#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nz8 s ILE 3 N 0.00 2.05 0.15 2.46 -0.00 -1.26 -4.55 121.20 120.05 1nz8 s ILE 3 Ca 0.00 -1.88 -0.15 0.00 -0.00 0.00 0.00 60.65 58.62 1nz8 s ILE 3 Cb 0.00 -2.93 0.03 0.00 -0.00 0.00 0.00 42.46 39.56 1nz8 s ILE 3 CO 0.00 0.00 0.41 -1.61 -0.00 0.00 0.00 174.94 173.74 1nz8 s GLU 4 N -3.81 1.16 -0.86 0.37 2.02 -0.52 -5.02 118.70 112.04 1nz8 s GLU 4 Ca 0.35 -0.81 -0.20 0.00 0.02 0.00 0.00 54.97 54.33 1nz8 s GLU 4 Cb 0.07 0.47 0.11 0.00 0.10 0.00 0.00 34.13 34.88 1nz8 s GLU 4 CO 0.19 -0.46 1.10 -1.58 0.02 0.00 0.00 175.26 174.53 1nz8 s TRP 5 N -3.84 2.96 -0.37 1.61 0.52 -1.26 -1.42 118.94 117.13 1nz8 s TRP 5 Ca 0.06 -1.13 -0.23 0.00 0.02 0.00 0.00 56.10 54.83 1nz8 s TRP 5 Cb 0.01 -4.31 0.01 0.00 -1.15 0.00 0.00 33.47 28.03 1nz8 s TRP 5 CO -0.08 -1.56 0.76 0.71 0.02 0.00 0.00 176.95 176.80 1nz8 s TYR 6 N 3.22 3.11 0.02 -1.98 2.02 0.28 -1.79 117.35 122.22 1nz8 s TYR 6 Ca 0.31 0.50 -0.01 0.00 -0.37 0.00 0.00 57.07 57.49 1nz8 s TYR 6 Cb -0.08 -3.38 -0.04 0.00 -0.40 0.00 0.00 41.96 38.06 1nz8 s TYR 6 CO -0.04 -0.74 0.17 0.00 -1.57 0.00 0.00 175.55 173.38 1nz8 s ALA 7 N 3.05 3.91 0.19 3.71 0.00 -1.14 -1.22 121.76 130.28 1nz8 s ALA 7 Ca 0.30 -0.81 0.07 0.00 0.00 0.00 0.00 51.96 51.52 1nz8 s ALA 7 Cb -0.13 -1.81 -0.05 0.00 0.00 0.00 0.00 23.12 21.13 1nz8 s ALA 7 CO 0.17 0.77 -0.13 0.08 0.00 0.00 0.00 175.76 176.65 1nz8 s VAL 8 N -1.37 1.57 0.22 0.00 1.01 -1.02 -3.94 120.40 116.87 1nz8 s VAL 8 Ca 0.29 -2.17 0.09 0.00 0.00 0.00 0.00 61.98 60.20 1nz8 s VAL 8 Cb -0.13 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1nz8 s VAL 8 CO 0.21 -0.62 -0.08 -1.00 0.00 0.00 0.00 175.10 173.61 1nz8 s HIS 9 N -3.07 2.61 0.18 5.22 3.76 -1.26 -2.37 115.29 120.36 1nz8 s HIS 9 Ca 0.21 -0.24 -0.05 0.00 -0.15 0.00 0.00 55.06 54.83 1nz8 s HIS 9 Cb 0.00 -1.23 0.02 0.00 1.11 0.00 0.00 32.58 32.49 1nz8 s HIS 9 CO 0.05 0.56 0.34 0.25 -0.85 0.00 0.00 174.74 175.10 1nz8 n THR 10 N -0.29 0.00 -3.34 1.30 -2.24 -0.73 -3.69 114.28 105.29 1nz8 n THR 10 Ca -0.09 -0.59 -0.35 0.00 -2.27 0.00 0.00 64.05 60.75 1nz8 n THR 10 Cb 0.57 0.49 -0.06 0.00 -2.10 0.00 0.00 70.33 69.24 1nz8 n THR 10 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1nz8 s LEU 11 N 0.00 4.31 0.21 3.22 1.43 -1.26 -4.78 118.68 121.81 1nz8 s LEU 11 Ca 0.10 1.08 -0.32 0.00 -1.03 0.00 0.00 54.13 53.96 1nz8 s LEU 11 Cb -0.02 -3.37 -0.12 0.00 0.03 0.00 0.00 46.19 42.71 1nz8 s LEU 11 CO 0.07 0.06 1.70 0.68 0.23 0.00 0.00 176.35 179.10 1nz8 s VAL 12 N -1.54 2.07 0.00 -1.59 -7.23 -1.26 -1.83 120.40 109.02 1nz8 s VAL 12 Ca 0.40 0.05 0.00 0.00 -1.81 0.00 0.00 61.98 60.62 1nz8 s VAL 12 Cb -0.14 -3.03 0.00 0.00 0.56 0.00 0.00 36.38 33.76 1nz8 s VAL 12 CO 0.19 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 1nz8 n GLY 13 N 3.79 2.99 0.08 2.32 0.00 -1.26 -4.78 105.19 108.32 1nz8 n GLY 13 Ca 0.15 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.24 1nz8 n GLY 13 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1nz8 n GLN 14 N -0.32 0.63 -0.26 1.61 1.13 -0.76 -4.26 117.38 115.16 1nz8 n GLN 14 Ca 0.00 0.03 0.03 0.00 -1.94 0.00 0.00 57.00 55.12 1nz8 n GLN 14 Cb 0.00 -1.70 0.16 0.00 0.11 0.00 0.00 30.24 28.81 1nz8 n GLN 14 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 1nz8 h GLU 15 N 0.00 0.56 -0.34 -1.09 4.11 -1.78 0.26 114.58 116.31 1nz8 h GLU 15 Ca -0.08 -0.03 -0.00 0.00 0.07 0.00 0.00 59.36 59.31 1nz8 h GLU 15 Cb 1.23 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 1nz8 h GLU 15 CO 0.01 0.37 0.19 1.49 0.07 0.00 0.00 179.01 181.15 1nz8 h GLU 16 N 0.58 0.46 0.03 1.06 4.81 -1.90 -1.85 114.58 117.77 1nz8 h GLU 16 Ca 0.38 -0.04 -0.23 0.00 -0.13 0.00 0.00 59.36 59.34 1nz8 h GLU 16 Cb 0.46 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1nz8 h GLU 16 CO -0.31 0.34 -1.11 -0.22 -0.73 0.00 0.00 179.01 176.98 1nz8 h LYS 17 N 0.47 0.06 0.04 1.92 1.63 -1.17 -3.17 116.57 116.35 1nz8 h LYS 17 Ca 0.12 -0.10 -0.00 0.00 -0.85 0.00 0.00 60.65 59.83 1nz8 h LYS 17 Cb 0.01 