#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yt8 n SER 2 N 0.00 -2.60 -4.80 1.61 3.41 -1.26 -4.94 113.62 105.04 2yt8 n SER 2 Ca 0.00 -1.03 -0.22 0.00 -0.26 0.00 0.00 58.87 57.36 2yt8 n SER 2 Cb 0.00 -2.69 -0.05 0.00 -0.26 0.00 0.00 64.21 61.21 2yt8 n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2yt8 s SER 3 N -3.50 5.06 0.00 4.04 1.04 -1.26 -5.13 113.70 113.95 2yt8 s SER 3 Ca 0.60 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 56.45 2yt8 s SER 3 Cb -0.33 -0.90 0.00 0.00 0.10 0.00 0.00 66.02 64.89 2yt8 s SER 3 CO 0.93 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 175.46 2yt8 n GLY 4 N -1.27 1.71 2.17 7.32 0.00 -1.26 -5.04 105.19 108.83 2yt8 n GLY 4 Ca -0.03 0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 2yt8 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yt8 n SER 5 N 0.00 6.40 -4.54 1.61 7.64 -1.26 -4.99 113.62 118.48 2yt8 n SER 5 Ca 0.00 -3.77 -0.35 0.00 1.01 0.00 0.00 58.87 55.76 2yt8 n SER 5 Cb 0.00 -0.71 -0.06 0.00 -1.01 0.00 0.00 64.21 62.43 2yt8 n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2yt8 n SER 6 N -0.84 1.90 0.17 6.43 2.88 -1.26 -4.17 113.62 118.73 2yt8 n SER 6 Ca 0.55 -0.47 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 2yt8 n SER 6 Cb 0.81 -1.47 0.00 0.00 -0.75 0.00 0.00 64.21 62.80 2yt8 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yt8 n GLY 7 N 6.14 -1.50 3.74 0.46 0.00 -1.26 -5.14 105.19 107.63 2yt8 n GLY 7 Ca 0.43 0.28 -0.33 0.00 0.00 0.00 0.00 46.02 46.41 2yt8 n GLY 7 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2yt8 s VAL 8 N -2.00 4.45 -0.07 1.61 1.01 -1.26 -5.03 120.40 119.11 2yt8 s VAL 8 Ca 0.00 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.35 2yt8 s VAL 8 Cb 0.00 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.31 2yt8 s VAL 8 CO 0.00 0.34 0.26 -0.89 0.00 0.00 0.00 175.10 174.81 2yt8 s THR 9 N -1.16 5.30 0.06 3.92 2.01 -1.14 -5.04 115.64 119.59 2yt8 s THR 9 Ca 0.22 0.49 0.08 0.00 0.31 0.00 0.00 61.69 62.79 2yt8 s THR 9 Cb -0.12 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.82 2yt8 s THR 9 CO 0.13 0.59 -0.22 -0.89 -0.69 0.00 0.00 174.62 173.55 2yt8 s THR 10 N -0.99 1.75 -0.10 -0.82 2.01 -1.26 -1.44 115.64 114.79 2yt8 s THR 10 Ca 0.19 -1.34 -0.09 0.00 0.31 0.00 0.00 61.69 60.75 2yt8 s THR 10 Cb -0.14 -1.54 0.03 0.00 0.01 0.00 0.00 72.50 70.86 2yt8 s THR 10 CO 0.08 0.14 0.26 0.00 -0.69 0.00 0.00 174.62 174.41 2yt8 s ALA 11 N -0.91 -0.65 0.03 7.40 0.00 -0.64 -4.95 121.76 122.03 2yt8 s ALA 11 Ca 0.08 0.73 0.05 0.00 0.00 0.00 0.00 51.96 52.82 2yt8 s ALA 11 Cb -0.09 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.57 2yt8 s ALA 11 CO 0.03 -0.13 -0.11 0.42 0.00 0.00 0.00 175.76 175.96 2yt8 s ILE 12 N 0.10 3.28 0.18 0.00 -1.09 -1.24 -0.71 121.20 121.72 2yt8 s ILE 12 Ca -0.00 -0.98 0.11 0.00 -2.23 0.00 0.00 60.65 57.54 2yt8 s ILE 12 