#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nz8 n ILE 3 N 0.00 0.00 -4.09 -1.33 -0.00 -1.26 -5.01 119.36 107.67 1nz8 n ILE 3 Ca 0.00 -0.19 -0.14 0.00 -0.00 0.00 0.00 62.75 62.42 1nz8 n ILE 3 Cb 0.00 0.09 -0.12 0.00 -0.00 0.00 0.00 39.64 39.62 1nz8 n ILE 3 CO 0.00 0.00 0.00 -1.61 -0.00 0.00 0.00 176.55 174.94 1nz8 s GLU 4 N -2.11 0.60 -0.41 6.28 0.41 0.72 -5.00 118.70 119.18 1nz8 s GLU 4 Ca 0.03 -0.81 -0.15 0.00 -0.41 0.00 0.00 54.97 53.63 1nz8 s GLU 4 Cb 0.00 -0.42 0.02 0.00 -1.78 0.00 0.00 34.13 31.96 1nz8 s GLU 4 CO 0.02 0.08 0.31 -1.58 -0.49 0.00 0.00 175.26 173.60 1nz8 s TRP 5 N -1.38 3.23 -0.14 1.61 0.52 -1.26 -0.56 118.94 120.96 1nz8 s TRP 5 Ca -0.08 -0.56 -0.08 0.00 0.02 0.00 0.00 56.10 55.39 1nz8 s TRP 5 Cb -0.10 -2.61 -0.04 0.00 -1.15 0.00 0.00 33.47 29.57 1nz8 s TRP 5 CO 0.01 -0.59 0.15 0.71 0.02 0.00 0.00 176.95 177.25 1nz8 s TYR 6 N 1.72 3.55 0.05 -1.98 1.51 0.28 -1.62 117.35 120.85 1nz8 s TYR 6 Ca 0.06 0.49 0.05 0.00 -1.01 0.00 0.00 57.07 56.66 1nz8 s TYR 6 Cb -0.19 -2.02 -0.04 0.00 -0.11 0.00 0.00 41.96 39.60 1nz8 s TYR 6 CO 0.10 0.60 -0.07 0.00 -1.11 0.00 0.00 175.55 175.07 1nz8 s ALA 7 N -0.62 3.01 0.08 3.71 0.00 -1.11 0.26 121.76 127.09 1nz8 s ALA 7 Ca 0.13 -1.11 0.01 0.00 0.00 0.00 0.00 51.96 50.99 1nz8 s ALA 7 Cb -0.12 -1.05 -0.04 0.00 0.00 0.00 0.00 23.12 21.91 1nz8 s ALA 7 CO 0.03 0.63 -0.05 0.54 0.00 0.00 0.00 175.76 176.91 1nz8 s VAL 8 N -1.10 0.52 -0.13 0.00 0.11 -1.08 -3.90 120.40 114.81 1nz8 s VAL 8 Ca 0.19 -1.83 0.03 0.00 -2.93 0.00 0.00 61.98 57.44 1nz8 s VAL 8 Cb -0.11 -1.55 0.01 0.00 -1.53 0.00 0.00 36.38 33.20 1nz8 s VAL 8 CO 0.11 -0.88 -0.22 -1.00 -3.33 0.00 0.00 175.10 169.78 1nz8 s HIS 9 N -3.57 2.66 0.30 1.54 3.76 -1.14 -2.20 115.29 116.63 1nz8 s HIS 9 Ca 0.09 -1.24 0.03 0.00 -0.15 0.00 0.00 55.06 53.79 1nz8 s HIS 9 Cb 0.05 -1.80 -0.01 0.00 1.11 0.00 0.00 32.58 31.93 1nz8 s HIS 9 CO -0.06 -0.55 0.13 0.25 -0.85 0.00 0.00 174.74 173.65 1nz8 n THR 10 N 3.93 0.00 -2.78 1.30 -2.24 -1.08 -3.15 114.28 110.26 1nz8 n THR 10 Ca -0.20 -1.80 -0.39 0.00 -2.27 0.00 0.00 64.05 59.39 1nz8 n THR 10 Cb 0.52 0.69 -0.06 0.00 -2.10 0.00 0.00 70.33 69.38 1nz8 n THR 10 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1nz8 s LEU 11 N 0.00 4.57 -0.13 3.22 0.20 -1.26 -4.85 118.68 120.42 1nz8 s LEU 11 Ca 0.18 1.89 -0.30 0.00 0.69 0.00 0.00 54.13 56.59 1nz8 s LEU 11 Cb 0.01 -3.68 -0.08 0.00 -0.43 0.00 0.00 46.19 42.01 1nz8 s LEU 11 CO 0.13 0.11 2.09 1.33 -0.29 0.00 0.00 176.35 179.72 1nz8 n VAL 12 N 1.27 0.50 0.00 1.68 0.24 -1.26 -1.30 118.33 119.46 1nz8 n VAL 12 Ca -0.01 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 1nz8 n VAL 12 Cb 0.48 -2.29 0.00 0.00 -1.47 0.00 0.00 33.84 30.56 1nz8 n VAL 12 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1nz8 n GLY 13 N 5.25 2.13 0.06 7.63 0.00 -1.26 -4.87 105.19 114.13 1nz8 n GLY 13 Ca 0.27 -0.42 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 1nz8 n GLY 13 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1nz8 h GLN 14 N 0.00 0.00 -0.97 1.61 7.50 -1.59 -3.29 115.11 118.37 1nz8 h GLN 14 Ca 0.00 -0.00 0.13 0.00 0.50 0.00 0.00 58.65 59.28 1nz8 h GLN 14 Cb 0.00 0.00 -0.08 0.00 0.05 0.00 0.00 27.48 27.45 1nz8 h GLN 14 CO 0.00 0.98 0.61 1.05 -1.50 0.00 0.00 178.83 179.97 1nz8 h GLU 15 N 0.00 0.86 -0.90 1.46 4.11 -1.86 0.19 114.58 118.44 1nz8 h GLU 15 Ca -0.02 -0.05 0.05 0.00 0.07 0.00 0.00 59.36 59.40 1nz8 h GLU 15 Cb 1.78 -0.19 -0.06 0.00 0.50 0.00 0.00 28.75 30.78 1nz8 h GLU 15 CO 0.13 0.57 0.58 0.93 0.07 0.00 0.00 179.01 181.29 1nz8 h GLU 16 N 0.89 1.06 0.00 1.06 4.39 -1.89 -1.84 114.58 118.25 1nz8 h GLU 16 Ca 0.49 -0.06 -0.15 0.00 0.34 0.00 0.00 59.36 59.98 1nz8 h GLU 16 Cb 0.59 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 1nz8 h GLU 16 CO -0.26 0.70 -0.75 0.87 -1.16 0.00 0.00 179.01 178.42 1nz8 h LYS 17 N 1.10 0.00 0.33 2.33 1.57 -1.32 -3.27 116.57 117.31 1nz8 h LYS 17 Ca 0.37 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.14 