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.67 1nz8 h LYS 17 CO -0.02 1.01 -0.02 0.00 -3.45 0.00 0.00 179.45 176.97 1nz8 h ALA 18 N 0.91 -0.06 -0.76 5.00 0.00 0.18 -1.32 119.26 123.21 1nz8 h ALA 18 Ca -0.06 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1nz8 h ALA 18 Cb 1.83 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.61 1nz8 h ALA 18 CO 0.14 -0.42 0.49 -0.22 0.00 0.00 0.00 179.25 179.23 1nz8 h LYS 19 N -0.28 1.01 0.29 0.00 3.64 -1.49 -0.94 116.57 118.82 1nz8 h LYS 19 Ca -0.01 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 1nz8 h LYS 19 Cb 0.25 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1nz8 h LYS 19 CO 0.01 0.69 -0.14 0.00 -2.27 0.00 0.00 179.45 177.73 1nz8 h ALA 20 N 1.50 -0.39 -0.04 5.00 0.00 -1.49 0.19 119.26 124.03 1nz8 h ALA 20 Ca 0.28 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1nz8 h ALA 20 Cb -0.09 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1nz8 h ALA 20 CO -0.06 -0.60 0.02 -0.91 0.00 0.00 0.00 179.25 177.70 1nz8 h ASN 21 N -0.63 0.04 0.12 0.00 2.35 -1.05 -2.39 115.58 114.02 1nz8 h ASN 21 Ca -0.04 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 1nz8 h ASN 21 Cb 0.45 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.81 1nz8 h ASN 21 CO 0.07 0.03 -0.06 0.25 -1.65 0.00 0.00 177.43 176.07 1nz8 h LEU 22 N 0.05 -0.14 -1.97 1.61 5.85 -0.97 -3.01 115.31 116.73 1nz8 h LEU 22 Ca 0.01 -0.28 0.32 0.00 0.84 0.00 0.00 57.88 58.78 1nz8 h LEU 22 Cb -0.00 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.02 1nz8 h LEU 22 CO -0.00 0.45 0.80 -0.33 -0.34 0.00 0.00 178.44 179.02 1nz8 h GLU 23 N -0.98 0.02 -0.05 1.25 5.08 -0.47 0.51 114.58 119.94 1nz8 h GLU 23 Ca -0.02 -0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.11 1nz8 h GLU 23 Cb 0.41 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.67 1nz8 h GLU 23 CO 0.03 0.01 -0.91 0.87 -1.00 0.00 0.00 179.01 178.01 1nz8 h LYS 24 N 0.02 0.63 -0.10 2.33 1.79 -1.49 -1.69 116.57 118.05 1nz8 h LYS 24 Ca 0.54 -0.61 -0.21 0.00 -2.18 0.00 0.00 60.65 58.20 1nz8 h LYS 24 Cb 2.12 0.15 0.00 0.00 -1.58 0.00 0.00 32.23 32.92 1nz8 h LYS 24 CO -0.02 1.22 -0.77 0.00 -1.08 0.00 0.00 179.45 178.79 1nz8 h ARG 25 N 0.39 0.59 0.00 3.15 2.47 0.00 0.29 114.38 121.26 1nz8 h ARG 25 Ca -0.08 -0.49 -0.11 0.00 -1.26 0.00 0.00 59.98 58.03 1nz8 h ARG 25 Cb 1.54 0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 29.95 1nz8 h ARG 25 CO 0.17 1.11 -0.52 0.82 0.56 0.00 0.00 179.97 182.12 1nz8 h ILE 26 N 0.39 1.18 0.04 2.04 1.08 -0.71 -2.18 117.51 119.35 1nz8 h ILE 26 Ca -0.05 -1.91 -0.31 0.00 -0.39 0.00 0.00 64.86 62.20 1nz8 h ILE 26 Cb 1.38 2.09 -0.04 0.00 -3.07 0.00 0.00 36.82 37.18 1nz8 h ILE 26 CO 0.15 0.51 -1.75 0.50 -0.69 0.00 0.00 178.15 176.86 1nz8 h LYS 27 N 0.00 0.08 -0.42 2.37 3.64 -1.25 -2.72 116.57 118.28 1nz8 h LYS 27 Ca -0.01 -0.14 -0.15 0.00 -1.27 0.00 0.00 60.65 59.09 1nz8 h LYS 27 Cb 1.05 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 1nz8 h LYS 27 CO 0.07 0.72 -0.31 0.00 -2.27 0.00 0.00 179.45 177.65 1nz8 h ALA 28 N 0.74 0.65 0.19 5.00 0.00 -0.41 -3.20 119.26 122.23 1nz8 h ALA 28 Ca -0.31 -0.43 -0.30 0.00 0.00 0.00 0.00 54.91 53.87 1nz8 h ALA 28 Cb 2.01 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 19.68 1nz8 h ALA 28 CO 0.09 0.67 -1.36 0.74 0.00 0.00 0.00 179.25 179.40 1nz8 h PHE 29 N 0.78 0.73 -0.65 0.00 0.04 -1.55 -3.49 116.94 112.80 1nz8 h PHE 29 Ca 0.08 -0.53 0.00 0.00 2.80 0.00 0.00 57.97 60.32 1nz8 h PHE 29 Cb 0.89 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.01 1nz8 h PHE 29 CO 0.06 1.41 0.00 0.41 -0.60 0.00 0.00 178.31 179.59 1nz8 n GLY 30 N 1.62 0.89 2.87 -1.45 0.00 -1.05 -5.00 105.19 103.07 1nz8 n GLY 30 Ca -0.12 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.14 1nz8 n GLY 30 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1nz8 n LEU 31 N -0.33 7.48 0.00 0.99 -0.00 -1.07 -4.63 117.00 119.43 1nz8 n LEU 31 Ca 0.00 -4.87 0.11 0.00 -0.00 0.00 0.00 56.01 51.26 1nz8 n LEU 31 Cb 0.28 -1.09 0.60 0.00 -0.00 0.00 0.00 43.42 43.21 1nz8 n LEU 31 CO 