS 35 N 1.02 0.40 -0.74 1.91 2.76 -0.24 0.19 115.15 120.45 1zg2 h HIS 35 Ca 0.26 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.40 1zg2 h HIS 35 Cb -0.01 -0.13 -0.04 0.00 1.55 0.00 0.00 27.41 28.79 1zg2 h HIS 35 CO 0.01 0.33 0.37 0.00 -1.30 0.00 0.00 177.93 177.34 1zg2 h ALA 36 N 1.03 1.26 0.00 5.26 0.00 -0.76 -1.93 119.26 124.13 1zg2 h ALA 36 Ca 0.10 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1zg2 h ALA 36 Cb 0.07 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1zg2 h ALA 36 CO -0.02 0.58 0.00 0.43 0.00 0.00 0.00 179.25 180.24 1zg2 n SER 37 N -4.34 0.12 0.00 0.00 7.64 -0.29 -3.58 113.62 113.17 1zg2 n SER 37 Ca 0.07 0.52 0.03 0.00 1.01 0.00 0.00 58.87 60.50 1zg2 n SER 37 Cb 0.12 -0.55 0.15 0.00 -1.01 0.00 0.00 64.21 62.93 1zg2 n SER 37 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1zg2 n GLY 38 N 0.93 -0.65 1.97 0.23 0.00 0.62 -4.84 105.19 103.44 1zg2 n GLY 38 Ca 0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 1zg2 n GLY 38 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1zg2 n LYS 39 N -0.62 -0.71 0.00 1.61 0.00 -1.23 -4.99 118.16 112.22 1zg2 n LYS 39 Ca 0.04 0.99 0.00 0.00 0.00 0.00 0.00 58.31 59.34 1zg2 n LYS 39 Cb 0.02 -2.90 0.00 0.00 0.00 0.00 0.00 35.03 32.15 1zg2 n LYS 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1zg2 n GLY 40 N -0.64 -0.02 5.43 3.14 0.00 -1.26 -5.09 105.19 106.76 1zg2 n GLY 40 Ca 0.03 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1zg2 n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zg2 n ALA 41 N -0.47 0.00 -4.04 4.61 0.00 -1.26 -4.32 120.51 115.02 1zg2 n ALA 41 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1zg2 n ALA 41 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.29 1zg2 n ALA 41 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1zg2 s LYS 42 N 0.00 2.26 -0.22 0.00 2.20 -1.26 -5.09 119.74 117.63 1zg2 s LYS 42 Ca 0.00 -1.00 -0.26 0.00 -0.36 0.00 0.00 55.97 54.35 1zg2 s LYS 42 Cb 0.00 -2.60 -0.01 0.00 -1.51 0.00 0.00 37.83 33.72 1zg2 s LYS 42 CO 0.00 -0.44 0.87 -0.47 -0.36 0.00 0.00 175.35 174.95 1zg2 s TYR 43 N 1.28 3.35 0.00 4.03 5.04 -1.26 -4.77 117.35 125.02 1zg2 s TYR 43 Ca -0.03 1.23 0.00 0.00 -2.44 0.00 0.00 57.07 55.84 1zg2 s TYR 43 Cb -0.17 -3.08 0.00 0.00 0.35 0.00 0.00 41.96 39.06 1zg2 s TYR 43 CO -0.08 -0.37 0.29 -2.37 -1.34 0.00 0.00 175.55 171.68 1zg2 n THR 44 N 5.11 0.00 -0.54 4.34 5.66 -1.26 -5.15 114.28 122.44 1zg2 n THR 44 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1zg2 n THR 44 Cb 0.48 0.06 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 1zg2 n THR 44 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 1zg2 n ARG 45 N 0.00 0.00 -2.40 1.09 1.85 -1.26 -4.89 116.66 111.04 1zg2 n ARG 45 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.73 1zg2 n ARG 45 Cb 0.51 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.92 1zg2 n ARG 45 