Cb -0.02 -2.42 -0.04 0.00 -1.58 0.00 0.00 42.46 38.39 2yt8 s ILE 12 CO 0.00 0.34 -0.23 -0.63 -1.23 0.00 0.00 174.94 173.19 2yt8 s ILE 13 N -0.99 2.24 -0.45 2.92 -1.09 -0.18 -3.98 121.20 119.66 2yt8 s ILE 13 Ca 0.17 -1.97 -0.08 0.00 -2.23 0.00 0.00 60.65 56.54 2yt8 s ILE 13 Cb -0.11 -2.05 0.11 0.00 -1.58 0.00 0.00 42.46 38.84 2yt8 s ILE 13 CO 0.07 -0.12 0.30 -1.00 -1.23 0.00 0.00 174.94 172.96 2yt8 s HIS 14 N -1.65 3.46 -0.66 3.97 3.76 -1.26 -1.35 115.29 121.56 2yt8 s HIS 14 Ca 0.19 -1.97 0.01 0.00 -0.15 0.00 0.00 55.06 53.13 2yt8 s HIS 14 Cb -0.08 -3.38 0.16 0.00 1.11 0.00 0.00 32.58 30.40 2yt8 s HIS 14 CO 0.09 -0.98 0.46 1.03 -0.85 0.00 0.00 174.74 174.49 2yt8 s ARG 15 N 1.31 2.52 0.51 1.40 0.52 0.60 -4.91 118.95 120.91 2yt8 s ARG 15 Ca 0.06 -2.84 0.30 0.00 -0.52 0.00 0.00 55.73 52.73 2yt8 s ARG 15 Cb -0.25 -3.61 1.26 0.00 0.52 0.00 0.00 34.95 32.87 2yt8 s ARG 15 CO -0.01 -1.19 1.95 -1.00 0.02 0.00 0.00 175.30 175.07 2yt8 h PRO 16 N 6.41 0.00 -5.39 3.54 0.13 -1.94 1.58 132.00 136.33 2yt8 h PRO 16 Ca 0.03 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.64 2yt8 h PRO 16 Cb 0.88 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.71 2yt8 h PRO 16 CO 0.73 0.09 -0.82 -1.58 -0.23 0.00 0.00 178.00 176.19 2yt8 s HIS 17 N -3.73 1.42 0.07 1.56 2.46 -1.26 -4.76 115.29 111.05 2yt8 s HIS 17 Ca 0.00 -0.30 -0.02 0.00 0.47 0.00 0.00 55.06 55.22 2yt8 s HIS 17 Cb 0.10 -0.93 -0.27 0.00 -0.13 0.00 0.00 32.58 31.35 2yt8 s HIS 17 CO 0.58 -0.05 1.13 0.00 -2.47 0.00 0.00 174.74 173.92 2yt8 h ALA 18 N 5.86 0.17 -0.19 1.58 0.00 -1.92 -3.26 119.26 121.50 2yt8 h ALA 18 Ca -0.35 -0.92 -0.09 0.00 0.00 0.00 0.00 54.91 53.54 2yt8 h ALA 18 Cb 1.16 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.91 2yt8 h ALA 18 CO 0.48 1.05 0.12 0.54 0.00 0.00 0.00 179.25 181.45 2yt8 n ARG 19 N -3.48 1.30 -5.22 0.00 1.74 -1.26 -4.80 116.66 104.94 2yt8 n ARG 19 Ca -0.08 -0.61 -0.31 0.00 -0.77 0.00 0.00 57.85 56.09 2yt8 n ARG 19 Cb 1.01 -1.28 -0.16 0.00 -1.02 0.00 0.00 32.46 31.01 2yt8 n ARG 19 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2yt8 s GLU 20 N -0.73 2.44 0.96 5.56 0.41 -1.23 -5.13 118.70 120.99 2yt8 s GLU 20 Ca 0.11 -0.87 -0.15 0.00 -0.41 0.00 0.00 54.97 53.66 2yt8 s GLU 20 Cb 0.09 -2.08 0.09 0.00 -1.78 0.00 0.00 34.13 30.45 2yt8 s GLU 20 CO 0.02 0.37 -0.02 1.04 -0.49 0.00 0.00 175.26 176.19 2yt8 n GLN 21 N 2.95 -1.59 -0.09 1.61 6.02 -1.26 -4.98 117.38 120.04 2yt8 n GLN 21 Ca -0.17 -0.47 -0.17 0.00 -0.01 0.00 0.00 57.00 56.18 2yt8 n GLN 21 Cb 0.52 -1.39 -0.07 0.00 1.02 0.00 0.00 30.24 30.32 2yt8 n GLN 21 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2yt8 n LEU 22 N -0.21 1.75 0.00 1.08 4.77 -1.26 -5.05 117.00 118.07 2yt8 n LEU 22 Ca 0.03 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2yt8 n LEU 22 Cb 0.41 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 