#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 7.21 -0.27 3.17 -0.87 -1.26 -4.52 114.94 118.40 1zg2 s ASN 7 Ca 0.00 1.49 -0.18 0.00 -1.57 0.00 0.00 52.86 52.59 1zg2 s ASN 7 Cb 0.00 -2.54 -0.02 0.00 -0.02 0.00 0.00 41.25 38.67 1zg2 s ASN 7 CO 0.00 -0.38 0.53 -1.00 -2.57 0.00 0.00 177.10 173.68 1zg2 s HIS 8 N 1.75 3.26 -0.21 2.20 3.76 0.14 -3.83 115.29 122.36 1zg2 s HIS 8 Ca 0.47 0.63 -0.09 0.00 -0.15 0.00 0.00 55.06 55.93 1zg2 s HIS 8 Cb -0.19 -2.75 -0.04 0.00 1.11 0.00 0.00 32.58 30.71 1zg2 s HIS 8 CO 0.19 -0.30 0.10 0.71 -0.85 0.00 0.00 174.74 174.59 1zg2 s TYR 9 N 2.35 3.28 -0.37 1.40 2.02 0.22 -0.31 117.35 125.93 1zg2 s TYR 9 Ca 0.22 0.11 -0.06 0.00 -0.37 0.00 0.00 57.07 56.96 1zg2 s TYR 9 Cb -0.16 -2.15 0.06 0.00 -0.40 0.00 0.00 41.96 39.31 1zg2 s TYR 9 CO 0.09 0.11 0.15 0.08 -1.57 0.00 0.00 175.55 174.42 1zg2 s VAL 10 N 0.65 3.80 -0.13 0.71 1.01 0.93 -2.15 120.40 125.20 1zg2 s VAL 10 Ca 0.05 -1.33 -0.01 0.00 0.00 0.00 0.00 61.98 60.69 1zg2 s VAL 10 Cb -0.13 -3.25 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 1zg2 s VAL 10 CO 0.01 -0.33 -0.11 -0.72 0.00 0.00 0.00 175.10 173.96 1zg2 s TYR 11 N 1.37 2.86 -0.31 5.22 1.13 -0.25 -0.33 117.35 127.03 1zg2 s TYR 11 Ca 0.01 -0.54 -0.09 0.00 -1.41 0.00 0.00 57.07 55.03 1zg2 s TYR 11 Cb -0.21 -1.86 -0.00 0.00 -1.10 0.00 0.00 41.96 38.79 1zg2 s TYR 11 CO 0.02 -0.15 0.15 0.42 -2.51 0.00 0.00 175.55 173.47 1zg2 s ILE 12 N 0.31 4.52 -0.17 -3.49 -1.09 0.20 -0.20 121.20 121.28 1zg2 s ILE 12 Ca -0.09 -0.48 -0.02 0.00 -2.23 0.00 0.00 60.65 57.83 1zg2 s ILE 12 Cb -0.15 -3.32 -0.01 0.00 -1.58 0.00 0.00 42.46 37.39 1zg2 s ILE 12 CO 0.05 0.05 -0.08 -0.76 -1.23 0.00 0.00 174.94 172.97 1zg2 s LEU 13 N 1.60 2.88 -0.33 2.97 1.43 -0.49 -0.91 118.68 125.82 1zg2 s LEU 13 Ca 0.04 -0.31 -0.21 0.00 -1.03 0.00 0.00 54.13 52.62 1zg2 s LEU 13 Cb -0.17 -1.69 -0.00 0.00 0.03 0.00 0.00 46.19 44.36 1zg2 s LEU 13 CO 0.06 0.10 0.66 -0.70 0.23 0.00 0.00 176.35 176.70 1zg2 s GLU 14 N 0.76 3.80 0.76 1.70 2.12 0.11 -0.17 118.70 127.79 1zg2 s GLU 14 Ca -0.03 0.23 -0.02 0.00 0.36 0.00 0.00 54.97 55.50 1zg2 s GLU 14 Cb -0.15 -3.77 0.14 0.00 0.26 0.00 0.00 34.13 30.62 1zg2 s GLU 14 CO 0.02 -0.67 1.05 0.00 -0.54 0.00 0.00 175.26 175.11 1zg2 h LYS 16 N -0.70 0.42 0.00 0.00 2.10 -1.87 0.20 116.57 116.73 1zg2 h LYS 16 Ca -0.36 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 1zg2 h LYS 16 Cb 1.26 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 1zg2 h LYS 16 CO 0.38 0.28 0.00 -0.25 -2.00 0.00 0.00 179.45 177.86 1zg2 n ASP 17 N -4.50 0.46 0.00 7.07 9.92 -1.26 -4.81 116.55 123.42 1zg2 n ASP 17 Ca 0.17 0.61 0.00 0.00 -0.53 0.00 0.00 54.79 55.04 1zg2 n ASP 17 Cb 0.61 -0.71 0.00 0.00 -0.64 0.00 0.00 41.12 40.38 1zg2 n ASP 17 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1zg2 n GLY 18 N 0.13 0.54 3.85 0.44 0.00 0.06 -5.04 105.19 105.17 1zg2 n GLY 18 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1zg2 n GLY 18 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1zg2 s SER 19 N -2.00 6.77 -0.22 1.61 0.15 -1.26 -4.83 113.70 113.92 1zg2 s SER 