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1zg2 n GLY 46 N 0.00 -0.09 3.10 2.89 0.00 -1.26 -4.93 105.19 104.90 1zg2 n GLY 46 Ca 0.00 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.25 1zg2 n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zg2 n ARG 47 N -2.35 4.01 -3.09 1.61 1.74 -1.26 -4.88 116.66 112.44 1zg2 n ARG 47 Ca -0.12 -4.29 0.00 0.00 -0.77 0.00 0.00 57.85 52.68 1zg2 n ARG 47 Cb 0.60 -2.64 0.00 0.00 -1.02 0.00 0.00 32.46 29.39 1zg2 n ARG 47 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1zg2 n GLY 48 N 2.15 -0.64 1.83 -0.13 0.00 -1.26 -4.90 105.19 102.24 1zg2 n GLY 48 Ca 0.29 -0.66 -0.15 0.00 0.00 0.00 0.00 46.02 45.50 1zg2 n GLY 48 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1zg2 n PRO 49 N 0.00 2.32 -2.80 1.61 -0.04 -1.26 -5.10 135.00 129.74 1zg2 n PRO 49 Ca 0.00 -3.07 -0.34 0.00 -0.04 0.00 0.00 63.50 60.04 1zg2 n PRO 49 Cb 0.00 -2.06 -0.07 0.00 -0.04 0.00 0.00 33.50 31.33 1zg2 n PRO 49 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1zg2 s PHE 50 N -3.23 3.42 0.59 0.54 -0.12 -1.26 -3.92 117.98 113.99 1zg2 s PHE 50 Ca 0.52 1.67 0.08 0.00 -0.05 0.00 0.00 56.93 59.15 1zg2 s PHE 50 Cb 0.45 -2.88 0.08 0.00 -0.63 0.00 0.00 43.02 40.04 1zg2 s PHE 50 CO 0.08 -0.03 0.69 1.03 -0.05 0.00 0.00 175.22 176.94 1zg2 s ARG 51 N -2.81 2.23 -0.09 1.99 3.00 0.20 -4.89 118.95 118.58 1zg2 s ARG 51 Ca 0.58 -1.82 0.02 0.00 0.00 0.00 0.00 55.73 54.52 1zg2 s ARG 51 Cb -0.12 -2.45 0.01 0.00 0.00 0.00 0.00 34.95 32.38 1zg2 s ARG 51 CO 0.17 -0.86 -0.17 -1.17 0.00 0.00 0.00 175.30 173.27 1zg2 s LEU 52 N -4.58 1.80 -0.21 2.53 0.20 -1.26 -0.53 118.68 116.62 1zg2 s LEU 52 Ca 0.53 -0.43 -0.16 0.00 0.69 0.00 0.00 54.13 54.76 1zg2 s LEU 52 Cb -0.04 -1.10 -0.10 0.00 -0.43 0.00 0.00 46.19 44.52 1zg2 s LEU 52 CO 0.34 0.06 -0.21 0.52 -0.29 0.00 0.00 176.35 176.76 1zg2 n VAL 53 N 3.92 1.50 -3.81 1.68 0.31 -0.67 -4.87 118.33 116.41 1zg2 n VAL 53 Ca -0.20 -0.06 -0.09 0.00 -0.01 0.00 0.00 64.34 63.98 1zg2 n VAL 53 Cb 0.52 -2.14 -0.04 0.00 -0.91 0.00 0.00 33.84 31.27 1zg2 n VAL 53 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1zg2 s ALA 54 N -2.63 -0.84 -0.07 3.52 0.00 -1.23 -4.88 121.76 115.63 1zg2 s ALA 54 Ca -0.30 -0.37 -0.03 0.00 0.00 0.00 0.00 51.96 51.26 1zg2 s ALA 54 Cb 0.08 0.89 0.04 0.00 0.00 0.00 0.00 23.12 24.13 1zg2 s ALA 54 CO 0.45 -0.85 0.15 0.99 0.00 0.00 0.00 175.76 176.50 1zg2 s THR 55 N -3.91 -0.04 0.13 0.00 2.01 -1.26 -2.11 115.64 110.46 1zg2 s THR 55 Ca 0.12 0.16 0.06 0.00 0.31 0.00 0.00 61.69 62.34 1zg2 s THR 55 Cb -0.02 -0.25 -0.04 0.00 0.01 0.00 0.00 72.50 72.20 1zg2 s THR 55 CO 0.01 0.07 0.02 0.26 -0.69 0.00 0.00 174.62 174.29 1zg2 s TRP 56 N 1.09 2.97 -0.13 4.92 0.51 0.14 -4.93 118.94 123.50 1zg2 s TRP 56 Ca -0.08 -0.06 -0.02 0.00 -2.12 0.00 0.00 56.10 53.81 1zg2 s TRP 56 Cb -0.11 -1.47 0.04 0.00 -0.81 0.00 0.00 33.47 31.12 1zg2 s TRP 56 CO -0.06 0.50 0.01 0.00 -0.51 0.00 0.00 176.95 