#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mi8 n GLY -1 N 0.00 0.47 0.00 5.00 0.00 -1.26 -4.79 105.19 104.60 1mi8 n GLY -1 Ca 0.00 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1mi8 n GLY -1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mi8 n ALA 1 N -3.00 0.00 -2.40 4.61 0.00 -1.26 -4.82 120.51 113.64 1mi8 n ALA 1 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1mi8 n ALA 1 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1mi8 n ALA 1 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1mi8 s ILE 2 N -2.00 1.41 0.52 0.00 -4.36 0.66 -1.08 121.20 116.35 1mi8 s ILE 2 Ca 0.00 -2.08 -0.23 0.00 -0.26 0.00 0.00 60.65 58.08 1mi8 s ILE 2 Cb 0.00 -2.43 -0.06 0.00 1.25 0.00 0.00 42.46 41.22 1mi8 s ILE 2 CO 0.00 -0.29 1.38 -0.55 0.24 0.00 0.00 174.94 175.72 1mi8 s SER 3 N -3.40 5.41 0.56 4.36 0.15 -0.72 -0.21 113.70 119.86 1mi8 s SER 3 Ca 0.29 2.81 0.38 0.00 0.70 0.00 0.00 55.95 60.14 1mi8 s SER 3 Cb 0.05 -2.64 2.00 0.00 -1.71 0.00 0.00 66.02 63.72 1mi8 s SER 3 CO 0.11 -1.48 2.15 1.23 1.20 0.00 0.00 173.24 176.45 1mi8 h GLY 4 N 1.68 0.00 2.00 9.45 0.00 -1.93 -1.21 103.07 113.06 1mi8 h GLY 4 Ca -0.51 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.78 1mi8 h GLY 4 CO 0.58 0.00 -0.19 -0.55 0.00 0.00 0.00 176.54 176.39 1mi8 h ASP 5 N 0.00 0.00 -2.26 0.19 3.45 -1.91 -2.41 116.42 113.48 1mi8 h ASP 5 Ca 0.00 0.00 -0.59 0.00 0.43 0.00 0.00 57.03 56.87 1mi8 h ASP 5 Cb 0.06 0.00 0.06 0.00 -0.56 0.00 0.00 39.33 38.89 1mi8 h ASP 5 CO 0.00 0.19 0.73 -1.20 -1.57 0.00 0.00 179.24 177.38 1mi8 n SER 6 N -3.38 2.87 -4.60 6.45 7.64 -0.46 -4.73 113.62 117.42 1mi8 n SER 6 Ca -0.00 1.10 -0.41 0.00 1.01 0.00 0.00 58.87 60.57 1mi8 n SER 6 Cb 0.39 -1.40 -0.07 0.00 -1.01 0.00 0.00 64.21 62.13 1mi8 n SER 6 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1mi8 s LEU 7 N 0.75 4.16 -0.14 -3.43 1.02 -1.26 -0.55 118.68 119.22 1mi8 s LEU 7 Ca 0.78 0.39 -0.22 0.00 0.02 0.00 0.00 54.13 55.10 1mi8 s LEU 7 Cb -0.71 -2.78 -0.03 0.00 0.02 0.00 0.00 46.19 42.69 1mi8 s LEU 7 CO 0.41 -0.47 0.69 -0.63 0.02 0.00 0.00 176.35 176.36 1mi8 s ILE 8 N 2.57 5.01 -0.17 -0.59 -1.09 -0.29 -0.80 121.20 125.83 1mi8 s ILE 8 Ca 0.24 1.35 -0.29 0.00 -2.23 0.00 0.00 60.65 59.72 1mi8 s ILE 8 Cb -0.15 -4.01 -0.00 0.00 -1.58 0.00 0.00 42.46 36.72 1mi8 s ILE 8 CO 0.12 0.16 1.12 -0.44 -1.23 0.00 0.00 174.94 174.67 1mi8 s SER 9 N 1.00 7.07 -0.38 3.58 0.01 -1.11 -2.57 113.70 121.30 1mi8 s SER 9 Ca 0.34 1.54 -0.18 0.00 1.31 0.00 0.00 55.95 58.96 1mi8 s SER 9 Cb -0.17 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.53 1mi8 s SER 9 CO 0.14 -0.66 0.52 -0.76 0.41 0.00 0.00 173.24 172.89 1mi8 s LEU 10 N 3.01 4.46 0.31 2.44 1.43 0.59 -3.78 118.68 127.14 1mi8 s LEU 10 Ca 0.49 -0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 53.39 1mi8 s LEU 10 Cb -0.19 -2.57 0.51 0.00 0.03 0.00 0.00 46.19 43.98 1mi8 s LEU 10 CO 0.12 -0.54 1.97 0.00 0.23 0.00 0.00 176.35 178.13 1mi8 h ALA 11 N 8.57 1.47 0.00 4.21 0.00 -1.67 0.19 119.26 132.03 1mi8 h ALA 11 Ca -0.27 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1mi8 h ALA 11 Cb 1.12 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1mi8 h ALA 11 CO 0.79 0.47 0.00 -1.13 0.00 0.00 0.00 179.25 179.39 1mi8 n SER 12 N -4.43 0.40 0.00 0.00 3.41 -1.26 -4.35 113.62 107.38 1mi8 n SER 12 Ca 0.10 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.27 1mi8 n SER 12 Cb 0.07 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 1mi8 n SER 12 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1mi8 n THR 13 N -1.91 0.00 -0.09 6.66 -2.24 -1.00 -5.00 114.28 110.70 1mi8 n THR 13 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1mi8 n THR 13 Cb 0.29 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 1mi8 n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mi8 n GLY 14 N 2.47 0.86 3.92 3.38 0.00 0.62 -5.06 105.19 111.39 1mi8 n GLY 14 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1mi8 n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mi8 s LYS 15 N -0.91 3.07 -0.05 1.61 3.01 -1.25 -4.85 119.74 120.38 1mi8 s LYS 15 Ca 0.00 -0.06 0.02 0.00 -1.01 0.00 0.00 55.97 54.92 1mi8 s LYS 15 Cb 0.00 -2.35 0.01 0.00 -1.01 0.00 0.00 37.83 34.48 1mi8 s LYS 15 CO 0.00 -0.52 -0.10 1.03 0.51 0.00 0.00 175.35 176.27 1mi8 s ARG 16 N -4.86 1.31 0.01 1.68 3.00 -1.26 -0.30 118.95 118.53 1mi8 s ARG 16 Ca 0.52 -0.33 0.01 0.00 0.00 0.00 0.00 55.73 55.92 1mi8 s ARG 16 Cb -0.10 -1.15 -0.01 0.00 0.00 0.00 0.00 34.95 33.69 1mi8 s ARG 16 CO 0.44 0.05 -0.03 0.14 0.00 0.00 0.00 175.30 175.90 1mi8 s VAL 17 N 0.53 0.16 0.59 3.52 -7.23 -1.06 -4.89 120.40 112.01 1mi8 s VAL 17 Ca -0.10 -0.35 -0.19 0.00 -1.81 0.00 0.00 61.98 59.53 1mi8 s VAL 17 Cb -0.13 -0.19 -0.05 0.00 0.56 0.00 0.00 36.38 36.56 1mi8 s VAL 