#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zx8 n HIS -1 N 0.00 3.09 -3.44 4.41 -0.00 -1.26 -5.14 115.22 112.87 1zx8 n HIS -1 Ca 0.00 -3.96 0.00 0.00 -0.00 0.00 0.00 57.72 53.76 1zx8 n HIS -1 Cb 0.00 -0.47 0.00 0.00 -0.00 0.00 0.00 29.99 29.52 1zx8 n HIS -1 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1zx8 n HIS 0 N -0.07 -0.05 -3.72 4.41 -0.00 -1.26 -1.04 115.22 113.49 1zx8 n HIS 0 Ca 0.29 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.88 1zx8 n HIS 0 Cb 0.46 0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 30.31 1zx8 n HIS 0 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1zx8 s ARG 2 N -0.39 0.13 -0.10 -0.41 0.52 -1.26 -4.92 118.95 112.53 1zx8 s ARG 2 Ca 0.00 0.51 0.03 0.00 -0.52 0.00 0.00 55.73 55.75 1zx8 s ARG 2 Cb 0.00 -0.15 0.01 0.00 0.52 0.00 0.00 34.95 35.32 1zx8 s ARG 2 CO 0.00 -0.20 -0.18 0.08 0.02 0.00 0.00 175.30 175.01 1zx8 s VAL 3 N 1.53 1.67 -0.10 3.52 1.01 0.36 -1.19 120.40 127.21 1zx8 s VAL 3 Ca -0.06 -0.78 -0.13 0.00 0.00 0.00 0.00 61.98 61.02 1zx8 s VAL 3 Cb -0.11 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 1zx8 s VAL 3 CO -0.07 0.47 0.30 -0.70 0.00 0.00 0.00 175.10 175.10 1zx8 s GLU 4 N 0.62 3.97 -0.26 2.72 2.12 0.87 -0.11 118.70 128.64 1zx8 s GLU 4 Ca -0.14 0.15 -0.04 0.00 0.36 0.00 0.00 54.97 55.30 1zx8 s GLU 4 Cb -0.16 -3.31 0.01 0.00 0.26 0.00 0.00 34.13 30.92 1zx8 s GLU 4 CO 0.04 0.50 0.00 -0.51 -0.54 0.00 0.00 175.26 174.75 1zx8 s LEU 5 N -0.34 3.36 -0.35 2.70 1.43 -0.12 -0.97 118.68 124.40 1zx8 s LEU 5 Ca 0.19 -0.66 -0.09 0.00 -1.03 0.00 0.00 54.13 52.53 1zx8 s LEU 5 Cb -0.14 -1.77 0.02 0.00 0.03 0.00 0.00 46.19 44.33 1zx8 s LEU 5 CO 0.07 -0.12 0.16 -0.76 0.23 0.00 0.00 176.35 175.93 1zx8 s LEU 6 N 1.44 4.43 0.00 1.79 1.02 -0.27 -1.17 118.68 125.92 1zx8 s LEU 6 Ca 0.03 -0.93 0.00 0.00 0.02 0.00 0.00 54.13 53.25 1zx8 s LEU 6 Cb -0.16 -1.96 0.00 0.00 0.02 0.00 0.00 46.19 44.09 1zx8 s LEU 6 CO -0.01 -0.32 0.02 0.49 0.02 0.00 0.00 176.35 176.55 1zx8 n PHE 7 N 4.93 -3.15 0.10 0.29 3.72 -0.27 -1.05 117.46 122.03 1zx8 n PHE 7 Ca -0.13 -0.04 -0.18 0.00 -0.05 0.00 0.00 57.45 57.05 1zx8 n PHE 7 Cb 0.46 -0.01 -0.14 0.00 -0.94 0.00 0.00 39.48 38.85 1zx8 n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1zx8 h GLU 8 N 0.00 0.32 -0.03 -1.08 5.08 -1.92 -3.37 114.58 113.58 1zx8 h GLU 8 Ca -0.01 -0.55 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 1zx8 h GLU 8 Cb 0.03 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1zx8 h GLU 8 CO 0.01 1.24 -0.06 0.43 -1.00 0.00 0.00 179.01 179.63 1zx8 n SER 9 N -3.55 2.86 0.00 1.42 7.64 -1.26 -5.03 113.62 115.71 1zx8 n SER 9 Ca -0.13 -1.93 0.00 0.00 1.01 0.00 0.00 58.87 57.81 1zx8 n SER 9 Cb 1.05 0.06 0.00 0.00 -1.01 0.00 0.00 64.21 64.31 1zx8 n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1zx8 n GLY 10 N 1.36 -1.27 3.34 0.23 0.00 -1.26 -4.89 105.19 102.69 1zx8 n GLY 10 Ca 0.13 -1.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.03 1zx8 n GLY 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1zx8 s LYS 11 N -1.02 1.11 0.23 1.61 -2.85 -1.26 -1.11 119.74 116.44 1zx8 s LYS 11 Ca 0.00 -0.62 -0.10 0.00 -1.00 0.00 0.00 55.97 54.26 1zx8 s LYS 11 Cb 0.00 0.49 -0.01 0.00 -2.06 0.00 0.00 37.83 36.25 1zx8 s LYS 11 CO 0.00 -0.44 0.39 0.00 0.10 0.00 0.00 175.35 175.40 1zx8 s VAL 13 N -4.05 1.74 0.13 0.00 1.01 -0.19 -0.95 120.40 118.09 1zx8 s VAL 13 Ca 0.26 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.44 1zx8 s VAL 13 Cb 0.01 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1zx8 s VAL 13 CO 0.09 0.49 -0.13 0.27 0.00 0.00 0.00 175.10 175.82 1zx8 s ILE 14 N -0.03 3.13 -0.23 2.22 -4.36 0.85 -0.68 121.20 122.11 1zx8 s ILE 14 Ca -0.05 -1.46 -0.01 0.00 -0.26 0.00 0.00 60.65 58.87 1zx8 s ILE 14 Cb -0.13 -2.48 0.02 0.00 1.25 0.00 0.00 42.46 41.12 1zx8 s ILE 14 CO 0.03 0.04 -0.10 -0.62 0.24 0.00 0.00 174.94 174.54 1zx8 s ASP 15 N -2.36 4.02 -0.05 4.36 -1.08 0.33 -0.48 116.67 121.41 1zx8 s ASP 15 Ca 0.21 -0.79 0.04 0.00 -0.52 0.00 0.00 52.55 51.50 1zx8 s ASP 15 Cb -0.10 -1.62 -0.02 0.00 -1.46 0.00 0.00 42.92 39.71 1zx8 s ASP 15 CO 0.13 -0.08 -0.16 -0.76 0.52 0.00 