#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 0.65 0.11 0.44 -0.00 -1.26 -4.98 121.20 116.15 1nz8 s ILE 3 Ca 0.00 -2.00 -0.01 0.00 -0.00 0.00 0.00 60.65 58.64 1nz8 s ILE 3 Cb 0.00 -2.51 -0.04 0.00 -0.00 0.00 0.00 42.46 39.90 1nz8 s ILE 3 CO 0.00 0.00 0.03 -1.61 -0.00 0.00 0.00 174.94 173.36 1nz8 s GLU 4 N -3.80 0.83 -0.85 0.37 2.02 -0.83 -5.01 118.70 111.42 1nz8 s GLU 4 Ca 0.31 -1.37 -0.19 0.00 0.02 0.00 0.00 54.97 53.74 1nz8 s GLU 4 Cb 0.05 0.22 0.13 0.00 0.10 0.00 0.00 34.13 34.63 1nz8 s GLU 4 CO 0.16 -0.21 1.02 -1.58 0.02 0.00 0.00 175.26 174.67 1nz8 s TRP 5 N -4.00 3.13 -0.54 1.61 0.52 -1.25 -1.16 118.94 117.25 1nz8 s TRP 5 Ca 0.19 -1.32 -0.29 0.00 0.02 0.00 0.00 56.10 54.71 1nz8 s TRP 5 Cb 0.08 -4.20 0.03 0.00 -1.15 0.00 0.00 33.47 28.22 1nz8 s TRP 5 CO -0.02 -1.43 1.18 0.71 0.02 0.00 0.00 176.95 177.42 1nz8 s TYR 6 N 2.55 2.67 0.24 -1.98 1.51 0.40 -0.82 117.35 121.92 1nz8 s TYR 6 Ca 0.28 0.53 -0.16 0.00 -1.01 0.00 0.00 57.07 56.70 1nz8 s TYR 6 Cb -0.09 -4.49 -0.08 0.00 -0.11 0.00 0.00 41.96 37.19 1nz8 s TYR 6 CO -0.06 -1.49 0.68 0.00 -1.11 0.00 0.00 175.55 173.57 1nz8 s ALA 7 N 4.82 3.43 0.32 3.71 0.00 -1.17 -1.83 121.76 131.04 1nz8 s ALA 7 Ca 0.45 0.04 -0.02 0.00 0.00 0.00 0.00 51.96 52.43 1nz8 s ALA 7 Cb -0.07 -2.72 -0.01 0.00 0.00 0.00 0.00 23.12 20.32 1nz8 s ALA 7 CO 0.28 0.37 0.42 0.14 0.00 0.00 0.00 175.76 176.97 1nz8 s VAL 8 N -1.67 0.00 0.26 0.00 -7.23 0.13 -4.13 120.40 107.77 1nz8 s VAL 8 Ca 0.46 -1.67 0.10 0.00 -1.81 0.00 0.00 61.98 59.05 1nz8 s VAL 8 Cb -0.14 -2.57 -0.05 0.00 0.56 0.00 0.00 36.38 34.18 1nz8 s VAL 8 CO 0.20 0.00 -0.16 -1.00 -0.31 0.00 0.00 175.10 173.82 1nz8 s HIS 9 N -3.28 2.09 0.08 2.82 3.76 -1.26 -0.89 115.29 118.62 1nz8 s HIS 9 Ca 0.32 -0.45 0.01 0.00 -0.15 0.00 0.00 55.06 54.80 1nz8 s HIS 9 Cb 0.01 -0.97 -0.04 0.00 1.11 0.00 0.00 32.58 32.69 1nz8 s HIS 9 CO 0.20 0.56 -0.06 0.95 -0.85 0.00 0.00 174.74 175.54 1nz8 s THR 10 N -2.70 0.56 0.08 1.30 -4.23 -1.12 -4.39 115.64 105.15 1nz8 s THR 10 Ca 0.28 -1.80 -0.34 0.00 -1.18 0.00 0.00 61.69 58.64 1nz8 s THR 10 Cb -0.02 -1.51 -0.14 0.00 1.34 0.00 0.00 72.50 72.17 1nz8 s THR 10 CO 0.12 -0.84 1.63 -0.11 -0.54 0.00 0.00 174.62 174.87 1nz8 n LEU 11 N 0.18 2.99 -4.71 4.79 0.00 -1.22 -4.74 117.00 114.29 1nz8 n LEU 11 Ca -0.14 1.06 -0.42 0.00 0.00 0.00 0.00 56.01 56.51 1nz8 n LEU 11 Cb 0.60 -1.38 -0.03 0.00 0.00 0.00 0.00 43.42 42.61 1nz8 n LEU 11 CO 0.28 -0.32 1.28 0.68 0.00 0.00 0.00 177.39 179.31 1nz8 s VAL 12 N 1.67 2.62 0.00 1.96 -7.23 -1.26 -1.97 120.40 116.19 1nz8 s VAL 12 Ca 0.83 0.38 0.00 0.00 -1.81 0.00 0.00 61.98 61.38 1nz8 s VAL 12 Cb -0.73 -3.24 0.00 0.00 0.56 0.00 0.00 36.38 32.97 1nz8 s VAL 12 CO 0.43 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.85 1nz8 n GLY 13 N 3.86 2.91 0.05 2.32 0.00 -1.26 -4.76 105.19 108.31 1nz8 n GLY 13 Ca 0.15 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.23 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 0.00 0.13 -0.35 1.61 1.13 -0.86 -4.39 117.38 114.65 1nz8 n GLN 14 Ca 0.00 -0.10 0.26 0.00 -1.94 0.00 0.00 57.00 55.22 1nz8 n GLN 14 Cb 0.00 -1.50 0.50 0.00 0.11 0.00 0.00 30.24 29.36 1nz8 n GLN 14 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1nz8 h GLU 15 N 0.24 0.29 -0.69 -1.09 5.08 -1.69 0.43 114.58 117.14 1nz8 h GLU 15 Ca 0.00 -0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.43 1nz8 h GLU 15 Cb 0.52 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.64 1nz8 h GLU 15 CO 0.00 0.19 0.35 0.93 -1.00 0.00 0.00 179.01 179.48 1nz8 h GLU 16 N 0.30 0.58 0.00 2.33 5.08 -1.90 -0.82 114.58 120.15 1nz8 h GLU 16 Ca 0.73 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.90 1nz8 h GLU 16 Cb 1.79 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.89 1nz8 h GLU 16 CO -0.55 0.38 -0.84 -0.22 -1.00 0.00 0.00 179.01 176.78 1nz8 h LYS 17 N 0.60 0.00 -0.26 2.33 3.64 -0.58 -3.31 116.57 118.99 1nz8 h LYS 17 Ca 0.34 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.70 