17 CO 0.02 -0.12 1.02 -1.54 -0.31 0.00 0.00 175.10 174.16 1mi8 n SER 18 N 2.57 1.03 0.01 4.85 3.41 -1.26 -1.14 113.62 123.10 1mi8 n SER 18 Ca -0.16 0.84 -0.00 0.00 -0.26 0.00 0.00 58.87 59.29 1mi8 n SER 18 Cb 0.58 -1.41 0.30 0.00 -0.26 0.00 0.00 64.21 63.42 1mi8 n SER 18 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1mi8 h ILE 19 N 0.64 1.20 -0.45 -1.33 2.10 -0.81 -2.07 117.51 116.79 1mi8 h ILE 19 Ca -0.48 -0.83 0.05 0.00 1.08 0.00 0.00 64.86 64.68 1mi8 h ILE 19 Cb 1.36 1.01 -0.05 0.00 -1.09 0.00 0.00 36.82 38.05 1mi8 h ILE 19 CO 0.52 0.28 0.18 0.50 -1.08 0.00 0.00 178.15 178.54 1mi8 h LYS 20 N 0.47 0.35 0.00 2.19 3.64 -1.70 0.08 116.57 121.60 1mi8 h LYS 20 Ca 0.10 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1mi8 h LYS 20 Cb 0.37 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1mi8 h LYS 20 CO 0.02 0.23 0.00 -0.25 -2.27 0.00 0.00 179.45 177.17 1mi8 n ASP 21 N -4.99 0.00 -0.97 4.20 8.00 -0.82 -2.07 116.55 119.91 1mi8 n ASP 21 Ca 0.04 0.39 0.09 0.00 0.71 0.00 0.00 54.79 56.02 1mi8 n ASP 21 Cb 0.16 -0.44 0.21 0.00 -0.02 0.00 0.00 41.12 41.04 1mi8 n ASP 21 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1mi8 n LEU 22 N -1.44 3.30 -0.26 0.64 4.77 -0.00 -4.67 117.00 119.34 1mi8 n LEU 22 Ca 0.03 -1.80 0.06 0.00 -0.03 0.00 0.00 56.01 54.27 1mi8 n LEU 22 Cb 0.12 -0.30 0.19 0.00 -2.33 0.00 0.00 43.42 41.10 1mi8 n LEU 22 CO 0.10 0.79 1.03 0.25 -1.33 0.00 0.00 177.39 178.22 1mi8 h LEU 23 N 3.32 0.31 -5.30 2.23 5.85 -1.18 -1.93 115.31 118.61 1mi8 h LEU 23 Ca 0.00 0.11 -0.78 0.00 0.84 0.00 0.00 57.88 58.05 1mi8 h LEU 23 Cb 0.85 0.08 -0.27 0.00 0.37 0.00 0.00 40.66 41.69 1mi8 h LEU 23 CO 0.00 0.11 1.05 0.47 -0.34 0.00 0.00 178.44 179.73 1mi8 n ASP 24 N -4.99 7.47 -3.93 1.25 8.00 -1.26 -4.44 116.55 118.65 1mi8 n ASP 24 Ca 0.15 -3.80 -0.10 0.00 0.71 0.00 0.00 54.79 51.75 1mi8 n ASP 24 Cb 0.42 -1.09 -0.10 0.00 -0.02 0.00 0.00 41.12 40.33 1mi8 n ASP 24 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1mi8 s GLU 25 N -4.14 0.39 0.13 -1.24 0.41 -0.73 -5.14 118.70 108.39 1mi8 s GLU 25 Ca 0.49 -0.52 -0.19 0.00 -0.41 0.00 0.00 54.97 54.33 1mi8 s GLU 25 Cb 0.38 0.15 0.05 0.00 -1.78 0.00 0.00 34.13 32.93 1mi8 s GLU 25 CO -0.35 -0.08 0.49 -1.59 -0.49 0.00 0.00 175.26 173.24 1mi8 s LYS 26 N -1.44 1.15 -1.10 1.61 -2.85 -1.26 -4.13 119.74 111.72 1mi8 s LYS 26 Ca -0.15 -0.58 -0.04 0.00 -1.00 0.00 0.00 55.97 54.20 1mi8 s LYS 26 Cb -0.09 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.21 1mi8 s LYS 26 CO 0.00 -0.47 0.94 -0.25 0.10 0.00 0.00 175.35 175.67 1mi8 n ASP 27 N -0.25 -3.98 -4.46 0.03 9.92 -0.00 -5.02 116.55 112.78 1mi8 n ASP 27 Ca -0.17 -0.50 -0.27 0.00 -0.53 0.00 0.00 54.79 53.33 1mi8 n ASP 27 Cb 0.64 -4.43 -0.11 0.00 -0.64 0.00 0.00 41.12 36.58 1mi8 n ASP 27 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 1mi8 s PHE 28 N -3.29 2.40 0.19 1.24 -0.12 -1.25 -4.86 117.98 112.29 1mi8 s PHE 28 Ca 0.26 -0.32 -0.16 0.00 -0.05 0.00 0.00 56.93 56.66 1mi8 s PHE 28 Cb -0.12 -1.20 -0.08 0.00 -0.63 0.00 0.00 43.02 41.00 1mi8 s PHE 28 CO 0.63 0.48 0.63 -1.21 -0.05 0.00 0.00 175.22 175.69 1mi8 s GLU 29 N -2.62 4.09 0.47 1.99 2.02 -1.26 -1.18 118.70 122.21 1mi8 s GLU 29 Ca 0.21 0.65 0.02 0.00 0.02 0.00 0.00 54.97 55.87 1mi8 s GLU 29 Cb -0.08 -2.88 -0.02 0.00 0.10 0.00 0.00 34.13 31.25 1mi8 s GLU 29 CO 0.11 0.43 0.05 0.96 0.02 0.00 0.00 175.26 176.83 1mi8 s ILE 30 N -1.52 0.92 -0.23 -1.63 -5.25 0.16 -2.13 121.20 111.52 1mi8 s ILE 30 Ca 0.41 -2.00 -0.10 0.00 -0.99 0.00 0.00 60.65 57.97 1mi8 s ILE 30 Cb -0.15 -2.21 -0.05 0.00 2.95 0.00 0.00 42.46 42.99 1mi8 s ILE 30 CO 0.20 0.00 0.14 0.26 -1.79 0.00 0.00 174.94 173.75 1mi8 s TRP 31 N -3.00 3.32 0.15 1.37 0.52 -1.25 -1.22 118.94 118.83 1mi8 s TRP 31 Ca 0.12 0.21 0.07 0.00 0.02 0.00 0.00 56.10 56.52 1mi8 s TRP 31 Cb 0.02 -2.24 -0.04 0.00 -1.15 0.00 0.00 33.47 30.06 1mi8 s TRP 31 CO 0.07 0.10 -0.15 0.00 0.02 0.00 0.00 176.95 176.99 1mi8 s ALA 32 N 0.91 1.73 -0.06 0.98 0.00 -0.71 -1.45 121.76 123.16 1mi8 s ALA 32 Ca 0.07 -1.41 -0.09 0.00 0.00 0.00 0.00 51.96 50.53 1mi8 s ALA 32 Cb -0.13 -0.11 -0.05 0.00 0.00 0.00 0.00 23.12 22.84 1mi8 s ALA 32 CO 0.03 0.13 0.23 -1.50 0.00 0.00 0.00 175.76 174.66 1mi8 s ILE 33 N -2.27 5.35 -0.47 0.00 2.07 -1.26 -0.33 121.20 124.29 1mi8 s ILE 33 Ca 0.13 0.34 -0.18 0.00 -1.41 0.00 0.00 60.65 59.53 1mi8 s ILE 33 Cb -0.04 -3.51 0.05 0.00 0.13 0.00 0.00 42.46 39.08 1mi8 s ILE 33 CO 0.05 0.54 0.51 0.21 -1.91 0.00 0.00 174.94 174.34 1mi8 s ASN 34 N -1.22 6.20 0.45 4.50 3.04 0.27 -4.88 114.94 123.29 1mi8 s ASN 34 Ca 0.20 -0.89 0.11 0.00 0.04 0.00 0.00 52.86 52.32 1mi8 s ASN 34 Cb -0.13 -2.24 1.00 0.00 -1.54 0.00 0.00 41.25 38.34 1mi8 s ASN 34 CO 0.09 -0.72 2.06 -0.33 -3.04 0.00 0.00 177.10 175.16 1mi8 h GLU 35 