1nz8 h LYS 17 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 1nz8 h LYS 17 CO -0.14 0.64 -0.18 0.00 -0.57 0.00 0.00 179.45 179.19 1nz8 h ALA 18 N 1.33 -0.48 -0.56 3.86 0.00 0.12 0.11 119.26 123.65 1nz8 h ALA 18 Ca -0.02 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1nz8 h ALA 18 Cb 1.53 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 19.50 1nz8 h ALA 18 CO 0.08 -0.77 0.37 1.57 0.00 0.00 0.00 179.25 180.50 1nz8 h LYS 19 N -0.48 0.72 0.45 0.00 5.09 -1.57 0.38 116.57 121.16 1nz8 h LYS 19 Ca -0.04 -0.04 -0.02 0.00 0.09 0.00 0.00 60.65 60.63 1nz8 h LYS 19 Cb 0.38 -0.16 0.00 0.00 0.10 0.00 0.00 32.23 32.56 1nz8 h LYS 19 CO 0.06 0.48 -0.21 0.00 -2.09 0.00 0.00 179.45 177.68 1nz8 h ALA 20 N 1.66 -0.60 -0.52 0.07 0.00 -1.51 0.26 119.26 118.62 1nz8 h ALA 20 Ca 0.21 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1nz8 h ALA 20 Cb -0.07 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1nz8 h ALA 20 CO -0.05 -0.64 0.17 -0.91 0.00 0.00 0.00 179.25 177.82 1nz8 h ASN 21 N -0.99 0.70 -0.08 0.00 4.21 -0.65 -2.33 115.58 116.45 1nz8 h ASN 21 Ca -0.06 -0.10 -0.04 0.00 1.21 0.00 0.00 56.30 57.31 1nz8 h ASN 21 Cb 0.57 -0.18 -0.00 0.00 -1.12 0.00 0.00 38.32 37.59 1nz8 h ASN 21 CO 0.10 0.66 -0.09 0.25 -1.29 0.00 0.00 177.43 177.07 1nz8 h LEU 22 N 0.75 0.21 -2.71 1.61 5.85 -0.25 -2.38 115.31 118.40 1nz8 h LEU 22 Ca 0.17 -0.50 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1nz8 h LEU 22 Cb 0.21 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 1nz8 h LEU 22 CO -0.01 0.67 0.04 -0.33 -0.34 0.00 0.00 178.44 178.47 1nz8 h GLU 23 N -0.24 0.00 0.10 1.25 5.08 -0.29 0.12 114.58 120.60 1nz8 h GLU 23 Ca 0.01 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.21 1nz8 h GLU 23 Cb 0.61 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.87 1nz8 h GLU 23 CO 0.02 0.00 -0.77 -0.22 -1.00 0.00 0.00 179.01 177.04 1nz8 h LYS 24 N 0.00 0.20 0.00 2.33 1.63 -1.26 -3.22 116.57 116.26 1nz8 h LYS 24 Ca 0.01 -0.34 -0.04 0.00 -0.85 0.00 0.00 60.65 59.42 1nz8 h LYS 24 Cb 0.08 0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.83 1nz8 h LYS 24 CO -0.00 1.16 -0.19 0.00 -3.45 0.00 0.00 179.45 176.98 1nz8 h ARG 25 N -0.54 0.00 0.00 1.90 2.47 -0.84 0.11 114.38 117.48 1nz8 h ARG 25 Ca -0.15 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.47 1nz8 h ARG 25 Cb 1.50 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.80 1nz8 h ARG 25 CO 0.08 0.19 -0.44 0.97 0.56 0.00 0.00 179.97 181.32 1nz8 h ILE 26 N 0.00 1.13 0.00 2.04 6.09 -0.87 -1.64 117.51 124.26 1nz8 h ILE 26 Ca -0.00 -1.62 -0.35 0.00 -1.37 0.00 0.00 64.86 61.51 1nz8 h ILE 26 Cb 0.56 1.92 -0.06 0.00 0.47 0.00 0.00 36.82 39.71 1nz8 h ILE 26 CO 0.02 0.43 -2.23 1.17 -3.07 0.00 0.00 178.15 174.48 1nz8 n LYS 27 N -3.74 0.68 -0.10 2.19 4.81 -0.90 0.65 118.16 121.75 1nz8 n LYS 27 Ca -0.01 0.09 -0.14 0.00 -0.87 0.00 0.00 58.31 57.38 1nz8 n LYS 27 Cb 0.51 -1.59 -0.04 0.00 0.02 0.00 0.00 35.03 33.93 1nz8 n LYS 27 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nz8 h ALA 28 N 0.87 0.48 0.00 3.14 0.00 -0.80 -3.13 119.26 119.82 1nz8 h ALA 28 Ca -0.49 -0.44 -0.12 0.00 0.00 0.00 0.00 54.91 53.86 1nz8 h ALA 28 Cb 2.15 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.83 1nz8 h ALA 28 CO 0.03 0.57 -0.56 0.74 0.00 0.00 0.00 179.25 180.03 1nz8 h PHE 29 N 0.60 0.00 -0.00 0.00 0.04 -1.50 -3.48 116.94 112.60 1nz8 h PHE 29 Ca 0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1nz8 h PHE 29 Cb 0.97 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.12 1nz8 h PHE 29 CO 0.07 0.56 0.00 0.41 -0.60 0.00 0.00 178.31 178.75 1nz8 n GLY 30 N 1.23 1.96 1.89 -1.45 0.00 -1.19 -5.00 105.19 102.64 1nz8 n GLY 30 Ca 0.02 -0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.00 5.68 0.29 0.99 4.77 0.21 -4.43 117.00 124.51 1nz8 n LEU 31 Ca 0.00 -2.97 0.15 0.00 -0.03 0.00 0.00 56.01 53.17 1nz8 n LEU 31 Cb 0.01 -0.73 0.90 0.00 -2.33 0.00 0.00 43.42 41.26 1nz8 n LEU 31 CO 0.00 0.79 1.09 1.56 -1.33 0.00 0.00 177.39 179.49 1nz8 h GLN 32 N 2.04 0.00 0.00 3.23 4.20 -1.73 0.48 115.11 123.33 1nz8 h GLN 32 Ca 0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.00 1nz8 h GLN 32 Cb 2.