0.00 175.17 174.82 1zx8 s LEU 16 N 1.32 2.64 -0.43 -1.34 1.43 -1.26 -1.81 118.68 119.23 1zx8 s LEU 16 Ca 0.01 -0.24 -0.26 0.00 -1.03 0.00 0.00 54.13 52.62 1zx8 s LEU 16 Cb -0.16 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.56 1zx8 s LEU 16 CO -0.07 0.34 0.94 0.21 0.23 0.00 0.00 176.35 178.00 1zx8 s ASN 17 N -0.71 6.57 0.00 2.29 3.84 -0.34 -4.33 114.94 122.26 1zx8 s ASN 17 Ca 0.11 0.30 0.09 0.00 0.21 0.00 0.00 52.86 53.58 1zx8 s ASN 17 Cb -0.11 -2.46 0.41 0.00 -0.55 0.00 0.00 41.25 38.54 1zx8 s ASN 17 CO 0.00 -0.99 1.26 -0.62 -2.79 0.00 0.00 177.10 173.96 1zx8 n GLU 18 N 7.06 0.04 0.28 0.43 1.02 -0.21 -2.38 120.64 126.89 1zx8 n GLU 18 Ca 0.07 0.31 0.16 0.00 -0.02 0.00 0.00 57.16 57.67 1zx8 n GLU 18 Cb 0.48 -1.50 0.81 0.00 -0.02 0.00 0.00 31.44 31.22 1zx8 n GLU 18 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1zx8 h GLU 19 N 0.00 0.00 -6.48 3.49 5.08 -1.92 -3.38 114.58 111.37 1zx8 h GLU 19 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 1zx8 h GLU 19 Cb 0.14 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1zx8 h GLU 19 CO 0.00 0.07 0.24 0.71 -1.00 0.00 0.00 179.01 179.03 1zx8 s TYR 20 N -4.04 3.83 0.24 4.33 2.02 -1.00 -4.97 117.35 117.75 1zx8 s TYR 20 Ca -0.02 1.65 -0.06 0.00 -0.37 0.00 0.00 57.07 58.27 1zx8 s TYR 20 Cb 0.12 -2.88 0.28 0.00 -0.40 0.00 0.00 41.96 39.08 1zx8 s TYR 20 CO 0.54 0.34 1.88 1.49 -1.57 0.00 0.00 175.55 178.23 1zx8 h GLU 21 N 5.11 1.07 -0.36 -0.62 4.57 -1.90 -2.20 114.58 120.24 1zx8 h GLU 21 Ca -0.45 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 57.63 1zx8 h GLU 21 Cb 1.21 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 29.54 1zx8 h GLU 21 CO 0.69 0.71 0.05 -0.24 -1.18 0.00 0.00 179.01 179.04 1zx8 h VAL 22 N 1.10 1.18 -0.32 0.32 3.04 -1.93 -1.58 116.25 118.06 1zx8 h VAL 22 Ca 0.36 -0.67 -0.13 0.00 -1.01 0.00 0.00 66.70 65.24 1zx8 h VAL 22 Cb 0.02 0.85 -0.00 0.00 -2.01 0.00 0.00 31.29 30.15 1zx8 h VAL 22 CO -0.12 0.24 -0.32 0.58 -1.01 0.00 0.00 177.57 176.93 1zx8 h VAL 23 N 0.52 1.29 -0.73 1.51 2.07 -1.70 -0.13 116.25 119.08 1zx8 h VAL 23 Ca 0.12 -1.49 0.08 0.00 0.82 0.00 0.00 66.70 66.23 1zx8 h VAL 23 Cb 0.25 1.51 -0.07 0.00 -1.52 0.00 0.00 31.29 31.47 1zx8 h VAL 23 CO 0.00 0.49 0.40 0.11 0.02 0.00 0.00 177.57 178.59 1zx8 h LYS 24 N 0.56 0.68 -0.05 1.57 1.57 -1.06 -1.54 116.57 118.31 1zx8 h LYS 24 Ca 0.05 -0.04 -0.23 0.00 -1.87 0.00 0.00 60.65 58.56 1zx8 h LYS 24 Cb 0.90 -0.15 0.01 0.00 0.08 0.00 0.00 32.23 33.07 1zx8 h LYS 24 CO 0.08 0.45 -0.90 -0.07 -0.57 0.00 0.00 179.45 178.43 1zx8 h LEU 25 N 0.70 0.73 -0.95 2.94 3.38 -1.18 -3.18 115.31 117.74 1zx8 h LEU 25 Ca 0.35 -0.54 0.04 0.00 0.09 0.00 0.00 57.88 57.82 1zx8 h LEU 25 Cb 0.30 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 1zx8 h LEU 25 CO -0.23 1.33 0.62 -0.07 0.09 0.00 0.00 178.44 180.18 1zx8 h LEU 26 N 0.35 1.01 -1.05 1.67 3.38 -0.83 -2.48 115.31 117.36 1zx8 h LEU 26 Ca -0.08 -0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.07 1zx8 h LEU 26 Cb 1.53 -0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.96 1zx8 h LEU 26 CO 0.17 0.68 0.61 0.50 0.09 0.00 0.00 178.44 180.49 1zx8 h LYS 27 N 1.17 0.73 0.00 1.13 3.64 -1.26 -0.95 116.57 121.03 1zx8 h LYS 27 Ca 0.39 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1zx8 h LYS 27 Cb 0.05 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1zx8 h LYS 27 CO -0.14 0.48 -0.03 0.93 -2.27 0.00 0.00 179.45 178.42 1zx8 h GLU 28 N 0.75 0.00 0.00 1.90 4.39 -1.47 -3.24 114.58 116.91 1zx8 h GLU 28 Ca 0.57 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 60.18 1zx8 h GLU 28 Cb 0.90 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.53 1zx8 h GLU 28 CO -0.36 0.03 -1.44 1.63 -1.16 0.00 0.00 179.01 177.71 1zx8 n LYS 29 N -3.11 0.63 -1.97 2.33 4.76 -0.45 -4.90 118.16 115.44 1zx8 n LYS 29 Ca 0.03 0.09 -0.41 0.00 -2.87 0.00 0.00 58.31 55.14 1zx8 n LYS 29 Cb 0.50 -1.74 -0.02 0.00 -1.84 0.00 0.00 35.03 31.93 1zx8 n LYS 29 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1zx8 s ILE 30 N -3.18 2.58 0.13 -0.18 1.01 -0.68 -3.80 121.20 117.08 1zx8 s ILE 30 Ca -0.04 0.48 -0.28 0.00 0.00 0.00 0.00 60.65 60.82 1zx8 