2yt8 n LEU 22 CO 0.29 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 2yt8 n GLY 23 N 2.11 3.20 3.65 -0.72 0.00 -1.26 -4.28 105.19 107.89 2yt8 n GLY 23 Ca -0.34 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.30 2yt8 n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2yt8 s PHE 24 N -0.14 3.35 -0.20 1.61 -0.71 -1.26 0.20 117.98 120.82 2yt8 s PHE 24 Ca 0.00 0.87 -0.27 0.00 -1.04 0.00 0.00 56.93 56.49 2yt8 s PHE 24 Cb 0.00 -2.79 -0.00 0.00 -1.21 0.00 0.00 43.02 39.02 2yt8 s PHE 24 CO 0.00 -0.20 0.94 0.00 -1.34 0.00 0.00 175.22 174.62 2yt8 s VAL 26 N 2.75 3.58 -0.14 0.00 1.01 -1.26 -1.17 120.40 125.17 2yt8 s VAL 26 Ca 0.41 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.90 2yt8 s VAL 26 Cb -0.16 -2.50 0.02 0.00 0.00 0.00 0.00 36.38 33.75 2yt8 s VAL 26 CO 0.09 0.55 -0.13 -1.61 0.00 0.00 0.00 175.10 174.01 2yt8 s GLU 27 N -0.25 2.10 -1.04 2.72 0.41 0.81 -4.73 118.70 118.72 2yt8 s GLU 27 Ca 0.03 -0.48 0.00 0.00 -0.41 0.00 0.00 54.97 54.11 2yt8 s GLU 27 Cb -0.13 -1.96 0.00 0.00 -1.78 0.00 0.00 34.13 30.26 2yt8 s GLU 27 CO 0.03 -0.23 0.00 -0.25 -0.49 0.00 0.00 175.26 174.31 2yt8 n ASP 28 N 4.77 -3.47 0.00 -0.19 9.92 -1.26 0.68 116.55 127.00 2yt8 n ASP 28 Ca -0.16 0.24 0.00 0.00 -0.53 0.00 0.00 54.79 54.34 2yt8 n ASP 28 Cb 0.50 -3.05 0.00 0.00 -0.64 0.00 0.00 41.12 37.93 2yt8 n ASP 28 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2yt8 n GLY 29 N -0.61 0.67 2.71 0.44 0.00 -1.26 -4.70 105.19 102.44 2yt8 n GLY 29 Ca -0.13 -0.58 -0.24 0.00 0.00 0.00 0.00 46.02 45.07 2yt8 n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yt8 s ILE 30 N -2.00 0.20 0.37 -0.61 1.01 0.21 -0.98 121.20 119.41 2yt8 s ILE 30 Ca 0.00 0.02 -0.28 0.00 0.00 0.00 0.00 60.65 60.39 2yt8 s ILE 30 Cb 0.00 -0.54 -0.10 0.00 0.01 0.00 0.00 42.46 41.83 2yt8 s ILE 30 CO 0.00 0.05 1.41 -0.63 0.00 0.00 0.00 174.94 175.77 2yt8 s ILE 31 N 2.03 2.30 0.00 2.92 1.01 -1.19 -0.14 121.20 128.14 2yt8 s ILE 31 Ca 0.03 0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.98 2yt8 s ILE 31 Cb -0.14 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.14 2yt8 s ILE 31 CO -0.06 0.07 0.00 0.00 0.00 0.00 0.00 174.94 174.95 2yt8 s SER 33 N -4.56 2.78 -0.02 0.00 0.01 -1.24 -4.67 113.70 106.01 2yt8 s SER 33 Ca 0.00 -1.06 0.02 0.00 1.31 0.00 0.00 55.95 56.22 2yt8 s SER 33 Cb 0.00 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.06 2yt8 s SER 33 CO 0.00 -0.18 -0.05 -0.22 0.41 0.00 0.00 173.24 173.20 2yt8 s LEU 34 N -3.38 1.77 -0.28 2.44 0.20 -1.26 -0.50 118.68 117.68 2yt8 s LEU 34 Ca 0.25 -0.11 -0.29 0.00 0.69 0.00 0.00 54.13 54.67 2yt8 s LEU 34 Cb -0.00 -0.35 -0.02 0.00 -0.43 0.00 0.00 46.19 45.38 2yt8 s LEU 34 CO 0.09 0.03 1.64 -0.22 -0.29 0.00 0.00 176.35 177.60 2yt8 s LEU 35 N 0.21 3.74 0.28 -0.68 2.96 0.13 -4.95 118.68 120.37 2yt8 s LEU 35 Ca -0.02 1.42 -0.30 0.00 -0.22 0.00 