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 30.00 1nz8 h GLN 32 CO 0.71 0.04 0.00 -3.47 -0.67 0.00 0.00 178.83 175.43 1nz8 n ASP 33 N -3.67 0.00 -0.02 1.46 2.03 -1.26 -4.15 116.55 110.94 1nz8 n ASP 33 Ca -0.03 -0.48 -0.02 0.00 0.52 0.00 0.00 54.79 54.78 1nz8 n ASP 33 Cb 0.13 -0.17 -0.01 0.00 -0.72 0.00 0.00 41.12 40.35 1nz8 n ASP 33 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1nz8 n LYS 34 N -1.17 0.13 -2.75 -0.67 4.01 0.14 -4.85 118.16 113.01 1nz8 n LYS 34 Ca 0.18 0.05 -0.42 0.00 -0.51 0.00 0.00 58.31 57.61 1nz8 n LYS 34 Cb 0.19 -0.73 -0.03 0.00 -0.51 0.00 0.00 35.03 33.95 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 -1.47 4.88 0.01 -0.18 -1.09 -1.14 -3.07 121.20 119.14 1nz8 s ILE 35 Ca -0.07 1.99 0.00 0.00 -2.23 0.00 0.00 60.65 60.34 1nz8 s ILE 35 Cb 0.01 -4.29 0.00 0.00 -1.58 0.00 0.00 42.46 36.60 1nz8 s ILE 35 CO 0.11 0.17 0.00 0.49 -1.23 0.00 0.00 174.94 174.48 1nz8 n PHE 36 N 3.87 -0.02 -4.47 3.97 3.72 -1.08 -4.78 117.46 118.65 1nz8 n PHE 36 Ca 0.05 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.21 1nz8 n PHE 36 Cb 0.51 0.11 -0.10 0.00 -0.94 0.00 0.00 39.48 39.06 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 -2.00 1.77 -0.28 -1.08 -0.21 -1.19 -4.96 119.66 111.70 1nz8 s GLN 37 Ca 0.00 -1.79 -0.02 0.00 0.02 0.00 0.00 55.36 53.57 1nz8 s GLN 37 Cb 0.00 -1.78 0.17 0.00 1.00 0.00 0.00 33.01 32.40 1nz8 s GLN 37 CO 0.00 0.28 0.55 0.08 -2.12 0.00 0.00 175.29 174.07 1nz8 s VAL 38 N -2.53 -0.90 0.41 1.09 1.01 -1.25 -0.33 120.40 117.89 1nz8 s VAL 38 Ca 0.31 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.31 1nz8 s VAL 38 Cb -0.03 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 1nz8 s VAL 38 CO 0.16 -0.03 0.07 -0.76 0.00 0.00 0.00 175.10 174.54 1nz8 s LEU 39 N 2.79 2.20 -0.46 3.92 2.01 -0.86 -5.00 118.68 123.28 1nz8 s LEU 39 Ca 0.17 -1.56 0.05 0.00 0.01 0.00 0.00 54.13 52.80 1nz8 s LEU 39 Cb -0.15 -0.41 0.27 0.00 0.01 0.00 0.00 46.19 45.91 1nz8 s LEU 39 CO -0.19 -0.78 1.00 2.30 1.01 0.00 0.00 176.35 179.69 1nz8 n ILE 40 N -0.94 0.00 -1.52 -0.59 -5.35 -1.26 -2.91 119.36 106.79 1nz8 n ILE 40 Ca -0.08 -1.41 -0.37 0.00 -0.27 0.00 0.00 62.75 60.62 1nz8 n ILE 40 Cb 0.66 1.45 0.05 0.00 -1.74 0.00 0.00 39.64 40.07 1nz8 n ILE 40 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1nz8 n PRO 41 N 1.25 0.67 -4.30 6.28 -0.04 -1.26 -4.87 135.00 132.72 1nz8 n PRO 41 Ca 0.07 0.27 -0.23 0.00 -0.04 0.00 0.00 63.50 63.57 1nz8 n PRO 41 Cb 0.66 -1.99 -0.12 0.00 -0.04 0.00 0.00 33.50 32.01 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 -1.64 1.75 0.21 0.52 -4.23 -1.26 -2.68 115.64 108.30 1nz8 s THR 42 Ca 0.73 -1.71 -0.30 0.00 -1.18 0.00 0.00 61.69 59.23 1nz8 s THR 42 Cb -0.41 -1.68 -0.08 0.00 1.34 0.00 0.00 72.50 71.67 1nz8 s THR 42 CO 0.50 -0.18 0.95 -0.70 -0.54 0.00 0.00 174.62 174.65 1nz8 s GLU 43 N -2.31 4.81 -0.15 3.99 2.56 0.38 -4.71 118.70 123.28 1nz8 s GLU 43 Ca 0.10 1.49 -0.06 0.00 0.00 0.00 0.00 54.97 56.51 1nz8 s GLU 43 Cb -0.08 -3.30 -0.04 0.00 2.00 0.00 0.00 34.13 32.71 1nz8 s GLU 43 CO 0.05 0.43 0.05 -1.21 -0.56 0.00 0.00 175.26 174.03 1nz8 s GLU 44 N -0.89 3.66 0.29 4.30 2.02 -1.26 -0.72 118.70 126.09 1nz8 s GLU 44 Ca 0.43 -0.34 -0.10 0.00 0.02 0.00 0.00 54.97 54.98 1nz8 s GLU 44 Cb -0.26 -3.09 0.00 0.00 0.10 0.00 0.00 34.13 30.88 1nz8 s GLU 44 CO 0.32 0.44 0.50 0.14 0.02 0.00 0.00 175.26 176.68 1nz8 s VAL 45 N -0.12 0.00 0.10 2.63 -7.23 0.03 -4.99 120.40 110.81 1nz8 s VAL 45 Ca 0.07 -1.44 0.07 0.00 -1.81 0.00 0.00 61.98 58.87 1nz8 s VAL 45 Cb -0.12 -2.42 -0.03 0.00 0.56 0.00 0.00 36.38 34.37 1nz8 s VAL 45 CO 0.01 0.00 -0.18 0.68 -0.31 0.00 0.00 175.10 175.30 1nz8 s VAL 46 N -3.55 1.52 0.04 1.32 -7.23 -1.26 -0.63 120.40 110.61 1nz8 s VAL 46 