N 8.84 0.26 -0.28 0.43 5.08 -1.93 1.42 114.58 128.40 1mi8 h GLU 35 Ca -0.27 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.02 1mi8 h GLU 35 Cb 1.10 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 1mi8 h GLU 35 CO 0.88 0.22 0.01 1.96 -1.00 0.00 0.00 179.01 181.08 1mi8 h GLN 36 N 0.26 0.50 0.00 2.33 4.20 -1.97 -3.29 115.11 117.14 1mi8 h GLN 36 Ca 0.07 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1mi8 h GLN 36 Cb 0.06 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1mi8 h GLN 36 CO -0.01 0.65 -1.11 0.25 -0.67 0.00 0.00 178.83 177.94 1mi8 n THR 37 N -4.60 0.25 -1.86 -0.54 -2.24 -0.98 -4.97 114.28 99.34 1mi8 n THR 37 Ca -0.03 -0.33 -0.18 0.00 -2.27 0.00 0.00 64.05 61.24 1mi8 n THR 37 Cb 0.25 0.06 -0.05 0.00 -2.10 0.00 0.00 70.33 68.49 1mi8 n THR 37 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1mi8 n MET 38 N -2.14 -1.34 -4.15 -0.78 2.81 0.48 -5.00 117.12 107.00 1mi8 n MET 38 Ca 0.01 1.04 -0.31 0.00 -1.81 0.00 0.00 57.70 56.63 1mi8 n MET 38 Cb 0.47 -5.41 -0.08 0.00 -0.71 0.00 0.00 33.22 27.50 1mi8 n MET 38 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1mi8 s LYS 39 N -4.10 2.65 0.25 0.03 1.02 -1.20 -4.47 119.74 113.92 1mi8 s LYS 39 Ca 0.00 -0.77 -0.23 0.00 0.02 0.00 0.00 55.97 55.00 1mi8 s LYS 39 Cb 0.00 -2.60 -0.09 0.00 -0.52 0.00 0.00 37.83 34.62 1mi8 s LYS 39 CO 0.00 0.56 0.81 -0.51 -0.92 0.00 0.00 175.35 175.29 1mi8 s LEU 40 N -2.17 4.37 -0.03 3.17 1.43 -1.26 -0.57 118.68 123.63 1mi8 s LEU 40 Ca 0.25 1.59 -0.09 0.00 -1.03 0.00 0.00 54.13 54.85 1mi8 s LEU 40 Cb -0.12 -3.70 0.01 0.00 0.03 0.00 0.00 46.19 42.41 1mi8 s LEU 40 CO 0.17 0.02 0.20 -1.83 0.23 0.00 0.00 176.35 175.14 1mi8 s GLU 41 N -1.91 0.46 0.43 1.70 -1.05 0.55 -4.91 118.70 113.96 1mi8 s GLU 41 Ca 0.45 -0.15 -0.26 0.00 -0.15 0.00 0.00 54.97 54.86 1mi8 s GLU 41 Cb -0.18 0.20 -0.09 0.00 -0.44 0.00 0.00 34.13 33.62 1mi8 s GLU 41 CO 0.23 -0.11 1.40 0.45 0.95 0.00 0.00 175.26 178.18 1mi8 s SER 42 N -0.93 6.07 -0.06 0.83 0.15 -1.26 -1.74 113.70 116.75 1mi8 s SER 42 Ca -0.10 2.86 -0.15 0.00 0.70 0.00 0.00 55.95 59.26 1mi8 s SER 42 Cb -0.05 -2.65 0.03 0.00 -1.71 0.00 0.00 66.02 61.64 1mi8 s SER 42 CO 0.02 -1.04 0.35 0.00 1.20 0.00 0.00 173.24 173.77 1mi8 s ALA 43 N -1.21 -0.89 0.29 5.45 0.00 -0.35 -4.87 121.76 120.18 1mi8 s ALA 43 Ca 0.59 0.65 -0.28 0.00 0.00 0.00 0.00 51.96 52.92 1mi8 s ALA 43 Cb -0.43 -0.19 -0.09 0.00 0.00 0.00 0.00 23.12 22.41 1mi8 s ALA 43 CO 0.55 -0.23 0.99 0.15 0.00 0.00 0.00 175.76 177.21 1mi8 s LYS 44 N -0.75 4.66 -0.22 0.00 1.02 -1.26 0.38 119.74 123.58 1mi8 s LYS 44 Ca -0.08 1.51 -0.14 0.00 0.02 0.00 0.00 55.97 57.28 1mi8 s LYS 44 Cb -0.04 -3.05 -0.04 0.00 -0.52 0.00 0.00 37.83 34.18 1mi8 s LYS 44 CO 0.03 0.32 0.32 0.08 -0.92 0.00 0.00 175.35 175.18 1mi8 s VAL 45 N -1.35 5.25 -0.10 3.17 1.01 -0.33 -4.31 120.40 123.74 1mi8 s VAL 45 Ca 0.46 0.54 -0.28 0.00 0.00 0.00 0.00 61.98 62.70 1mi8 s VAL 45 Cb -0.25 -3.66 -0.24 0.00 0.00 0.00 0.00 36.38 32.23 1mi8 s VAL 45 CO 0.31 0.28 0.93 0.77 0.00 0.00 0.00 175.10 177.39 1mi8 h SER 46 N 7.45 0.02 -5.00 3.32 4.64 -1.34 0.03 113.55 122.66 1mi8 h SER 46 Ca -0.36 -0.84 -0.04 0.00 -0.47 0.00 0.00 61.79 60.07 1mi8 h SER 46 Cb 1.16 -0.01 -0.16 0.00 -0.31 0.00 0.00 62.40 63.09 1mi8 h SER 46 CO 0.70 0.86 0.17 0.00 -0.87 0.00 0.00 176.83 177.68 1mi8 s ARG 47 N -2.86 1.15 -0.01 4.77 1.70 -1.25 -4.22 118.95 118.23 1mi8 s ARG 47 Ca -0.18 -0.15 0.06 0.00 -0.47 0.00 0.00 55.73 55.00 1mi8 s ARG 47 Cb -0.01 0.53 -0.03 0.00 -0.57 0.00 0.00 34.95 34.87 1mi8 s ARG 47 CO 0.69 -0.43 -0.19 0.08 -1.08 0.00 0.00 175.30 174.37 1mi8 s VAL 48 N -2.51 2.71 -0.01 4.99 1.01 -1.26 -1.27 120.40 124.06 1mi8 s VAL 48 Ca -0.05 -1.00 -0.28 0.00 0.00 0.00 0.00 61.98 60.65 1mi8 s VAL 48 Cb -0.01 -2.07 0.06 0.00 0.00 0.00 0.00 36.38 34.37 1mi8 s VAL 48 CO -0.02 0.49 0.63 0.72 0.00 0.00 0.00 175.10 176.92 1mi8 s PHE 49 N -0.78 -0.59 0.16 5.22 -0.12 -0.90 -4.80 117.98 116.17 1mi8 s PHE 49 Ca 0.12 0.91 -0.20 0.00 -0.05 0.00 0.00 56.93 57.72 1mi8 s PHE 49 Cb -0.10 0.40 -0.07 0.00 -0.63 0.00 0.00 43.02 42.61 1mi8 s PHE 49 CO 0.02 -0.62 0.66 1.41 -0.05 0.00 0.00 175.22 176.63 1mi8 s MET 50 N -1.61 4.24 -0.04 1.99 -2.45 -1.26 -1.71 119.30 118.46 1mi8 s MET 50 Ca -0.09 0.81 0.11 0.00 -1.25 0.00 0.00 55.69 55.27 1mi8 s MET 50 Cb -0.01 -3.06 0.31 0.00 1.25 0.00 0.00 34.83 33.33 1mi8 s MET 50 CO 0.06 0.51 1.26 0.25 1.05 0.00 0.00 175.02 178.14 1mi8 n THR 51 N 1.17 1.26 0.00 10.11 -2.24 0.15 -4.95 114.28 119.78 1mi8 n THR 51 Ca -0.06 -1.19 0.00 0.00 -2.27 0.00 0.00 64.05 60.53 1mi8 n THR 51 Cb 0.51 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 1mi8 n THR 51 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mi8 n GLY 52 N 0.18 -0.43 3.67 3.38 0.00 -1.24 -4.94 105.19 