1nz8 h LYS 17 Cb 0.34 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1nz8 h LYS 17 CO -0.26 0.68 0.11 0.00 -2.27 0.00 0.00 179.45 177.71 1nz8 h ALA 18 N 1.27 0.34 -0.31 5.00 0.00 0.09 0.61 119.26 126.26 1nz8 h ALA 18 Ca -0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1nz8 h ALA 18 Cb 1.59 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 1nz8 h ALA 18 CO 0.09 -0.07 0.20 -0.22 0.00 0.00 0.00 179.25 179.26 1nz8 h LYS 19 N 0.28 0.41 0.00 0.00 3.11 -1.29 0.21 116.57 119.28 1nz8 h LYS 19 Ca 0.09 -0.02 -0.06 0.00 -2.81 0.00 0.00 60.65 57.85 1nz8 h LYS 19 Cb 0.17 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.30 1nz8 h LYS 19 CO -0.01 0.27 -0.33 0.00 -2.81 0.00 0.00 179.45 176.57 1nz8 h ALA 20 N 1.81 0.07 -0.54 5.00 0.00 -1.55 -2.74 119.26 121.30 1nz8 h ALA 20 Ca 0.11 -0.64 0.03 0.00 0.00 0.00 0.00 54.91 54.41 1nz8 h ALA 20 Cb -0.05 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1nz8 h ALA 20 CO -0.02 0.19 0.36 -0.91 0.00 0.00 0.00 179.25 178.86 1nz8 h ASN 21 N -1.00 0.54 0.28 0.00 -0.26 0.34 -0.05 115.58 115.43 1nz8 h ASN 21 Ca -0.09 -0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.63 1nz8 h ASN 21 Cb 0.99 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 38.13 1nz8 h ASN 21 CO -0.05 0.38 -0.14 0.25 -1.06 0.00 0.00 177.43 176.81 1nz8 h LEU 22 N 0.63 -0.32 -1.67 1.61 5.85 -0.72 -2.64 115.31 118.05 1nz8 h LEU 22 Ca 0.21 -0.17 0.14 0.00 0.84 0.00 0.00 57.88 58.91 1nz8 h LEU 22 Cb 0.07 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1nz8 h LEU 22 CO -0.06 0.16 0.47 -0.33 -0.34 0.00 0.00 178.44 178.34 1nz8 h GLU 23 N -0.98 0.33 -0.46 1.25 4.39 -1.32 -0.09 114.58 117.70 1nz8 h GLU 23 Ca -0.04 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.52 1nz8 h GLU 23 Cb 0.48 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1nz8 h GLU 23 CO 0.06 0.22 -0.17 0.87 -1.16 0.00 0.00 179.01 178.83 1nz8 h LYS 24 N 0.34 0.93 -0.41 2.33 1.57 -1.03 -1.57 116.57 118.72 1nz8 h LYS 24 Ca 0.34 -0.38 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 1nz8 h LYS 24 Cb 0.84 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 1nz8 h LYS 24 CO -0.09 1.04 -0.23 0.00 -0.57 0.00 0.00 179.45 179.60 1nz8 h ARG 25 N 0.77 0.84 -0.00 3.15 2.47 -0.68 0.62 114.38 121.55 1nz8 h ARG 25 Ca 0.11 -0.35 -0.10 0.00 -1.26 0.00 0.00 59.98 58.38 1nz8 h ARG 25 Cb 0.73 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 29.00 1nz8 h ARG 25 CO 0.06 0.98 -0.47 0.82 0.56 0.00 0.00 179.97 181.92 1nz8 h ILE 26 N 0.73 1.34 0.05 2.04 1.08 -1.11 -1.99 117.51 119.65 1nz8 h ILE 26 Ca 0.10 -1.61 -0.31 0.00 -0.39 0.00 0.00 64.86 62.64 1nz8 h ILE 26 Cb 0.76 1.87 -0.03 0.00 -3.07 0.00 0.00 36.82 36.35 1nz8 h ILE 26 CO 0.06 0.46 -1.74 0.11 -0.69 0.00 0.00 178.15 176.36 1nz8 h LYS 27 N 0.01 0.11 0.00 2.37 1.57 -1.04 -0.12 116.57 119.46 1nz8 h LYS 27 Ca -0.00 -0.19 -0.08 0.00 -1.87 0.00 0.00 60.65 58.51 1nz8 h LYS 27 Cb 0.83 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1nz8 h LYS 27 CO 0.06 0.80 -0.39 0.00 -0.57 0.00 0.00 179.45 179.36 1nz8 h ALA 28 N 0.67 1.32 0.00 3.86 0.00 0.31 -3.12 119.26 122.30 1nz8 h ALA 28 Ca -0.31 -0.35 -0.26 0.00 0.00 0.00 0.00 54.91 53.99 1nz8 h ALA 28 Cb 2.01 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 19.69 1nz8 h ALA 28 CO 0.10 0.49 -2.23 1.19 0.00 0.00 0.00 179.25 178.79 1nz8 n PHE 29 N -4.02 0.06 -1.56 0.00 3.72 -0.76 -5.04 117.46 109.86 1nz8 n PHE 29 Ca -0.02 0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1nz8 n PHE 29 Cb 0.43 -0.87 0.00 0.00 -0.94 0.00 0.00 39.48 38.10 1nz8 n PHE 29 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nz8 n GLY 30 N 1.60 0.77 2.10 1.37 0.00 -0.49 -4.98 105.19 105.56 1nz8 n GLY 30 Ca -0.24 -0.35 -0.26 0.00 0.00 0.00 0.00 46.02 45.17 1nz8 n GLY 30 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nz8 n LEU 31 N -1.28 6.61 0.00 0.99 4.77 -0.18 -4.56 117.00 123.35 1nz8 n LEU 31 Ca 0.00 -4.05 0.12 0.00 -0.03 0.00 0.00 56.01 