s ILE 30 Cb 0.10 -3.31 -0.07 0.00 0.01 0.00 0.00 42.46 39.19 1zx8 s ILE 30 CO 0.82 0.07 0.86 -2.16 0.00 0.00 0.00 174.94 174.54 1zx8 s PRO 31 N -0.24 4.65 0.18 2.79 0.04 -1.26 -5.01 135.00 136.14 1zx8 s PRO 31 Ca 0.61 1.29 -0.03 0.00 0.04 0.00 0.00 61.00 62.91 1zx8 s PRO 31 Cb -0.43 -3.33 -0.03 0.00 0.04 0.00 0.00 34.50 30.75 1zx8 s PRO 31 CO 0.43 0.37 0.15 -0.59 0.04 0.00 0.00 177.00 177.40 1zx8 s PHE 32 N -0.51 0.91 0.18 0.56 -0.12 -1.17 -5.03 117.98 112.80 1zx8 s PHE 32 Ca 0.41 -1.21 0.09 0.00 -0.05 0.00 0.00 56.93 56.18 1zx8 s PHE 32 Cb -0.23 -0.41 -0.04 0.00 -0.63 0.00 0.00 43.02 41.70 1zx8 s PHE 32 CO 0.28 -0.64 -0.19 -1.21 -0.05 0.00 0.00 175.22 173.41 1zx8 s GLU 33 N -4.09 1.36 0.00 1.99 8.01 -1.26 -0.80 118.70 123.92 1zx8 s GLU 33 Ca 0.30 -1.48 0.00 0.00 0.01 0.00 0.00 54.97 53.80 1zx8 s GLU 33 Cb 0.06 -1.46 0.00 0.00 -4.31 0.00 0.00 34.13 28.42 1zx8 s GLU 33 CO 0.07 0.29 0.00 0.45 0.01 0.00 0.00 175.26 176.08 1zx8 n SER 34 N 0.15 0.00 -3.95 -0.19 2.88 0.20 -4.99 113.62 107.71 1zx8 n SER 34 Ca -0.12 -0.67 -0.20 0.00 -1.33 0.00 0.00 58.87 56.55 1zx8 n SER 34 Cb 0.57 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.88 1zx8 n SER 34 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1zx8 s VAL 35 N -2.14 0.67 0.26 2.46 1.01 -1.26 -1.27 120.40 120.13 1zx8 s VAL 35 Ca 0.00 -0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.43 1zx8 s VAL 35 Cb 0.00 -0.64 -0.09 0.00 0.00 0.00 0.00 36.38 35.65 1zx8 s VAL 35 CO 0.00 0.23 0.97 -0.69 0.00 0.00 0.00 175.10 175.61 1zx8 s VAL 36 N 0.49 3.99 0.12 2.92 1.01 0.11 -4.46 120.40 124.57 1zx8 s VAL 36 Ca -0.07 1.96 0.07 0.00 0.00 0.00 0.00 61.98 63.94 1zx8 s VAL 36 Cb -0.11 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 1zx8 s VAL 36 CO 0.01 0.44 -0.18 0.20 0.00 0.00 0.00 175.10 175.56 1zx8 s ASN 37 N -1.18 2.36 0.16 3.32 0.01 -0.25 -0.12 114.94 119.24 1zx8 s ASN 37 Ca 0.43 -0.74 0.11 0.00 -0.71 0.00 0.00 52.86 51.95 1zx8 s ASN 37 Cb -0.26 -0.12 -0.04 0.00 0.41 0.00 0.00 41.25 41.24 1zx8 s ASN 37 CO 0.33 -0.02 -0.25 0.42 -1.51 0.00 0.00 177.10 176.07 1zx8 s THR 38 N -1.54 2.34 -0.35 1.60 -4.23 -1.26 -0.96 115.64 111.23 1zx8 s THR 38 Ca 0.08 -1.89 0.02 0.00 -1.18 0.00 0.00 61.69 58.72 1zx8 s THR 38 Cb -0.08 -2.08 0.15 0.00 1.34 0.00 0.00 72.50 71.83 1zx8 s THR 38 CO 0.04 -0.02 0.36 0.86 -0.54 0.00 0.00 174.62 175.32 1zx8 s TRP 39 N -1.39 -0.37 0.00 3.99 -0.00 -0.22 -4.99 118.94 115.97 1zx8 s TRP 39 Ca 0.18 -0.63 0.00 0.00 -0.00 0.00 0.00 56.10 55.65 1zx8 s TRP 39 Cb -0.09 -0.41 0.00 0.00 -0.00 0.00 0.00 33.47 32.97 1zx8 s TRP 39 CO 0.08 -0.96 0.00 0.41 -0.00 0.00 0.00 176.95 176.48 1zx8 n GLY 40 N 4.53 3.08 2.54 5.86 0.00 -1.26 -3.19 105.19 116.75 1zx8 n GLY 40 Ca 0.08 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 1zx8 n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1zx8 n GLU 41 N 14.00 3.04 -4.25 1.61 1.02 -0.11 -4.78 120.64 131.18 1zx8 n GLU 41 Ca 0.00 -2.82 -0.20 0.00 -0.02 0.00 0.00 57.16 54.12 1zx8 n GLU 41 Cb 0.00 -2.27 -0.16 0.00 -0.02 0.00 0.00 31.44 28.98 1zx8 n GLU 41 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1zx8 s GLU 42 N -1.98 0.89 -0.14 3.49 2.12 -1.19 -1.40 118.70 120.49 1zx8 s GLU 42 Ca 0.56 -0.18 -0.06 0.00 0.36 0.00 0.00 54.97 55.66 1zx8 s GLU 42 Cb 0.34 -0.85 -0.04 0.00 0.26 0.00 0.00 34.13 33.84 1zx8 s GLU 42 CO -0.21 -0.02 0.06 0.42 -0.54 0.00 0.00 175.26 174.97 1zx8 s ILE 43 N 0.66 4.81 0.02 -3.70 1.01 -0.68 -1.05 121.20 122.26 1zx8 s ILE 43 Ca -0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.50 1zx8 s ILE 43 Cb -0.13 -3.11 -0.02 0.00 0.01 0.00 0.00 42.46 39.21 1zx8 s ILE 43 CO 0.01 0.54 -0.01 -0.72 0.00 0.00 0.00 174.94 174.75 1zx8 s TYR 44 N -0.28 0.24 -0.05 3.97 1.13 -0.14 0.27 117.35 122.49 1zx8 s TYR 44 Ca 0.08 -0.50 -0.16 0.00 -1.41 0.00 0.00 57.07 55.09 1zx8 s TYR 44 Cb -0.12 -0.18 0.03 0.00 -1.10 0.00 0.00 41.96 40.59 1zx8 s TYR 44 CO 0.02 -0.21 0.35 -0.59 -2.51 0.00 0.00 175.55 172.61 1zx8 s PHE 45 N -1.53 -0.27 0.49 -3.49 -0.12 -0.70 -1.09 117.98 111.27 1zx8 s PHE 45 Ca -0.15 0.52 -0.19 0.00 -0.05 0.00 0.00 56.93 57.06 1zx8 s PHE 45 Cb -0.09 0.13 -0.08 