105.79 1mi8 n GLY 52 Ca 0.12 -2.19 -0.35 0.00 0.00 0.00 0.00 46.02 43.59 1mi8 n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mi8 s LYS 53 N 0.00 4.06 0.02 1.61 1.02 -1.26 -0.14 119.74 125.05 1mi8 s LYS 53 Ca 0.00 -0.28 -0.07 0.00 0.02 0.00 0.00 55.97 55.63 1mi8 s LYS 53 Cb 0.00 -3.40 -0.00 0.00 -0.52 0.00 0.00 37.83 33.91 1mi8 s LYS 53 CO 0.00 0.19 0.14 0.15 -0.92 0.00 0.00 175.35 174.91 1mi8 s LYS 54 N 0.66 0.57 0.28 1.68 -0.14 0.19 -4.87 119.74 118.10 1mi8 s LYS 54 Ca 0.06 -0.55 -0.30 0.00 -1.36 0.00 0.00 55.97 53.82 1mi8 s LYS 54 Cb -0.12 0.23 -0.11 0.00 -1.68 0.00 0.00 37.83 36.15 1mi8 s LYS 54 CO 0.01 -0.15 1.53 -1.17 -0.76 0.00 0.00 175.35 174.81 1mi8 s LEU 55 N -1.77 4.36 0.22 3.17 2.96 -1.26 -1.71 118.68 124.65 1mi8 s LEU 55 Ca -0.10 2.85 0.11 0.00 -0.22 0.00 0.00 54.13 56.77 1mi8 s LEU 55 Cb -0.04 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 42.97 1mi8 s LEU 55 CO -0.01 -0.83 -0.20 0.54 -1.32 0.00 0.00 176.35 174.52 1mi8 s VAL 56 N -0.10 2.22 -0.02 1.68 0.11 0.15 -4.37 120.40 120.07 1mi8 s VAL 56 Ca 0.61 -2.18 0.02 0.00 -2.93 0.00 0.00 61.98 57.50 1mi8 s VAL 56 Cb -0.45 -2.13 0.00 0.00 -1.53 0.00 0.00 36.38 32.27 1mi8 s VAL 56 CO 0.47 -0.32 -0.08 -0.31 -3.33 0.00 0.00 175.10 171.53 1mi8 s TYR 57 N -2.23 0.81 -0.22 1.54 1.51 0.14 -0.92 117.35 117.98 1mi8 s TYR 57 Ca 0.24 -0.18 -0.24 0.00 -1.01 0.00 0.00 57.07 55.87 1mi8 s TYR 57 Cb -0.05 -0.57 -0.01 0.00 -0.11 0.00 0.00 41.96 41.21 1mi8 s TYR 57 CO 0.11 -0.07 0.81 0.42 -1.11 0.00 0.00 175.55 175.70 1mi8 s ILE 58 N 0.12 4.87 -0.15 2.71 1.01 0.77 -0.81 121.20 129.73 1mi8 s ILE 58 Ca -0.02 1.54 -0.04 0.00 0.00 0.00 0.00 60.65 62.14 1mi8 s ILE 58 Cb -0.07 -4.10 -0.03 0.00 0.01 0.00 0.00 42.46 38.27 1mi8 s ILE 58 CO 0.00 -0.03 -0.03 -0.22 0.00 0.00 0.00 174.94 174.67 1mi8 s LEU 59 N 2.55 3.31 -0.01 2.97 0.20 0.20 -1.15 118.68 126.75 1mi8 s LEU 59 Ca 0.35 -0.09 0.04 0.00 0.69 0.00 0.00 54.13 55.12 1mi8 s LEU 59 Cb -0.16 -1.79 -0.01 0.00 -0.43 0.00 0.00 46.19 43.80 1mi8 s LEU 59 CO 0.09 0.20 -0.13 -0.75 -0.29 0.00 0.00 176.35 175.47 1mi8 s LYS 60 N 0.20 1.08 0.36 1.98 2.20 0.10 -1.64 119.74 124.02 1mi8 s LYS 60 Ca -0.02 -0.45 0.07 0.00 -0.36 0.00 0.00 55.97 55.22 1mi8 s LYS 60 Cb -0.14 -1.03 -0.01 0.00 -1.51 0.00 0.00 37.83 35.14 1mi8 s LYS 60 CO 0.03 0.26 0.43 0.95 -0.36 0.00 0.00 175.35 176.66 1mi8 s THR 61 N -0.22 3.57 0.33 3.43 -4.23 0.96 -0.28 115.64 119.20 1mi8 s THR 61 Ca 0.03 -1.13 0.01 0.00 -1.18 0.00 0.00 61.69 59.43 1mi8 s THR 61 Cb -0.06 -3.23 0.26 0.00 1.34 0.00 0.00 72.50 70.82 1mi8 s THR 61 CO -0.00 -0.11 2.00 -0.09 -0.54 0.00 0.00 174.62 175.87 1mi8 h ARG 62 N 0.95 0.91 0.00 3.99 2.43 -1.18 0.17 114.38 121.64 1mi8 h ARG 62 Ca -0.44 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1mi8 h ARG 62 Cb 1.26 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1mi8 h ARG 62 CO 0.53 0.60 0.00 -0.07 -1.51 0.00 0.00 179.97 179.52 1mi8 h LEU 63 N 0.94 0.00 0.00 3.80 3.38 -1.95 -3.46 115.31 118.02 1mi8 h LEU 63 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1mi8 h LEU 63 Cb -0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1mi8 h LEU 63 CO -0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.08 1mi8 n GLY 64 N -0.71 0.71 3.77 0.83 0.00 0.58 -5.07 105.19 105.30 1mi8 n GLY 64 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1mi8 n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mi8 s ARG 65 N -0.72 4.33 0.01 1.61 0.52 -1.25 -4.72 118.95 118.73 1mi8 s ARG 65 Ca 0.00 1.93 -0.09 0.00 -0.52 0.00 0.00 55.73 57.05 1mi8 s ARG 65 Cb 0.00 -2.95 0.01 0.00 0.52 0.00 0.00 34.95 32.52 1mi8 s ARG 65 CO 0.00 -0.11 0.19 0.99 0.02 0.00 0.00 175.30 176.39 1mi8 s THR 66 N -1.26 0.09 -0.01 0.02 2.01 -1.26 -0.03 115.64 115.20 1mi8 s THR 66 Ca 0.51 -0.71 -0.24 0.00 0.31 0.00 0.00 61.69 61.56 1mi8 s THR 66 Cb -0.34 -0.61 0.05 0.00 0.01 0.00 0.00 72.50 71.62 1mi8 s THR 66 CO 0.43 -0.39 0.54 -0.51 -0.69 0.00 0.00 174.62 174.00 1mi8 s ILE 67 N -1.71 0.02 -0.16 1.82 2.07 -0.65 -4.84 121.20 117.76 1mi8 s ILE 67 Ca -0.12 -0.20 -0.05 0.00 -1.41 0.00 0.00 60.65 58.87 1mi8 s ILE 67 Cb -0.05 -0.90 -0.03 0.00 0.13 0.00 0.00 42.46 41.60 1mi8 s ILE 67 CO 0.01 -0.11 0.01 -0.54 -1.91 0.00 0.00 174.94 172.40 1mi8 s LYS 68 N -1.68 3.71 0.15 3.50 1.02 -1.26 -0.63 119.74 124.54 1mi8 s LYS 68 Ca -0.09 -0.43 -0.17 0.00 0.02 0.00 0.00 55.97 55.30 1mi8 s LYS 68 Cb -0.01 -3.03 0.04 0.00 -0.52 0.00 0.00 37.83 34.31 1mi8 s LYS 68 CO 0.04 0.33 0.46 0.00 -0.92 0.00 0.00 175.35 175.26 1mi8 s ALA 69 N 0.17 -0.99 0.72 5.17 0.00 0.01 -1.75 121.76 125.10 1mi8 s ALA 69 Ca 0.01 -0.06 -0.12 0.00 0.00 0.00 0.00 51.96 51.79 1mi8 s ALA 69 Cb -0.13 0.77 0.03 0.00 0.00 0.00 0.00 23.12 23.79 1mi8 s ALA 69 CO 0.02 -0.71 1.09 0.95 0.00 0.00 0.00 175.76 177.11 1mi8 s THR 70 N -3.82 3.40 0.58 0.00 -4.23 -0.24 -0.68 115.64 110.65 1mi8 s THR 70 Ca 0.05 0.52 0.28 0.00 -1.18 0.00 0.00 61.69 61.36 1mi8 s THR 70 Cb 0.01 -3.05 0.36 0.00 1.34 0.00 0.00 72.50 71.16 1mi8 s THR 70 CO -0.09 -0.53 2.11 0.00 -0.54 0.00 0.00 174.62 175.57 1mi8 h ALA 71 N -0.65 1.82 -0.12 3.99 0.00 -1.91 -1.40 119.26 120.99 1mi8 h ALA 71 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1mi8 h ALA 71 Cb 1.