0.00 1.79 0.88 0.00 -0.00 0.00 0.00 177.39 180.06 1nz8 n GLN 32 N -0.41 0.37 0.15 1.47 6.02 -1.26 -2.81 117.38 120.92 1nz8 n GLN 32 Ca 0.53 0.06 0.04 0.00 -0.01 0.00 0.00 57.00 57.62 1nz8 n GLN 32 Cb 0.25 -1.50 0.06 0.00 1.02 0.00 0.00 30.24 30.07 1nz8 n GLN 32 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1nz8 h ASP 33 N 0.00 0.00 0.00 1.08 3.32 -1.98 -3.37 116.42 115.47 1nz8 h ASP 33 Ca 0.00 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.79 1nz8 h ASP 33 Cb 0.20 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.71 1nz8 h ASP 33 CO 0.00 0.42 -1.59 0.29 -1.72 0.00 0.00 179.24 176.64 1nz8 n LYS 34 N -3.21 0.56 -3.27 3.56 4.76 -1.12 -4.84 118.16 114.59 1nz8 n LYS 34 Ca 0.02 0.43 -0.42 0.00 -2.87 0.00 0.00 58.31 55.47 1nz8 n LYS 34 Cb 0.70 -1.62 -0.08 0.00 -1.84 0.00 0.00 35.03 32.18 1nz8 n LYS 34 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1nz8 s ILE 35 N -2.45 5.03 -0.14 -0.18 1.01 -1.18 -1.04 121.20 122.25 1nz8 s ILE 35 Ca -0.31 -0.07 -0.15 0.00 0.00 0.00 0.00 60.65 60.12 1nz8 s ILE 35 Cb 0.08 -4.03 -0.05 0.00 0.01 0.00 0.00 42.46 38.47 1nz8 s ILE 35 CO 0.49 -0.38 -0.30 0.49 0.00 0.00 0.00 174.94 175.24 1nz8 n PHE 36 N 5.74 0.00 -3.91 3.97 3.72 -1.08 -4.59 117.46 121.31 1nz8 n PHE 36 Ca -0.06 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.00 1nz8 n PHE 36 Cb 0.48 -0.43 -0.09 0.00 -0.94 0.00 0.00 39.48 38.50 1nz8 n PHE 36 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1nz8 s GLN 37 N -2.76 4.05 -0.58 -1.08 -0.21 -1.18 -4.97 119.66 112.94 1nz8 s GLN 37 Ca -0.25 -0.30 0.06 0.00 0.02 0.00 0.00 55.36 54.89 1nz8 s GLN 37 Cb 0.03 -3.29 0.23 0.00 1.00 0.00 0.00 33.01 30.99 1nz8 s GLN 37 CO 0.37 0.29 0.62 1.55 -2.12 0.00 0.00 175.29 176.00 1nz8 n VAL 38 N 3.52 1.27 -2.92 1.09 3.14 -1.26 0.12 118.33 123.29 1nz8 n VAL 38 Ca -0.16 -4.75 -0.40 0.00 -2.96 0.00 0.00 64.34 56.06 1nz8 n VAL 38 Cb 0.52 -2.05 -0.05 0.00 -1.06 0.00 0.00 33.84 31.21 1nz8 n VAL 38 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 1nz8 s LEU 39 N -1.81 4.43 -0.20 6.55 1.98 -0.50 -4.99 118.68 124.14 1nz8 s LEU 39 Ca 0.36 1.50 -0.05 0.00 -2.89 0.00 0.00 54.13 53.05 1nz8 s LEU 39 Cb 0.11 -3.31 -0.02 0.00 0.66 0.00 0.00 46.19 43.63 1nz8 s LEU 39 CO -0.08 -0.05 -0.01 0.27 -1.89 0.00 0.00 176.35 174.59 1nz8 s ILE 40 N 0.18 3.84 -0.37 6.68 -0.00 -1.26 -1.72 121.20 128.54 1nz8 s ILE 40 Ca 0.41 -0.35 -0.13 0.00 -0.00 0.00 0.00 60.65 60.58 1nz8 s ILE 40 Cb -0.21 -2.73 -0.13 0.00 -0.00 0.00 0.00 42.46 39.40 1nz8 s ILE 40 CO 0.24 0.43 1.38 -2.65 -0.00 0.00 0.00 174.94 174.35 1nz8 n PRO 41 N 4.25 0.03 -3.53 0.37 -0.02 -1.26 -4.75 135.00 130.10 1nz8 n PRO 41 Ca -0.17 -0.70 -0.16 0.00 -2.02 0.00 0.00 63.50 60.45 1nz8 n PRO 41 Cb 0.52 -2.19 -0.05 0.00 -0.02 0.00 0.00 33.50 31.76 1nz8 n PRO 41 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1nz8 s THR 42 N 7.24 0.01 0.24 3.45 -4.23 -1.26 -1.67 115.64 119.41 1nz8 s THR 42 Ca 0.36 -0.08 -0.00 0.00 -1.18 0.00 0.00 61.69 60.79 1nz8 s THR 42 Cb 0.00 -0.97 -0.04 0.00 1.34 0.00 0.00 72.50 72.83 1nz8 s THR 42 CO 0.11 -0.04 0.43 -1.61 -0.54 0.00 0.00 174.62 172.96 1nz8 s GLU 43 N -1.80 3.51 -0.03 3.99 0.41 -1.08 -4.75 118.70 118.95 1nz8 s GLU 43 Ca -0.08 -0.37 -0.01 0.00 -0.41 0.00 0.00 54.97 54.10 1nz8 s GLU 43 Cb -0.01 -2.80 0.02 0.00 -1.78 0.00 0.00 34.13 29.57 1nz8 s GLU 43 CO 0.04 0.34 0.06 -1.21 -0.49 0.00 0.00 175.26 174.00 1nz8 s GLU 44 N -3.60 0.02 -0.17 1.61 2.02 -1.26 -0.38 118.70 116.93 1nz8 s GLU 44 Ca 0.39 0.18 0.00 0.00 0.02 0.00 0.00 54.97 55.55 1nz8 s GLU 44 Cb -0.10 -0.13 0.04 0.00 0.10 0.00 0.00 34.13 34.03 1nz8 s GLU 44 CO 0.30 -0.11 -0.09 0.14 0.02 0.00 0.00 175.26 175.53 1nz8 s VAL 45 N 0.70 1.40 0.00 2.63 -7.23 -0.66 -5.02 120.40 112.22 1nz8 s VAL 45 Ca -0.06 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.35 1nz8 s VAL 45 Cb -0.08 -1.48 0.00 0.00 0.56 0.00 0.00 36.38 35.38 1nz8 s VAL 45 CO -0.02 0.22 0.00 0.55 -0.31 0.00 0.00 175.10 175.53 1nz8 n VAL 46 N 4.78 0.00 -2.75 1.32 3.14 -1.13 -2.79 118.33 120.91 