0.00 -0.63 0.00 0.00 43.02 42.35 1zx8 s PHE 45 CO -0.01 -0.36 0.99 -1.54 -0.05 0.00 0.00 175.22 174.26 1zx8 s SER 46 N -0.94 6.55 0.17 1.98 1.04 -1.26 -0.99 113.70 120.25 1zx8 s SER 46 Ca -0.10 1.71 0.06 0.00 0.48 0.00 0.00 55.95 58.11 1zx8 s SER 46 Cb -0.04 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.50 1zx8 s SER 46 CO 0.04 -0.63 -0.13 0.42 0.98 0.00 0.00 173.24 173.91 1zx8 s THR 47 N -2.33 1.48 -0.28 2.02 -4.23 0.21 -4.78 115.64 107.72 1zx8 s THR 47 Ca 0.62 -2.09 0.01 0.00 -1.18 0.00 0.00 61.69 59.05 1zx8 s THR 47 Cb -0.12 -1.90 0.07 0.00 1.34 0.00 0.00 72.50 71.89 1zx8 s THR 47 CO 0.24 -0.62 0.96 -0.81 -0.54 0.00 0.00 174.62 173.85 1zx8 n PRO 48 N -0.18 1.19 -4.70 3.99 -0.04 -1.26 -4.81 135.00 129.20 1zx8 n PRO 48 Ca -0.10 -0.30 -0.28 0.00 -0.04 0.00 0.00 63.50 62.78 1zx8 n PRO 48 Cb 0.60 -1.24 -0.17 0.00 -0.04 0.00 0.00 33.50 32.65 1zx8 n PRO 48 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1zx8 s VAL 49 N -0.56 1.53 -0.33 0.52 1.01 -1.26 -5.08 120.40 116.24 1zx8 s VAL 49 Ca 0.06 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1zx8 s VAL 49 Cb 0.05 -1.37 0.08 0.00 0.00 0.00 0.00 36.38 35.14 1zx8 s VAL 49 CO 0.01 0.44 0.04 0.21 0.00 0.00 0.00 175.10 175.80 1zx8 s ASN 50 N 0.71 4.83 -0.28 3.32 2.47 -1.26 -4.80 114.94 119.92 1zx8 s ASN 50 Ca -0.12 -1.79 -0.01 0.00 0.42 0.00 0.00 52.86 51.36 1zx8 s ASN 50 Cb -0.16 -1.67 0.09 0.00 -1.45 0.00 0.00 41.25 38.06 1zx8 s ASN 50 CO 0.03 -0.35 0.07 -0.69 -3.72 0.00 0.00 177.10 172.44 1zx8 s VAL 51 N 1.07 0.92 0.24 -5.21 1.01 -1.26 -5.02 120.40 112.14 1zx8 s VAL 51 Ca 0.03 -1.27 0.05 0.00 0.00 0.00 0.00 61.98 60.79 1zx8 s VAL 51 Cb -0.20 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1zx8 s VAL 51 CO -0.05 -0.54 1.57 1.56 0.00 0.00 0.00 175.10 177.63 1zx8 h GLN 52 N 8.09 0.21 0.00 2.72 1.08 -1.97 -3.44 115.11 121.81 1zx8 h GLN 52 Ca -0.14 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 56.91 1zx8 h GLN 52 Cb 1.04 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.49 1zx8 h GLN 52 CO 0.45 0.75 0.00 1.17 -0.95 0.00 0.00 178.83 180.25 1zx8 n LYS 53 N -3.87 -0.01 0.00 1.46 4.81 -1.26 -4.92 118.16 114.37 1zx8 n LYS 53 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.42 1zx8 n LYS 53 Cb 0.62 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.67 1zx8 n LYS 53 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1zx8 n GLU 55 N -0.99 3.32 -3.17 1.64 4.71 -1.26 -4.94 120.64 119.95 1zx8 n GLU 55 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.16 56.96 1zx8 n GLU 55 Cb 0.00 -0.48 -0.03 0.00 -1.01 0.00 0.00 31.44 29.92 1zx8 n GLU 55 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 1zx8 n ASN 56 N -0.21 0.59 -4.75 1.62 5.15 -1.26 -5.09 115.26 111.31 1zx8 n ASN 56 Ca 0.00 -2.97 -0.41 0.00 -0.60 0.00 0.00 54.58 50.60 1zx8 n ASN 56 Cb 0.00 -0.53 -0.04 0.00 -0.53 0.00 0.00 39.78 38.68 1zx8 n ASN 56 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1zx8 s PRO 57 N -2.10 4.55 -0.01 1.20 0.04 -1.26 -1.64 135.00 135.79 1zx8 s PRO 57 Ca 0.39 1.88 0.02 0.00 0.04 0.00 0.00 61.00 63.33 1zx8 s PRO 57 Cb 0.31 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.66 1zx8 s PRO 57 CO -0.09 0.06 -0.06 1.03 0.04 0.00 0.00 177.00 177.99 1zx8 s ARG 58 N -1.09 0.53 0.00 4.56 1.81 0.06 -4.93 118.95 119.89 1zx8 s ARG 58 Ca 0.48 -0.19 0.17 0.00 -1.72 0.00 0.00 55.73 54.47 1zx8 s ARG 58 Cb -0.33 -0.52 0.05 0.00 -0.45 0.00 0.00 34.95 33.70 1zx8 s ARG 58 CO 0.41 0.09 0.95 0.39 -0.68 0.00 0.00 175.30 176.46 1zx8 n GLU 59 N 3.12 1.56 -3.83 3.54 1.02 -1.26 -2.14 120.64 122.65 1zx8 n GLU 59 Ca -0.15 -1.11 -0.13 0.00 -0.02 0.00 0.00 57.16 55.74 1zx8 n GLU 59 Cb 0.57 -1.31 -0.14 0.00 -0.02 0.00 0.00 31.44 30.53 1zx8 n GLU 59 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1zx8 s VAL 60 N -1.76 -0.02 0.33 2.62 1.01 -1.26 -3.98 120.40 117.34 1zx8 s VAL 60 Ca 0.16 0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.26 1zx8 s VAL 60 Cb 0.14 -0.07 -0.06 0.00 0.00 0.00 0.00 36.38 36.38 1zx8 s VAL 60 CO 0.34 0.03 0.06 0.68 0.00 0.00 0.00 175.10 176.21 1zx8 s VAL 61 N 0.40 1.19 0.27 2.92 -7.23 -0.55 -4.99 120.40 112.40 