176.89 1zg2 s ALA 57 N -1.54 0.89 -0.05 0.98 0.00 -1.26 0.09 121.76 120.86 1zg2 s ALA 57 Ca 0.27 -0.42 0.04 0.00 0.00 0.00 0.00 51.96 51.86 1zg2 s ALA 57 Cb -0.11 -0.95 -0.00 0.00 0.00 0.00 0.00 23.12 22.06 1zg2 s ALA 57 CO 0.19 -0.77 -0.17 -0.06 0.00 0.00 0.00 175.76 174.95 1zg2 s PHE 58 N 1.90 1.71 -0.35 0.00 0.08 -0.03 -5.01 117.98 116.27 1zg2 s PHE 58 Ca 0.02 -0.51 0.24 0.00 0.12 0.00 0.00 56.93 56.81 1zg2 s PHE 58 Cb -0.14 -1.16 0.49 0.00 -0.57 0.00 0.00 43.02 41.64 1zg2 s PHE 58 CO -0.07 -0.19 1.66 -1.00 -0.10 0.00 0.00 175.22 175.53 1zg2 h PRO 59 N 6.34 0.00 -5.85 0.24 0.13 -1.91 -3.06 132.00 127.89 1zg2 h PRO 59 Ca -0.32 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.24 1zg2 h PRO 59 Cb 1.18 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.24 1zg2 h PRO 59 CO 0.48 0.01 0.06 -1.12 -0.23 0.00 0.00 178.00 177.20 1zg2 s SER 60 N -6.14 6.83 0.16 1.44 0.01 -1.26 -4.86 113.70 109.88 1zg2 s SER 60 Ca 0.06 1.00 -0.14 0.00 1.31 0.00 0.00 55.95 58.18 1zg2 s SER 60 Cb 0.06 -2.37 0.04 0.00 0.21 0.00 0.00 66.02 63.96 1zg2 s SER 60 CO 0.65 -0.15 1.77 0.50 0.41 0.00 0.00 173.24 176.42 1zg2 h LYS 61 N 6.99 0.69 -0.51 12.44 3.64 -1.95 -1.69 116.57 136.17 1zg2 h LYS 61 Ca -0.38 -0.08 -0.07 0.00 -1.27 0.00 0.00 60.65 58.86 1zg2 h LYS 61 Cb 1.17 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 1zg2 h LYS 61 CO 0.76 0.54 0.04 0.93 -2.27 0.00 0.00 179.45 179.45 1zg2 h GLU 62 N 0.66 0.83 -0.23 1.90 3.07 -1.99 -1.56 114.58 117.25 1zg2 h GLU 62 Ca 0.17 -0.21 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 1zg2 h GLU 62 Cb 0.05 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 27.84 1zg2 h GLU 62 CO -0.03 0.81 0.07 1.49 -1.40 0.00 0.00 179.01 179.95 1zg2 h GLU 63 N 0.78 0.36 -0.31 2.33 4.57 -1.91 -0.55 114.58 119.85 1zg2 h GLU 63 Ca 0.16 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1zg2 h GLU 63 Cb 0.41 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.94 1zg2 h GLU 63 CO 0.01 0.45 0.18 0.00 -1.18 0.00 0.00 179.01 178.47 1zg2 h ALA 64 N 0.90 0.40 -0.47 2.92 0.00 -1.01 0.21 119.26 122.21 1zg2 h ALA 64 Ca 0.07 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1zg2 h ALA 64 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1zg2 h ALA 64 CO -0.00 -0.09 0.10 0.52 0.00 0.00 0.00 179.25 179.78 1zg2 h MET 65 N 0.39 0.76 0.10 0.00 2.86 -1.25 -2.45 114.93 115.34 1zg2 h MET 65 Ca 0.11 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1zg2 h MET 65 Cb 0.03 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.60 1zg2 h MET 65 CO -0.02 0.75 -0.05 -0.09 1.06 0.00 0.00 176.91 178.56 1zg2 h ARG 66 N 0.64 -0.13 0.18 1.72 2.43 -0.83 -1.46 114.38 116.93 1zg2 h ARG 66 Ca 0.15 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1zg2 h ARG 66 Cb 0.34 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 1zg2 h ARG 66 CO 0.00 -0.07 -0.28 2.35 -1.51 0.00 0.00 179.97 180.47 1zg2 h TRP 67 N -0.16 -0.74 -0.72 2.20 7.01 -0.49 0.10 115.95 123.15 1zg2 h TRP 67 Ca -0.01 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.00 1zg2 h TRP 67 Cb 0.12 0.30 -0.04 0.00 -2.10 0.00 0.00 29.16 27.45 1zg2 h TRP 67 CO -0.06 -0.39 0.47 1.49 -2.79 0.00 0.00 178.44 177.16 1zg2 h GLU 68 N -0.53 0.95 -0.12 2.65 4.81 -1.47 -2.07 114.58 118.80 1zg2 h GLU 68 Ca 0.01 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.22 1zg2 h GLU 68 Cb 0.53 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.65 1zg2 h GLU 68 CO -0.12 0.64 -0.12 -0.92 -0.73 0.00 0.00 179.01 177.76 1zg2 h TYR 69 N 0.98 -0.29 0.22 0.92 3.20 -0.69 -2.21 116.97 119.09 1zg2 h TYR 69 Ca 0.26 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 1zg2 h TYR 69 Cb -0.10 0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.32 1zg2 h TYR 69 CO -0.02 -0.18 -0.11 0.93 -1.64 0.00 0.00 178.16 177.15 1zg2 h GLU 70 N -0.14 -0.28 -0.63 1.82 5.08 -0.49 -2.73 114.58 117.21 1zg2 h GLU 70 Ca 0.08 0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 1zg2 h GLU 70 Cb 0.26 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 1zg2 h GLU 70 CO -0.20 -0.12 0.42 0.28 -1.00 0.00 0.00 179.01 178.38 1zg2 h VAL 71 N -0.38 0.98 -0.10 3.13 2.07 -1.31 -0.33 116.25 120.30 1zg2 h VAL 71 Ca -0.03 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 1zg2 h VAL 71 Cb 0.29 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1zg2 h VAL 71 CO 0.05 0.11 -0.12 0.11 0.02 0.00 0.00 177.57 177.73 1zg2 h LYS 72 N 0.58 0.25 0.00 1.57 1.57 -1.25 -3.15 116.57 116.14 1zg2 h LYS 72 Ca 0.28 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1zg2 h LYS 72 Cb 0.34 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1zg2 h LYS 72 CO -0.08 0.70 0.00 0.72 -0.57 0.00 0.00 179.45 180.21 1zg2 n HIS 73 N -4.62 0.05 -2.09 -1.35 8.25 -0.98 -4.82 115.22 109.67 1zg2 n HIS 73 Ca -0.07 0.02 -0.40 0.00 -0.26 0.00 0.00 57.72 57.01 1zg2 n HIS 73 Cb 0.35 -0.53 -0.01 0.00 1.12 0.00 0.00 29.99 30.92 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 -3.09 4.32 0.52 2.41 1.43 -0.17 -5.02 118.68 119.08 1zg2 s LEU 74 Ca 0.13 2.67 -0.18 0.00 -1.03 0.00 0.00 54.13 55.73 1zg2 s LEU 74 Cb 0.18 -3.78 -0.07 0.00 0.03 0.00 0.00 46.19 42.55 1zg2 s LEU 74 CO 0.51 -0.69 1.01 -0.44 0.23 0.00 0.00 176.35 176.97 1zg2 s SER 75 N -0.62 6.35 0.14 2.29 0.01 -1.26 -4.83 113.70 115.78 1zg2 s SER 75 Ca 0.53 1.73 0.00 0.00 1.31 0.00 0.00 55.95 59.52 1zg2 s SER 75 Cb -0.39 -2.53 0.34 0.00 0.21 0.00 0.00 66.02 63.65 1zg2 s SER 75 CO 0.51 -0.78 0.74 0.54 0.41 0.00 0.00 173.24 174.66 1zg2 n ARG 76 N -1.49 -0.04 0.19 12.44 1.74 -1.26 0.84 116.66 129.09 1zg2 n ARG 76 Ca 0.08 0.71 0.13 0.00 -0.77 0.00 0.00 57.85 58.00 1zg2 n ARG 76 Cb 0.53 -1.11 0.69 0.00 -1.02 0.00 0.00 32.46 31.55 1zg2 n ARG 76 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1zg2 h ARG 77 N 0.00 0.00 -0.72 5.56 2.43 -2.00 0.14 114.38 119.80 1zg2 h ARG 77 