1nz8 n VAL 46 Ca -0.14 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 60.86 1nz8 n VAL 46 Cb 0.48 -0.88 -0.06 0.00 -1.06 0.00 0.00 33.84 32.32 1nz8 n VAL 46 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 1nz8 s GLU 47 N 2.23 4.62 0.08 1.45 2.12 -1.22 -2.27 118.70 125.71 1nz8 s GLU 47 Ca 0.00 1.39 0.00 0.00 0.36 0.00 0.00 54.97 56.73 1nz8 s GLU 47 Cb 0.00 -2.91 0.00 0.00 0.26 0.00 0.00 34.13 31.49 1nz8 s GLU 47 CO 0.00 0.31 0.04 1.28 -0.54 0.00 0.00 175.26 176.34 1nz8 n LEU 48 N 0.75 0.00 -3.15 2.70 4.32 -1.21 -4.92 117.00 115.49 1nz8 n LEU 48 Ca 0.01 -0.42 -0.18 0.00 -0.02 0.00 0.00 56.01 55.40 1nz8 n LEU 48 Cb 0.49 0.01 -0.06 0.00 -1.62 0.00 0.00 43.42 42.25 1nz8 n LEU 48 CO 0.46 -0.22 -0.15 -0.60 -1.22 0.00 0.00 177.39 175.66 1nz8 s ARG 49 N -2.30 0.95 0.06 3.23 3.52 -1.26 -4.80 118.95 118.36 1nz8 s ARG 49 Ca 0.03 -1.66 0.00 0.00 -0.13 0.00 0.00 55.73 53.97 1nz8 s ARG 49 Cb -0.00 -0.87 0.00 0.00 -1.56 0.00 0.00 34.95 32.52 1nz8 s ARG 49 CO 0.02 -1.36 0.00 0.39 -0.81 0.00 0.00 175.30 173.54 1nz8 n GLU 50 N 2.94 0.00 -1.70 5.12 1.02 -1.26 -5.00 120.64 121.76 1nz8 n GLU 50 Ca 0.25 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.36 1nz8 n GLU 50 Cb 0.51 -0.39 0.03 0.00 -0.02 0.00 0.00 31.44 31.57 1nz8 n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nz8 n GLY 51 N 2.85 0.61 0.23 0.62 0.00 -1.26 -4.98 105.19 103.27 1nz8 n GLY 51 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1nz8 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nz8 n GLY 52 N -0.61 1.59 3.47 -0.02 0.00 -1.26 -5.10 105.19 103.26 1nz8 n GLY 52 Ca -0.13 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1nz8 n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nz8 s LYS 53 N -1.06 2.59 -0.10 1.61 3.01 -1.26 -5.12 119.74 119.41 1nz8 s LYS 53 Ca 0.00 -0.69 -0.28 0.00 -1.01 0.00 0.00 55.97 53.99 1nz8 s LYS 53 Cb 0.00 -2.41 0.07 0.00 -1.01 0.00 0.00 37.83 34.47 1nz8 s LYS 53 CO 0.00 0.59 0.65 -1.59 0.51 0.00 0.00 175.35 175.52 1nz8 s LYS 54 N -0.64 0.96 0.06 1.68 0.00 -1.26 -3.34 119.74 117.20 1nz8 s LYS 54 Ca 0.10 0.41 0.06 0.00 0.00 0.00 0.00 55.97 56.54 1nz8 s LYS 54 Cb -0.11 0.46 -0.03 0.00 0.00 0.00 0.00 37.83 38.15 1nz8 s LYS 54 CO 0.01 -0.26 -0.15 -1.21 0.00 0.00 0.00 175.35 173.74 1nz8 s GLU 55 N -0.78 0.92 -0.41 1.78 2.02 -0.96 -4.94 118.70 116.32 1nz8 s GLU 55 Ca -0.08 -0.92 0.04 0.00 0.02 0.00 0.00 54.97 54.02 1nz8 s GLU 55 Cb -0.02 -0.96 0.17 0.00 0.10 0.00 0.00 34.13 33.42 1nz8 s GLU 55 CO 0.07 0.22 0.37 0.14 0.02 0.00 0.00 175.26 176.08 1nz8 s VAL 56 N -1.11 0.10 0.38 2.63 -7.23 -1.12 -2.82 120.40 111.22 1nz8 s VAL 56 Ca 0.01 -2.18 -0.14 0.00 -1.81 0.00 0.00 61.98 57.86 1nz8 s VAL 56 Cb -0.09 -1.04 0.06 0.00 0.56 0.00 0.00 36.38 35.86 1nz8 s VAL 56 CO 0.02 -1.01 0.75 1.33 -0.31 0.00 0.00 175.10 175.89 1nz8 n VAL 57 N 3.15 0.00 -4.32 1.32 0.24 -1.12 -5.01 118.33 112.59 1nz8 n VAL 57 Ca 0.24 -1.00 -0.16 0.00 -2.04 0.00 0.00 64.34 61.38 1nz8 n VAL 57 Cb 0.47 0.96 -0.10 0.00 -1.47 0.00 0.00 33.84 33.70 1nz8 n VAL 57 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1nz8 s ARG 58 N -2.12 1.40 0.00 7.34 0.52 -1.26 -1.65 118.95 123.17 1nz8 s ARG 58 Ca 0.16 -1.75 0.00 0.00 -0.52 0.00 0.00 55.73 53.62 1nz8 s ARG 58 Cb -0.05 -0.28 0.00 0.00 0.52 0.00 0.00 34.95 35.14 1nz8 s ARG 58 CO 0.12 -0.28 0.00 1.17 0.02 0.00 0.00 175.30 176.33 1nz8 n LYS 59 N -0.45 0.00 -3.64 3.54 3.00 0.49 -4.87 118.16 116.22 1nz8 n LYS 59 Ca -0.01 0.00 -0.24 0.00 -0.00 0.00 0.00 58.31 58.07 1nz8 n LYS 59 Cb 0.66 0.00 -0.17 0.00 0.00 0.00 0.00 35.03 35.52 1nz8 n LYS 59 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1nz8 s LYS 60 N -0.55 0.03 -0.15 1.64 -2.85 -1.26 -2.62 119.74 113.99 1nz8 s LYS 60 Ca 0.00 0.07 -0.22 0.00 -1.00 0.00 0.00 55.97 54.82 1nz8 s LYS 60 Cb 0.00 -1.38 -0.24 0.00 -2.06 0.00 0.00 37.83 34.15 1nz8 s LYS 60 CO 0.00 -0.55 0.52 -0.07 0.10 0.00 0.00 175.35 175.35 1nz8 h LEU 61 N 8.42 0.14 -6.61 2.77 3.38 -1.61 -3.44 115.31 118.36 1nz8 h LEU 61 Ca -0.14 -0.78 -0.59 