1zx8 s VAL 61 Ca -0.03 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.20 1zx8 s VAL 61 Cb -0.05 -2.80 -0.03 0.00 0.56 0.00 0.00 36.38 34.06 1zx8 s VAL 61 CO -0.01 0.00 0.26 -1.61 -0.31 0.00 0.00 175.10 173.43 1zx8 s GLU 62 N -3.89 3.02 0.24 4.82 0.41 -1.26 -4.10 118.70 117.94 1zx8 s GLU 62 Ca 0.37 -1.02 -0.31 0.00 -0.41 0.00 0.00 54.97 53.59 1zx8 s GLU 62 Cb 0.09 -2.64 -0.13 0.00 -1.78 0.00 0.00 34.13 29.68 1zx8 s GLU 62 CO 0.16 0.35 1.58 -0.89 -0.49 0.00 0.00 175.26 175.96 1zx8 n ILE 63 N -1.28 0.59 -0.09 -1.63 5.41 -1.26 -1.70 119.36 119.40 1zx8 n ILE 63 Ca -0.07 -0.15 0.00 0.00 1.00 0.00 0.00 62.75 63.53 1zx8 n ILE 63 Cb 0.58 -1.78 0.00 0.00 -0.71 0.00 0.00 39.64 37.73 1zx8 n ILE 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1zx8 n GLY 64 N 2.79 1.34 3.77 7.39 0.00 0.51 -5.00 105.19 115.98 1zx8 n GLY 64 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1zx8 n GLY 64 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1zx8 s ASP 65 N -2.98 6.47 -0.19 1.61 1.01 -0.69 0.09 116.67 122.00 1zx8 s ASP 65 Ca 0.00 2.50 -0.05 0.00 0.71 0.00 0.00 52.55 55.71 1zx8 s ASP 65 Cb 0.00 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.27 1zx8 s ASP 65 CO 0.00 -0.72 0.01 -0.69 0.21 0.00 0.00 175.17 173.97 1zx8 s VAL 66 N -1.31 4.11 0.14 -1.27 1.01 -0.17 -1.93 120.40 120.98 1zx8 s VAL 66 Ca 0.56 -0.27 0.10 0.00 0.00 0.00 0.00 61.98 62.37 1zx8 s VAL 66 Cb -0.35 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1zx8 s VAL 66 CO 0.44 0.45 -0.22 -0.83 0.00 0.00 0.00 175.10 174.94 1zx8 s GLY 67 N 0.74 1.65 -0.17 4.51 0.00 -0.08 -1.02 107.32 112.95 1zx8 s GLY 67 Ca 0.00 -1.45 -0.05 0.00 0.00 0.00 0.00 44.72 43.23 1zx8 s GLY 67 CO 0.02 -1.44 -0.01 -0.47 0.00 0.00 0.00 173.10 171.20 1zx8 s TYR 68 N -1.23 3.07 -0.42 1.90 5.04 0.20 0.26 117.35 126.17 1zx8 s TYR 68 Ca 0.17 -0.24 -0.06 0.00 -2.44 0.00 0.00 57.07 54.50 1zx8 s TYR 68 Cb -0.10 -2.00 0.10 0.00 0.35 0.00 0.00 41.96 40.31 1zx8 s TYR 68 CO 0.09 -0.02 0.24 -0.46 -1.34 0.00 0.00 175.55 174.06 1zx8 s TRP 69 N 0.44 3.46 0.37 4.97 -0.00 0.26 -0.83 118.94 127.61 1zx8 s TRP 69 Ca -0.02 -2.02 0.04 0.00 -0.00 0.00 0.00 56.10 54.10 1zx8 s TRP 69 Cb -0.14 -3.15 0.70 0.00 -0.00 0.00 0.00 33.47 30.88 1zx8 s TRP 69 CO 0.02 -0.94 2.01 -1.35 -0.00 0.00 0.00 176.95 176.70 1zx8 h PRO 70 N 8.24 0.76 -0.79 5.86 0.11 -1.85 -1.89 132.00 142.44 1zx8 h PRO 70 Ca -0.18 -0.05 0.11 0.00 0.11 0.00 0.00 66.00 65.99 1zx8 h PRO 70 Cb 1.06 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 31.95 1zx8 h PRO 70 CO 0.74 0.50 0.52 -1.35 -0.21 0.00 0.00 178.00 178.20 1zx8 h PRO 71 N 0.78 0.66 -0.44 1.05 0.11 -1.94 -1.76 132.00 130.46 1zx8 h PRO 71 Ca 0.23 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1zx8 h PRO 71 Cb -0.03 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 30.93 1zx8 h PRO 71 CO -0.05 0.43 0.00 0.41 -0.21 0.00 0.00 178.00 178.58 1zx8 n GLY 72 N -1.45 2.63 4.18 -0.55 0.00 -1.08 -4.98 105.19 103.93 1zx8 n GLY 72 Ca 0.14 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 1zx8 n GLY 72 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1zx8 n LYS 73 N 0.83 -2.75 -4.81 1.61 4.01 -0.66 -4.58 118.16 111.80 1zx8 n LYS 73 Ca 0.15 0.33 -0.33 0.00 -0.51 0.00 0.00 58.31 57.95 1zx8 n LYS 73 Cb 0.48 -4.70 -0.13 0.00 -0.51 0.00 0.00 35.03 30.17 1zx8 n LYS 73 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1zx8 s ALA 74 N -3.63 2.75 0.11 7.82 0.00 -0.94 -0.62 121.76 127.24 1zx8 s ALA 74 Ca 0.43 -0.95 -0.25 0.00 0.00 0.00 0.00 51.96 51.19 1zx8 s ALA 74 Cb -0.23 -1.05 -0.07 0.00 0.00 0.00 0.00 23.12 21.77 1zx8 s ALA 74 CO 0.93 0.54 0.75 -0.51 0.00 0.00 0.00 175.76 177.48 1zx8 s LEU 75 N -0.69 4.53 -0.07 0.00 1.43 -0.16 -0.58 118.68 123.14 1zx8 s LEU 75 Ca 0.10 1.53 0.03 0.00 -1.03 0.00 0.00 54.13 54.76 1zx8 s LEU 75 Cb -0.11 -3.23 0.01 0.00 0.03 0.00 0.00 46.19 42.89 1zx8 s LEU 75 CO 0.01 0.13 -0.18 0.00 0.23 0.00 0.00 176.35 176.55 1zx8 s LEU 77 N 0.43 2.90 -0.34 0.00 1.43 0.14 -0.91 118.68 122.34 1zx8 s LEU 77 Ca -0.14 -0.68 -0.10 0.00 -1.03 0.00 0.00 54.13 52.17 1zx8 s LEU 77 Cb -0.16 -1.65 0.01 0.00 0.03 0.00 0.00 46.19 44.42 1zx8 