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1mi8 h ALA 71 CO 0.53 -0.27 0.00 0.27 0.00 0.00 0.00 179.25 179.78 1mi8 n ASN 72 N -3.87 3.04 -4.74 0.00 6.94 -1.26 -1.77 115.26 113.60 1mi8 n ASN 72 Ca 0.01 -1.96 -0.41 0.00 -0.02 0.00 0.00 54.58 52.20 1mi8 n ASN 72 Cb 0.30 -0.06 -0.03 0.00 -2.36 0.00 0.00 39.78 37.63 1mi8 n ASN 72 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1mi8 s HIS 73 N -1.78 3.39 0.02 -2.53 2.46 -0.53 -4.43 115.29 111.89 1mi8 s HIS 73 Ca 0.30 1.41 -0.12 0.00 0.47 0.00 0.00 55.06 57.11 1mi8 s HIS 73 Cb 0.20 -3.46 -0.06 0.00 -0.13 0.00 0.00 32.58 29.13 1mi8 s HIS 73 CO 0.29 -1.30 0.38 1.03 -2.47 0.00 0.00 174.74 172.67 1mi8 s ARG 74 N -0.41 3.82 0.20 2.88 0.52 -1.26 -0.86 118.95 123.84 1mi8 s ARG 74 Ca 0.53 0.28 0.10 0.00 -0.52 0.00 0.00 55.73 56.12 1mi8 s ARG 74 Cb -0.34 -3.14 -0.04 0.00 0.52 0.00 0.00 34.95 31.95 1mi8 s ARG 74 CO 0.38 0.66 -0.20 -0.06 0.02 0.00 0.00 175.30 176.10 1mi8 s PHE 75 N -1.18 2.06 -0.34 -0.53 0.40 -0.29 -1.71 117.98 116.38 1mi8 s PHE 75 Ca 0.26 -0.42 -0.18 0.00 -0.60 0.00 0.00 56.93 55.99 1mi8 s PHE 75 Cb -0.15 -0.99 -0.01 0.00 0.51 0.00 0.00 43.02 42.39 1mi8 s PHE 75 CO 0.14 0.47 0.52 -1.17 0.70 0.00 0.00 175.22 175.88 1mi8 s LEU 76 N -2.91 4.31 0.32 -0.37 2.96 -1.26 -1.32 118.68 120.41 1mi8 s LEU 76 Ca 0.21 0.05 0.04 0.00 -0.22 0.00 0.00 54.13 54.21 1mi8 s LEU 76 Cb -0.06 -2.61 -0.02 0.00 0.50 0.00 0.00 46.19 44.00 1mi8 s LEU 76 CO 0.09 -0.47 0.47 -0.89 -1.32 0.00 0.00 176.35 174.24 1mi8 s THR 77 N 2.42 4.60 0.41 3.68 2.01 0.04 -0.11 115.64 128.68 1mi8 s THR 77 Ca 0.19 -0.85 0.11 0.00 0.31 0.00 0.00 61.69 61.45 1mi8 s THR 77 Cb -0.15 -3.63 0.31 0.00 0.01 0.00 0.00 72.50 69.03 1mi8 s THR 77 CO 0.13 -0.29 1.98 0.40 -0.69 0.00 0.00 174.62 176.15 1mi8 h ILE 78 N 0.90 0.96 -1.15 1.82 2.04 -1.96 -1.00 117.51 119.12 1mi8 h ILE 78 Ca -0.48 -0.18 -0.63 0.00 1.00 0.00 0.00 64.86 64.56 1mi8 h ILE 78 Cb 1.24 0.39 -0.36 0.00 -0.74 0.00 0.00 36.82 37.35 1mi8 h ILE 78 CO 0.57 0.10 0.07 -0.90 0.00 0.00 0.00 178.15 177.99 1mi8 n ASP 79 N -4.48 6.25 0.00 1.72 5.68 -1.26 -5.05 116.55 119.41 1mi8 n ASP 79 Ca 0.09 -3.77 0.00 0.00 -0.50 0.00 0.00 54.79 50.61 1mi8 n ASP 79 Cb 0.29 -0.69 0.00 0.00 -1.14 0.00 0.00 41.12 39.58 1mi8 n ASP 79 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1mi8 n GLY 80 N -0.72 0.71 3.73 6.12 0.00 -0.38 -5.00 105.19 109.66 1mi8 n GLY 80 Ca 0.51 -2.19 -0.41 0.00 0.00 0.00 0.00 46.02 43.93 1mi8 n GLY 80 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1mi8 s TRP 81 N -1.09 3.30 0.02 1.61 0.52 -1.26 -0.78 118.94 121.26 1mi8 s TRP 81 Ca 0.00 1.25 0.02 0.00 0.02 0.00 0.00 56.10 57.39 1mi8 s TRP 81 Cb 0.00 -3.56 -0.01 0.00 -1.15 0.00 0.00 33.47 28.75 1mi8 s TRP 81 CO 0.00 -1.73 -0.06 0.15 0.02 0.00 0.00 176.95 175.33 1mi8 s LYS 82 N 0.01 0.47 0.49 4.98 1.02 -0.43 -4.91 119.74 121.38 1mi8 s LYS 82 Ca 0.56 -0.45 -0.22 0.00 0.02 0.00 0.00 55.97 55.89 1mi8 s LYS 82 Cb -0.35 -0.36 -0.07 0.00 -0.52 0.00 0.00 37.83 36.53 1mi8 s LYS 82 CO 0.37 0.08 1.16 1.03 -0.92 0.00 0.00 175.35 177.07 1mi8 s ARG 83 N -0.78 3.61 0.29 1.68 0.52 -1.26 -1.14 118.95 121.86 1mi8 s ARG 83 Ca -0.03 1.73 0.04 0.00 -0.52 0.00 0.00 55.73 56.94 1mi8 s ARG 83 Cb -0.06 -2.27 0.70 0.00 0.52 0.00 0.00 34.95 33.85 1mi8 s ARG 83 CO 0.00 -0.67 1.73 1.25 0.02 0.00 0.00 175.30 177.63 1mi8 h LEU 84 N 1.75 0.48 0.00 2.53 6.46 -0.94 0.02 115.31 125.61 1mi8 h LEU 84 Ca -0.50 0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 1mi8 h LEU 84 Cb 1.25 0.07 0.00 0.00 -0.73 0.00 0.00 40.66 41.25 1mi8 h LEU 84 CO 0.59 0.10 0.00 -0.90 -0.62 0.00 0.00 178.44 177.61 1mi8 n ASP 85 N -4.95 0.00 -0.00 1.25 3.85 -0.73 -1.96 116.55 114.02 1mi8 n ASP 85 Ca 0.22 -0.48 0.06 0.00 -0.71 0.00 0.00 54.79 53.88 1mi8 n ASP 85 Cb 0.60 -0.08 -0.08 0.00 -1.35 0.00 0.00 41.12 40.21 1mi8 n ASP 85 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1mi8 n GLU 86 N -1.08 2.49 -2.51 0.11 1.02 -0.03 -5.02 120.64 115.61 1mi8 n GLU 86 Ca 0.14 -0.01 -0.34 0.00 -0.02 0.00 0.00 57.16 56.93 1mi8 n GLU 86 Cb 0.10 -1.13 -0.03 0.00 -0.02 0.00 0.00 31.44 30.36 1mi8 n GLU 86 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1mi8 s LEU 87 N -2.74 3.83 0.25 -4.62 1.43 -0.83 -4.95 118.68 111.06 1mi8 s LEU 87 Ca 0.04 1.93 0.02 0.00 -1.03 0.00 0.00 54.13 55.09 1mi8 s LEU 87 Cb 