0.00 54.13 55.01 2yt8 s LEU 35 Cb -0.07 -3.53 -0.13 0.00 0.50 0.00 0.00 46.19 42.96 2yt8 s LEU 35 CO -0.00 -1.41 1.36 -1.14 -1.32 0.00 0.00 176.35 173.84 2yt8 n ARG 36 N 7.94 2.08 -3.69 1.98 3.00 -1.26 -2.53 116.66 124.18 2yt8 n ARG 36 Ca 0.20 0.74 -0.23 0.00 -0.00 0.00 0.00 57.85 58.55 2yt8 n ARG 36 Cb 0.46 -2.36 0.03 0.00 0.00 0.00 0.00 32.46 30.59 2yt8 n ARG 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2yt8 n GLY 37 N 1.62 -0.50 0.00 5.14 0.00 -1.26 -4.99 105.19 105.20 2yt8 n GLY 37 Ca 0.09 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2yt8 n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yt8 n GLY 38 N -1.62 6.10 0.10 -0.02 0.00 -1.05 -5.08 105.19 103.64 2yt8 n GLY 38 Ca -0.24 -1.89 -0.20 0.00 0.00 0.00 0.00 46.02 43.69 2yt8 n GLY 38 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2yt8 h ILE 39 N 0.00 1.21 0.05 -0.61 2.04 -1.85 -3.35 117.51 115.00 2yt8 h ILE 39 Ca 0.00 -2.33 0.01 0.00 1.00 0.00 0.00 64.86 63.54 2yt8 h ILE 39 Cb 0.00 2.77 -0.04 0.00 -0.74 0.00 0.00 36.82 38.81 2yt8 h ILE 39 CO 0.00 0.56 -0.39 0.00 0.00 0.00 0.00 178.15 178.32 2yt8 h ALA 40 N -0.16 -0.87 -0.99 1.87 0.00 -1.91 0.18 119.26 117.39 2yt8 h ALA 40 Ca -0.23 -0.08 0.36 0.00 0.00 0.00 0.00 54.91 54.97 2yt8 h ALA 40 Cb 1.43 0.81 -0.18 0.00 0.00 0.00 0.00 17.79 19.84 2yt8 h ALA 40 CO -0.03 -0.97 0.35 -1.91 0.00 0.00 0.00 179.25 176.69 2yt8 n GLU 41 N -4.68 -0.07 0.04 0.00 0.00 -1.26 0.19 120.64 114.86 2yt8 n GLU 41 Ca -0.06 1.41 -0.12 0.00 0.00 0.00 0.00 57.16 58.39 2yt8 n GLU 41 Cb 0.30 -2.42 -0.01 0.00 0.00 0.00 0.00 31.44 29.32 2yt8 n GLU 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2yt8 h ARG 42 N 0.00 0.48 -0.22 5.31 3.08 -1.39 -3.29 114.38 118.35 2yt8 h ARG 42 Ca 0.75 -0.42 -0.05 0.00 0.07 0.00 0.00 59.98 60.34 2yt8 h ARG 42 Cb 1.87 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 32.01 2yt8 h ARG 42 CO -0.82 1.05 -0.07 0.78 -1.07 0.00 0.00 179.97 179.85 2yt8 h GLY 43 N 1.14 0.47 0.00 0.04 0.00 0.50 -3.48 103.07 101.74 2yt8 h GLY 43 Ca -0.05 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2yt8 h GLY 43 CO 0.14 0.36 0.00 0.61 0.00 0.00 0.00 176.54 177.65 2yt8 n GLY 44 N -0.11 0.82 3.73 4.60 0.00 0.79 -3.73 105.19 111.29 2yt8 n GLY 44 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 2yt8 n GLY 44 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yt8 s ILE 45 N -0.82 4.53 -0.16 -0.61 -1.09 -1.13 -4.74 121.20 117.18 2yt8 s ILE 45 Ca 0.00 2.03 -0.00 0.00 -2.23 0.00 0.00 60.65 60.45 2yt8 s ILE 45 Cb 0.00 -4.31 0.04 0.00 -1.58 0.00 0.00 42.46 36.61 2yt8 s ILE 45 CO 0.00 0.32 -0.06 -0.13 -1.23 0.00 0.00 174.94 173.84 2yt8 s ARG 46 N 0.02 1.50 0.79 2.79 1.81 -1.26 -4.65 118.95 119.95 2yt8 s ARG 46 Ca 0.46 -0.48 -0.14 0.00 -1.72 0.00 0.00 55.73 53.85 2yt8 s ARG 46 Cb -0.23 -1.95 0.05 0.00 -0.45 0.00 0.00 34.95 32.37 2yt8 s ARG 46 