Ca 0.25 -1.49 -0.00 0.00 -1.81 0.00 0.00 61.98 58.92 1nz8 s VAL 46 Cb -0.01 -1.42 -0.03 0.00 0.56 0.00 0.00 36.38 35.49 1nz8 s VAL 46 CO 0.13 -0.13 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.14 1nz8 s GLU 47 N -1.92 0.49 0.04 4.82 2.02 -1.25 -4.87 118.70 118.03 1nz8 s GLU 47 Ca 0.04 -0.92 0.04 0.00 0.02 0.00 0.00 54.97 54.15 1nz8 s GLU 47 Cb -0.10 0.10 -0.02 0.00 0.10 0.00 0.00 34.13 34.21 1nz8 s GLU 47 CO 0.04 -0.07 -0.12 -1.17 0.02 0.00 0.00 175.26 173.96 1nz8 s LEU 48 N -2.18 2.19 0.57 1.80 2.96 -1.26 -4.43 118.68 118.33 1nz8 s LEU 48 Ca -0.04 -0.47 0.04 0.00 -0.22 0.00 0.00 54.13 53.44 1nz8 s LEU 48 Cb -0.02 -0.48 0.07 0.00 0.50 0.00 0.00 46.19 46.26 1nz8 s LEU 48 CO -0.05 -0.03 0.79 -0.60 -1.32 0.00 0.00 176.35 175.14 1nz8 s ARG 49 N -1.23 2.33 0.15 1.98 3.52 -1.26 -5.02 118.95 119.43 1nz8 s ARG 49 Ca -0.01 -1.19 -0.13 0.00 -0.13 0.00 0.00 55.73 54.28 1nz8 s ARG 49 Cb -0.08 -2.55 0.03 0.00 -1.56 0.00 0.00 34.95 30.79 1nz8 s ARG 49 CO 0.01 -0.84 1.65 1.49 -0.81 0.00 0.00 175.30 176.81 1nz8 h GLU 50 N 0.08 0.84 -1.82 5.12 4.81 -2.01 -3.42 114.58 118.17 1nz8 h GLU 50 Ca -0.37 -0.21 -0.16 0.00 -0.13 0.00 0.00 59.36 58.49 1nz8 h GLU 50 Cb 1.28 -0.10 -0.29 0.00 0.63 0.00 0.00 28.75 30.27 1nz8 h GLU 50 CO 0.45 0.81 -0.50 0.20 -0.73 0.00 0.00 179.01 179.24 1nz8 s GLY 51 N -3.27 -0.47 0.00 1.92 0.00 -1.26 -5.12 107.32 99.12 1nz8 s GLY 51 Ca -0.13 0.69 0.00 0.00 0.00 0.00 0.00 44.72 45.28 1nz8 s GLY 51 CO 0.80 2.80 0.00 0.61 0.00 0.00 0.00 173.10 177.31 1nz8 n GLY 52 N 5.36 0.34 3.19 0.20 0.00 -1.26 -5.11 105.19 107.91 1nz8 n GLY 52 Ca -0.02 -1.39 -0.27 0.00 0.00 0.00 0.00 46.02 44.33 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 -2.00 1.89 0.41 1.61 1.02 -1.26 -4.84 119.74 116.57 1nz8 s LYS 53 Ca 0.00 -0.71 0.05 0.00 0.02 0.00 0.00 55.97 55.32 1nz8 s LYS 53 Cb 0.00 -1.69 -0.06 0.00 -0.52 0.00 0.00 37.83 35.56 1nz8 s LYS 53 CO 0.00 0.34 0.03 0.15 -0.92 0.00 0.00 175.35 174.96 1nz8 s LYS 54 N -0.20 1.92 0.00 1.68 -0.14 -1.26 -4.94 119.74 116.80 1nz8 s LYS 54 Ca 0.01 -2.12 0.00 0.00 -1.36 0.00 0.00 55.97 52.49 1nz8 s LYS 54 Cb -0.11 -1.32 0.00 0.00 -1.68 0.00 0.00 37.83 34.73 1nz8 s LYS 54 CO 0.01 -0.19 0.00 -1.91 -0.76 0.00 0.00 175.35 172.50 1nz8 n GLU 55 N -0.95 2.32 -3.12 1.68 4.07 -1.26 -5.03 120.64 118.36 1nz8 n GLU 55 Ca -0.07 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.62 1nz8 n GLU 55 Cb 0.67 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.98 1nz8 n GLU 55 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 1nz8 s VAL 56 N -0.65 4.97 0.42 6.31 -7.23 -1.26 -3.77 120.40 119.19 1nz8 s VAL 56 Ca 0.00 1.01 -0.04 0.00 -1.81 0.00 0.00 61.98 61.15 1nz8 s VAL 56 Cb 0.00 -3.95 -0.04 0.00 0.56 0.00 0.00 36.38 32.95 1nz8 s VAL 56 CO 0.00 -0.03 0.69 0.68 -0.31 0.00 0.00 175.10 176.13 1nz8 s VAL 57 N 2.53 4.98 -0.00 1.32 -7.23 0.20 -4.93 120.40 117.27 1nz8 s VAL 57 Ca 0.25 -0.01 -0.00 0.00 -1.81 0.00 0.00 61.98 60.42 1nz8 s VAL 57 Cb -0.15 -3.85 0.00 0.00 0.56 0.00 0.00 36.38 32.94 1nz8 s VAL 57 CO 0.10 -0.70 0.00 -0.13 -0.31 0.00 0.00 175.10 174.07 1nz8 s ARG 58 N -4.46 -0.00 0.01 4.82 0.52 -1.26 -0.79 118.95 117.78 1nz8 s ARG 58 Ca 0.45 0.02 0.06 0.00 -0.52 0.00 0.00 55.73 55.74 1nz8 s ARG 58 Cb -0.10 -0.02 -0.02 0.00 0.52 0.00 0.00 34.95 35.33 1nz8 s ARG 58 CO 0.40 -0.02 -0.18 -1.59 0.02 0.00 0.00 175.30 173.94 1nz8 s LYS 59 N 0.10 1.36 0.13 3.54 0.00 0.10 -4.95 119.74 120.01 1nz8 s LYS 59 Ca -0.01 -0.71 -0.34 0.00 0.00 0.00 0.00 55.97 54.91 1nz8 s LYS 59 Cb -0.01 -1.36 -0.16 0.00 0.00 0.00 0.00 37.83 36.30 1nz8 s LYS 59 CO -0.00 0.36 1.18 1.63 0.00 0.00 0.00 175.35 178.52 1nz8 n LYS 60 N 2.39 1.00 -0.07 1.78 4.01 -1.26 0.14 118.16 126.14 1nz8 n LYS 60 Ca -0.16 0.36 -0.07 0.00 -0.51 0.00 0.00 58.31 57.93 1nz8 n LYS 60 Cb 0.54 -1.88 -0.03 0.00 -0.51 0.00 0.00 35.03 33.15 1nz8 n LYS 60 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1nz8 n LEU 61 N 2.11 1.82 -3.38 -0.35 4.77 -1.09 -4.46 117.00 116.42 1nz8 n LEU 61 Ca 0.17 0.61 -0.32 0.00 -0.03 0.00 0.00 56.01 56.43 1nz8 n LEU 61 Cb 0.21 -0.88 -0.03 0.00 -2.33 0.00 0.00 43.42 40.39 1nz8 n LEU 61 CO 0.61 -0.38 0.53 0.49 -1.33 0.00 0.00 177.39 177.31 1nz8 n PHE 62 N -4.59 3.42 -1.86 -1.77 3.01 -1.18 -4.95 117.46 109.53 1nz8 n PHE 62 Ca -0.10 -3.55 -0.41 0.00 1.01 0.00 0.00 57.45 54.40 1nz8 n PHE 62 Cb 0.32 -0.76 -0.02 0.00 -0.01 0.00 0.00 39.48 39.01 1nz8 n PHE 62 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1nz8 s PRO 63 N -3.26 4.17 0.00 -1.08 0.04 -1.26 -1.81 135.00 131.79 1nz8 s PRO 63 Ca 0.42 2.48 0.00 0.00 0.04 0.00 0.00 61.00 63.94 1nz8 s PRO 63 Cb 0.19 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.68 1nz8 s PRO 63 CO -0.06 -0.55 0.00 0.41 0.04 0.00 0.00 177.00 176.84 1nz8 n GLY 64 N 2.06 0.48 3.34 0.56 0.00 -1.26 -4.99 105.19 105.38 1nz8 n GLY 64 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.22 2.86 -0.28 1.61 1.51 -0.75 -2.64 117.35 117.43 1nz8 s TYR 65 Ca 0.00 -0.77 -0.08 0.00 -1.01 0.00 0.00 57.07 55.21 1nz8 s TYR 65 Cb 0.00 -1.92 -0.01 0.00 -0.11 0.00 0.00 41.96 39.92 1nz8 s TYR 65 CO 0.00 -0.33 0.09 -0.51 -1.11 0.00 0.00 175.55 173.69 1nz8 s LEU 66 N 0.70 3.77 -0.77 -1.29 1.43 -0.94 -4.85 118.68 116.74 1nz8 s LEU 66 Ca -0.05 -0.51 -0.20 0.00 -1.03 0.00 0.00 54.13 52.34 1nz8 s LEU 66 Cb -0.15 -1.92 0.11 0.00 0.03 0.00 0.00 46.19 44.26 1nz8 s LEU 66 CO 0.02 -0.14 0.98 -0.36 0.23 0.00 0.00 176.35 177.08 1nz8 s PHE 67 N 1.56 2.96 -0.36 0.29 0.08 -1.15 -2.63 117.98 118.73 1nz8 s PHE 67 Ca 0.04 -1.04 -0.17 0.00 0.12 0.00 0.00 56.93 55.88 1nz8 s PHE 67 Cb -0.16 -4.22 -0.00 0.00 -0.57 0.00 0.00 43.02 38.06 1nz8 s PHE 67 CO 0.04 -1.50 0.46 0.42 -0.10 0.00 0.00 175.22 174.54 1nz8 s ILE 68 N 3.09 5.07 -1.42 0.64 1.01 0.14 -2.03 121.20 127.70 1nz8 s ILE 68 Ca 0.25 0.11 -0.12 0.00 0.00 0.00 0.00 60.65 60.89 1nz8 s ILE 68 Cb -0.13 -3.94 0.07 0.00 0.01 0.00 0.00 42.46 38.47 1nz8 s ILE 68 CO 0.00 -0.23 2.20 1.67 0.00 0.00 0.00 174.94 178.58 1nz8 n GLN 69 N 5.63 3.23 -0.31 2.79 7.27 0.55 0.10 117.38 136.63 1nz8 n GLN 69 Ca -0.06 -2.87 0.00 0.00 0.07 0.00 0.00 57.00 54.13 1nz8 n GLN 69 Cb 0.49 -3.11 0.00 0.00 2.41 0.00 0.00 30.24 30.03 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 5.01 1.28 -3.20 3.69 0.00 0.27 -2.64 117.12 121.53 1nz8 n MET 70 Ca 0.51 0.00 -0.16 0.00 0.00 0.00 0.00 57.70 58.06 1nz8 n MET 70 Cb 0.36 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 33.52 1nz8 n MET 70 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 175.97 176.13 1nz8 s ASP 71 N -1.00 0.40 0.07 3.17 -4.77 -1.17 -0.20 116.67 113.17 1nz8 s ASP 71 Ca 0.00 -2.04 -0.05 0.00 -3.30 0.00 0.00 52.55 47.17 1nz8 s ASP 71 Cb 0.00 0.69 -0.28 0.00 -1.09 0.00 0.00 42.92 42.24 1nz8 s ASP 71 CO 0.00 -0.17 1.14 -0.07 0.70 0.00 0.00 175.17 176.77 1nz8 h LEU 72 N 6.07 0.44 -2.37 2.11 3.38 -1.92 -3.48 115.31 119.54 1nz8 h LEU 72 Ca 0.12 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1nz8 h LEU 72 Cb 1.03 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1nz8 h LEU 72 CO 0.19 1.36 -0.28 0.61 0.09 0.00 0.00 178.44 180.42 1nz8 n GLY 73 N 1.53 -3.46 1.34 0.83 0.00 -1.26 -4.77 105.19 99.41 1nz8 n GLY 73 Ca -0.09 -0.17 0.17 0.00 0.00 0.00 0.00 46.02 45.94 1nz8 n GLY 73 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nz8 n ASP 74 N 0.38 -7.91 -1.77 1.61 8.00 -1.26 -4.54 116.55 111.07 1nz8 n ASP 74 Ca -0.05 1.05 -0.17 0.00 0.71 0.00 0.00 54.79 56.33 1nz8 n ASP 74 Cb 0.07 -4.41 0.16 0.00 -0.02 0.00 0.00 41.12 36.93 1nz8 n ASP 74 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1nz8 n GLU 75 N -4.19 2.23 0.00 -1.24 4.71 -1.26 -4.75 120.64 116.14 1nz8 n GLU 75 Ca -0.05 -3.22 0.00 0.00 -0.01 0.00 0.00 57.16 53.88 1nz8 n GLU 75 Cb 0.63 -2.04 0.00 0.00 -1.01 0.00 0.00 31.44 29.01 1nz8 n GLU 75 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1nz8 n GLU 76 N -1.08 0.00 -3.47 3.49 1.02 -1.26 -4.94 120.64 114.40 1nz8 n GLU 