0.00 0.09 0.00 0.00 57.88 56.45 1nz8 h LEU 61 Cb 1.14 -0.05 -0.39 0.00 0.09 0.00 0.00 40.66 41.45 1nz8 h LEU 61 CO 0.24 1.38 -0.86 -0.36 0.09 0.00 0.00 178.44 178.94 1nz8 s PHE 62 N -2.36 1.42 0.40 1.13 0.40 -1.18 -4.99 117.98 112.81 1nz8 s PHE 62 Ca -0.22 -2.27 -0.26 0.00 -0.60 0.00 0.00 56.93 53.58 1nz8 s PHE 62 Cb 0.03 -1.28 -0.10 0.00 0.51 0.00 0.00 43.02 42.18 1nz8 s PHE 62 CO 0.69 -0.79 1.29 -2.30 0.70 0.00 0.00 175.22 174.81 1nz8 n PRO 63 N 3.18 2.02 -0.95 0.24 -0.02 -1.26 -1.97 135.00 136.24 1nz8 n PRO 63 Ca 0.20 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 1nz8 n PRO 63 Cb 0.41 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 1nz8 n PRO 63 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nz8 n GLY 64 N 0.78 0.60 3.50 -1.23 0.00 -1.26 -5.00 105.19 102.57 1nz8 n GLY 64 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 1nz8 n GLY 64 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nz8 s TYR 65 N -2.60 2.41 -0.25 1.61 1.51 -0.83 -1.78 117.35 117.42 1nz8 s TYR 65 Ca 0.00 -0.30 -0.02 0.00 -1.01 0.00 0.00 57.07 55.74 1nz8 s TYR 65 Cb 0.00 -1.13 0.13 0.00 -0.11 0.00 0.00 41.96 40.85 1nz8 s TYR 65 CO 0.00 0.59 0.36 -0.51 -1.11 0.00 0.00 175.55 174.88 1nz8 s LEU 66 N -3.08 -0.59 -0.14 -1.29 1.02 -1.00 -4.16 118.68 109.44 1nz8 s LEU 66 Ca 0.26 0.03 -0.28 0.00 0.02 0.00 0.00 54.13 54.16 1nz8 s LEU 66 Cb -0.07 1.01 -0.01 0.00 0.02 0.00 0.00 46.19 47.14 1nz8 s LEU 66 CO 0.14 -0.32 0.94 -0.36 0.02 0.00 0.00 176.35 176.77 1nz8 s PHE 67 N 2.52 3.46 -0.18 0.29 0.08 -0.70 -2.43 117.98 121.01 1nz8 s PHE 67 Ca 0.12 1.45 -0.00 0.00 0.12 0.00 0.00 56.93 58.61 1nz8 s PHE 67 Cb -0.15 -3.12 0.05 0.00 -0.57 0.00 0.00 43.02 39.22 1nz8 s PHE 67 CO -0.19 -0.25 -0.06 0.42 -0.10 0.00 0.00 175.22 175.04 1nz8 s ILE 68 N 2.16 1.25 -1.43 0.64 1.09 -0.36 -1.41 121.20 123.14 1nz8 s ILE 68 Ca 0.44 -0.80 -0.14 0.00 -1.10 0.00 0.00 60.65 59.05 1nz8 s ILE 68 Cb -0.17 -1.44 0.05 0.00 -1.06 0.00 0.00 42.46 39.84 1nz8 s ILE 68 CO 0.15 0.08 2.15 1.67 -0.10 0.00 0.00 174.94 178.89 1nz8 n GLN 69 N 4.81 2.94 -1.56 2.79 7.27 0.32 0.99 117.38 134.94 1nz8 n GLN 69 Ca -0.12 -2.74 -0.12 0.00 0.07 0.00 0.00 57.00 54.08 1nz8 n GLN 69 Cb 0.47 -3.28 0.07 0.00 2.41 0.00 0.00 30.24 29.90 1nz8 n GLN 69 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1nz8 n MET 70 N 6.18 0.15 -3.86 3.69 0.00 -0.51 -2.64 117.12 120.13 1nz8 n MET 70 Ca 0.51 -1.37 -0.30 0.00 0.00 0.00 0.00 57.70 56.54 1nz8 n MET 70 Cb 0.40 -0.38 -0.14 0.00 0.00 0.00 0.00 33.22 33.10 1nz8 n MET 70 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1nz8 s ASP 71 N -3.14 4.12 -0.18 3.17 2.15 -0.20 -1.44 116.67 121.14 1nz8 s ASP 71 Ca 0.35 -2.66 -0.15 0.00 0.43 0.00 0.00 52.55 50.51 1nz8 s ASP 71 Cb -0.02 -1.37 -0.07 0.00 -0.30 0.00 0.00 42.92 41.17 1nz8 s ASP 71 CO 0.23 -0.28 -0.24 0.18 -0.17 0.00 0.00 175.17 174.89 1nz8 n LEU 72 N 3.54 1.89 0.00 -1.34 4.77 -1.26 -4.84 117.00 119.76 1nz8 n LEU 72 Ca 0.06 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 1nz8 n LEU 72 Cb 0.35 -0.82 0.00 0.00 -2.33 0.00 0.00 43.42 40.62 1nz8 n LEU 72 CO 0.27 -0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.76 1nz8 n GLY 73 N 1.48 2.29 3.51 -0.72 0.00 -1.26 -4.70 105.19 105.79 1nz8 n GLY 73 Ca -0.19 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 1nz8 n GLY 73 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nz8 s ASP 74 N 0.00 3.58 -0.01 1.61 1.11 -1.26 -5.05 116.67 116.65 1nz8 s ASP 74 Ca 0.00 -1.16 0.08 0.00 0.18 0.00 0.00 52.55 51.65 1nz8 s ASP 74 Cb 0.00 -0.32 -0.11 0.00 1.07 0.00 0.00 42.92 43.56 1nz8 s ASP 74 CO 0.00 -0.17 0.23 -0.62 1.18 0.00 0.00 175.17 175.79 1nz8 n GLU 75 N -0.73 1.68 0.02 8.23 1.02 -1.26 -4.58 120.64 125.02 1nz8 n GLU 75 Ca -0.05 -0.05 -0.13 0.00 -0.02 0.00 0.00 57.16 56.91 1nz8 n GLU 75 Cb 0.63 -1.08 -0.14 0.00 -0.02 0.00 0.00 31.44 30.83 1nz8 n GLU 75 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1nz8 h GLU 76 N 0.00 0.11 -2.99 3.49 4.81 -2.01 -3.44 114.58 114.55 1nz8 h GLU 76 Ca 0.00 -0.19 -0.58 0.00 -0.13 0.00 0.00 59.36 58.46 1nz8 h GLU 76 Cb 0.30 0.07 -0.40 0.00 0.63 0.00 0.00 28.75 29.36 1nz8 h GLU 76 CO 0.00 0.85 -0.78 -1.83 -0.73 0.00 0.00 179.01 176.52 1nz8 s GLU 77 N -2.61 0.76 1.18 1.92 -1.05 -1.26 -5.14 118.70 112.49 1nz8 s GLU 77 Ca -0.08 -1.34 -0.15 0.00 -0.15 0.00 0.00 54.97 53.26 1nz8 s GLU 77 Cb 0.08 -1.77 0.28 0.00 -0.44 0.00 0.00 34.13 32.28 1nz8 s GLU 77 CO 0.82 -1.11 1.03 -2.14 0.95 0.00 0.00 175.26 174.82 1nz8 s PRO 78 N 1.16 -1.04 0.58 -4.83 0.02 -1.26 -4.67 135.00 124.96 1nz8 s PRO 78 Ca 0.14 0.58 -0.02 0.00 0.02 0.00 0.00 61.00 61.72 1nz8 s PRO 78 Cb -0.21 -1.56 0.12 0.00 0.02 0.00 0.00 34.50 32.87 1nz8 s PRO 78 CO -0.12 -3.74 0.79 -1.71 -0.33 0.00 0.00 177.00 171.90 1nz8 n ASN 79 N -4.89 0.84 0.18 2.53 4.05 -1.26 -4.94 115.26 111.77 1nz8 n ASN 79 Ca 0.05 -1.76 0.14 0.00 0.45 0.00 0.00 54.58 53.46 1nz8 n ASN 79 Cb 0.56 -0.53 0.71 0.00 1.23 0.00 0.00 39.78 41.75 1nz8 n ASN 79 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 177.26 174.13 1nz8 h GLU 80 N 0.00 0.00 -0.92 1.20 4.81 -1.96 -1.87 114.58 115.84 1nz8 h GLU 80 Ca -0.26 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.08 1nz8 h GLU 80 Cb 0.91 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.20 1nz8 h GLU 80 CO 0.26 0.00 0.55 0.00 -0.73 0.00 0.00 179.01 179.09 1nz8 h ALA 81 N 1.89 1.37 -0.98 2.92 0.00 -1.96 -0.79 119.26 121.70 1nz8 h ALA 81 Ca 0.09 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1nz8 h ALA 81 Cb 0.37 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1nz8 h ALA 81 CO -0.00 0.14 0.65 2.35 0.00 0.00 0.00 179.25 182.40 1nz8 h TRP 82 N 0.88 1.23 -0.78 0.00 -0.00 -1.70 -1.51 115.95 114.07 1nz8 h TRP 82 Ca 0.46 0.03 -0.05 0.00 -0.00 0.00 0.00 58.89 59.33 1nz8 h TRP 82 Cb 0.46 -0.42 -0.03 0.00 -0.00 0.00 0.00 29.16 29.17 1nz8 h TRP 82 CO -0.03 0.77 0.31 1.49 -0.00 0.00 0.00 178.44 180.98 1nz8 h GLU 83 N 1.33 1.18 -0.14 2.65 4.22 -1.25 0.08 114.58 122.63 1nz8 h GLU 83 Ca 0.36 -0.22 -0.02 0.00 0.08 0.00 0.00 59.36 59.57 1nz8 h GLU 83 Cb -0.14 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 28.92 1nz8 h GLU 83 CO -0.08 0.96 0.02 0.28 -2.18 0.00 0.00 179.01 178.00 1nz8 h VAL 84 N 1.14 1.23 -0.37 0.32 2.07 -0.90 -1.91 116.25 117.83 1nz8 h VAL 84 Ca 0.26 -0.73 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1nz8 h VAL 84 Cb 0.22 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1nz8 h VAL 84 CO -0.02 0.22 0.14 0.58 0.02 0.00 0.00 177.57 178.51 1nz8 h VAL 85 N 0.01 1.20 0.00 2.57 2.07 -1.16 -2.35 116.25 118.58 1nz8 h VAL 85 Ca 0.04 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1nz8 h VAL 85 Cb 0.32 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1nz8 h VAL 85 CO 0.00 0.22 -0.03 -0.09 0.02 0.00 0.00 177.57 177.69 1nz8 h ARG 86 N 0.45 0.00 -0.00 1.57 2.43 -0.95 -1.80 114.38 116.08 1nz8 h ARG 86 Ca 0.12 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.12 1nz8 h ARG 86 Cb 0.20 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 1nz8 h ARG 86 CO -0.01 0.03 -0.81 0.78 -1.51 0.00 0.00 179.97 178.45 1nz8 h GLY 87 N 0.10 0.10 -6.75 2.80 0.00 -0.84 -3.44 103.07 95.05 1nz8 h GLY 87 Ca -0.00 -0.18 -0.58 0.00 0.00 0.00 0.00 47.33 46.57 1nz8 h GLY 87 CO 0.00 0.16 1.44 -0.51 0.00 0.00 0.00 176.54 177.63 1nz8 s THR 88 N -3.24 3.05 0.18 4.70 -4.23 -0.68 -4.89 115.64 110.52 1nz8 s THR 88 Ca -0.02 0.05 -0.33 0.00 -1.18 0.00 0.00 61.69 60.22 1nz8 s THR 88 Cb 0.11 -3.06 -0.15 0.00 1.34 0.00 0.00 72.50 70.74 1nz8 s THR 88 CO 0.80 -0.03 1.26 -2.65 -0.54 0.00 0.00 174.62 173.46 1nz8 n PRO 89 N 8.58 1.41 0.00 3.99 -0.02 -1.26 -2.23 135.00 145.46 1nz8 n PRO 89 Ca 0.28 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1nz8 n PRO 89 Cb 0.45 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1nz8 n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nz8 n GLY 90 N 2.18 0.79 3.73 -1.23 0.00 -1.26 -4.77 105.19 104.63 1nz8 n GLY 90 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1nz8 n GLY 90 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1nz8 