CO 0.29 -0.40 0.99 1.33 -0.68 0.00 0.00 175.30 176.84 2yt8 n VAL 47 N 4.88 1.99 0.00 3.52 0.24 -1.26 -3.13 118.33 124.57 2yt8 n VAL 47 Ca -0.12 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 2yt8 n VAL 47 Cb 0.48 -1.07 0.00 0.00 -1.47 0.00 0.00 33.84 31.78 2yt8 n VAL 47 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2yt8 n GLY 48 N 0.89 2.84 3.76 7.63 0.00 -0.49 -4.98 105.19 114.84 2yt8 n GLY 48 Ca 0.12 -0.44 -0.40 0.00 0.00 0.00 0.00 46.02 45.31 2yt8 n GLY 48 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2yt8 s HIS 49 N -1.52 3.79 0.16 1.61 3.76 -1.18 -4.71 115.29 117.18 2yt8 s HIS 49 Ca 0.00 1.82 -0.14 0.00 -0.15 0.00 0.00 55.06 56.59 2yt8 s HIS 49 Cb 0.00 -3.09 -0.07 0.00 1.11 0.00 0.00 32.58 30.53 2yt8 s HIS 49 CO 0.00 0.02 0.55 0.50 -0.85 0.00 0.00 174.74 174.96 2yt8 s ARG 50 N -1.40 3.95 -0.25 1.40 3.52 0.64 -3.17 118.95 123.65 2yt8 s ARG 50 Ca 0.44 0.45 -0.23 0.00 -0.13 0.00 0.00 55.73 56.26 2yt8 s ARG 50 Cb -0.27 -2.89 -0.01 0.00 -1.56 0.00 0.00 34.95 30.21 2yt8 s ARG 50 CO 0.35 0.46 0.75 0.42 -0.81 0.00 0.00 175.30 176.47 2yt8 s ILE 51 N -1.51 4.89 -0.07 4.11 -1.09 -0.15 -0.99 121.20 126.39 2yt8 s ILE 51 Ca 0.39 1.40 0.13 0.00 -2.23 0.00 0.00 60.65 60.34 2yt8 s ILE 51 Cb -0.14 -4.05 -0.19 0.00 -1.58 0.00 0.00 42.46 36.50 2yt8 s ILE 51 CO 0.19 -0.03 0.18 2.30 -1.23 0.00 0.00 174.94 176.35 2yt8 n ILE 52 N 5.22 0.41 -3.81 2.92 -5.35 -1.17 -4.43 119.36 113.17 2yt8 n ILE 52 Ca 0.03 -0.42 -0.12 0.00 -0.27 0.00 0.00 62.75 61.97 2yt8 n ILE 52 Cb 0.48 -0.21 -0.09 0.00 -1.74 0.00 0.00 39.64 38.07 2yt8 n ILE 52 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2yt8 s GLU 53 N -2.65 0.55 -0.10 6.28 2.12 -1.23 -0.09 118.70 123.58 2yt8 s GLU 53 Ca -0.06 -0.20 -0.08 0.00 0.36 0.00 0.00 54.97 54.99 2yt8 s GLU 53 Cb 0.06 0.24 0.03 0.00 0.26 0.00 0.00 34.13 34.73 2yt8 s GLU 53 CO 0.55 -0.14 0.26 0.96 -0.54 0.00 0.00 175.26 176.34 2yt8 s ILE 54 N -1.17 -0.01 -1.80 -3.70 -5.25 0.01 -1.28 121.20 108.01 2yt8 s ILE 54 Ca -0.12 0.05 -0.20 0.00 -0.99 0.00 0.00 60.65 59.38 2yt8 s ILE 54 Cb -0.06 -0.37 0.19 0.00 2.95 0.00 0.00 42.46 45.17 2yt8 s ILE 54 CO 0.03 0.02 0.62 0.59 -1.79 0.00 0.00 174.94 174.41 2yt8 n ASN 55 N 3.39 -2.12 -2.24 4.36 3.02 0.62 0.35 115.26 122.64 2yt8 n ASN 55 Ca -0.17 -1.17 -0.12 0.00 -0.03 0.00 0.00 54.58 53.09 2yt8 n ASN 55 Cb 0.57 -2.02 0.05 0.00 -0.61 0.00 0.00 39.78 37.76 2yt8 n ASN 55 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2yt8 n GLY 56 N -1.29 0.09 2.76 7.41 0.00 -1.26 -4.98 105.19 107.92 2yt8 n GLY 56 Ca 0.07 -0.16 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 2yt8 n GLY 56 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yt8 s GLN 57 N -5.43 -0.03 -0.36 1.61 -1.52 0.15 -5.11 119.66 108.98 2yt8 s GLN 57 Ca 0.23 0.35 -0.29 0.00 -1.95 0.00 0.00 55.36 53.70 2yt8 s GLN 57 Cb -0.10 -0.35 -0.01 