Ca 0.28 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.38 1zg2 h ARG 77 Cb 0.55 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.07 1zg2 h ARG 77 CO -0.45 0.00 0.19 1.57 -1.51 0.00 0.00 179.97 179.77 1zg2 h LYS 78 N 0.00 1.14 0.00 0.20 -0.00 0.12 0.16 116.57 118.19 1zg2 h LYS 78 Ca 0.00 -0.27 -0.21 0.00 -0.00 0.00 0.00 60.65 60.18 1zg2 h LYS 78 Cb 0.07 -0.15 -0.01 0.00 -0.00 0.00 0.00 32.23 32.13 1zg2 h LYS 78 CO 0.00 0.99 -0.90 -0.22 -0.00 0.00 0.00 179.45 179.33 1zg2 h LYS 79 N 1.08 0.27 -0.46 0.07 3.64 -0.89 0.86 116.57 121.14 1zg2 h LYS 79 Ca 0.23 -0.29 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 1zg2 h LYS 79 Cb 0.35 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1zg2 h LYS 79 CO -0.00 1.00 0.05 0.93 -2.27 0.00 0.00 179.45 179.17 1zg2 h GLU 80 N 0.15 0.77 -0.09 1.90 5.08 -1.39 -3.05 114.58 117.95 1zg2 h GLU 80 Ca -0.06 -0.22 -0.19 0.00 -1.00 0.00 0.00 59.36 57.90 1zg2 h GLU 80 Cb 1.53 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 30.70 1zg2 h GLU 80 CO 0.14 0.80 -0.68 0.37 -1.00 0.00 0.00 179.01 178.64 1zg2 h GLN 81 N 0.63 0.62 -0.50 2.33 5.75 -0.30 -3.01 115.11 120.62 1zg2 h GLN 81 Ca 0.14 -0.54 0.08 0.00 -0.15 0.00 0.00 58.65 58.17 1zg2 h GLN 81 Cb 0.42 0.13 -0.07 0.00 1.07 0.00 0.00 27.48 29.03 1zg2 h GLN 81 CO 0.01 1.16 0.13 1.25 -2.65 0.00 0.00 178.83 178.73 1zg2 h LEU 82 N 0.25 0.06 -0.66 -2.39 5.85 0.71 0.04 115.31 119.18 1zg2 h LEU 82 Ca -0.06 0.08 -0.14 0.00 0.84 0.00 0.00 57.88 58.60 1zg2 h LEU 82 Cb 1.33 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.45 1zg2 h LEU 82 CO 0.14 0.06 -0.46 0.58 -0.34 0.00 0.00 178.44 178.42 1zg2 h VAL 83 N 0.28 1.31 0.00 1.05 2.07 -1.62 -2.50 116.25 116.83 1zg2 h VAL 83 Ca 0.25 -1.66 0.00 0.00 0.82 0.00 0.00 66.70 66.11 1zg2 h VAL 83 Cb 0.32 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1zg2 h VAL 83 CO -0.30 0.52 0.00 0.28 0.02 0.00 0.00 177.57 178.08 1zg2 h SER 84 N 0.40 0.00 1.06 0.57 0.02 -1.13 -1.68 113.55 112.79 1zg2 h SER 84 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1zg2 h SER 84 Cb 0.96 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.50 1zg2 h SER 84 CO 0.09 0.00 -0.72 0.25 -1.14 0.00 0.00 176.83 175.30 1zg2 h LEU 85 N 0.00 0.00 -5.98 5.07 6.46 -0.60 -3.40 115.31 116.86 1zg2 h LEU 85 Ca 0.00 -0.09 0.03 0.00 -0.12 0.00 0.00 57.88 57.70 1zg2 h LEU 85 Cb 0.45 0.00 -0.20 0.00 -0.73 0.00 0.00 40.66 40.18 1zg2 h LEU 85 CO 0.00 0.04 -0.35 -0.75 -0.62 0.00 0.00 178.44 176.76 1zg2 s LYS 86 N -3.26 0.56 0.00 1.25 2.36 -0.65 -4.88 119.74 115.12 1zg2 s LYS 86 Ca 0.03 0.32 0.00 0.00 -2.55 0.00 0.00 55.97 53.78 1zg2 s LYS 86 Cb 0.11 0.19 0.00 0.00 -1.05 0.00 0.00 37.83 37.08 1zg2 s LYS 86 CO 0.75 -0.98 0.00 0.41 1.55 0.00 0.00 175.35 177.08 1zg2 n GLY 87 N 5.13 1.06 1.26 5.54 0.00 -1.07 -4.52 105.19 112.60 1zg2 n GLY 87 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 0.00 -3.99 3.49 -0.02 0.00 -1.17 -4.77 105.19 98.73 1zg2 n GLY 88 Ca 0.00 -0.89 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 1zg2 n GLY 88 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1zg2 s PRO 89 N -4.78 3.45 0.27 1.61 0.04 -1.26 -4.81 135.00 129.51 1zg2 s PRO 89 Ca 0.00 -1.21 0.16 0.00 0.04 0.00 0.00 61.00 59.98 1zg2 s PRO 89 Cb 0.00 -4.83 0.06 0.00 0.04 0.00 0.00 34.50 29.77 1zg2 s PRO 89 CO 0.00 -1.96 1.40 1.88 0.04 0.00 0.00 177.00 178.36 1zg2 h TYR 90 N 9.41 0.00 0.00 0.56 -1.99 -1.99 -3.31 116.97 119.65 1zg2 h TYR 90 Ca 0.03 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1zg2 h TYR 90 Cb 1.03 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.76 1zg2 h TYR 90 CO 1.16 0.47 -1.39 -0.85 -0.00 0.00 0.00 178.16 177.55 1zg2 n GLU 91 N -3.18 0.61 -0.63 4.88 0.28 -1.26 -4.30 120.64 117.03 1zg2 n GLU 91 Ca 0.01 -0.09 -0.11 0.00 -0.16 0.00 0.00 57.16 56.81 1zg2 n GLU 91 Cb 0.73 -1.44 0.05 0.00 1.43 0.00 0.00 31.44 32.21 1zg2 n GLU 91 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1zg2 n ASN 92 N -1.81 4.68 0.10 -1.84 4.05 -1.25 -4.09 115.26 115.10 1zg2 n ASN 92 Ca 0.00 -2.76 0.00 0.00 0.45 0.00 0.00 54.58 52.28 1zg2 n ASN 92 Cb 0.41 -0.84 0.32 0.00 1.23 0.00 0.00 39.78 40.90 1zg2 n ASN 92 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 1zg2 h THR 93 N 0.67 1.23 -3.66 -0.44 1.35 -1.76 -3.42 112.91 106.87 1zg2 h THR 93 Ca 0.24 -1.05 -0.19 0.00 -0.55 0.00 0.00 66.41 64.85 1zg2 h THR 93 Cb 1.34 1.35 -0.25 0.00 -1.73 0.00 0.00 68.15 68.86 1zg2 h THR 93 CO 0.50 0.32 -0.64 0.28 -0.25 0.00 0.00 175.52 175.74 1zg2 s THR 94 N -4.54 0.04 -2.46 6.82 -1.32 -1.26 -5.03 115.64 107.89 1zg2 s THR 94 Ca -0.05 -0.31 0.28 0.00 -1.21 0.00 0.00 61.69 60.40 1zg2 s THR 94 Cb 0.15 -0.18 0.54 0.00 -1.51 0.00 0.00 72.50 71.49 1zg2 s THR 94 CO 0.75 -0.17 1.74 1.17 -2.21 0.00 0.00 174.62 175.90 1zg2 n LYS 95 N 2.48 1.62 0.00 7.08 4.81 -1.26 -4.97 118.16 127.93 1zg2 n LYS 95 Ca -0.16 -0.94 0.00 0.00 -0.87 0.00 0.00 58.31 56.33 1zg2 n LYS 95 Cb 0.58 -1.48 0.00 0.00 0.02 0.00 0.00 35.03 34.15 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 0.13 0.00 0.00 3.14 4.32 -1.26 -4.15 117.00 119.18 1zg2 n LEU 96 Ca 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.18 1zg2 n LEU 96 Cb 0.35 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.15 1zg2 n LEU 96 CO 0.17 0.00 0.00 -1.20 -1.22 0.00 0.00 177.39 175.14 1zg2 n SER 97 N 3.05 0.00 -3.60 -1.43 7.64 -1.26 -5.16 113.62 112.86 1zg2 n SER 97 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 1zg2 n SER 97 Cb 0.00 0.30 -0.05 0.00 -1.01 0.00 0.00 64.21 63.45 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 -0.60 0.00 -2.57 0.44 -1.32 -1.26 -5.27 115.64 105.06 1zg2 s THR 98 Ca 0.00 0.00 0.27 0.00 -1.21 0.00 0.00 61.69 60.75 1zg2 s THR 98 Cb 0.00 -1.00 0.50 0.00 -1.51 0.00 0.00 72.50 70.49 1zg2 s THR 98 CO 0.00 0.00 1.68 0.35 -2.21 0.00 0.00 174.62 174.44