76 Ca 0.48 0.07 -0.17 0.00 -0.02 0.00 0.00 57.16 57.51 1nz8 n GLU 76 Cb 1.21 -0.64 -0.12 0.00 -0.02 0.00 0.00 31.44 31.86 1nz8 n GLU 76 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1nz8 s GLU 77 N -0.31 0.22 0.93 3.49 2.02 -1.26 -5.15 118.70 118.64 1nz8 s GLU 77 Ca 0.00 0.19 -0.14 0.00 0.02 0.00 0.00 54.97 55.04 1nz8 s GLU 77 Cb 0.00 -1.09 0.01 0.00 0.10 0.00 0.00 34.13 33.15 1nz8 s GLU 77 CO 0.00 -0.70 0.29 -2.30 0.02 0.00 0.00 175.26 172.57 1nz8 n PRO 78 N 5.32 -0.20 -0.50 0.39 -0.02 -1.26 -5.02 135.00 133.71 1nz8 n PRO 78 Ca -0.05 -0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1nz8 n PRO 78 Cb 0.49 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 1nz8 n PRO 78 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1nz8 n ASN 79 N -0.69 0.00 0.22 2.55 6.94 -1.26 -4.91 115.26 118.11 1nz8 n ASN 79 Ca 0.06 -1.00 0.18 0.00 -0.02 0.00 0.00 54.58 53.81 1nz8 n ASN 79 Cb 0.53 0.00 0.83 0.00 -2.36 0.00 0.00 39.78 38.79 1nz8 n ASN 79 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1nz8 h GLU 80 N 0.00 0.00 -0.21 -3.83 4.81 -2.00 -2.33 114.58 111.02 1nz8 h GLU 80 Ca 0.00 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1nz8 h GLU 80 Cb 0.00 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 1nz8 h GLU 80 CO 0.00 0.00 -0.20 0.00 -0.73 0.00 0.00 179.01 178.08 1nz8 h ALA 81 N 1.58 -0.08 -0.26 2.92 0.00 -2.00 0.12 119.26 121.55 1nz8 h ALA 81 Ca 0.09 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1nz8 h ALA 81 Cb 0.68 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1nz8 h ALA 81 CO -0.00 -0.63 0.18 2.35 0.00 0.00 0.00 179.25 181.15 1nz8 h TRP 82 N -0.21 0.10 -0.03 0.00 -0.00 -1.77 0.18 115.95 114.22 1nz8 h TRP 82 Ca 0.13 0.00 -0.13 0.00 -0.00 0.00 0.00 58.89 58.89 1nz8 h TRP 82 Cb 0.40 -0.03 -0.02 0.00 -0.00 0.00 0.00 29.16 29.52 1nz8 h TRP 82 CO -0.35 0.05 -0.60 0.93 -0.00 0.00 0.00 178.44 178.48 1nz8 h GLU 83 N 0.10 0.09 0.00 2.65 5.08 -1.12 -1.87 114.58 119.51 1nz8 h GLU 83 Ca 0.12 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1nz8 h GLU 83 Cb 0.35 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1nz8 h GLU 83 CO -0.01 0.66 -0.39 0.28 -1.00 0.00 0.00 179.01 178.54 1nz8 h VAL 84 N 0.07 1.29 -0.84 3.13 2.07 0.12 -2.99 116.25 119.09 1nz8 h VAL 84 Ca -0.01 -2.11 0.06 0.00 0.82 0.00 0.00 66.70 65.46 1nz8 h VAL 84 Cb 1.07 2.57 -0.06 0.00 -1.52 0.00 0.00 31.29 33.36 1nz8 h VAL 84 CO 0.08 0.44 0.52 0.58 0.02 0.00 0.00 177.57 179.21 1nz8 h VAL 85 N -1.00 1.04 0.00 2.57 2.07 -0.82 -0.37 116.25 119.74 1nz8 h VAL 85 Ca -0.10 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 1nz8 h VAL 85 Cb 0.97 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1nz8 h VAL 85 CO -0.06 0.17 -0.16 -0.09 0.02 0.00 0.00 177.57 177.45 1nz8 h ARG 86 N 0.95 0.00 0.00 1.57 2.43 -1.49 -2.91 114.38 114.93 1nz8 h ARG 86 Ca 0.36 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.53 1nz8 h ARG 86 Cb 0.16 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1nz8 h ARG 86 CO -0.17 0.16 -0.37 0.78 -1.51 0.00 0.00 179.97 178.86 1nz8 h GLY 87 N 2.21 0.00 -4.05 2.80 0.00 -0.94 -3.47 103.07 99.62 1nz8 h GLY 87 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.78 1nz8 h GLY 87 CO 0.02 0.00 0.74 -1.30 0.00 0.00 0.00 176.54 176.00 1nz8 n THR 88 N -2.61 1.86 -2.30 4.70 -2.24 -0.63 -4.90 114.28 108.17 1nz8 n THR 88 Ca 0.03 -0.47 -0.41 0.00 -2.27 0.00 0.00 64.05 60.93 1nz8 n THR 88 Cb 0.49 -1.90 -0.03 0.00 -2.10 0.00 0.00 70.33 66.80 1nz8 n THR 88 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1nz8 s PRO 89 N -1.85 3.24 0.00 -0.78 0.04 -1.26 -2.95 135.00 131.45 1nz8 s PRO 89 Ca 0.55 0.64 0.00 0.00 0.04 0.00 0.00 61.00 62.23 1nz8 s PRO 89 Cb -0.50 -4.16 0.00 0.00 0.04 0.00 0.00 34.50 29.89 1nz8 s PRO 89 CO 0.62 -2.00 0.00 0.41 0.04 0.00 0.00 177.00 176.07 1nz8 n GLY 90 N 5.32 1.36 3.70 0.56 0.00 -1.26 -4.86 105.19 110.01 1nz8 n GLY 90 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.88 4.84 -0.14 -0.61 -1.16 -1.15 -4.82 121.20 117.28 1nz8 s ILE 91 Ca 0.00 2.05 0.15 0.00 -0.51 0.00 0.00 60.65 62.35 1nz8 s ILE 91 Cb 0.00 -4.32 -0.22 0.00 0.61 0.00 0.00 42.46 38.54 1nz8 s ILE 91 CO 0.00 0.11 0.11 0.41 -2.81 0.00 0.00 174.94 172.76 1nz8 n THR 92 N 4.12 0.95 0.00 4.00 -1.04 -1.26 -4.99 114.28 116.06 1nz8 n THR 92 Ca 0.07 -0.66 0.00 0.00 -2.04 0.00 0.00 64.05 61.42 1nz8 n THR 92 Cb 0.50 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.56 1nz8 n THR 92 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nz8 n GLY 93 N 1.90 2.55 3.69 3.41 0.00 -1.24 -4.93 105.19 110.57 1nz8 n GLY 93 Ca -0.23 -0.56 -0.10 0.00 0.00 0.00 0.00 46.02 45.13 1nz8 n GLY 93 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nz8 s PHE 94 N 0.00 0.37 0.02 1.61 0.40 -1.19 -2.89 117.98 116.30 1nz8 s PHE 94 Ca 0.00 -0.84 -0.08 0.00 -0.60 0.00 0.00 56.93 55.40 1nz8 s PHE 94 Cb 0.00 0.46 -0.04 0.00 0.51 0.00 0.00 43.02 43.95 1nz8 s PHE 94 CO 0.00 -1.31 1.13 0.28 0.70 0.00 0.00 175.22 176.02 1nz8 h VAL 95 N 2.07 0.00 -0.67 -0.44 2.07 -1.92 -3.44 116.25 113.93 1nz8 h VAL 95 Ca -0.28 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.12 1nz8 h VAL 95 Cb 1.25 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.86 1nz8 h VAL 95 CO 0.37 0.00 -0.38 0.61 0.02 0.00 0.00 177.57 178.18 1nz8 n GLY 96 N -1.13 -0.84 3.61 2.17 0.00 -1.26 -5.04 105.19 102.70 1nz8 n GLY 96 Ca -0.03 0.66 -0.03 0.00 0.00 0.00 0.00 46.02 46.62 1nz8 n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nz8 s ALA 97 N 0.85 -2.13 -0.59 4.61 0.00 -1.26 -5.11 121.76 118.12 1nz8 s ALA 97 Ca 0.28 1.41 -0.02 0.00 0.00 0.00 0.00 51.96 53.63 1nz8 s ALA 97 Cb 0.06 -0.03 0.15 0.00 0.00 0.00 0.00 23.12 23.31 1nz8 s ALA 97 CO -0.08 -0.71 0.40 0.20 0.00 0.00 0.00 175.76 175.57 1nz8 s GLY 98 N -2.37 2.44 0.12 0.00 0.00 -1.26 -4.81 107.32 101.45 1nz8 s GLY 98 Ca 0.11 -3.18 0.01 0.00 0.00 0.00 0.00 44.72 41.65 1nz8 s GLY 98 CO -0.04 1.08 0.15 -0.13 0.00 0.00 0.00 173.10 174.16 1nz8 n MET 99 N 3.57 0.21 -1.79 2.90 0.00 -1.26 -5.17 117.12 115.58 1nz8 n MET 99 Ca 0.07 -1.08 -0.31 0.00 -0.00 0.00 0.00 57.70 56.38 1nz8 n MET 99 Cb 0.38 0.97 0.04 0.00 0.00 0.00 0.00 33.22 34.61 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 -2.36 3.07 1.04 2.12 1.81 -1.26 -5.04 118.95 118.33 1nz8 s ARG 100 Ca 0.12 0.67 -0.16 0.00 -1.72 0.00 0.00 55.73 54.64 1nz8 s ARG 100 Cb 0.00 -2.03 0.13 0.00 -0.45 0.00 0.00 34.95 32.60 1nz8 s ARG 100 CO 0.08 -0.93 0.09 -2.30 -0.68 0.00 0.00 175.30 171.57 1nz8 n PRO 101 N -2.97 -1.93 -3.56 3.54 -0.02 -1.26 -4.99 135.00 123.80 1nz8 n PRO 101 Ca 0.07 -0.56 -0.27 0.00 -2.02 0.00 0.00 63.50 60.71 1nz8 n PRO 101 Cb 0.55 -1.50 -0.11 0.00 -0.02 0.00 0.00 33.50 32.43 1nz8 n PRO 101 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 1nz8 n VAL 102 N -4.35 -0.11 -2.69 -1.45 3.14 -1.25 -5.04 118.33 106.57 1nz8 n VAL 102 Ca 0.04 -4.00 -0.36 0.00 -2.96 0.00 0.00 64.34 57.06 1nz8 n VAL 102 Cb 0.46 -1.86 -0.06 0.00 -1.06 0.00 0.00 33.84 31.32 1nz8 n VAL 102 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1nz8 s PRO 103 N -0.59 4.34 0.60 1.45 0.04 -1.26 -2.73 135.00 136.84 1nz8 s PRO 103 Ca 0.30 1.37 -0.07 0.00 0.04 0.00 0.00 61.00 62.64 1nz8 s PRO 103 Cb 0.02 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.99 1nz8 s PRO 103 CO -0.18 0.04 0.92 -0.51 0.04 0.00 0.00 177.00 177.32 1nz8 s LEU 104 N -2.51 3.23 0.26 -3.56 2.01 -0.64 -4.96 118.68 112.51 1nz8 s LEU 104 Ca 0.56 0.85 -0.10 0.00 0.01 0.00 0.00 54.13 55.44 1nz8 s LEU 104 Cb -0.18 -3.70 -0.07 0.00 0.01 0.00 0.00 46.19 42.25 1nz8 s LEU 104 CO 0.23 -1.04 0.59 -0.44 1.01 0.00 0.00 176.35 176.71 1nz8 s SER 105 N -4.28 6.64 0.58 2.29 0.01 -1.26 -4.68 113.70 112.99 1nz8 s SER 105 Ca 0.54 0.99 0.32 0.00 1.31 0.00 0.00 55.95 59.11 1nz8 s SER 105 Cb -0.11 -2.25 1.39 0.00 0.21 0.00 0.00 66.02 65.27 1nz8 s SER 105 CO 0.47 -0.12 1.71 -0.65 0.41 0.00 0.00 173.24 175.06 1nz8 h PRO 106 N 2.38 0.00 0.06 12.44 0.11 -1.98 