0.00 -0.22 0.00 0.00 33.01 32.33 2yt8 s GLN 57 CO 0.40 -0.25 1.63 -1.54 -0.25 0.00 0.00 175.29 175.27 2yt8 s SER 58 N 1.72 6.11 -0.22 5.90 1.04 -1.26 -0.81 113.70 126.18 2yt8 s SER 58 Ca -0.02 1.13 0.15 0.00 0.48 0.00 0.00 55.95 57.69 2yt8 s SER 58 Cb -0.12 -2.53 0.46 0.00 0.10 0.00 0.00 66.02 63.92 2yt8 s SER 58 CO -0.04 -1.56 1.18 1.33 0.98 0.00 0.00 173.24 175.13 2yt8 n VAL 59 N 7.22 1.77 0.27 5.02 0.24 0.87 -4.77 118.33 128.95 2yt8 n VAL 59 Ca 0.20 -3.20 0.15 0.00 -2.04 0.00 0.00 64.34 59.46 2yt8 n VAL 59 Cb 0.47 -0.02 0.72 0.00 -1.47 0.00 0.00 33.84 33.54 2yt8 n VAL 59 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 2yt8 h VAL 60 N 3.44 0.26 0.00 3.34 3.04 -1.49 -3.31 116.25 121.53 2yt8 h VAL 60 Ca 0.07 -0.58 -0.06 0.00 -1.01 0.00 0.00 66.70 65.11 2yt8 h VAL 60 Cb 1.40 1.46 -0.01 0.00 -2.01 0.00 0.00 31.29 32.13 2yt8 h VAL 60 CO 0.34 0.08 -1.23 0.00 -1.01 0.00 0.00 177.57 175.75 2yt8 n ALA 61 N -2.17 1.98 -1.01 3.17 0.00 -1.26 -4.96 120.51 116.26 2yt8 n ALA 61 Ca -0.01 -0.17 -0.36 0.00 0.00 0.00 0.00 53.44 52.90 2yt8 n ALA 61 Cb 0.28 0.41 -0.03 0.00 0.00 0.00 0.00 19.45 20.11 2yt8 n ALA 61 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2yt8 n THR 62 N -2.67 1.05 -2.25 0.00 -1.04 -1.25 -4.83 114.28 103.30 2yt8 n THR 62 Ca -0.07 -0.26 -0.40 0.00 -2.04 0.00 0.00 64.05 61.27 2yt8 n THR 62 Cb 0.57 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.06 2yt8 n THR 62 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2yt8 s PRO 63 N -0.53 4.41 0.21 -2.82 0.04 -1.26 -4.76 135.00 130.30 2yt8 s PRO 63 Ca 0.50 2.04 -0.19 0.00 0.04 0.00 0.00 61.00 63.39 2yt8 s PRO 63 Cb -0.72 -3.06 0.19 0.00 0.04 0.00 0.00 34.50 30.95 2yt8 s PRO 63 CO 0.40 -0.07 1.51 1.58 0.04 0.00 0.00 177.00 180.45 2yt8 n HIS 64 N 0.84 -0.04 -0.34 0.56 -0.00 -1.26 -0.26 115.22 114.71 2yt8 n HIS 64 Ca 0.00 1.20 -0.01 0.00 -0.00 0.00 0.00 57.72 58.92 2yt8 n HIS 64 Cb 0.43 -0.82 0.04 0.00 -0.00 0.00 0.00 29.99 29.64 2yt8 n HIS 64 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2yt8 n ALA 65 N -3.46 -0.09 -0.04 1.57 0.00 -1.26 -0.29 120.51 116.94 2yt8 n ALA 65 Ca 0.09 0.90 -0.13 0.00 0.00 0.00 0.00 53.44 54.30 2yt8 n ALA 65 Cb 0.37 -0.41 -0.08 0.00 0.00 0.00 0.00 19.45 19.33 2yt8 n ALA 65 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2yt8 h ARG 66 N 0.00 0.24 -0.96 0.00 9.65 -1.00 -3.14 114.38 119.17 2yt8 h ARG 66 Ca 0.32 -0.12 0.28 0.00 -1.10 0.00 0.00 59.98 59.36 2yt8 h ARG 66 Cb 0.54 0.00 -0.14 0.00 -1.39 0.00 0.00 29.97 28.99 2yt8 h ARG 66 CO -0.89 0.64 0.48 0.82 2.80 0.00 0.00 179.97 183.82 2yt8 h ILE 67 N -0.16 0.36 0.10 1.20 2.04 0.10 0.57 117.51 121.74 2yt8 h ILE 67 Ca 0.02 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 2yt8 h ILE 67 Cb 0.59 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2yt8 h ILE 67 CO 0.02 0.06 -0.05 0.40 0.00 0.00 0.00 