52.05 1nz8 n LEU 31 Cb 0.47 -0.82 0.62 0.00 -2.33 0.00 0.00 43.42 41.36 1nz8 n LEU 31 CO 0.00 1.37 0.88 0.00 -1.33 0.00 0.00 177.39 178.31 1nz8 n GLN 32 N -1.00 0.44 0.09 3.23 6.02 -1.26 -2.65 117.38 122.25 1nz8 n GLN 32 Ca 0.56 0.05 -0.03 0.00 -0.01 0.00 0.00 57.00 57.57 1nz8 n GLN 32 Cb 1.08 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.78 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 -1.97 -3.38 116.42 115.46 1nz8 h ASP 33 Ca 0.00 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.83 1nz8 h ASP 33 Cb 0.16 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1nz8 h ASP 33 CO 0.00 0.80 -1.58 0.29 -1.72 0.00 0.00 179.24 177.03 1nz8 n LYS 34 N -3.31 0.55 -2.81 3.56 4.01 -1.13 -4.78 118.16 114.24 1nz8 n LYS 34 Ca 0.01 0.34 -0.43 0.00 -0.51 0.00 0.00 58.31 57.72 1nz8 n LYS 34 Cb 0.85 -1.55 -0.03 0.00 -0.51 0.00 0.00 35.03 33.79 1nz8 n LYS 34 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1nz8 s ILE 35 N -2.56 4.35 -0.16 -0.18 1.09 -1.09 -3.21 121.20 119.45 1nz8 s ILE 35 Ca -0.31 -0.78 -0.27 0.00 -1.10 0.00 0.00 60.65 58.20 1nz8 s ILE 35 Cb 0.08 -4.80 -0.24 0.00 -1.06 0.00 0.00 42.46 36.45 1nz8 s ILE 35 CO 0.45 -1.58 0.60 -0.26 -0.10 0.00 0.00 174.94 174.05 1nz8 h PHE 36 N 9.39 0.00 -4.09 3.97 0.04 -1.71 -3.42 116.94 121.12 1nz8 h PHE 36 Ca -0.06 0.00 -0.69 0.00 2.80 0.00 0.00 57.97 60.02 1nz8 h PHE 36 Cb 1.04 0.00 -0.25 0.00 2.20 0.00 0.00 35.95 38.94 1nz8 h PHE 36 CO 1.10 1.14 -0.80 -1.14 -0.60 0.00 0.00 178.31 178.01 1nz8 s GLN 37 N -2.26 2.49 -0.05 1.51 0.74 -1.19 -4.99 119.66 115.92 1nz8 s GLN 37 Ca -0.22 -0.75 -0.04 0.00 0.05 0.00 0.00 55.36 54.40 1nz8 s GLN 37 Cb -0.00 -2.32 0.02 0.00 1.10 0.00 0.00 33.01 31.81 1nz8 s GLN 37 CO 0.66 0.56 0.12 0.54 -0.55 0.00 0.00 175.29 176.63 1nz8 s VAL 38 N -0.59 -0.01 0.06 1.34 0.11 -1.26 0.11 120.40 120.17 1nz8 s VAL 38 Ca 0.09 0.03 -0.27 0.00 -2.93 0.00 0.00 61.98 58.90 1nz8 s VAL 38 Cb -0.11 -0.19 0.07 0.00 -1.53 0.00 0.00 36.38 34.62 1nz8 s VAL 38 CO 0.01 0.01 0.64 -1.48 -3.33 0.00 0.00 175.10 170.95 1nz8 s LEU 39 N 0.22 -0.60 -0.14 2.54 -0.00 -1.03 -5.02 118.68 114.65 1nz8 s LEU 39 Ca -0.01 0.32 -0.00 0.00 -0.00 0.00 0.00 54.13 54.43 1nz8 s LEU 39 Cb -0.02 2.56 -0.01 0.00 -0.00 0.00 0.00 46.19 48.71 1nz8 s LEU 39 CO -0.01 -0.80 -0.13 -0.51 -0.00 0.00 0.00 176.35 174.90 1nz8 s ILE 40 N -2.60 2.96 -0.86 1.48 2.07 -1.26 -2.74 121.20 120.25 1nz8 s ILE 40 Ca -0.04 -0.68 -0.21 0.00 -1.41 0.00 0.00 60.65 58.30 1nz8 s ILE 40 Cb -0.01 -2.25 -0.19 0.00 0.13 0.00 0.00 42.46 40.15 1nz8 s ILE 40 CO -0.03 0.52 1.91 -0.81 -1.91 0.00 0.00 174.94 174.61 1nz8 n PRO 41 N 3.73 0.09 -3.60 3.50 -0.04 -1.26 -4.74 135.00 132.68 1nz8 n PRO 41 Ca -0.18 -1.31 -0.15 0.00 -0.04 0.00 0.00 63.50 61.82 1nz8 n PRO 41 Cb 0.52 -3.31 -0.07 0.00 -0.04 0.00 0.00 33.50 30.60 1nz8 n PRO 41 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1nz8 s THR 42 N 13.70 0.00 0.34 0.52 -4.23 -1.26 -2.44 115.64 122.26 1nz8 s THR 42 Ca 0.66 -0.00 -0.25 0.00 -1.18 0.00 0.00 61.69 60.92 1nz8 s THR 42 Cb -0.05 -0.99 -0.10 0.00 1.34 0.00 0.00 72.50 72.69 1nz8 s THR 42 CO 0.15 -0.00 0.95 -0.70 -0.54 0.00 0.00 174.62 174.48 1nz8 s GLU 43 N -0.04 4.53 -0.08 3.99 -6.30 0.05 -4.07 118.70 116.78 1nz8 s GLU 43 Ca -0.03 1.31 -0.03 0.00 -2.50 0.00 0.00 54.97 53.72 1nz8 s GLU 43 Cb -0.04 -2.71 0.05 0.00 0.00 0.00 0.00 34.13 31.43 1nz8 s GLU 43 CO 0.03 0.23 0.15 -1.21 0.02 0.00 0.00 175.26 174.48 1nz8 s GLU 44 N -2.21 0.04 -0.12 4.30 2.02 -1.26 -2.88 118.70 118.58 1nz8 s GLU 44 Ca 0.52 0.53 -0.04 0.00 0.02 0.00 0.00 54.97 56.00 1nz8 s GLU 44 Cb -0.18 -0.27 0.06 0.00 0.10 0.00 0.00 34.13 33.85 1nz8 s GLU 44 CO 0.23 -0.29 0.18 0.14 0.02 0.00 0.00 175.26 175.54 1nz8 s VAL 45 N 2.14 -0.28 -0.47 2.63 -7.23 -1.14 -5.03 120.40 111.03 1nz8 s VAL 45 Ca 0.02 0.21 0.06 0.00 -1.81 0.00 0.00 61.98 60.46 1nz8 s VAL 45 Cb -0.12 -0.41 0.30 0.00 0.56 0.00 0.00 36.38 36.71 1nz8 s VAL 45 CO -0.06 0.04 1.06 0.55 -0.31 