19 Ca 0.00 0.93 -0.09 0.00 0.70 0.00 0.00 55.95 57.49 1zg2 s SER 19 Cb 0.00 -2.24 -0.04 0.00 -1.71 0.00 0.00 66.02 62.03 1zg2 s SER 19 CO 0.00 0.26 0.11 0.26 1.20 0.00 0.00 173.24 175.08 1zg2 s TRP 20 N -1.20 3.26 -0.22 3.44 0.51 -1.26 -0.94 118.94 122.51 1zg2 s TRP 20 Ca 0.28 0.07 -0.19 0.00 -2.12 0.00 0.00 56.10 54.14 1zg2 s TRP 20 Cb -0.16 -2.20 -0.03 0.00 -0.81 0.00 0.00 33.47 30.27 1zg2 s TRP 20 CO 0.15 0.03 0.53 -0.47 -0.51 0.00 0.00 176.95 176.68 1zg2 s TYR 21 N 0.92 3.33 -0.61 -1.98 5.04 0.77 -4.88 117.35 119.94 1zg2 s TYR 21 Ca 0.06 0.74 -0.18 0.00 -2.44 0.00 0.00 57.07 55.25 1zg2 s TYR 21 Cb -0.13 -2.71 0.12 0.00 0.35 0.00 0.00 41.96 39.59 1zg2 s TYR 21 CO 0.03 -0.18 0.68 0.99 -1.34 0.00 0.00 175.55 175.73 1zg2 s THR 22 N 1.94 4.95 0.05 4.34 2.01 -1.26 -1.40 115.64 126.27 1zg2 s THR 22 Ca 0.23 -1.23 -0.06 0.00 0.31 0.00 0.00 61.69 60.95 1zg2 s THR 22 Cb -0.15 -4.47 -0.05 0.00 0.01 0.00 0.00 72.50 67.84 1zg2 s THR 22 CO 0.09 -1.08 0.29 -0.83 -0.69 0.00 0.00 174.62 172.40 1zg2 s GLY 23 N 3.53 2.25 -0.07 4.40 0.00 0.72 -4.94 107.32 113.21 1zg2 s GLY 23 Ca 0.11 -0.59 -0.00 0.00 0.00 0.00 0.00 44.72 44.23 1zg2 s GLY 23 CO 0.04 -0.45 -0.02 -0.47 0.00 0.00 0.00 173.10 172.20 1zg2 s TYR 24 N -1.41 0.76 0.12 1.90 5.04 -1.26 -1.09 117.35 121.41 1zg2 s TYR 24 Ca 0.32 -0.23 -0.10 0.00 -2.44 0.00 0.00 57.07 54.63 1zg2 s TYR 24 Cb -0.13 -0.79 -0.00 0.00 0.35 0.00 0.00 41.96 41.39 1zg2 s TYR 24 CO 0.20 -0.30 0.25 -0.08 -1.34 0.00 0.00 175.55 174.28 1zg2 s THR 25 N 1.58 0.11 -0.39 4.34 -1.32 -0.91 -5.00 115.64 114.05 1zg2 s THR 25 Ca -0.01 -1.20 0.05 0.00 -1.21 0.00 0.00 61.69 59.33 1zg2 s THR 25 Cb -0.13 -1.51 0.17 0.00 -1.51 0.00 0.00 72.50 69.51 1zg2 s THR 25 CO -0.04 -0.48 0.49 0.28 -2.21 0.00 0.00 174.62 172.66 1zg2 s THR 26 N -3.90 -0.64 -0.00 5.08 -1.32 -1.26 0.69 115.64 114.30 1zg2 s THR 26 Ca 0.09 -0.53 0.01 0.00 -1.21 0.00 0.00 61.69 60.05 1zg2 s THR 26 Cb 0.04 -0.39 -0.00 0.00 -1.51 0.00 0.00 72.50 70.64 1zg2 s THR 26 CO -0.07 -0.32 -0.05 1.51 -2.21 0.00 0.00 174.62 173.49 1zg2 s ASP 27 N 1.65 0.53 0.17 8.08 1.47 -1.25 -4.86 116.67 122.45 1zg2 s ASP 27 Ca 0.16 -0.10 0.16 0.00 1.18 0.00 0.00 52.55 53.95 1zg2 s ASP 27 Cb -0.10 -0.05 0.75 0.00 -0.34 0.00 0.00 42.92 43.18 1zg2 s ASP 27 CO -0.06 0.04 1.49 0.55 0.68 0.00 0.00 175.17 177.88 1zg2 n VAL 28 N 2.90 1.17 -0.17 2.11 3.14 -1.26 -3.37 118.33 122.86 1zg2 n VAL 28 Ca -0.13 0.44 -0.10 0.00 -2.96 0.00 0.00 64.34 61.58 1zg2 n VAL 28 Cb 0.58 -1.37 0.02 0.00 -1.06 0.00 0.00 33.84 32.02 1zg2 n VAL 28 CO 0.00 0.00 0.00 -0.78 -6.46 0.00 0.00 176.83 169.59 1zg2 h ASP 29 N 0.00 1.01 -0.91 6.55 3.58 -1.99 -1.40 116.42 123.25 1zg2 h ASP 29 Ca 0.00 -0.36 0.14 0.00 0.42 0.00 0.00 57.03 57.23 1zg2 h ASP 29 Cb 0.16 -0.28 -0.07 0.00 1.72 0.00 0.00 39.33 40.86 1zg2 h ASP 29 CO 0.00 1.15 0.59 -0.09 -2.88 0.00 0.00 179.24 178.00 1zg2 h ARG 30 N 0.87 0.75 0.35 0.28 2.43 -1.91 0.61 114.38 117.76 1zg2 h ARG 30 Ca 0.13 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 1zg2 h ARG 30 Cb 0.73 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 