s ILE 91 N -2.11 4.41 -0.09 -0.61 1.10 -0.95 -4.87 121.20 118.09 1nz8 s ILE 91 Ca 0.00 2.07 0.04 0.00 -0.51 0.00 0.00 60.65 62.25 1nz8 s ILE 91 Cb 0.00 -4.32 -0.08 0.00 0.15 0.00 0.00 42.46 38.21 1nz8 s ILE 91 CO 0.00 0.35 -0.03 0.35 -2.11 0.00 0.00 174.94 173.50 1nz8 n THR 92 N 2.52 0.56 0.00 4.00 -2.24 -1.26 -5.02 114.28 112.84 1nz8 n THR 92 Ca 0.01 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1nz8 n THR 92 Cb 0.49 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 1nz8 n THR 92 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nz8 n GLY 93 N 2.77 3.06 3.64 3.38 0.00 -1.25 -4.96 105.19 111.82 1nz8 n GLY 93 Ca -0.15 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.87 1nz8 n GLY 93 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1nz8 s PHE 94 N -2.46 -0.06 0.02 1.61 5.36 -1.24 -4.26 117.98 116.96 1nz8 s PHE 94 Ca 0.00 -0.07 -0.11 0.00 -0.96 0.00 0.00 56.93 55.78 1nz8 s PHE 94 Cb 0.00 0.56 -0.06 0.00 -0.34 0.00 0.00 43.02 43.18 1nz8 s PHE 94 CO 0.00 -0.35 1.17 0.28 -1.46 0.00 0.00 175.22 174.87 1nz8 h VAL 95 N 2.00 0.00 0.00 3.12 2.07 -1.88 -3.43 116.25 118.13 1nz8 h VAL 95 Ca -0.29 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1nz8 h VAL 95 Cb 1.21 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1nz8 h VAL 95 CO 0.28 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.48 1nz8 n GLY 96 N -1.19 -1.06 1.40 2.17 0.00 -1.26 -4.97 105.19 100.28 1nz8 n GLY 96 Ca -0.04 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1nz8 n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nz8 n ALA 97 N 0.00 2.49 -2.25 4.61 0.00 -1.26 -5.14 120.51 118.96 1nz8 n ALA 97 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1nz8 n ALA 97 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1nz8 n ALA 97 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1nz8 s GLY 98 N -4.19 1.51 -0.19 0.00 0.00 -1.26 -5.06 107.32 98.13 1nz8 s GLY 98 Ca 0.00 -1.75 0.16 0.00 0.00 0.00 0.00 44.72 43.13 1nz8 s GLY 98 CO 0.00 -1.49 0.05 1.03 0.00 0.00 0.00 173.10 172.69 1nz8 n MET 99 N -0.33 0.90 -1.42 2.90 0.00 -1.26 -4.54 117.12 113.37 1nz8 n MET 99 Ca 0.00 -0.00 -0.34 0.00 0.00 0.00 0.00 57.70 57.36 1nz8 n MET 99 Cb 0.66 -1.48 0.09 0.00 0.00 0.00 0.00 33.22 32.49 1nz8 n MET 99 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 1nz8 s ARG 100 N -2.46 2.15 1.05 0.03 3.00 -1.26 -4.83 118.95 116.62 1nz8 s ARG 100 Ca -0.11 1.69 -0.14 0.00 0.00 0.00 0.00 55.73 57.17 1nz8 s ARG 100 Cb 0.06 -1.84 0.21 0.00 0.00 0.00 0.00 34.95 33.38 1nz8 s ARG 100 CO 0.76 -1.81 1.10 -1.25 0.00 0.00 0.00 175.30 174.10 1nz8 s PRO 101 N -4.00 0.05 -0.27 3.54 0.04 -1.26 -4.92 135.00 128.17 1nz8 s PRO 101 Ca 0.73 0.36 -0.03 0.00 0.04 0.00 0.00 61.00 62.09 1nz8 s PRO 101 Cb -0.27 -1.71 0.11 0.00 0.04 0.00 0.00 34.50 32.67 1nz8 s PRO 101 CO 0.46 -2.95 0.18 0.14 0.04 0.00 0.00 177.00 174.87 1nz8 s VAL 102 N -3.00 -0.19 0.69 -0.36 -7.23 -1.25 -5.08 120.40 103.98 1nz8 s VAL 102 Ca 0.67 -0.58 -0.13 0.00 -1.81 0.00 0.00 61.98 60.13 1nz8 s VAL 102 Cb -0.17 -0.92 0.01 0.00 0.56 0.00 0.00 36.38 35.87 1nz8 s VAL 102 CO 0.57 -0.57 1.08 -2.16 -0.31 0.00 0.00 175.10 173.71 1nz8 s PRO 103 N 2.20 2.74 0.50 4.82 0.04 -1.26 -2.86 135.00 141.17 1nz8 s PRO 103 Ca 0.08 1.18 -0.03 0.00 0.04 0.00 0.00 61.00 62.28 1nz8 s PRO 103 Cb -0.15 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 1nz8 s PRO 103 CO -0.31 -1.27 0.76 -0.51 0.04 0.00 0.00 177.00 175.70 1nz8 s LEU 104 N -5.32 3.52 0.15 -3.56 1.43 -0.74 -4.89 118.68 109.26 1nz8 s LEU 104 Ca 0.62 0.54 -0.21 0.00 -1.03 0.00 0.00 54.13 54.05 1nz8 s LEU 104 Cb -0.17 -3.41 -0.08 0.00 0.03 0.00 0.00 46.19 42.57 1nz8 s LEU 104 CO 0.49 -0.79 0.68 -0.94 0.23 0.00 0.00 176.35 176.02 1nz8 s SER 105 N -4.22 7.16 0.45 2.29 1.04 -1.26 -4.85 113.70 114.31 1nz8 s SER 105 Ca 0.50 1.42 0.23 0.00 0.48 0.00 0.00 55.95 58.58 1nz8 s SER 105 Cb -0.10 -2.42 1.24 0.00 0.10 0.00 0.00 66.02 64.84 1nz8 s SER 105 CO 0.41 0.18 1.82 -0.65 0.98 0.00 0.00 173.24 175.99 1nz8 h PRO 