0.00 0.00 175.10 176.39 1nz8 n VAL 46 N 5.32 -0.00 -3.96 1.32 3.14 -1.21 -2.88 118.33 120.06 1nz8 n VAL 46 Ca -0.05 -1.50 -0.09 0.00 -2.96 0.00 0.00 64.34 59.74 1nz8 n VAL 46 Cb 0.50 1.50 -0.05 0.00 -1.06 0.00 0.00 33.84 34.73 1nz8 n VAL 46 CO 0.00 0.00 0.00 -1.83 -6.46 0.00 0.00 176.83 168.54 1nz8 s GLU 47 N 0.37 1.55 -0.05 1.45 -1.05 -1.26 -5.03 118.70 114.67 1nz8 s GLU 47 Ca 0.24 -1.19 -0.14 0.00 -0.15 0.00 0.00 54.97 53.73 1nz8 s GLU 47 Cb 0.28 0.49 -0.05 0.00 -0.44 0.00 0.00 34.13 34.40 1nz8 s GLU 47 CO -0.10 -0.65 0.37 -0.51 0.95 0.00 0.00 175.26 175.32 1nz8 s LEU 48 N -2.99 4.40 0.00 1.83 1.43 -1.26 -4.66 118.68 117.43 1nz8 s LEU 48 Ca 0.20 0.81 0.00 0.00 -1.03 0.00 0.00 54.13 54.11 1nz8 s LEU 48 Cb -0.01 -2.50 0.00 0.00 0.03 0.00 0.00 46.19 43.71 1nz8 s LEU 48 CO 0.08 0.26 0.00 -1.14 0.23 0.00 0.00 176.35 175.77 1nz8 n ARG 49 N 2.36 0.00 -3.16 1.70 3.00 -1.26 -5.03 116.66 114.27 1nz8 n ARG 49 Ca -0.13 0.00 -0.45 0.00 -0.00 0.00 0.00 57.85 57.26 1nz8 n ARG 49 Cb 0.52 -0.04 -0.01 0.00 0.00 0.00 0.00 32.46 32.93 1nz8 n ARG 49 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 1nz8 s GLU 50 N -1.63 3.79 7.94 -0.14 2.12 -1.26 -4.97 118.70 124.56 1nz8 s GLU 50 Ca 0.00 -2.43 0.00 0.00 0.36 0.00 0.00 54.97 52.90 1nz8 s GLU 50 Cb 0.00 -4.69 0.00 0.00 0.26 0.00 0.00 34.13 29.70 1nz8 s GLU 50 CO 0.00 -1.49 0.00 0.41 -0.54 0.00 0.00 175.26 173.64 1nz8 n GLY 51 N 4.18 3.90 2.56 -1.50 0.00 -1.26 -2.86 105.19 110.21 1nz8 n GLY 51 Ca 0.22 0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 5.93 3.81 -0.02 0.00 -1.26 -5.02 105.19 108.63 1nz8 n GLY 52 Ca 0.00 -2.73 -0.29 0.00 0.00 0.00 0.00 46.02 43.00 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 -3.61 2.98 -0.09 1.61 1.02 -1.13 -5.12 119.74 115.40 1nz8 s LYS 53 Ca 0.48 -0.71 0.01 0.00 0.02 0.00 0.00 55.97 55.77 1nz8 s LYS 53 Cb 0.40 -2.75 0.02 0.00 -0.52 0.00 0.00 37.83 34.98 1nz8 s LYS 53 CO -0.22 0.54 -0.10 -1.59 -0.92 0.00 0.00 175.35 173.06 1nz8 s LYS 54 N -2.68 1.63 -0.12 1.68 0.00 -1.26 -4.68 119.74 114.32 1nz8 s LYS 54 Ca 0.31 -0.35 -0.03 0.00 0.00 0.00 0.00 55.97 55.90 1nz8 s LYS 54 Cb -0.12 -1.50 0.04 0.00 0.00 0.00 0.00 37.83 36.26 1nz8 s LYS 54 CO 0.23 -0.11 0.05 -2.00 0.00 0.00 0.00 175.35 173.52 1nz8 s GLU 55 N 1.13 0.30 -0.33 1.78 2.12 -1.26 -5.10 118.70 117.33 1nz8 s GLU 55 Ca -0.06 0.01 0.03 0.00 0.36 0.00 0.00 54.97 55.31 1nz8 s GLU 55 Cb -0.14 -1.34 0.10 0.00 0.26 0.00 0.00 34.13 33.00 1nz8 s GLU 55 CO -0.02 -0.48 0.06 0.54 -0.54 0.00 0.00 175.26 174.82 1nz8 s VAL 56 N 2.04 1.94 0.32 3.70 0.11 -1.24 -3.34 120.40 123.93 1nz8 s VAL 56 Ca 0.03 -2.13 -0.15 0.00 -2.93 0.00 0.00 61.98 56.80 1nz8 s VAL 56 Cb -0.14 -2.44 0.02 0.00 -1.53 0.00 0.00 36.38 32.29 1nz8 s VAL 56 CO -0.06 -0.62 0.67 0.68 -3.33 0.00 0.00 175.10 172.43 1nz8 s VAL 57 N 1.06 0.00 0.01 2.04 -7.23 -1.14 -5.04 120.40 110.11 1nz8 s VAL 57 Ca 0.11 -1.15 -0.04 0.00 -1.81 0.00 0.00 61.98 59.08 1nz8 s VAL 57 Cb -0.19 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.33 1nz8 s VAL 57 CO -0.12 0.00 0.07 -0.13 -0.31 0.00 0.00 175.10 174.61 1nz8 s ARG 58 N -3.29 0.43 -0.26 4.82 0.52 -1.26 -2.86 118.95 117.05 1nz8 s ARG 58 Ca 0.17 -0.52 -0.01 0.00 -0.52 0.00 0.00 55.73 54.86 1nz8 s ARG 58 Cb -0.04 0.17 0.08 0.00 0.52 0.00 0.00 34.95 35.68 1nz8 s ARG 58 CO 0.11 -0.09 0.04 0.15 0.02 0.00 0.00 175.30 175.52 1nz8 s LYS 59 N -1.54 0.97 -0.13 3.54 -0.14 -1.14 -4.84 119.74 116.45 1nz8 s LYS 59 Ca -0.14 -0.94 -0.29 0.00 -1.36 0.00 0.00 55.97 53.24 1nz8 s LYS 59 Cb -0.08 -2.25 -0.05 0.00 -1.68 0.00 0.00 37.83 33.76 1nz8 s LYS 59 CO 0.00 -0.80 1.91 0.21 -0.76 0.00 0.00 175.35 175.91 1nz8 s LYS 60 N 1.58 3.71 -0.11 1.68 2.20 -1.26 -0.77 119.74 126.76 1nz8 s LYS 60 Ca 0.03 2.09 -0.07 0.00 -0.36 0.00 0.00 55.97 57.66 1nz8 s LYS 60 Cb -0.18 -4.18 -0.26 0.00 -1.51 0.00 0.00 37.83 31.70 1nz8 s LYS 60 CO -0.15 -1.42 0.38 1.28 -0.36 0.00 0.00 175.35 175.08 1nz8 n LEU 61 N 9.12 2.61 -3.71 5.43 4.77 -1.02 -4.77 117.00 129.42 1nz8 n LEU 61 Ca 0.22 0.22 -0.30 0.00 -0.03 0.00 0.00 56.01 56.13 1nz8 n LEU 61 Cb 0.44 -1.10 -0.14 0.00 -2.33 0.00 0.00 43.42 40.28 1nz8 n LEU 61 CO 0.66 0.85 -0.30 -0.36 -1.33 0.00 0.00 177.39 176.91 1nz8 s PHE 62 N -2.56 1.79 0.26 -1.77 0.40 -1.18 -5.05 117.98 109.86 1nz8 s PHE 62 Ca -0.22 -2.02 -0.31 0.00 -0.60 0.00 0.00 56.93 53.79 1nz8 s PHE 62 Cb 0.07 -1.75 -0.12 0.00 0.51 0.00 0.00 43.02 41.73 1nz8 s PHE 62 CO 0.77 -0.84 1.65 -2.14 0.70 0.00 0.00 175.22 175.36 1nz8 s PRO 63 N 1.09 4.11 -1.93 0.24 0.02 -1.26 -1.89 135.00 135.39 1nz8 s PRO 63 Ca 0.13 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.76 1nz8 s PRO 63 Cb -0.20 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.28 1nz8 s PRO 63 CO -0.13 -0.69 0.00 0.41 -0.33 0.00 0.00 177.00 176.26 1nz8 n GLY 64 N 2.84 1.12 3.51 0.52 0.00 -1.26 -4.98 105.19 106.94 1nz8 n GLY 64 Ca 0.11 -0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.80 2.51 -0.28 1.61 2.02 -0.79 -2.77 117.35 116.85 1nz8 s TYR 65 Ca 0.00 -0.27 -0.17 0.00 -0.37 0.00 0.00 57.07 56.26 1nz8 s TYR 65 Cb 0.00 -1.24 0.08 0.00 -0.40 0.00 0.00 41.96 40.40 1nz8 s TYR 65 CO 0.00 0.50 0.71 -0.51 -1.57 0.00 0.00 175.55 174.68 1nz8 s LEU 66 N -2.73 -0.91 -0.03 -1.29 1.02 -0.07 -4.04 118.68 110.63 1nz8 s LEU 66 Ca 0.23 1.48 0.01 0.00 0.02 0.00 0.00 54.13 55.87 1nz8 s LEU 66 Cb -0.09 2.36 -0.03 0.00 0.02 0.00 0.00 46.19 48.45 1nz8 s LEU 66 CO 0.13 -0.23 -0.03 -0.36 0.02 0.00 0.00 176.35 175.87 1nz8 s PHE 67 N 1.51 3.01 -0.05 0.29 0.08 -1.11 0.23 117.98 121.94 1nz8 s PHE 67 Ca -0.09 0.05 -0.01 0.00 0.12 0.00 0.00 56.93 57.00 1nz8 s PHE 67 Cb -0.05 -1.68 0.03 0.00 -0.57 0.00 0.00 43.02 40.75 1nz8 s PHE 67 CO -0.18 0.41 0.03 0.42 -0.10 0.00 0.00 175.22 175.80 1nz8 s ILE 68 N -0.97 0.08 -1.53 0.64 1.09 -0.76 -2.47 121.20 117.29 1nz8 s ILE 68 Ca 0.16 0.27 -0.12 0.00 -1.10 0.00 0.00 60.65 59.86 1nz8 s ILE 68 Cb -0.11 -0.28 -0.02 0.00 -1.06 0.00 0.00 42.46 40.99 1nz8 s ILE 68 CO 0.06 0.19 2.58 1.67 -0.10 0.00 0.00 174.94 179.34 1nz8 n GLN 69 N 4.98 3.24 -0.55 2.79 7.27 0.31 0.15 117.38 135.57 1nz8 n GLN 69 Ca -0.10 -2.39 0.00 0.00 0.07 0.00 0.00 57.00 54.58 1nz8 n GLN 69 Cb 0.50 -3.05 0.00 0.00 2.41 0.00 0.00 30.24 30.10 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 4.90 0.69 -3.13 3.69 0.00 -0.31 -2.76 117.12 120.21 1nz8 n MET 70 Ca 0.65 0.00 -0.17 0.00 0.00 0.00 0.00 57.70 58.18 1nz8 n MET 70 Cb 0.31 0.00 -0.05 0.00 0.00 0.00 0.00 33.22 33.48 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 -1.00 0.21 -0.07 3.17 2.15 -1.20 -1.96 116.67 117.97 1nz8 s ASP 71 Ca 0.00 -2.45 0.05 0.00 0.43 0.00 0.00 52.55 50.58 1nz8 s ASP 71 Cb 0.00 0.58 -0.08 0.00 -0.30 0.00 0.00 42.92 43.12 1nz8 s ASP 71 CO 0.00 -0.12 0.01 0.00 -0.17 0.00 0.00 175.17 174.89 1nz8 n LEU 72 N 2.95 0.35 -4.52 -1.34 -0.00 -1.26 -4.73 117.00 108.45 1nz8 n LEU 72 Ca 0.24 -0.01 -0.29 0.00 -0.00 0.00 0.00 56.01 55.96 1nz8 n LEU 72 Cb 0.51 0.11 -0.15 0.00 -0.00 0.00 0.00 43.42 43.89 1nz8 n LEU 72 CO 0.04 0.22 1.99 0.61 -0.00 0.00 0.00 177.39 180.25 1nz8 n GLY 73 N 2.65 -0.35 0.00 1.47 0.00 -1.26 -4.34 105.19 103.37 1nz8 n GLY 73 Ca -0.11 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.44 1nz8 n GLY 73 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nz8 n ASP 74 N 10.71 0.58 0.00 1.61 -0.08 -1.26 -5.04 116.55 123.07 1nz8 n ASP 74 Ca 0.60 -1.25 0.00 0.00 -1.51 0.00 0.00 54.79 52.62 1nz8 n ASP 74 Cb 0.21 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.67 1nz8 n ASP 74 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1nz8 n GLU 75 N -0.13 0.00 0.00 -0.67 4.07 -1.26 -4.36 120.64 118.29 1nz8 n GLU 75 Ca 0.00 0.00 -0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1nz8 n GLU 75 Cb 0.36 0.00 -0.00 0.00 -0.06 0.00 0.00 31.44 31.74 1nz8 n GLU 75 CO 0.00 0.00 0.00 1.49 -0.06 0.00 0.00 177.13 178.56 1nz8 h GLU 76 N 0.00 -0.02 -2.41 5.31 4.22 -1.96 -3.47 114.58 116.26 1nz8 h GLU 76 Ca 