1zg2 h ARG 30 CO 0.06 0.49 -0.17 0.00 -1.51 0.00 0.00 179.97 178.84 1zg2 h ARG 31 N 0.77 -0.45 -0.15 0.20 2.47 -1.47 -2.52 114.38 113.23 1zg2 h ARG 31 Ca 0.46 0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 59.19 1zg2 h ARG 31 Cb 0.65 0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 29.06 1zg2 h ARG 31 CO -0.22 -0.14 -0.00 0.97 0.56 0.00 0.00 179.97 181.14 1zg2 h ILE 32 N -0.79 1.10 -0.86 2.04 2.10 -1.11 -1.41 117.51 118.58 1zg2 h ILE 32 Ca -0.05 -0.39 -0.00 0.00 1.08 0.00 0.00 64.86 65.50 1zg2 h ILE 32 Cb 0.52 1.00 -0.04 0.00 -1.09 0.00 0.00 36.82 37.20 1zg2 h ILE 32 CO 0.08 0.13 0.52 0.11 -1.08 0.00 0.00 178.15 177.91 1zg2 h LYS 33 N 0.21 1.16 -0.50 2.19 6.56 -0.82 0.36 116.57 125.73 1zg2 h LYS 33 Ca 0.05 -0.10 0.05 0.00 -1.06 0.00 0.00 60.65 59.59 1zg2 h LYS 33 Cb 0.15 -0.25 -0.05 0.00 -0.57 0.00 0.00 32.23 31.52 1zg2 h LYS 33 CO 0.00 0.81 0.23 -0.22 -2.06 0.00 0.00 179.45 178.22 1zg2 h LYS 34 N 1.18 0.44 0.07 3.15 3.64 -0.81 0.43 116.57 124.66 1zg2 h LYS 34 Ca 0.31 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1zg2 h LYS 34 Cb -0.06 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1zg2 h LYS 34 CO -0.06 0.29 -0.03 1.25 -2.27 0.00 0.00 179.45 178.63 1zg2 h HIS 35 N 0.45 -0.09 -0.82 1.91 2.76 -1.16 -1.75 115.15 116.45 1zg2 h HIS 35 Ca 0.23 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.39 1zg2 h HIS 35 Cb 0.17 0.03 -0.04 0.00 1.55 0.00 0.00 27.41 29.12 1zg2 h HIS 35 CO -0.12 0.26 0.48 0.00 -1.30 0.00 0.00 177.93 177.25 1zg2 h ALA 36 N 0.46 1.05 0.00 5.26 0.00 -0.05 -2.20 119.26 123.79 1zg2 h ALA 36 Ca -0.01 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1zg2 h ALA 36 Cb 0.38 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1zg2 h ALA 36 CO 0.02 0.53 -0.18 1.03 0.00 0.00 0.00 179.25 180.64 1zg2 h SER 37 N 1.13 0.00 0.01 0.00 0.87 -0.18 -3.26 113.55 112.13 1zg2 h SER 37 Ca 0.29 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 1zg2 h SER 37 Cb -0.02 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 1zg2 h SER 37 CO -0.05 0.18 0.00 1.23 -0.53 0.00 0.00 176.83 177.66 1zg2 h GLY 38 N 2.92 0.00 0.89 5.77 0.00 -0.64 0.48 103.07 112.49 1zg2 h GLY 38 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 1zg2 h GLY 38 CO 0.02 0.00 -0.05 0.50 0.00 0.00 0.00 176.54 177.02 1zg2 h LYS 39 N 0.00 -0.13 0.00 4.80 1.57 -1.70 -3.13 116.57 117.99 1zg2 h LYS 39 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1zg2 h LYS 39 Cb 0.01 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1zg2 h LYS 39 CO 0.00 0.02 -1.15 0.41 -0.57 0.00 0.00 179.45 178.15 1zg2 n GLY 40 N -0.84 -1.34 4.33 3.86 0.00 -0.78 -4.96 105.19 105.46 1zg2 n GLY 40 Ca -0.08 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.10 0.00 -2.74 4.61 0.00 0.16 -4.80 120.51 115.64 1zg2 n ALA 41 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 1zg2 n ALA 41 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.91 1zg2 n ALA 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1zg2 s LYS 42 N 0.00 1.15 -0.19 0.00 -2.85 -1.26 -4.81 119.74 111.79 1zg2 s LYS 42 Ca 0.00 -1.14 -0.06 0.00 -1.00 0.00 0.00 55.97 53.77 1zg2 s LYS 42 Cb 0.00 0.38 0.09 0.00 -2.06 0.00 0.00 37.83 36.24 1zg2 s LYS 42 CO 0.00 -0.42 0.36 -0.47 0.10 0.00 0.00 175.35 174.92 1zg2 s TYR 43 N -3.96 -0.68 0.00 1.78 6.14 -1.26 -5.11 117.35 114.26 1zg2 s TYR 43 Ca 0.16 1.22 0.00 0.00 0.64 0.00 0.00 57.07 59.09 1zg2 s TYR 43 Cb 0.03 0.14 0.00 0.00 0.42 0.00 0.00 41.96 42.55 1zg2 s TYR 43 CO -0.01 -0.49 0.72 2.41 0.64 0.00 0.00 175.55 178.82 1zg2 n THR 44 N 5.37 0.00 0.00 4.34 -1.04 -1.26 -4.77 114.28 116.92 1zg2 n THR 44 Ca -0.07 1.22 0.00 0.00 -2.04 0.00 0.00 64.05 63.16 1zg2 n THR 44 Cb 0.50 -2.04 0.00 0.00 -1.82 0.00 0.00 70.33 66.96 1zg2 n THR 44 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1zg2 n ARG 45 N -1.39 0.00 0.00 -2.82 1.74 -1.26 -4.92 116.66 108.01 1zg2 n ARG 45 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1zg2 n ARG 45 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1zg2 n ARG 45 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1zg2 n GLY 46 N 0.00 -1.90 2.09 -0.13 0.00 -1.26 -5.14 105.19 98.85 1zg2 n GLY 46 Ca 0.00 0.74 -0.03 0.00 0.00 0.00 0.00 46.02 46.73 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 -2.99 -0.19 1.61 3.00 -1.26 -5.06 116.66 111.77 1zg2 n ARG 47 Ca 0.00 2.41 0.00 0.00 -0.00 0.00 0.00 57.85 60.26 1zg2 n ARG 47 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 32.46 29.01 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 1.09 2.60 3.49 5.14 0.00 -1.26 -4.47 105.19 111.77 1zg2 n GLY 48 Ca -0.20 -0.78 -0.43 0.00 0.00 0.00 0.00 46.02 44.60 1zg2 n GLY 48 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1zg2 s PRO 49 N 0.48 3.23 -0.30 1.61 0.05 -1.26 -5.10 135.00 133.72 1zg2 s PRO 49 Ca 0.00 -0.55 -0.00 0.00 0.05 0.00 0.00 61.00 60.50 1zg2 s PRO 49 Cb 0.00 -4.08 0.09 0.00 0.05 0.00 0.00 34.50 30.56 1zg2 s PRO 49 CO 0.00 -1.40 0.07 -0.06 0.05 0.00 0.00 177.00 175.66 1zg2 s PHE 50 N 3.42 2.05 -0.39 0.56 0.08 -1.26 -3.58 117.98 118.86 1zg2 s PHE 50 Ca 0.24 -1.88 -0.18 0.00 0.12 0.00 0.00 56.93 55.23 1zg2 s PHE 50 Cb -0.15 -1.85 0.01 0.00 -0.57 0.00 0.00 43.02 40.45 1zg2 s PHE 50 CO 0.16 -0.86 0.49 1.03 -0.10 0.00 0.00 175.22 175.93 1zg2 s ARG 51 N 1.50 3.39 -0.09 0.44 0.52 0.50 -4.81 118.95 120.40 1zg2 s ARG 51 Ca 0.08 -0.42 -0.30 0.00 -0.52 0.00 0.00 55.73 54.57 1zg2 s ARG 51 Cb -0.18 -3.88 -0.04 0.00 0.52 0.00 0.00 34.95 31.37 1zg2 s ARG 51 CO -0.20 -0.75 1.55 -1.17 0.02 0.00 0.00 175.30 174.75 1zg2 s LEU 52 N 2.33 4.26 -0.16 2.53 0.20 -1.26 0.08 118.68 126.66 1zg2 s LEU 52 Ca 0.16 2.05 -0.16 0.00 0.69 0.00 0.00 54.13 56.88 1zg2 s LEU 52 Cb -0.16 -3.53 -0.13 0.00 -0.43 0.00 0.00 46.19 41.94 1zg2 s LEU 52 CO 0.14 -0.90 0.16 0.58 -0.29 0.00 0.00 176.35 176.04 1zg2 h VAL 53 N 5.59 0.66 -3.33 1.68 2.07 -1.39 -3.39 116.25 118.13 1zg2 h VAL 53 Ca -0.35 -1.67 -0.03 0.00 0.82 0.00 0.00 66.70 65.47 1zg2 h VAL 53 Cb 1.16 1.42 -0.10 0.00 -1.52 0.00 0.00 31.29 32.24 1zg2 h VAL 53 CO 0.96 0.22 0.01 0.00 0.02 0.00 0.00 177.57 178.79 1zg2 s ALA 54 N -2.48 -0.91 -0.20 1.67 0.00 -1.23 -1.43 121.76 117.18 1zg2 s ALA 54 Ca -0.18 -0.21 -0.10 0.00 0.00 0.00 0.00 51.96 51.46 1zg2 s ALA 54 Cb 0.02 0.84 0.07 0.00 0.00 0.00 0.00 23.12 24.05 1zg2 s ALA 54 CO 0.40 -0.78 0.48 0.99 0.00 0.00 0.00 175.76 176.86 1zg2 s THR 55 N -3.87 -0.15 0.25 0.00 2.01 -1.26 -0.63 115.64 112.00 1zg2 s THR 55 Ca 0.09 0.08 0.11 0.00 0.31 0.00 0.00 61.69 62.28 1zg2 s THR 55 Cb -0.01 -0.72 -0.05 0.00 0.01 0.00 0.00 72.50 71.74 1zg2 s THR 55 CO -0.04 0.03 -0.19 0.26 -0.69 0.00 0.00 174.62 173.99 1zg2 s TRP 56 N 1.69 2.34 -0.15 4.92 0.51 0.55 -4.93 118.94 123.87 1zg2 s TRP 56 Ca -0.08 -0.32 -0.04 0.00 -2.12 0.00 0.00 56.10 53.53 1zg2 s TRP 56 Cb -0.08 -1.07 0.05 0.00 -0.81 0.00 0.00 33.47 31.56 1zg2 s TRP 56 CO -0.15 0.63 0.07 0.00 -0.51 0.00 0.00 176.95 177.00 1zg2 s ALA 57 N -2.19 0.51 -0.12 0.98 0.00 -1.26 -0.05 121.76 119.64 1zg2 s ALA 57 Ca 0.27 -0.29 0.02 0.00 0.00 0.00 0.00 51.96 51.96 1zg2 s ALA 57 Cb -0.06 -0.98 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 1zg2 s ALA 57 CO 0.14 -1.03 -0.18 -0.06 0.00 0.00 0.00 175.76 174.62 1zg2 s PHE 58 N 2.08 2.69 -0.40 0.00 0.08 0.58 -4.86 117.98 118.16 1zg2 s PHE 58 Ca 0.02 -0.88 0.26 0.00 0.12 0.00 0.00 56.93 56.46 1zg2 s PHE 58 Cb -0.15 -1.79 0.98 0.00 -0.57 0.00 0.00 43.02 41.49 1zg2 s PHE 58 CO -0.08 -0.34 1.78 -1.35 -0.10 0.00 0.00 175.22 175.13 1zg2 h PRO 59 N 6.77 0.00 -5.90 0.24 0.11 -1.85 0.39 132.00 131.76 1zg2 h PRO 59 Ca -0.23 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.30 1zg2 h PRO 59 Cb 1.22 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 1zg2 h PRO 59 CO 0.52 0.00 0.32 -1.12 -0.21 0.00 0.00 178.00 177.50 1zg2 s SER 60 N -4.82 6.91 0.07 -2.05 0.01 -1.26 -4.57 113.70 107.99 1zg2 s SER 60 Ca 0.05 1.12 -0.29 0.00 1.31 0.00 0.00 55.95 58.14 1zg2 s SER 60 Cb 0.09 -2.43 -0.18 0.00 0.21 0.00 0.00 66.02 63.72 1zg2 s SER 60 CO 0.50 -0.35 1.60 0.50 0.41 0.00 0.00 173.24 175.89 1zg2 h LYS 61 N 7.31 -0.56 -0.19 12.44 3.64 -1.90 -2.35 116.57 134.95 1zg2 h LYS 61 Ca -0.31 0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.04 1zg2 h LYS 61 Cb 1.14 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 1zg2 h LYS 61 CO 0.82 -0.35 -0.21 1.05 -2.27 0.00 0.00 179.45 178.49 1zg2 h GLU 62 N -0.64 0.33 -0.35 1.90 9.09 -1.99 -1.16 114.58 121.76 1zg2 h GLU 62 Ca -0.06 -0.10 -0.10 0.00 0.05 0.00 0.00 59.36 59.14 1zg2 h GLU 62 Cb 0.48 -0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.54 1zg2 h GLU 62 CO 0.10 0.53 -0.19 1.49 0.05 0.00 0.00 179.01 180.99 1zg2 h GLU 63 N 0.30 0.75 -0.22 1.06 4.81 -1.96 -1.08 114.58 118.24 1zg2 h GLU 63 Ca 0.05 -0.34 -0.15 0.00 -0.13 0.00 0.00 59.36 58.80 1zg2 h GLU 63 Cb 0.55 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 1zg2 h GLU 63 CO 0.04 0.95 -0.46 0.00 -0.73 0.00 0.00 179.01 178.81 1zg2 h ALA 64 N 0.78 0.78 -0.22 2.92 0.00 -1.15 0.15 119.26 122.52 1zg2 h ALA 64 Ca 0.08 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1zg2 h ALA 64 Cb 0.74 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1zg2 h ALA 64 CO 0.06 0.66 0.11 1.98 0.00 0.00 0.00 179.25 182.06 1zg2 h MET 65 N 0.46 0.32 -0.58 0.00 1.85 -1.07 -0.78 114.93 