s LEU 77 CO 0.05 -0.07 0.18 -0.36 0.23 0.00 0.00 176.35 176.38 1zx8 s PHE 78 N 1.37 3.21 0.00 0.29 0.08 -0.81 -1.69 117.98 120.43 1zx8 s PHE 78 Ca 0.03 -0.78 0.00 0.00 0.12 0.00 0.00 56.93 56.30 1zx8 s PHE 78 Cb -0.15 -2.40 0.00 0.00 -0.57 0.00 0.00 43.02 39.90 1zx8 s PHE 78 CO -0.06 -0.56 0.71 1.97 -0.10 0.00 0.00 175.22 177.19 1zx8 n PHE 79 N 4.99 0.00 -3.34 0.36 -1.74 -0.49 -0.37 117.46 116.86 1zx8 n PHE 79 Ca -0.13 -0.24 0.00 0.00 -0.56 0.00 0.00 57.45 56.53 1zx8 n PHE 79 Cb 0.47 -0.02 0.00 0.00 1.52 0.00 0.00 39.48 41.45 1zx8 n PHE 79 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1zx8 n GLY 80 N -0.24 0.69 3.80 4.97 0.00 -0.92 -4.88 105.19 108.61 1zx8 n GLY 80 Ca 0.00 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 44.99 1zx8 n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zx8 s LYS 81 N -0.20 4.28 0.65 1.61 1.02 -1.26 -4.60 119.74 121.24 1zx8 s LYS 81 Ca 0.00 1.28 -0.01 0.00 0.02 0.00 0.00 55.97 57.26 1zx8 s LYS 81 Cb 0.00 -2.42 0.08 0.00 -0.52 0.00 0.00 37.83 34.97 1zx8 s LYS 81 CO 0.00 -0.00 0.91 0.95 -0.92 0.00 0.00 175.35 176.29 1zx8 s THR 82 N -1.90 2.38 -0.20 2.17 -4.23 -1.26 -0.93 115.64 111.67 1zx8 s THR 82 Ca 0.58 -0.56 -0.02 0.00 -1.18 0.00 0.00 61.69 60.52 1zx8 s THR 82 Cb -0.15 -2.82 -0.03 0.00 1.34 0.00 0.00 72.50 70.84 1zx8 s THR 82 CO 0.20 0.00 1.27 -2.65 -0.54 0.00 0.00 174.62 172.90 1zx8 n PRO 83 N -2.66 0.59 -0.70 3.99 -0.02 -1.26 -4.86 135.00 130.08 1zx8 n PRO 83 Ca 0.11 -0.59 -0.32 0.00 -2.02 0.00 0.00 63.50 60.68 1zx8 n PRO 83 Cb 0.60 -1.95 0.16 0.00 -0.02 0.00 0.00 33.50 32.29 1zx8 n PRO 83 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1zx8 n SER 85 N 4.07 -1.26 -0.00 2.55 2.88 -1.26 -5.14 113.62 115.46 1zx8 n SER 85 Ca 0.13 0.25 0.09 0.00 -1.33 0.00 0.00 58.87 58.00 1zx8 n SER 85 Cb 0.09 -1.27 -0.11 0.00 -0.75 0.00 0.00 64.21 62.17 1zx8 n SER 85 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1zx8 n ASP 86 N -2.79 0.91 0.00 -3.46 5.75 -1.26 -4.59 116.55 111.10 1zx8 n ASP 86 Ca 0.07 -0.95 0.00 0.00 -0.01 0.00 0.00 54.79 53.90 1zx8 n ASP 86 Cb 0.54 1.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.63 1zx8 n ASP 86 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1zx8 n ASP 87 N -1.46 0.77 -3.74 -1.12 5.68 -1.26 -5.08 116.55 110.34 1zx8 n ASP 87 Ca 0.04 -1.27 -0.07 0.00 -0.50 0.00 0.00 54.79 52.99 1zx8 n ASP 87 Cb 0.30 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.26 1zx8 n ASP 87 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1zx8 s LYS 88 N -0.27 1.45 -0.48 0.11 0.00 -1.26 -5.11 119.74 114.18 1zx8 s LYS 88 Ca 0.00 -0.76 -0.21 0.00 0.00 0.00 0.00 55.97 55.00 1zx8 s LYS 88 Cb 0.00 0.52 0.04 0.00 0.00 0.00 0.00 37.83 38.39 1zx8 s LYS 88 CO 0.00 -0.66 0.71 0.42 0.00 0.00 0.00 175.35 175.82 1zx8 s ILE 89 N -3.62 4.74 -0.31 3.79 1.01 -1.26 -4.47 121.20 121.08 1zx8 s ILE 89 Ca 0.10 -0.01 -0.03 0.00 0.00 0.00 0.00 60.65 60.71 1zx8 s ILE 89 Cb -0.03 -4.31 0.04 0.00 0.01 0.00 0.00 42.46 38.17 1zx8 s ILE 89 CO 0.02 -0.77 0.03 -1.58 0.00 0.00 0.00 174.94 172.64 1zx8 s GLN 90 N 3.02 2.52 0.94 2.79 0.74 -1.26 -1.48 119.66 126.92 1zx8 s GLN 90 Ca 0.22 -1.22 -0.11 0.00 0.05 0.00 0.00 55.36 54.30 1zx8 s GLN 90 Cb -0.15 -3.27 0.15 0.00 1.10 0.00 0.00 33.01 30.84 1zx8 s GLN 90 CO 0.17 -0.63 1.10 -1.25 -0.55 0.00 0.00 175.29 174.14 1zx8 s PRO 91 N 1.31 0.90 0.17 1.67 0.04 -1.26 -4.66 135.00 133.17 1zx8 s PRO 91 Ca -0.04 1.18 -0.14 0.00 0.04 0.00 0.00 61.00 62.05 1zx8 s PRO 91 Cb -0.20 -1.74 0.07 0.00 0.04 0.00 0.00 34.50 32.67 1zx8 s PRO 91 CO 0.00 -2.60 1.81 0.00 0.04 0.00 0.00 177.00 176.25 1zx8 h ALA 92 N -1.83 0.69 -2.84 8.56 0.00 -1.98 -3.44 119.26 118.42 1zx8 h ALA 92 Ca -0.48 -0.07 -0.35 0.00 0.00 0.00 0.00 54.91 54.01 1zx8 h ALA 92 Cb 1.28 -0.22 -0.12 0.00 0.00 0.00 0.00 17.79 18.73 1zx8 h ALA 92 CO 0.48 0.17 -0.42 -1.54 0.00 0.00 0.00 179.25 177.94 1zx8 s SER 93 N -5.77 1.08 0.24 0.00 1.04 -1.26 -5.13 113.70 103.90 1zx8 s SER 93 Ca -0.13 -1.57 -0.31 0.00 0.48 0.00 0.00 55.95 54.41 1zx8 s SER 93 Cb 0.12 0.55 -0.14 0.00 0.10 0.00 0.00 66.02 66.66 1zx8 s SER 93 CO 0.75 -1.08 1.35 0.00 0.98 0.00 0.00 173.24 