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 59.36 59.39 1nz8 h GLU 76 Cb 0.00 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.08 1nz8 h GLU 76 CO 0.00 -0.01 0.15 -1.21 -2.18 0.00 0.00 179.01 175.76 1nz8 s GLU 77 N -3.05 1.09 1.13 1.92 2.02 -1.26 -5.18 118.70 115.37 1nz8 s GLU 77 Ca -0.00 -0.01 -0.18 0.00 0.02 0.00 0.00 54.97 54.79 1nz8 s GLU 77 Cb 0.00 0.51 0.26 0.00 0.10 0.00 0.00 34.13 35.00 1nz8 s GLU 77 CO 0.01 -0.38 1.18 -1.25 0.02 0.00 0.00 175.26 174.83 1nz8 s PRO 78 N -2.01 -0.67 0.80 0.39 0.04 -1.26 -4.53 135.00 127.76 1nz8 s PRO 78 Ca -0.07 -0.18 -0.03 0.00 0.04 0.00 0.00 61.00 60.75 1nz8 s PRO 78 Cb -0.01 -1.67 0.16 0.00 0.04 0.00 0.00 34.50 33.03 1nz8 s PRO 78 CO 0.02 -3.33 1.09 0.09 0.04 0.00 0.00 177.00 174.92 1nz8 n ASN 79 N -4.46 1.14 0.29 6.66 4.13 -1.26 -4.96 115.26 116.80 1nz8 n ASN 79 Ca 0.14 -2.04 0.16 0.00 1.68 0.00 0.00 54.58 54.51 1nz8 n ASN 79 Cb 0.59 -0.74 0.91 0.00 -1.54 0.00 0.00 39.78 39.01 1nz8 n ASN 79 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1nz8 h GLU 80 N 0.00 0.00 -0.47 3.52 4.57 -1.98 -2.70 114.58 117.52 1nz8 h GLU 80 Ca -0.36 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 57.90 1nz8 h GLU 80 Cb 1.25 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.77 1nz8 h GLU 80 CO 0.35 0.03 0.11 0.00 -1.18 0.00 0.00 179.01 178.33 1nz8 h ALA 81 N 1.97 0.54 -0.78 2.92 0.00 -1.94 -1.67 119.26 120.30 1nz8 h ALA 81 Ca -0.00 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1nz8 h ALA 81 Cb 0.09 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1nz8 h ALA 81 CO 0.00 -0.29 0.51 2.35 0.00 0.00 0.00 179.25 181.82 1nz8 h TRP 82 N 0.26 0.95 -0.22 0.00 -0.00 -1.86 0.24 115.95 115.32 1nz8 h TRP 82 Ca 0.23 0.02 0.00 0.00 -0.00 0.00 0.00 58.89 59.15 1nz8 h TRP 82 Cb 0.29 -0.32 -0.01 0.00 -0.00 0.00 0.00 29.16 29.12 1nz8 h TRP 82 CO -0.21 0.57 0.15 0.93 -0.00 0.00 0.00 178.44 179.89 1nz8 h GLU 83 N 1.01 0.29 0.02 2.65 5.08 -1.42 0.23 114.58 122.44 1nz8 h GLU 83 Ca 0.30 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.56 1nz8 h GLU 83 Cb -0.05 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1nz8 h GLU 83 CO -0.09 0.19 -0.44 0.28 -1.00 0.00 0.00 179.01 177.96 1nz8 h VAL 84 N 0.30 1.53 0.13 3.13 2.07 -0.58 -2.68 116.25 120.14 1nz8 h VAL 84 Ca 0.08 -2.33 -0.01 0.00 0.82 0.00 0.00 66.70 65.27 1nz8 h VAL 84 Cb -0.03 3.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.81 1nz8 h VAL 84 CO -0.02 0.56 -0.06 0.58 0.02 0.00 0.00 177.57 178.64 1nz8 h VAL 85 N -0.91 0.87 0.00 2.57 2.07 -0.38 -1.88 116.25 118.59 1nz8 h VAL 85 Ca -0.11 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.37 1nz8 h VAL 85 Cb 1.17 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1nz8 h VAL 85 CO -0.03 0.00 -0.18 -0.09 0.02 0.00 0.00 177.57 177.29 1nz8 h ARG 86 N -0.17 0.00 -0.07 1.57 2.43 -0.72 -2.71 114.38 114.71 1nz8 h ARG 86 Ca -0.02 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.01 1nz8 h ARG 86 Cb 0.14 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1nz8 h ARG 86 CO 0.02 0.18 -0.60 0.78 -1.51 0.00 0.00 179.97 178.84 1nz8 h GLY 87 N 1.09 0.25 -3.26 2.80 0.00 -1.05 -3.42 103.07 99.48 1nz8 h GLY 87 Ca -0.00 -0.31 -0.54 0.00 0.00 0.00 0.00 47.33 46.48 1nz8 h GLY 87 CO 0.02 0.28 0.66 -0.51 0.00 0.00 0.00 176.54 176.99 1nz8 s THR 88 N -3.75 2.19 -0.83 4.70 -4.23 -0.76 -4.86 115.64 108.10 1nz8 s THR 88 Ca -0.04 0.17 -0.25 0.00 -1.18 0.00 0.00 61.69 60.39 1nz8 s THR 88 Cb 0.12 -3.09 -0.07 0.00 1.34 0.00 0.00 72.50 70.79 1nz8 s THR 88 CO 0.80 0.02 2.10 -2.16 -0.54 0.00 0.00 174.62 174.83 1nz8 s PRO 89 N -2.52 2.25 0.00 3.99 0.04 -1.26 -2.97 135.00 134.52 1nz8 s PRO 89 Ca 0.63 0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.75 1nz8 s PRO 89 Cb -0.42 -4.91 0.00 0.00 0.04 0.00 0.00 34.50 29.22 1nz8 s PRO 89 CO 0.52 -3.65 0.00 0.41 0.04 0.00 0.00 177.00 174.32 1nz8 n GLY 90 N 6.72 1.11 3.63 0.56 0.00 -1.26 -4.75 105.19 111.20 1nz8 n GLY 90 Ca 0.41 -0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.96 1nz8 n GLY 90 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nz8 s ILE 91 N 0.00 5.20 -0.02 -0.61 -1.09 -1.16 -3.42 121.20 120.12 1nz8 s ILE 91 Ca 0.00 0.57 0.21 0.00 -2.23 0.00 0.00 60.65 59.20 1nz8 s ILE 91 Cb 0.00 -3.69 0.36 0.00 -1.58 0.00 0.00 42.46 37.55 1nz8 s ILE 91 CO 0.00 0.21 1.14 0.35 -1.23 0.00 0.00 174.94 175.41 1nz8 n THR 92 N 4.74 0.06 -2.38 2.92 -2.24 -1.26 -4.72 114.28 111.40 1nz8 n THR 92 Ca -0.09 -0.91 -0.01 0.00 -2.27 0.00 0.00 64.05 60.77 1nz8 n THR 92 Cb 0.51 0.92 -0.00 0.00 -2.10 0.00 0.00 70.33 69.66 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 0.33 -5.65 2.69 3.38 0.00 -1.26 -5.01 105.19 99.68 1nz8 n GLY 93 Ca -0.00 0.26 -0.02 0.00 0.00 0.00 0.00 46.02 46.26 1nz8 n GLY 93 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1nz8 n PHE 94 N 1.85 -1.43 0.73 1.61 7.35 -1.26 -4.83 117.46 121.49 1nz8 n PHE 94 Ca -0.04 -1.79 0.06 0.00 -0.76 0.00 0.00 57.45 54.92 1nz8 n PHE 94 Cb 0.07 1.22 0.17 0.00 0.35 0.00 0.00 39.48 41.29 1nz8 n PHE 94 CO 0.00 0.00 0.00 1.55 -0.76 0.00 0.00 176.76 177.55 1nz8 n VAL 95 N -1.37 0.59 0.00 -2.13 3.14 -1.26 -4.69 118.33 112.61 1nz8 n VAL 95 Ca -0.13 -0.52 0.00 0.00 -2.96 0.00 0.00 64.34 60.73 1nz8 n VAL 95 Cb 0.86 0.19 0.00 0.00 -1.06 0.00 0.00 33.84 33.84 1nz8 n VAL 95 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1nz8 n GLY 96 N 1.02 2.39 0.32 7.55 0.00 -1.26 -4.77 105.19 110.44 1nz8 n GLY 96 Ca 0.13 -0.53 0.09 0.00 0.00 0.00 0.00 46.02 45.71 1nz8 n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nz8 h ALA 97 N 0.00 1.97 0.00 4.61 0.00 -1.91 -3.47 119.26 120.45 1nz8 h ALA 97 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1nz8 h ALA 97 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1nz8 h ALA 97 CO 0.00 -0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.63 1nz8 n GLY 98 N -1.52 1.92 0.44 0.00 0.00 -1.26 -4.81 105.19 99.94 1nz8 n GLY 98 Ca 0.04 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1nz8 n GLY 98 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1nz8 n MET 99 N 0.00 0.00 -2.26 1.61 0.00 -1.26 -4.40 117.12 110.81 1nz8 n MET 99 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 57.70 57.27 1nz8 n MET 99 Cb 0.00 -0.71 -0.02 0.00 0.00 0.00 0.00 33.22 32.48 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 -1.86 4.13 0.14 0.03 0.52 -1.26 -4.79 118.95 115.85 1nz8 s ARG 100 Ca 0.00 1.77 -0.02 0.00 -0.52 0.00 0.00 55.73 56.96 1nz8 s ARG 100 Cb 0.00 -3.88 0.03 0.00 0.52 0.00 0.00 34.95 31.62 1nz8 s ARG 100 CO 0.00 -0.87 0.07 -2.30 0.02 0.00 0.00 175.30 172.22 1nz8 n PRO 101 N 6.97 -1.03 -3.53 3.54 -0.02 -1.26 -4.67 135.00 135.00 1nz8 n PRO 101 Ca 0.16 -0.12 -0.10 0.00 -2.02 0.00 0.00 63.50 61.42 1nz8 n PRO 101 Cb 0.44 -0.19 -0.10 0.00 -0.02 0.00 0.00 33.50 33.64 1nz8 n PRO 101 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1nz8 s VAL 102 N -0.85 -0.58 0.44 -1.45 1.01 -1.26 -4.98 120.40 112.73 1nz8 s VAL 102 Ca 0.05 0.08 -0.24 0.00 0.00 0.00 0.00 61.98 61.87 1nz8 s VAL 102 Cb -0.01 -0.69 -0.08 0.00 0.00 0.00 0.00 36.38 35.60 1nz8 s VAL 102 CO 0.04 -0.01 1.22 -2.84 0.00 0.00 0.00 175.10 173.51 1nz8 s PRO 103 N 2.54 3.80 0.48 2.72 0.02 -1.26 -3.04 135.00 140.26 1nz8 s PRO 103 Ca 0.05 1.92 -0.07 0.00 0.02 0.00 0.00 61.00 62.93 1nz8 s PRO 103 Cb -0.14 -2.53 -0.04 0.00 0.02 0.00 0.00 34.50 31.82 1nz8 s PRO 103 CO -0.13 -0.56 0.81 -0.51 -0.33 0.00 0.00 177.00 176.28 1nz8 s LEU 104 N -2.83 3.62 0.10 -5.54 1.02 0.00 -4.94 118.68 110.11 1nz8 s LEU 104 Ca 0.62 1.02 -0.18 0.00 0.02 0.00 0.00 54.13 55.61 1nz8 s LEU 104 Cb -0.32 -3.97 -0.07 0.00 0.02 0.00 0.00 46.19 41.85 1nz8 s LEU 104 CO 0.40 -0.58 0.56 -0.44 0.02 0.00 0.00 176.35 176.32 1nz8 s SER 105 N -3.95 6.99 0.39 2.29 0.01 -1.26 -4.57 113.70 113.59 1nz8 s SER 105 Ca 0.49 1.21 0.18 0.00 1.31 0.00 0.00 55.95 59.14 1nz8 s SER 105 Cb -0.10 -2.34 1.11 0.00 0.21 0.00 0.00 66.02 64.90 1nz8 s SER 105 CO 0.44 0.22 