0.55 132.00 145.55 1nz8 h PRO 106 Ca -0.47 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.54 1nz8 h PRO 106 Cb 1.17 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.29 1nz8 h PRO 106 CO 0.68 0.00 -0.43 -0.44 -0.21 0.00 0.00 178.00 177.60 1nz8 h ASP 107 N 0.00 0.28 0.59 -2.05 3.32 -2.00 -3.09 116.42 113.47 1nz8 h ASP 107 Ca 0.43 -0.92 -0.14 0.00 0.02 0.00 0.00 57.03 56.42 1nz8 h ASP 107 Cb 2.08 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 41.53 1nz8 h ASP 107 CO -0.00 1.17 -0.65 -0.08 -1.72 0.00 0.00 179.24 177.95 1nz8 h GLU 108 N -0.58 0.05 0.45 3.56 4.81 -1.23 -3.19 114.58 118.46 1nz8 h GLU 108 Ca -0.07 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 1nz8 h GLU 108 Cb 1.29 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1nz8 h GLU 108 CO 0.08 0.69 -0.22 0.28 -0.73 0.00 0.00 179.01 179.11 1nz8 h VAL 109 N 0.04 0.54 -0.22 0.32 2.07 -0.15 -1.46 116.25 117.38 1nz8 h VAL 109 Ca -0.01 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 67.34 1nz8 h VAL 109 Cb 1.16 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1nz8 h VAL 109 CO 0.09 0.04 0.27 -0.09 0.02 0.00 0.00 177.57 177.90 1nz8 h ARG 110 N -0.75 0.00 0.07 1.57 9.65 -1.60 0.22 114.38 123.54 1nz8 h ARG 110 Ca -0.06 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.66 1nz8 h ARG 110 Cb 0.54 0.00 0.02 0.00 -1.39 0.00 0.00 29.97 29.13 1nz8 h ARG 110 CO 0.10 0.00 -0.65 0.45 2.80 0.00 0.00 179.97 182.67 1nz8 h HIS 111 N 0.00 0.53 0.00 2.20 3.86 -1.45 -2.36 115.15 117.93 1nz8 h HIS 111 Ca 0.10 -0.33 -0.11 0.00 -1.16 0.00 0.00 60.37 58.87 1nz8 h HIS 111 Cb 0.65 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 29.06 1nz8 h HIS 111 CO 0.00 1.20 -0.55 -0.84 0.86 0.00 0.00 177.93 178.61 1nz8 h ILE 112 N -0.30 1.27 0.00 2.45 3.07 -0.15 -2.83 117.51 121.03 1nz8 h ILE 112 Ca -0.10 -1.95 -0.18 0.00 1.55 0.00 0.00 64.86 64.18 1nz8 h ILE 112 Cb 1.43 2.09 -0.02 0.00 -0.27 0.00 0.00 36.82 40.05 1nz8 h ILE 112 CO 0.12 0.54 -0.83 -0.07 -1.05 0.00 0.00 178.15 176.86 1nz8 h LEU 113 N 0.00 0.07 -0.78 0.16 3.38 -0.70 -1.49 115.31 115.95 1nz8 h LEU 113 Ca -0.01 -0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 1nz8 h LEU 113 Cb 1.04 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1nz8 h LEU 113 CO 0.07 0.87 -0.52 -0.08 0.09 0.00 0.00 178.44 178.87 1nz8 h GLU 114 N 0.03 0.23 0.00 1.13 4.81 -1.27 -2.08 114.58 117.43 1nz8 h GLU 114 Ca -0.02 -0.13 -0.16 0.00 -0.13 0.00 0.00 59.36 58.92 1nz8 h GLU 114 Cb 1.46 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.83 1nz8 h GLU 114 CO 0.11 0.70 -0.98 0.28 -0.73 0.00 0.00 179.01 178.39 1nz8 h VAL 115 N 0.18 0.87 -0.32 0.32 2.07 -1.46 -2.96 116.25 114.95 1nz8 h VAL 115 Ca 0.00 -2.37 -0.09 0.00 0.82 0.00 0.00 66.70 65.06 1nz8 h VAL 115 Cb 0.98 2.36 -0.01 0.00 -1.52 0.00 0.00 31.29 33.10 1nz8 h VAL 115 CO 0.08 0.50 -0.16 0.77 0.02 0.00 0.00 177.57 178.78 1nz8 h SER 116 N 0.00 0.70 0.00 0.57 4.64 -1.11 -3.38 113.55 114.97 1nz8 h SER 116 Ca -0.08 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1nz8 h SER 116 Cb 1.56 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1nz8 h SER 116 CO 0.07 0.95 0.00 0.61 -0.87 0.00 0.00 176.83 177.59 1nz8 n GLY 117 N -0.04 -0.07 0.05 -0.77 0.00 -1.00 -4.83 105.19 98.53 1nz8 n GLY 117 Ca -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.97 1nz8 n GLY 117 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1nz8 h LEU 118 N 0.00 0.00 0.00 0.99 3.38 -1.66 -3.40 115.31 114.62 1nz8 h LEU 118 Ca 0.00 -0.15 -0.30 0.00 0.09 0.00 0.00 57.88 57.52 1nz8 h LEU 118 Cb 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 1nz8 h LEU 118 CO 0.00 0.58 -2.00 0.18 0.09 0.00 0.00 178.44 177.29 1nz8 n LEU 119 N -4.75 0.44 -0.68 1.67 4.77 -1.16 -5.02 117.00 112.27 1nz8 n LEU 119 Ca -0.02 0.21 0.08 0.00 -0.03 0.00 0.00 56.01 56.25 1nz8 n LEU 119 Cb 0.07 0.30 0.07 0.00 -2.33 0.00 0.00 43.42 41.54 1nz8 n LEU 119 CO 0.05 0.40 0.52 0.61 -1.33 0.00 0.00 177.39 177.64