115.14 1zg2 h MET 65 Ca 0.03 -0.04 0.00 0.00 -0.61 0.00 0.00 59.70 59.08 1zg2 h MET 65 Cb 0.98 -0.06 -0.03 0.00 0.43 0.00 0.00 31.60 32.93 1zg2 h MET 65 CO 0.09 0.32 0.37 0.00 -0.40 0.00 0.00 176.91 177.29 1zg2 h ARG 66 N 0.24 0.77 0.66 0.39 2.47 -1.12 -2.73 114.38 115.07 1zg2 h ARG 66 Ca 0.08 -0.06 -0.03 0.00 -1.26 0.00 0.00 59.98 58.71 1zg2 h ARG 66 Cb 0.10 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.24 1zg2 h ARG 66 CO -0.01 0.54 -0.48 2.35 0.56 0.00 0.00 179.97 182.93 1zg2 h TRP 67 N 0.78 -1.29 0.08 3.04 7.01 -0.53 0.56 115.95 125.60 1zg2 h TRP 67 Ca 0.21 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.22 1zg2 h TRP 67 Cb -0.05 0.48 -0.03 0.00 -2.10 0.00 0.00 29.16 27.45 1zg2 h TRP 67 CO -0.03 -0.69 -0.21 1.49 -2.79 0.00 0.00 178.44 176.21 1zg2 h GLU 68 N -1.10 -0.37 -0.05 2.65 4.81 -1.19 -0.55 114.58 118.77 1zg2 h GLU 68 Ca -0.08 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1zg2 h GLU 68 Cb 0.91 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 30.33 1zg2 h GLU 68 CO 0.04 -0.25 -0.19 -0.92 -0.73 0.00 0.00 179.01 176.96 1zg2 h TYR 69 N -0.38 -0.50 -0.40 0.92 3.20 -1.40 0.29 116.97 118.70 1zg2 h TYR 69 Ca 0.04 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 1zg2 h TYR 69 Cb 0.42 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 1zg2 h TYR 69 CO -0.22 -0.27 0.15 0.93 -1.64 0.00 0.00 178.16 177.11 1zg2 h GLU 70 N -0.28 0.60 -0.50 1.82 5.08 -0.71 -2.40 114.58 118.20 1zg2 h GLU 70 Ca 0.07 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 1zg2 h GLU 70 Cb 0.38 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1zg2 h GLU 70 CO -0.22 0.58 0.11 0.28 -1.00 0.00 0.00 179.01 178.77 1zg2 h VAL 71 N 0.50 1.21 -0.86 3.13 2.07 -0.82 -0.59 116.25 120.89 1zg2 h VAL 71 Ca 0.13 -0.77 0.10 0.00 0.82 0.00 0.00 66.70 66.98 1zg2 h VAL 71 Cb 0.21 0.71 -0.08 0.00 -1.52 0.00 0.00 31.29 30.62 1zg2 h VAL 71 CO -0.01 0.29 0.50 0.50 0.02 0.00 0.00 177.57 178.87 1zg2 h LYS 72 N 0.73 0.79 -0.59 1.57 3.64 0.07 -1.58 116.57 121.21 1zg2 h LYS 72 Ca 0.16 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1zg2 h LYS 72 Cb 0.28 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1zg2 h LYS 72 CO -0.00 0.52 0.00 -2.39 -2.27 0.00 0.00 179.45 175.31 1zg2 n HIS 73 N -4.73 0.77 -1.46 1.91 1.44 -0.96 -4.98 115.22 107.21 1zg2 n HIS 73 Ca 0.15 -0.40 -0.35 0.00 -2.01 0.00 0.00 57.72 55.11 1zg2 n HIS 73 Cb 0.31 -0.00 0.09 0.00 0.12 0.00 0.00 29.99 30.51 1zg2 n HIS 73 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1zg2 s LEU 74 N -1.18 3.34 0.79 2.39 1.43 -0.27 -5.00 118.68 120.17 1zg2 s LEU 74 Ca 0.44 2.39 -0.11 0.00 -1.03 0.00 0.00 54.13 55.82 1zg2 s LEU 74 Cb 0.24 -4.59 0.06 0.00 0.03 0.00 0.00 46.19 41.93 1zg2 s LEU 74 CO 0.32 -2.25 1.10 -0.94 0.23 0.00 0.00 176.35 174.81 1zg2 s SER 75 N -1.95 4.59 0.36 2.29 1.04 -1.26 -4.77 113.70 114.00 1zg2 s SER 75 Ca 0.75 1.28 0.07 0.00 0.48 0.00 0.00 55.95 58.53 1zg2 s SER 75 Cb -0.30 -2.01 0.78 0.00 0.10 0.00 0.00 66.02 64.58 1zg2 s SER 75 CO 0.45 -1.90 1.94 0.03 0.98 0.00 0.00 173.24 174.73 1zg2 h ARG 76 N -1.04 0.70 -0.37 4.02 3.08 -1.98 0.23 114.38 119.02 1zg2 h ARG 76 Ca -0.47 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 59.44 1zg2 h ARG 76 Cb 1.27 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 1zg2 h ARG 76 CO 0.60 0.46 -0.17 -0.09 -1.07 0.00 0.00 179.97 179.70 1zg2 h ARG 77 N 0.72 0.77 -0.54 0.04 2.43 -1.99 -0.15 114.38 115.66 1zg2 h ARG 77 Ca 0.34 -0.33 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1zg2 h ARG 77 Cb 0.38 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1zg2 h ARG 77 CO -0.12 0.95 -0.11 0.87 -1.51 0.00 0.00 179.97 180.05 1zg2 h LYS 78 N 0.56 1.01 -0.71 0.20 1.79 -1.67 -0.56 116.57 117.20 1zg2 h LYS 78 Ca 0.08 -0.37 -0.05 0.00 -2.18 0.00 0.00 60.65 58.14 1zg2 h LYS 78 Cb 0.71 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 31.27 1zg2 h LYS 78 CO 0.05 1.05 0.26 0.87 -1.08 0.00 0.00 179.45 180.60 1zg2 h LYS 79 N 0.90 1.08 -0.21 3.15 1.57 -0.47 -0.67 116.57 121.92 1zg2 h LYS 79 Ca 0.14 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 1zg2 h LYS 79 Cb 0.67 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1zg2 h LYS 79 CO 0.05 0.91 -0.23 1.49 -0.57 0.00 0.00 179.45 181.09 1zg2 h GLU 80 N 1.02 0.38 -0.62 3.15 4.81 -0.75 0.80 114.58 123.38 1zg2 h GLU 80 Ca 0.23 -0.13 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1zg2 h GLU 80 Cb 0.25 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1zg2 h GLU 80 CO -0.01 0.59 0.20 1.96 -0.73 0.00 0.00 179.01 181.02 1zg2 h GLN 81 N 0.34 0.95 0.00 1.92 1.08 -0.52 0.00 115.11 118.88 1zg2 h GLN 81 Ca 0.05 -0.20 -0.08 0.00 -1.45 0.00 0.00 58.65 56.98 1zg2 h GLN 81 Cb 0.60 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 1zg2 h GLN 81 CO 0.04 0.84 -0.36 -0.07 -0.95 0.00 0.00 178.83 178.33 1zg2 h LEU 82 N 0.88 0.00 -0.28 1.46 3.38 -0.64 -2.35 115.31 117.76 1zg2 h LEU 82 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1zg2 h LEU 82 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1zg2 h LEU 82 CO -0.01 0.36 -0.11 0.52 0.09 0.00 0.00 178.44 179.30 1zg2 n VAL 83 N -3.73 0.00 1.15 1.22 0.31 0.23 -3.45 118.33 114.06 1zg2 n VAL 83 Ca -0.01 -0.07 0.05 0.00 -0.01 0.00 0.00 64.34 64.30 1zg2 n VAL 83 Cb 0.45 -0.04 0.30 0.00 -0.91 0.00 0.00 33.84 33.65 1zg2 n VAL 83 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1zg2 n SER 84 N -0.87 0.00 -0.85 4.52 7.64 -0.07 -0.64 113.62 123.35 1zg2 n SER 84 Ca 0.15 -0.83 0.07 0.00 1.01 0.00 0.00 58.87 59.28 1zg2 n SER 84 Cb 0.28 0.00 0.22 0.00 -1.01 0.00 0.00 64.21 63.70 1zg2 n SER 84 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1zg2 n LEU 85 N -0.78 3.52 -4.69 -3.43 4.77 -1.22 -5.03 117.00 110.14 1zg2 n LEU 85 Ca 0.08 -2.45 -0.61 0.00 -0.03 0.00 0.00 56.01 53.00 1zg2 n LEU 85 Cb 0.04 -0.39 -0.08 0.00 -2.33 0.00 0.00 43.42 40.65 1zg2 n LEU 85 CO 0.06 0.72 1.13 1.17 -1.33 0.00 0.00 177.39 179.14 1zg2 n LYS 86 N 0.19 0.59 0.00 3.23 3.00 0.19 -2.60 118.16 122.75 1zg2 n LYS 86 Ca 0.17 0.22 0.00 0.00 -0.00 0.00 0.00 58.31 58.70 1zg2 n LYS 86 Cb 0.66 -1.81 0.00 0.00 0.00 0.00 0.00 35.03 33.89 1zg2 n LYS 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1zg2 