175.25 1zx8 n ALA 94 N -0.52 0.82 -2.41 5.32 0.00 -1.26 -4.90 120.51 117.54 1zx8 n ALA 94 Ca 0.04 0.41 -0.28 0.00 0.00 0.00 0.00 53.44 53.62 1zx8 n ALA 94 Cb 0.63 -2.23 -0.12 0.00 0.00 0.00 0.00 19.45 17.73 1zx8 n ALA 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1zx8 s VAL 95 N -0.18 2.36 -0.53 0.00 -7.23 -0.91 -4.71 120.40 109.20 1zx8 s VAL 95 Ca 0.68 -1.85 -0.26 0.00 -1.81 0.00 0.00 61.98 58.74 1zx8 s VAL 95 Cb -0.67 -2.09 0.03 0.00 0.56 0.00 0.00 36.38 34.21 1zx8 s VAL 95 CO 0.51 0.00 1.00 0.21 -0.31 0.00 0.00 175.10 176.51 1zx8 s ASN 96 N -2.33 6.42 -0.47 4.85 2.47 -0.01 -0.76 114.94 125.12 1zx8 s ASN 96 Ca 0.17 -0.08 -0.29 0.00 0.42 0.00 0.00 52.86 53.08 1zx8 s ASN 96 Cb -0.09 -2.47 0.03 0.00 -1.45 0.00 0.00 41.25 37.27 1zx8 s ASN 96 CO 0.08 -1.23 1.16 -0.69 -3.72 0.00 0.00 177.10 172.70 1zx8 s VAL 97 N 4.11 4.19 -0.40 -5.21 1.01 -0.65 -0.63 120.40 122.82 1zx8 s VAL 97 Ca 0.36 1.22 0.04 0.00 0.00 0.00 0.00 61.98 63.60 1zx8 s VAL 97 Cb -0.10 -4.57 0.02 0.00 0.00 0.00 0.00 36.38 31.72 1zx8 s VAL 97 CO 0.23 -0.97 0.53 2.30 0.00 0.00 0.00 175.10 177.19 1zx8 n ILE 98 N 6.83 0.00 -3.21 2.22 -5.35 -0.19 -4.82 119.36 114.84 1zx8 n ILE 98 Ca 0.12 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 1zx8 n ILE 98 Cb 0.49 1.06 0.00 0.00 -1.74 0.00 0.00 39.64 39.45 1zx8 n ILE 98 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1zx8 n GLY 99 N 0.37 -0.76 2.93 3.28 0.00 -1.14 -1.19 105.19 108.67 1zx8 n GLY 99 Ca 0.02 -0.76 -0.11 0.00 0.00 0.00 0.00 46.02 45.17 1zx8 n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zx8 s LYS 100 N -0.42 0.14 -0.28 1.61 1.02 -0.75 -1.00 119.74 120.07 1zx8 s LYS 100 Ca 0.00 -0.22 -0.29 0.00 0.02 0.00 0.00 55.97 55.48 1zx8 s LYS 100 Cb 0.00 0.05 -0.01 0.00 -0.52 0.00 0.00 37.83 37.36 1zx8 s LYS 100 CO 0.00 -0.02 1.38 0.42 -0.92 0.00 0.00 175.35 176.20 1zx8 s ILE 101 N -0.58 4.03 -0.08 2.17 1.01 0.11 -0.51 121.20 127.36 1zx8 s ILE 101 Ca -0.06 1.17 0.13 0.00 0.00 0.00 0.00 60.65 61.88 1zx8 s ILE 101 Cb -0.04 -4.04 -0.19 0.00 0.01 0.00 0.00 42.46 38.20 1zx8 s ILE 101 CO -0.00 -0.42 0.31 1.33 0.00 0.00 0.00 174.94 176.15 1zx8 n VAL 102 N 6.24 0.00 -3.86 2.92 0.24 0.15 -4.88 118.33 119.13 1zx8 n VAL 102 Ca 0.16 -0.28 -0.11 0.00 -2.04 0.00 0.00 64.34 62.06 1zx8 n VAL 102 Cb 0.46 0.29 -0.12 0.00 -1.47 0.00 0.00 33.84 33.01 1zx8 n VAL 102 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1zx8 s GLU 103 N -2.81 0.28 0.00 7.34 2.02 -1.05 -4.92 118.70 119.55 1zx8 s GLU 103 Ca -0.04 -0.13 0.00 0.00 0.02 0.00 0.00 54.97 54.83 1zx8 s GLU 103 Cb 0.08 0.12 0.00 0.00 0.10 0.00 0.00 34.13 34.43 1zx8 s GLU 103 CO 0.53 -0.05 0.00 0.41 0.02 0.00 0.00 175.26 176.17 1zx8 n GLY 104 N 2.31 0.50 0.36 -1.39 0.00 -1.26 -1.02 105.19 104.68 1zx8 n GLY 104 Ca -0.17 -0.59 0.11 0.00 0.00 0.00 0.00 46.02 45.37 1zx8 n GLY 104 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1zx8 h LEU 105 N 0.00 0.82 -1.16 0.99 5.85 -1.90 -0.55 115.31 119.36 1zx8 h LEU 105 Ca 0.00 0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.74 1zx8 h LEU 105 Cb 0.00 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1zx8 h LEU 105 CO 0.00 0.35 -0.28 -0.33 -0.34 0.00 0.00 178.44 177.84 1zx8 h GLU 106 N 0.83 0.00 0.00 1.25 3.07 -1.96 -2.72 114.58 115.05 1zx8 h GLU 106 Ca 0.54 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.38 1zx8 h GLU 106 Cb 0.76 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.67 1zx8 h GLU 106 CO -0.33 0.28 -0.09 -0.44 -1.40 0.00 0.00 179.01 177.03 1zx8 h ASP 107 N 0.00 0.00 -0.38 1.42 5.19 -1.40 -3.33 116.42 117.92 1zx8 h ASP 107 Ca -0.00 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.36 1zx8 h ASP 107 Cb 0.74 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.23 1zx8 h ASP 107 CO 0.04 0.09 0.10 -0.07 -3.12 0.00 0.00 179.24 176.27 1zx8 h LEU 108 N 0.00 0.63 -1.87 1.55 3.38 -1.50 -1.30 115.31 116.19 1zx8 h LEU 108 Ca -0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1zx8 h LEU 108 Cb 0.25 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1zx8 h LEU 108 CO 0.01 0.63 0.00 0.11 0.09 0.00 0.00 178.44 179.28 1zx8 h LYS 109 N 0.66 0.00 0.00 