106 N 4.13 0.26 -0.35 4.02 0.11 -1.98 0.83 132.00 139.03 1nz8 h PRO 106 Ca -0.48 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.48 1nz8 h PRO 106 Cb 1.20 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1nz8 h PRO 106 CO 0.65 0.17 -0.29 -0.44 -0.21 0.00 0.00 178.00 177.88 1nz8 h ASP 107 N 0.27 0.85 0.85 -2.05 5.19 -2.01 -2.47 116.42 117.05 1nz8 h ASP 107 Ca 0.53 -0.45 -0.24 0.00 -0.62 0.00 0.00 57.03 56.25 1nz8 h ASP 107 Cb 1.58 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 40.83 1nz8 h ASP 107 CO -0.17 1.12 -1.16 -0.33 -3.12 0.00 0.00 179.24 175.59 1nz8 h GLU 108 N 0.59 0.05 -0.50 3.56 4.39 -1.30 -3.31 114.58 118.07 1nz8 h GLU 108 Ca 0.06 -0.09 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 1nz8 h GLU 108 Cb 0.86 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.52 1nz8 h GLU 108 CO 0.07 0.97 0.19 0.28 -1.16 0.00 0.00 179.01 179.37 1nz8 h VAL 109 N 0.01 1.22 -0.04 3.13 2.07 0.56 -1.76 116.25 121.45 1nz8 h VAL 109 Ca -0.08 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 1nz8 h VAL 109 Cb 1.85 0.72 -0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1nz8 h VAL 109 CO 0.14 0.26 -0.04 -0.09 0.02 0.00 0.00 177.57 177.85 1nz8 h ARG 110 N 0.68 0.05 0.09 1.57 2.43 -1.54 0.12 114.38 117.78 1nz8 h ARG 110 Ca 0.17 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1nz8 h ARG 110 Cb 0.21 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1nz8 h ARG 110 CO -0.01 0.10 -0.04 0.45 -1.51 0.00 0.00 179.97 178.95 1nz8 h HIS 111 N 0.05 -0.11 0.00 2.20 3.86 -1.53 -3.04 115.15 116.59 1nz8 h HIS 111 Ca 0.01 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1nz8 h HIS 111 Cb 0.11 0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.61 1nz8 h HIS 111 CO 0.00 0.43 0.00 -0.84 0.86 0.00 0.00 177.93 178.38 1nz8 h ILE 112 N -0.82 0.00 -0.14 2.45 -0.00 -1.11 -2.14 117.51 115.76 1nz8 h ILE 112 Ca -0.01 -0.21 -0.19 0.00 -0.00 0.00 0.00 64.86 64.45 1nz8 h ILE 112 Cb 0.59 0.97 -0.00 0.00 -0.00 0.00 0.00 36.82 38.37 1nz8 h ILE 112 CO 0.02 0.00 -0.68 0.25 -0.00 0.00 0.00 178.15 177.74 1nz8 h LEU 113 N 0.00 0.65 -2.48 0.16 5.85 -0.71 -2.91 115.31 115.87 1nz8 h LEU 113 Ca 0.00 -0.40 0.02 0.00 0.84 0.00 0.00 57.88 58.34 1nz8 h LEU 113 Cb 0.26 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 1nz8 h LEU 113 CO 0.00 1.15 0.14 -0.08 -0.34 0.00 0.00 178.44 179.30 1nz8 h GLU 114 N 0.40 0.00 0.45 1.25 4.81 -1.27 -2.44 114.58 117.79 1nz8 h GLU 114 Ca -0.02 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1nz8 h GLU 114 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1nz8 h GLU 114 CO 0.13 0.00 -0.22 0.28 -0.73 0.00 0.00 179.01 178.47 1nz8 h VAL 115 N 0.00 0.00 -0.14 0.32 2.07 -1.62 -3.34 116.25 113.54 1nz8 h VAL 115 Ca 0.03 -0.47 0.05 0.00 0.82 0.00 0.00 66.70 67.13 1nz8 h VAL 115 Cb 0.30 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.01 1nz8 h VAL 115 CO -0.00 0.00 -0.25 -1.28 0.02 0.00 0.00 177.57 176.06 1nz8 h SER 116 N -1.07 -0.79 0.00 0.57 0.87 -1.57 -3.46 113.55 108.11 1nz8 h SER 116 Ca -0.06 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1nz8 h SER 116 Cb 0.46 0.35 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1nz8 h SER 116 CO 0.10 -0.30 0.00 0.61 -0.53 0.00 0.00 176.83 176.71 1nz8 n GLY 117 N -1.38 0.74 0.98 5.77 0.00 -0.95 -5.04 105.19 105.32 1nz8 n GLY 117 Ca -0.03 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.11 1nz8 n GLY 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nz8 n LEU 118 N 0.00 3.06 0.07 0.99 4.77 -1.18 -4.71 117.00 120.00 1nz8 n LEU 118 Ca 0.00 -1.06 0.00 0.00 -0.03 0.00 0.00 56.01 54.92 1nz8 n LEU 118 Cb 0.00 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1nz8 n LEU 118 CO 0.00 0.53 0.00 0.18 -1.33 0.00 0.00 177.39 176.77 1nz8 n LEU 119 N 1.37 0.26 -0.28 2.23 4.32 -1.26 -5.01 117.00 118.62 1nz8 n LEU 119 Ca 0.15 0.24 0.04 0.00 -0.02 0.00 0.00 56.01 56.42 1nz8 n LEU 119 Cb 0.60 0.07 0.03 0.00 -1.62 0.00 0.00 43.42 42.50 1nz8 n LEU 119 CO 0.15 -0.70 0.36 0.61 -1.22 0.00 0.00 177.39 176.60