1.74 -0.65 0.41 0.00 0.00 173.24 175.39 1nz8 h PRO 106 N 4.20 0.36 -0.13 12.44 0.11 -1.97 0.74 132.00 147.75 1nz8 h PRO 106 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1nz8 h PRO 106 Cb 1.21 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1nz8 h PRO 106 CO 0.64 0.24 0.08 -0.44 -0.21 0.00 0.00 178.00 178.32 1nz8 h ASP 107 N 0.37 0.15 0.70 -2.05 5.19 -2.00 -0.66 116.42 118.12 1nz8 h ASP 107 Ca 0.64 -0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 56.79 1nz8 h ASP 107 Cb 1.62 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 41.09 1nz8 h ASP 107 CO -0.36 0.11 -1.20 -0.33 -3.12 0.00 0.00 179.24 174.33 1nz8 h GLU 108 N 0.17 0.22 -0.03 3.56 4.39 -1.42 -3.33 114.58 118.14 1nz8 h GLU 108 Ca 0.05 -0.37 0.01 0.00 0.34 0.00 0.00 59.36 59.39 1nz8 h GLU 108 Cb -0.02 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1nz8 h GLU 108 CO -0.01 1.18 -0.04 0.28 -1.16 0.00 0.00 179.01 179.25 1nz8 h VAL 109 N 0.06 0.88 -0.97 3.13 2.07 0.53 -1.88 116.25 120.08 1nz8 h VAL 109 Ca -0.11 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.60 1nz8 h VAL 109 Cb 1.93 0.88 -0.09 0.00 -1.52 0.00 0.00 31.29 32.49 1nz8 h VAL 109 CO 0.19 0.00 0.61 -0.09 0.02 0.00 0.00 177.57 178.30 1nz8 h ARG 110 N -0.06 0.63 0.16 1.57 2.43 -1.23 0.88 114.38 118.76 1nz8 h ARG 110 Ca 0.03 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1nz8 h ARG 110 Cb 0.10 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1nz8 h ARG 110 CO -0.07 0.42 -0.08 0.45 -1.51 0.00 0.00 179.97 179.18 1nz8 h HIS 111 N 0.65 -0.20 0.00 2.20 3.86 -1.53 -0.65 115.15 119.48 1nz8 h HIS 111 Ca 0.53 -0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.69 1nz8 h HIS 111 Cb 0.96 0.07 -0.01 0.00 1.06 0.00 0.00 27.41 29.49 1nz8 h HIS 111 CO -0.00 0.18 -0.19 -0.84 0.86 0.00 0.00 177.93 177.94 1nz8 h ILE 112 N -0.63 0.75 -0.12 2.45 3.07 -0.56 -2.70 117.51 119.77 1nz8 h ILE 112 Ca -0.02 -0.79 -0.21 0.00 1.55 0.00 0.00 64.86 65.39 1nz8 h ILE 112 Cb 0.47 1.48 0.01 0.00 -0.27 0.00 0.00 36.82 38.52 1nz8 h ILE 112 CO 0.04 0.19 -0.73 -0.07 -1.05 0.00 0.00 178.15 176.53 1nz8 h LEU 113 N 0.00 0.84 -2.46 0.16 4.07 0.87 -3.05 115.31 115.74 1nz8 h LEU 113 Ca -0.00 -0.65 -0.01 0.00 0.08 0.00 0.00 57.88 57.30 1nz8 h LEU 113 Cb 0.47 -0.25 -0.00 0.00 1.08 0.00 0.00 40.66 41.96 1nz8 h LEU 113 CO 0.03 1.36 -0.03 -0.08 -1.08 0.00 0.00 178.44 178.64 1nz8 h GLU 114 N 0.39 0.00 0.16 1.13 4.22 -0.78 -0.84 114.58 118.86 1nz8 h GLU 114 Ca -0.06 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.37 1nz8 h GLU 114 Cb 1.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1nz8 h GLU 114 CO 0.15 0.03 -0.08 0.28 -2.18 0.00 0.00 179.01 177.21 1nz8 h VAL 115 N 0.00 0.15 0.67 0.32 2.07 -1.43 -3.38 116.25 114.65 1nz8 h VAL 115 Ca -0.00 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 1nz8 h VAL 115 Cb 0.09 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 1nz8 h VAL 115 CO 0.00 0.05 -0.35 -1.28 0.02 0.00 0.00 177.57 176.01 1nz8 h SER 116 N -1.04 -0.85 0.00 0.57 0.87 -1.43 -3.38 113.55 108.29 1nz8 h SER 116 Ca -0.02 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1nz8 h SER 116 Cb 0.24 0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.43 1nz8 h SER 116 CO 0.04 -0.57 0.00 0.61 -0.53 0.00 0.00 176.83 176.37 1nz8 n GLY 117 N -1.50 -0.07 0.00 5.77 0.00 -0.37 -4.74 105.19 104.27 1nz8 n GLY 117 Ca -0.13 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 0.51 -0.06 0.99 4.77 -0.89 -4.80 117.00 117.52 1nz8 n LEU 118 Ca 0.00 -0.51 -0.16 0.00 -0.03 0.00 0.00 56.01 55.31 1nz8 n LEU 118 Cb 0.00 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 1nz8 n LEU 118 CO 0.00 0.13 -1.01 -0.11 -1.33 0.00 0.00 177.39 175.07 1nz8 n LEU 119 N -0.09 1.95 0.00 2.23 7.94 -1.26 -4.96 117.00 122.81 1nz8 n LEU 119 Ca 0.00 0.09 0.01 0.00 -1.11 0.00 0.00 56.01 55.00 1nz8 n LEU 119 Cb 0.31 -0.52 0.06 0.00 0.53 0.00 0.00 43.42 43.79 1nz8 n LEU 119 CO 0.00 0.74 0.30 0.61 -1.11 0.00 0.00 177.39 177.93