1.13 6.56 -1.77 -2.24 116.57 120.91 1zx8 h LYS 109 Ca 0.15 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.74 1zx8 h LYS 109 Cb 0.26 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.92 1zx8 h LYS 109 CO -0.00 0.00 -0.18 1.63 -2.06 0.00 0.00 179.45 178.83 1zx8 n LYS 110 N -2.63 0.27 -2.66 3.15 5.02 -0.49 -4.91 118.16 115.91 1zx8 n LYS 110 Ca -0.01 0.18 -0.42 0.00 -2.02 0.00 0.00 58.31 56.03 1zx8 n LYS 110 Cb 0.11 -1.77 -0.03 0.00 -0.02 0.00 0.00 35.03 33.32 1zx8 n LYS 110 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1zx8 s ILE 111 N -3.12 4.72 0.23 -0.18 -1.09 -0.84 -4.87 121.20 116.04 1zx8 s ILE 111 Ca 0.09 1.97 -0.02 0.00 -2.23 0.00 0.00 60.65 60.47 1zx8 s ILE 111 Cb 0.13 -4.27 -0.05 0.00 -1.58 0.00 0.00 42.46 36.69 1zx8 s ILE 111 CO 0.63 0.04 0.44 -0.54 -1.23 0.00 0.00 174.94 174.29 1zx8 s LYS 112 N 1.77 3.56 0.27 2.79 -0.14 -1.26 -4.99 119.74 121.74 1zx8 s LYS 112 Ca 0.50 -0.23 -0.30 0.00 -1.36 0.00 0.00 55.97 54.59 1zx8 s LYS 112 Cb -0.20 -2.77 -0.13 0.00 -1.68 0.00 0.00 37.83 33.05 1zx8 s LYS 112 CO 0.21 0.34 1.44 -0.25 -0.76 0.00 0.00 175.35 176.33 1zx8 n ASP 113 N -0.75 3.06 0.00 2.83 9.92 -1.26 -2.42 116.55 127.93 1zx8 n ASP 113 Ca -0.04 1.16 0.00 0.00 -0.53 0.00 0.00 54.79 55.38 1zx8 n ASP 113 Cb 0.54 -1.48 0.00 0.00 -0.64 0.00 0.00 41.12 39.54 1zx8 n ASP 113 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1zx8 n GLY 114 N 1.91 1.18 3.76 0.44 0.00 0.82 -5.00 105.19 108.29 1zx8 n GLY 114 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1zx8 n GLY 114 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1zx8 s GLU 115 N -0.44 4.40 0.52 1.61 2.02 -1.02 -4.66 118.70 121.13 1zx8 s GLU 115 Ca 0.00 2.13 -0.21 0.00 0.02 0.00 0.00 54.97 56.90 1zx8 s GLU 115 Cb 0.00 -3.12 -0.06 0.00 0.10 0.00 0.00 34.13 31.05 1zx8 s GLU 115 CO 0.00 -0.17 1.20 0.15 0.02 0.00 0.00 175.26 176.47 1zx8 s LYS 116 N -1.22 3.42 -0.06 1.61 1.02 -1.26 -0.71 119.74 122.53 1zx8 s LYS 116 Ca 0.51 1.85 0.04 0.00 0.02 0.00 0.00 55.97 58.39 1zx8 s LYS 116 Cb -0.38 -2.22 -0.00 0.00 -0.52 0.00 0.00 37.83 34.71 1zx8 s LYS 116 CO 0.47 -0.85 -0.20 0.54 -0.92 0.00 0.00 175.35 174.38 1zx8 s VAL 117 N -1.54 1.71 -0.26 3.17 0.11 -0.39 -3.50 120.40 119.69 1zx8 s VAL 117 Ca 0.69 -0.85 -0.11 0.00 -2.93 0.00 0.00 61.98 58.79 1zx8 s VAL 117 Cb -0.30 -1.47 -0.05 0.00 -1.53 0.00 0.00 36.38 33.02 1zx8 s VAL 117 CO 0.36 0.48 0.17 0.00 -3.33 0.00 0.00 175.10 172.78 1zx8 s ALA 118 N 0.14 3.53 -0.30 1.54 0.00 -0.22 -0.63 121.76 125.81 1zx8 s ALA 118 Ca -0.09 -1.02 -0.13 0.00 0.00 0.00 0.00 51.96 50.72 1zx8 s ALA 118 Cb -0.14 -2.40 -0.03 0.00 0.00 0.00 0.00 23.12 20.55 1zx8 s ALA 118 CO 0.04 -0.42 0.26 0.08 0.00 0.00 0.00 175.76 175.72 1zx8 s VAL 119 N 1.51 5.26 0.05 0.00 1.01 0.02 -1.11 120.40 127.14 1zx8 s VAL 119 Ca 0.07 0.10 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 1zx8 s VAL 119 Cb -0.15 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1zx8 s VAL 119 CO 0.08 0.11 -0.01 -0.13 0.00 0.00 0.00 175.10 175.15 1zx8 s ARG 120 N 1.84 0.60 0.28 2.72 1.81 -0.14 -3.06 118.95 123.00 1zx8 s ARG 120 Ca 0.09 -1.15 -0.29 0.00 -1.72 0.00 0.00 55.73 52.66 1zx8 s ARG 120 Cb -0.16 0.21 -0.10 0.00 -0.45 0.00 0.00 34.95 34.45 1zx8 s ARG 120 CO 0.11 -0.12 1.15 -0.06 -0.68 0.00 0.00 175.30 175.70 1zx8 s PHE 121 N -3.70 3.46 0.48 -0.53 0.08 -1.26 -0.09 117.98 116.41 1zx8 s PHE 121 Ca 0.05 1.62 -0.23 0.00 0.12 0.00 0.00 56.93 58.49 1zx8 s PHE 121 Cb 0.06 -3.38 -0.07 0.00 -0.57 0.00 0.00 43.02 39.07 1zx8 s PHE 121 CO -0.09 -0.87 1.32 0.00 -0.10 0.00 0.00 175.22 175.48 1zx8 s ALA 122 N -1.07 3.01 -2.51 5.36 0.00 -0.33 -4.54 121.76 121.68 1zx8 s ALA 122 Ca 0.46 1.26 0.26 0.00 0.00 0.00 0.00 51.96 53.94 1zx8 s ALA 122 Cb -0.34 -3.52 0.72 0.00 0.00 0.00 0.00 23.12 19.98 1zx8 s ALA 122 CO 0.43 -1.09 1.55 0.43 0.00 0.00 0.00 175.76 177.08 1zx8 n SER 123 N -0.54 1.87 0.00 0.00 7.64 -1.26 -4.96 113.62 116.36 1zx8 n SER 123 Ca 0.07 -1.56 0.00 0.00 1.01 0.00 0.00 58.87 58.40 1zx8 n SER 123 Cb 0.45 0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 1zx8 n SER 123 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49