0.10 -4.56 -0.05 0.00 0.03 0.00 0.00 46.19 41.70 1mi8 s LEU 87 CO 0.53 -0.81 0.06 -0.94 0.23 0.00 0.00 176.35 175.42 1mi8 s SER 88 N -2.01 1.52 0.06 2.29 1.04 -1.26 -5.03 113.70 110.31 1mi8 s SER 88 Ca 0.67 -1.32 0.13 0.00 0.48 0.00 0.00 55.95 55.91 1mi8 s SER 88 Cb -0.16 0.08 0.58 0.00 0.10 0.00 0.00 66.02 66.62 1mi8 s SER 88 CO 0.21 -0.65 1.42 0.18 0.98 0.00 0.00 173.24 175.38 1mi8 n LEU 89 N -0.46 0.15 -0.19 2.42 4.77 -1.26 -1.27 117.00 121.16 1mi8 n LEU 89 Ca -0.02 0.54 0.14 0.00 -0.03 0.00 0.00 56.01 56.64 1mi8 n LEU 89 Cb 0.65 -0.53 0.58 0.00 -2.33 0.00 0.00 43.42 41.79 1mi8 n LEU 89 CO 0.38 -0.40 0.85 2.29 -1.33 0.00 0.00 177.39 179.17 1mi8 n LYS 90 N -1.67 0.91 -2.86 3.23 2.85 -1.26 -4.43 118.16 114.92 1mi8 n LYS 90 Ca 0.02 -0.39 -0.28 0.00 -1.05 0.00 0.00 58.31 56.62 1mi8 n LYS 90 Cb 0.14 -1.49 -0.01 0.00 -0.65 0.00 0.00 35.03 33.01 1mi8 n LYS 90 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1mi8 s GLU 91 N -2.35 3.59 0.12 -1.58 0.41 -0.39 -5.00 118.70 113.50 1mi8 s GLU 91 Ca 0.31 0.16 0.10 0.00 -0.41 0.00 0.00 54.97 55.14 1mi8 s GLU 91 Cb 0.20 -2.45 -0.04 0.00 -1.78 0.00 0.00 34.13 30.06 1mi8 s GLU 91 CO 0.45 -0.07 -0.25 -1.01 -0.49 0.00 0.00 175.26 173.89 1mi8 s HIS 92 N -2.53 2.37 0.15 1.61 3.76 -1.26 -2.80 115.29 116.59 1mi8 s HIS 92 Ca 0.47 -0.35 0.07 0.00 -0.15 0.00 0.00 55.06 55.10 1mi8 s HIS 92 Cb -0.10 -1.28 -0.04 0.00 1.11 0.00 0.00 32.58 32.27 1mi8 s HIS 92 CO 0.39 0.35 -0.15 0.96 -0.85 0.00 0.00 174.74 175.44 1mi8 s ILE 93 N -1.08 1.55 -0.03 0.60 -4.36 0.07 -3.60 121.20 114.36 1mi8 s ILE 93 Ca 0.15 -1.87 -0.30 0.00 -0.26 0.00 0.00 60.65 58.37 1mi8 s ILE 93 Cb -0.10 -1.72 -0.04 0.00 1.25 0.00 0.00 42.46 41.84 1mi8 s ILE 93 CO 0.07 -0.42 1.27 0.00 0.24 0.00 0.00 174.94 176.11 1mi8 s ALA 94 N -2.27 3.52 0.03 2.27 0.00 0.85 -1.70 121.76 124.46 1mi8 s ALA 94 Ca 0.13 0.73 0.07 0.00 0.00 0.00 0.00 51.96 52.90 1mi8 s ALA 94 Cb -0.04 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.51 1mi8 s ALA 94 CO 0.05 -0.79 -0.22 -0.51 0.00 0.00 0.00 175.76 174.29 1mi8 s LEU 95 N 2.20 2.13 0.25 0.00 1.43 0.02 -2.07 118.68 122.63 1mi8 s LEU 95 Ca 0.59 -0.49 -0.30 0.00 -1.03 0.00 0.00 54.13 52.90 1mi8 s LEU 95 Cb -0.27 -1.05 -0.10 0.00 0.03 0.00 0.00 46.19 44.80 1mi8 s LEU 95 CO 0.24 0.20 1.42 -2.16 0.23 0.00 0.00 176.35 176.28 1mi8 s PRO 96 N -0.99 4.29 -0.08 1.29 0.04 -1.26 -0.94 135.00 137.35 1mi8 s PRO 96 Ca 0.08 2.27 -0.01 0.00 0.04 0.00 0.00 61.00 63.38 1mi8 s PRO 96 Cb -0.09 -3.12 -0.00 0.00 0.04 0.00 0.00 34.50 31.33 1mi8 s PRO 96 CO 0.01 -0.39 -0.02 -0.09 0.04 0.00 0.00 177.00 176.55 1mi8 h ARG 97 N 5.02 0.00 0.00 4.56 2.43 -1.32 -3.43 114.38 121.64 1mi8 h ARG 97 Ca -0.46 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1mi8 h ARG 97 Cb 1.22 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.77 1mi8 h ARG 97 CO 0.77 0.00 0.00 0.87 -1.51 0.00 0.00 179.97 180.10 1mi8 h LYS 98 N -0.79 0.00 -0.26 0.20 1.57 -1.98 -3.49 116.57 111.81 1mi8 h LYS 98 Ca 0.00 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1mi8 h LYS 98 Cb 0.06 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.33 1mi8 h LYS 98 CO 0.00 0.00 -0.12 0.45 -0.57 0.00 0.00 179.45 179.21 1mi8 n SER 116 N -2.53 -0.21 0.26 0.86 2.88 -1.26 -5.24 113.62 108.37 1mi8 n SER 116 Ca -0.02 0.46 0.12 0.00 -1.33 0.00 0.00 58.87 58.10 1mi8 n SER 116 Cb 0.07 -0.09 0.68 0.00 -0.75 0.00 0.00 64.21 64.12 1mi8 n SER 116 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1mi8 h ASP 117 N 0.00 0.00 -4.28 -3.46 3.45 -1.98 -3.45 116.42 106.71 1mi8 h ASP 117 Ca 0.07 0.00 -0.30 0.00 0.43 0.00 0.00 57.03 57.23 1mi8 h ASP 117 Cb 0.14 0.00 -0.16 0.00 -0.56 0.00 0.00 39.33 38.75 1mi8 h ASP 117 CO -0.25 0.14 -0.72 0.27 -1.57 0.00 0.00 179.24 177.11 1mi8 s ILE 118 N -4.10 0.97 -0.11 0.35 -4.36 -1.26 -0.88 121.20 111.82 1mi8 s ILE 118 Ca -0.02 -1.86 -0.03 0.00 -0.26 0.00 0.00 60.65 58.48 1mi8 s ILE 118 Cb 0.13 -1.61 -0.03 0.00 1.25 0.00 0.00 42.46 42.19 1mi8 s ILE 118 CO 0.59 -0.70 -0.01 -0.55 0.24 0.00 0.00 174.94 174.52 1mi8 s SER 119 N -2.84 5.12 -0.59 4.36 0.15 -0.12 -4.79 113.70 114.99 1mi8 s SER 119 Ca 0.11 0.06 -0.10 0.00 0.70 0.00 0.00 55.95 56.72 1mi8 s SER 119 Cb 0.01 -1.57 0.15 0.00 -1.71 0.00 0.00 66.02 62.90 1mi8 s SER 119 CO -0.01 0.31 0.48 0.26 1.20 0.00 0.00 173.24 175.48 1mi8 s TRP 120 N -0.45 3.47 -0.02 3.44 0.52 -1.26 -0.80 118.94 123.85 1mi8 s TRP 120 Ca 0.08 -1.95 -0.07 0.00 0.02 0.00 0.00 56.10 54.18 1mi8 s TRP 120 Cb -0.12 -3.57 -0.05 0.00 -1.15 0.00 0.00 33.47 28.59 1mi8 s TRP 120 CO 0.02 -0.97 0.25 0.34 0.02 0.00 0.00 176.95 176.61 1mi8 s ASP 121 N 2.37 6.49 0.43 2.95 2.15 -0.69 -4.73 116.67 125.65 1mi8 s ASP 121 Ca 0.10 0.56 -0.24 0.00 0.43 0.00 0.00 52.55 53.40 1mi8 s ASP 121 Cb -0.22 -2.09 -0.08 0.00 -0.30 0.00 0.00 42.92 40.23 1mi8 s ASP 121 CO -0.02 0.29 1.16 -0.44 -0.17 0.00 0.00 175.17 175.98 1mi8 s SER 122 N -1.56 6.35 0.06 -0.34 0.01 -1.26 -0.75 113.70 116.21 1mi8 s SER 122 Ca 0.25 2.29 -0.28 0.00 1.31 0.00 0.00 55.95 59.52 1mi8 s SER 122 Cb -0.13 -2.60 -0.05 0.00 0.21 0.00 0.00 66.02 63.44 1mi8 s SER 122 CO 0.14 -0.79 0.89 -0.63 0.41 0.00 0.00 173.24 173.26 1mi8 s ILE 123 N -1.51 4.66 -0.09 1.44 1.01 -1.12 -0.61 121.20 124.98 1mi8 s ILE 123 Ca 0.61 1.91 0.03 0.00 0.00 0.00 0.00 60.65 63.20 1mi8 s ILE 123 Cb -0.29 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 37.90 1mi8 s ILE 123 CO 0.35 0.30 0.11 1.33 0.00 0.00 0.00 174.94 177.03 1mi8 n VAL 124 N 3.04 0.00 -3.66 2.92 0.24 0.61 -4.72 118.33 116.75 1mi8 n VAL 124 Ca 0.01 -0.29 -0.14 0.00 -2.04 0.00 0.00 64.34 61.89 1mi8 n VAL 124 Cb 0.50 0.77 -0.08 0.00 -1.47 0.00 0.00 33.84 33.56 1mi8 n VAL 124 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1mi8 s SER 125 N -1.71 -0.63 -0.18 -1.34 0.15 -0.84 -4.97 113.70 104.18 1mi8 s SER 125 Ca 0.00 1.18 -0.04 0.00 0.70 0.00 0.00 55.95 57.79 1mi8 s SER 125 Cb 0.02 1.19 0.09 0.00 -1.71 0.00 0.00 66.02 65.61 1mi8 s SER 125 CO 0.13 -0.24 0.22 -0.63 1.20 0.00 0.00 173.24 173.91 1mi8 s ILE 126 N 0.20 -0.32 -0.06 6.45 1.01 -1.24 0.02 121.20 127.26 1mi8 s ILE 126 Ca -0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 60.65 60.57 1mi8 s ILE 126 Cb -0.04 -0.62 0.03 0.00 0.01 0.00 0.00 42.46 41.84 1mi8 s ILE 126 CO 0.01 -0.15 0.14 0.42 0.00 0.00 0.00 174.94 175.37 1mi8 s THR 127 N 2.33 -0.03 0.30 2.92 -4.23 -0.30 -4.98 115.64 111.65 1mi8 s THR 127 Ca 0.06 0.12 -0.29 0.00 -1.18 0.00 0.00 61.69 60.40 1mi8 s THR 127 Cb -0.15 -0.22 -0.10 0.00 1.34 0.00 0.00 72.50 73.37 1mi8 s THR 127 CO -0.11 0.05 1.39 -0.70 -0.54 0.00 0.00 174.62 174.71 1mi8 s GLU 128 N 0.81 4.28 0.00 3.99 2.12 -1.26 -0.16 118.70 128.48 1mi8 s GLU 128 Ca -0.06 2.31 0.00 0.00 0.36 0.00 0.00 54.97 57.57 1mi8 s GLU 128 Cb -0.08 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.24 1mi8 s GLU 128 CO -0.04 -0.34 0.00 0.25 -0.54 0.00 0.00 175.26 174.59 1mi8 n THR 129 N 1.44 0.00 0.00 -1.70 -2.24 -0.10 -4.84 114.28 106.84 1mi8 n THR 129 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1mi8 n THR 129 Cb 0.41 -1.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.28 1mi8 n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mi8 n GLY 130 N 3.06 -0.66 3.86 3.38 0.00 -1.18 -4.99 105.19 108.66 1mi8 n GLY 130 Ca 0.00 -1.10 -0.36 0.00 0.00 0.00 0.00 46.02 44.57 1mi8 n GLY 130 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mi8 s VAL 131 N -2.00 5.10 0.22 1.61 1.01 -1.26 0.32 120.40 125.41 1mi8 s VAL 131 Ca 0.00 0.53 -0.16 0.00 0.00 0.00 0.00 61.98 62.34 1mi8 s VAL 131 Cb 0.00 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.75 1mi8 s VAL 131 CO 0.00 0.38 0.53 -1.61 0.00 0.00 0.00 175.10 174.39 1mi8 s GLU 132 N -1.66 1.48 0.27 2.72 2.02 -0.70 -4.91 118.70 117.91 1mi8 s GLU 132 Ca 0.30 -1.01 -0.30 0.00 0.02 0.00 0.00 54.97 53.98 1mi8 s GLU 132 Cb -0.14 0.51 -0.10 0.00 0.10 0.00 0.00 34.13 34.50 1mi8 s GLU 132 CO 0.16 -0.63 1.34 -1.21 0.02 0.00 0.00 175.26 174.94 1mi8 s GLU 133 N -3.93 4.35 0.05 1.61 2.02 -1.26 0.54 118.70 122.08 1mi8 s GLU 133 Ca 0.14 2.18 0.05 0.00 0.02 0.00 0.00 54.97 57.36 1mi8 s GLU 133 Cb -0.01 -3.12 -0.02 0.00 0.10 0.00 0.00 34.13 31.07 1mi8 s GLU 133 CO 0.02 -0.26 -0.15 0.54 0.02 0.00 0.00 175.26 175.43 1mi8 s VAL 134 N -0.43 1.18 0.19 2.63 0.11 0.80 -3.68 120.40 121.20 1mi8 s VAL 134 Ca 0.54 -1.07 0.04 0.00 -2.93 0.00 0.00 61.98 58.56 1mi8 s VAL 134 Cb -0.39 -1.08 -0.05 0.00 -1.53 0.00 0.00 36.38 33.34 1mi8 s VAL 134 CO 0.45 -0.01 -0.06 -0.36 -3.33 0.00 0.00 175.10 171.80 1mi8 s PHE 135 N -0.91 1.41 0.35 1.54 0.40 0.70 0.33 117.98 121.80 1mi8 s PHE 135 Ca 0.02 -0.83 -0.05 0.00 -0.60 0.00 0.00 56.93 55.46 1mi8 s PHE 135 Cb -0.08 -0.77 0.01 0.00 0.51 0.00 0.00 43.02 42.69 1mi8 s PHE 135 CO 0.02 0.03 0.54 0.34 0.70 0.00 0.00 175.22 176.84 1mi8 s ASP 136 N -3.23 0.72 0.15 1.36 -1.08 -0.70 -0.24 116.67 113.64 1mi8 s ASP 136 Ca 0.22 -1.41 -0.13 0.00 -0.52 0.00 0.00 52.55 50.72 1mi8 s ASP 136 Cb 0.04 0.70 0.01 0.00 -1.46 0.00 0.00 42.92 42.21 1mi8 s ASP 136 CO 0.04 -1.37 0.36 -1.48 0.52 0.00 0.00 175.17 173.24 1mi8 s LEU 137 N -3.20 0.68 -0.10 -1.34 0.05 -1.26 -2.12 118.68 111.39 1mi8 s LEU 137 Ca 0.27 -0.60 -0.01 0.00 0.05 0.00 0.00 54.13 53.84 1mi8 s LEU 137 Cb -0.01 1.56 -0.03 0.00 -2.05 0.00 0.00 46.19 45.66 1mi8 s LEU 137 CO 0.18 -0.90 -0.05 -0.89 -0.55 0.00 0.00 176.35 174.15 1mi8 s THR 138 N -3.89 3.88 -0.34 5.48 2.01 -0.39 -0.99 115.64 121.39 1mi8 s THR 138 Ca 0.10 -0.40 -0.01 0.00 0.31 0.00 0.00 61.69 61.69 1mi8 s THR 138 Cb 0.02 -2.63 0.13 0.00 0.01 0.00 0.00 72.50 70.03 1mi8 s THR 138 