n GLY 87 N 3.65 3.95 7.00 3.14 0.00 -0.51 -5.05 105.19 117.36 1zg2 n GLY 87 Ca 0.27 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 1.09 0.00 -0.02 0.00 -1.07 -4.81 105.19 100.38 1zg2 n GLY 88 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1zg2 n GLY 88 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1zg2 n PRO 89 N 3.38 2.03 -2.34 1.61 -0.04 -1.26 -5.01 135.00 133.38 1zg2 n PRO 89 Ca 0.00 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 1zg2 n PRO 89 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1zg2 n PRO 89 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1zg2 n TYR 90 N -0.44 2.68 0.00 0.54 0.18 -1.26 -4.89 117.16 113.97 1zg2 n TYR 90 Ca 0.00 -2.74 0.00 0.00 1.88 0.00 0.00 57.90 57.04 1zg2 n TYR 90 Cb 0.00 -1.72 0.00 0.00 -0.38 0.00 0.00 39.34 37.24 1zg2 n TYR 90 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1zg2 n GLU 91 N 2.27 0.00 -3.36 -3.48 -0.58 -1.26 -4.85 120.64 109.38 1zg2 n GLU 91 Ca 0.47 0.00 -0.24 0.00 -0.42 0.00 0.00 57.16 56.96 1zg2 n GLU 91 Cb 0.30 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.19 1zg2 n GLU 91 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1zg2 n ASN 92 N 0.00 -4.66 0.00 1.62 2.85 -1.26 -4.86 115.26 108.95 1zg2 n ASN 92 Ca 0.00 -0.43 0.00 0.00 -0.11 0.00 0.00 54.58 54.04 1zg2 n ASN 92 Cb 0.00 -3.79 0.00 0.00 1.24 0.00 0.00 39.78 37.23 1zg2 n ASN 92 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1zg2 n THR 93 N -4.25 0.00 -1.85 -0.44 -2.24 -1.26 -4.93 114.28 99.31 1zg2 n THR 93 Ca -0.03 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.37 1zg2 n THR 93 Cb 0.56 -0.31 -0.04 0.00 -2.10 0.00 0.00 70.33 68.44 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 -1.20 2.50 -1.70 4.28 -1.04 -1.26 -3.16 114.28 112.69 1zg2 n THR 94 Ca 0.00 -2.43 -0.03 0.00 -2.04 0.00 0.00 64.05 59.55 1zg2 n THR 94 Cb 0.20 -2.31 -0.03 0.00 -1.82 0.00 0.00 70.33 66.37 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 7.63 0.00 0.00 -2.82 4.81 -1.26 -5.04 118.16 121.47 1zg2 n LYS 95 Ca 0.48 -0.40 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 1zg2 n LYS 95 Cb 0.44 0.41 0.00 0.00 0.02 0.00 0.00 35.03 35.90 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 -0.42 3.14 4.77 -1.19 -1.37 117.00 121.93 1zg2 n LEU 96 Ca -0.11 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.86 1zg2 n LEU 96 Cb 0.43 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.51 1zg2 n LEU 96 CO -0.06 0.00 0.09 -1.20 -1.33 0.00 0.00 177.39 174.89 1zg2 n SER 97 N 1.74 -0.16 0.00 -1.43 7.64 -1.26 -4.93 113.62 115.22 1zg2 n SER 97 Ca 0.00 -0.46 0.00 0.00 1.01 0.00 0.00 58.87 59.42 1zg2 n SER 97 Cb 0.00 0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 1zg2 n SER 97 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1zg2 n THR 98 N 0.00 0.00 -0.63 0.44 -1.04 -0.47 -5.23 114.28 107.35 1zg2 n THR 98 Ca -0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 1zg2 n THR 98 Cb 0.28 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.79 1zg2 n THR 98 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50