CO -0.05 0.57 0.19 0.54 -0.69 0.00 0.00 174.62 175.18 1mi8 s VAL 139 N -0.45 0.21 0.12 3.82 0.11 -1.26 -0.87 120.40 122.08 1mi8 s VAL 139 Ca 0.07 -1.59 -0.35 0.00 -2.93 0.00 0.00 61.98 57.18 1mi8 s VAL 139 Cb -0.12 -1.17 -0.15 0.00 -1.53 0.00 0.00 36.38 33.41 1mi8 s VAL 139 CO 0.02 -0.93 1.49 -2.65 -3.33 0.00 0.00 175.10 169.71 1mi8 n PRO 140 N 4.25 1.75 0.00 1.54 -0.02 -1.26 -0.83 135.00 140.43 1mi8 n PRO 140 Ca 0.08 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1mi8 n PRO 140 Cb 0.38 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1mi8 n PRO 140 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mi8 n GLY 141 N 3.09 0.88 0.23 -1.23 0.00 -1.26 -4.58 105.19 102.31 1mi8 n GLY 141 Ca 0.18 -0.65 0.13 0.00 0.00 0.00 0.00 46.02 45.68 1mi8 n GLY 141 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mi8 h PRO 142 N 0.00 0.00 -4.62 1.61 0.13 -1.90 -3.48 132.00 123.74 1mi8 h PRO 142 Ca 0.00 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.75 1mi8 h PRO 142 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 1mi8 h PRO 142 CO 0.00 0.02 -0.55 0.72 -0.23 0.00 0.00 178.00 177.96 1mi8 n HIS 143 N -3.11 -1.77 -3.92 1.56 8.25 -0.01 -4.94 115.22 111.29 1mi8 n HIS 143 Ca 0.03 0.40 -0.09 0.00 -0.26 0.00 0.00 57.72 57.81 1mi8 n HIS 143 Cb 0.49 -3.72 -0.04 0.00 1.12 0.00 0.00 29.99 27.84 1mi8 n HIS 143 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1mi8 s ASN 144 N -2.58 -0.15 0.23 0.41 2.20 -1.26 0.17 114.94 113.95 1mi8 s ASN 144 Ca 0.28 -0.78 -0.21 0.00 -0.94 0.00 0.00 52.86 51.21 1mi8 s ASN 144 Cb -0.13 0.61 0.04 0.00 -2.00 0.00 0.00 41.25 39.77 1mi8 s ASN 144 CO 0.34 -1.17 0.65 0.72 -2.94 0.00 0.00 177.10 174.71 1mi8 s PHE 145 N -3.97 -0.28 -0.21 1.54 -0.71 0.85 -4.48 117.98 110.72 1mi8 s PHE 145 Ca 0.17 -0.08 -0.17 0.00 -1.04 0.00 0.00 56.93 55.81 1mi8 s PHE 145 Cb -0.02 0.61 -0.03 0.00 -1.21 0.00 0.00 43.02 42.37 1mi8 s PHE 145 CO 0.06 -1.07 0.46 0.08 -1.34 0.00 0.00 175.22 173.42 1mi8 s VAL 146 N -3.86 5.14 -0.02 -2.49 1.01 -0.53 -0.45 120.40 119.20 1mi8 s VAL 146 Ca 0.08 0.83 0.01 0.00 0.00 0.00 0.00 61.98 62.90 1mi8 s VAL 146 Cb -0.04 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.57 1mi8 s VAL 146 CO -0.01 0.20 -0.04 0.00 0.00 0.00 0.00 175.10 175.26 1mi8 s ALA 147 N 1.58 0.48 -1.50 5.51 0.00 -0.26 -2.77 121.76 124.80 1mi8 s ALA 147 Ca 0.21 -0.06 -0.13 0.00 0.00 0.00 0.00 51.96 51.99 1mi8 s ALA 147 Cb -0.15 -0.27 0.09 0.00 0.00 0.00 0.00 23.12 22.79 1mi8 s ALA 147 CO 0.09 0.02 0.80 0.09 0.00 0.00 0.00 175.76 176.76 1mi8 n ASN 148 N 3.64 -4.38 -2.51 0.00 4.13 0.02 -1.00 115.26 115.15 1mi8 n ASN 148 Ca -0.21 -0.69 -0.21 0.00 1.68 0.00 0.00 54.58 55.15 1mi8 n ASN 148 Cb 0.53 -3.54 0.00 0.00 -1.54 0.00 0.00 39.78 35.24 1mi8 n ASN 148 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1mi8 n ASP 149 N -2.64 -5.92 -4.06 6.41 8.00 -1.26 -4.51 116.55 112.58 1mi8 n ASP 149 Ca 0.03 -0.09 -0.17 0.00 0.71 0.00 0.00 54.79 55.27 1mi8 n ASP 149 Cb 0.53 -4.88 -0.13 0.00 -0.02 0.00 0.00 41.12 36.62 1mi8 n ASP 149 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1mi8 s ILE 150 N -3.07 0.73 -0.10 0.53 1.01 -0.17 -4.19 121.20 115.93 1mi8 s ILE 150 Ca 0.08 -0.75 -0.30 0.00 0.00 0.00 0.00 60.65 59.69 1mi8 s ILE 150 Cb -0.03 -0.68 -0.02 0.00 0.01 0.00 0.00 42.46 41.74 1mi8 s ILE 150 CO 0.10 -0.05 1.08 -0.63 0.00 0.00 0.00 174.94 175.44 1mi8 s ILE 151 N -0.73 4.60 0.07 2.92 -1.09 -0.88 -1.10 121.20 124.98 1mi8 s ILE 151 Ca -0.01 1.89 0.04 0.00 -2.23 0.00 0.00 60.65 60.33 1mi8 s ILE 151 Cb -0.06 -4.21 -0.03 0.00 -1.58 0.00 0.00 42.46 36.57 1mi8 s ILE 151 CO 0.00 -0.01 -0.11 0.68 -1.23 0.00 0.00 174.94 174.27 1mi8 s VAL 152 N 2.18 0.87 0.43 2.92 -7.23 0.41 -4.17 120.40 115.81 1mi8 s VAL 152 Ca 0.51 -1.33 -0.23 0.00 -1.81 0.00 0.00 61.98 59.12 1mi8 s VAL 152 Cb -0.20 -1.00 -0.09 0.00 0.56 0.00 0.00 36.38 35.65 1mi8 s VAL 152 CO 0.18 -0.38 1.06 -2.28 -0.31 0.00 0.00 175.10 173.38 1mi8 s HIS 153 N -1.66 3.15 0.57 2.82 2.46 -0.69 -0.10 115.29 121.83 1mi8 s HIS 153 Ca -0.02 1.61 0.07 0.00 0.47 0.00 0.00 55.06 57.19 1mi8 s HIS 153 Cb -0.08 -3.14 0.10 0.00 -0.13 0.00 0.00 32.58 29.33 1mi8 s HIS 153 CO 0.01 -0.77 0.78 0.00 -2.47 0.00 0.00 174.74 172.29 1mi8 n ALA 154 N -0.35 0.95 -0.95 1.58 0.00 0.13 -4.79 120.51 117.07 1mi8 n ALA 154 Ca 0.06 -1.92 -0.32 0.00 0.00 0.00 0.00 53.44 51.27 1mi8 n ALA 154 Cb 0.50 0.48 -0.02 0.00 0.00 0.00 0.00 19.45 20.41 1mi8 n ALA 154 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1mi8 n SER 155 N -2.49 -1.05 0.00 0.00 2.88 -0.16 -4.51 113.62 108.29 1mi8 n SER 155 Ca 0.15 0.74 0.00 0.00 -1.33 0.00 0.00 58.87 58.43 1mi8 n SER 155 Cb 0.55 -0.64 0.00 0.00 -0.75 0.00 0.00 64.21 63.37 1mi8 n SER 155 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43