178.15 178.59 2yt8 h ILE 68 N 0.35 0.98 -0.83 -0.67 1.08 -0.84 -2.16 117.51 115.42 2yt8 h ILE 68 Ca 0.66 -0.30 0.19 0.00 -0.39 0.00 0.00 64.86 65.03 2yt8 h ILE 68 Cb 1.40 1.17 -0.05 0.00 -3.07 0.00 0.00 36.82 36.26 2yt8 h ILE 68 CO -0.59 0.07 0.56 -0.33 -0.69 0.00 0.00 178.15 177.18 2yt8 h GLU 69 N -0.27 0.31 0.49 2.37 4.39 -0.88 -0.09 114.58 120.90 2yt8 h GLU 69 Ca -0.01 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.64 2yt8 h GLU 69 Cb 0.23 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2yt8 h GLU 69 CO 0.02 0.21 -0.24 -0.07 -1.16 0.00 0.00 179.01 177.77 2yt8 h LEU 70 N 0.32 -0.56 -0.60 1.33 3.38 -0.99 -2.53 115.31 115.67 2yt8 h LEU 70 Ca 0.42 0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.53 2yt8 h LEU 70 Cb 1.14 0.14 -0.09 0.00 0.09 0.00 0.00 40.66 41.95 2yt8 h LEU 70 CO -0.12 -0.18 0.09 -0.07 0.09 0.00 0.00 178.44 178.24 2yt8 h LEU 71 N -1.09 -0.08 -0.91 1.67 3.38 -0.94 -0.22 115.31 117.11 2yt8 h LEU 71 Ca -0.07 0.12 0.09 0.00 0.09 0.00 0.00 57.88 58.12 2yt8 h LEU 71 Cb 0.51 0.19 -0.07 0.00 0.09 0.00 0.00 40.66 41.37 2yt8 h LEU 71 CO 0.11 -0.03 0.56 0.74 0.09 0.00 0.00 178.44 179.91 2yt8 h THR 72 N 0.21 0.96 0.00 0.22 2.02 -1.10 0.82 112.91 116.04 2yt8 h THR 72 Ca 0.32 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 2yt8 h THR 72 Cb 0.49 -0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 66.84 2yt8 h THR 72 CO -0.44 0.17 -0.05 -0.33 0.37 0.00 0.00 175.52 175.24 2yt8 h GLU 73 N 0.94 0.00 -6.62 6.66 5.08 -0.58 -3.42 114.58 116.63 2yt8 h GLU 73 Ca 0.43 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 58.27 2yt8 h GLU 73 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2yt8 h GLU 73 CO -0.23 0.05 0.47 0.00 -1.00 0.00 0.00 179.01 178.30 2yt8 s ALA 74 N -4.38 3.35 0.40 3.43 0.00 0.28 -5.05 121.76 119.79 2yt8 s ALA 74 Ca -0.04 0.78 0.08 0.00 0.00 0.00 0.00 51.96 52.78 2yt8 s ALA 74 Cb 0.14 -3.35 -0.08 0.00 0.00 0.00 0.00 23.12 19.83 2yt8 s ALA 74 CO 0.55 -0.21 -0.01 0.71 0.00 0.00 0.00 175.76 176.80 2yt8 s TYR 75 N -0.03 2.49 0.00 0.00 2.02 -1.26 -4.94 117.35 115.63 2yt8 s TYR 75 Ca 0.50 -0.63 0.00 0.00 -0.37 0.00 0.00 57.07 56.57 2yt8 s TYR 75 Cb -0.28 -1.70 0.00 0.00 -0.40 0.00 0.00 41.96 39.58 2yt8 s TYR 75 CO 0.33 0.48 0.00 0.41 -1.57 0.00 0.00 175.55 175.20 2yt8 n GLY 76 N -0.93 1.52 3.58 0.71 0.00 0.54 -4.08 105.19 106.52 2yt8 n GLY 76 Ca -0.05 0.63 -0.42 0.00 0.00 0.00 0.00 46.02 46.18 2yt8 n GLY 76 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yt8 s GLU 77 N 0.00 3.28 -0.41 1.61 2.12 -1.26 -0.29 118.70 123.75 2yt8 s GLU 77 Ca 0.00 0.86 -0.05 0.00 0.36 0.00 0.00 54.97 56.14 2yt8 s GLU 77 Cb 0.00 -4.16 0.10 0.00 0.26 0.00 0.00 34.13 30.33 2yt8 s GLU 77 CO 0.00 -1.94 0.21 0.08 -0.54 0.00 0.00 175.26 173.07 2yt8 s VAL 78 N 6.58 3.59 0.32 3.70 1.01 -0.45 -4.96 120.40 130.18 2yt8 s VAL 78 Ca 0.64 -1.79 -0.27 0.00 0.00 0.00 0.00 61.98 60.56 2yt8 s VAL 78 Cb -0.15 -3.34 -0.09 0.00 0.00 0.00 0.00 36.38 32.80 2yt8 s VAL 78 CO 0.29 -0.59 1.03 -1.00 0.00 0.00 0.00 175.10 174.82 2yt8 s HIS 79 N 1.25 3.58 -0.19 5.22 3.76 -1.26 -1.01 115.29 126.64 2yt8 s HIS 79 Ca 0.05 1.74 -0.04 0.00 -0.15 0.00 0.00 55.06 56.66 2yt8 s HIS 79 Cb -0.23 -3.12 0.09 0.00 1.11 0.00 0.00 32.58 30.44 2yt8 s HIS 79 CO -0.02 -0.25 0.27 0.42 -0.85 0.00 0.00 174.74 174.31 2yt8 s ILE 80 N -1.39 -0.41 -0.46 0.60 1.01 0.12 -0.27 121.20 120.39 2yt8 s ILE 80 Ca 0.49 0.00 -0.22 0.00 0.00 0.00 0.00 60.65 60.92 2yt8 s ILE 80 Cb -0.26 -0.64 0.03 0.00 0.01 0.00 0.00 42.46 41.60 2yt8 s ILE 80 CO 0.32 -0.10 0.75 -0.75 0.00 0.00 0.00 174.94 175.16 2yt8 s LYS 81 N 2.40 3.34 0.03 2.79 2.20 -0.40 -1.62 119.74 128.48 2yt8 s LYS 81 Ca 0.07 -0.25 -0.10 0.00 -0.36 0.00 0.00 55.97 55.33 2yt8 s LYS 81 Cb -0.15 -3.96 -0.05 0.00 -1.51 0.00 0.00 37.83 32.16 2yt8 s LYS 81 CO -0.12 -1.13 0.36 0.95 -0.36 0.00 0.00 175.35 175.05 2yt8 s THR 82 N 3.18 5.15 -0.16 3.43 -4.23 -0.52 -3.03 115.64 119.46 2yt8 s THR 82 Ca 0.27 0.47 -0.13 0.00 -1.18 0.00 0.00 61.69 61.12 2yt8 s THR 82 Cb -0.13 -3.63 0.05 0.00 1.34 0.00 0.00 72.50 70.13 2yt8 s THR 82 CO 0.21 0.40 0.41 -0.32 -0.54 0.00 0.00 174.62 174.78 2yt8 s MET 83 N -1.61 0.45 -0.02 3.99 0.00 -0.16 -2.87 119.30 119.08 2yt8 s MET 83 Ca 0.28 0.63 -0.30 0.00 0.00 0.00 0.00 55.69 56.31 2yt8 s MET 83 Cb -0.14 0.16 -0.05 0.00 0.00 0.00 0.00 34.83 34.79 2yt8 s MET 83 CO 0.15 -0.09 1.47 -1.25 0.00 0.00 0.00 175.02 175.30 2yt8 s PRO 84 N 0.56 4.25 0.27 4.11 0.04 -1.26 -0.26 135.00 142.70 2yt8 s PRO 84 Ca -0.03 2.02 -0.00 0.00 0.04 0.00 0.00 61.00 63.02 2yt8 s PRO 84 Cb -0.04 -3.69 0.60 0.00 0.04 0.00 0.00 34.50 31.41 2yt8 s PRO 84 CO -0.03 -0.66 1.70 0.00 0.04 0.00 0.00 177.00 178.04 2yt8 h ALA 85 N 8.29 1.21 -0.07 8.56 0.00 -1.89 -2.43 119.26 132.94 2yt8 h ALA 85 Ca -0.37 0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.71 2yt8 h ALA 85 Cb 1.17 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 2yt8 h ALA 85 CO 0.92 -0.32 -0.21 0.00 0.00 0.00 0.00 179.25 179.65 2yt8 h ALA 86 N 1.66 -0.59 -0.27 0.00 0.00 -1.97 -0.50 119.26 117.59 2yt8 h ALA 86 Ca 0.49 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.41 2yt8 h ALA 86 Cb 0.88 0.76 -0.05 0.00 0.00 0.00 0.00 17.79 19.37 2yt8 h ALA 86 CO -0.51 -0.67 -0.38 1.15 0.00 0.00 0.00 179.25 178.85 2yt8 h THR 87 N -0.21 0.00 -0.75 0.00 2.02 -1.85 -0.59 112.91 111.53 2yt8 h THR 87 Ca 0.01 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.26 2yt8 h THR 87 Cb 0.25 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.57 2yt8 h THR 87 CO -0.17 0.00 -0.49 0.22 0.37 0.00 0.00 175.52 175.44 2yt8 h TYR 88 N -0.27 -1.57 -0.92 3.16 5.03 -1.31 0.54 116.97 121.63 2yt8 h TYR 88 Ca 0.05 0.10 0.22 0.00 2.58 0.00 0.00 58.73 61.68 2yt8 h TYR 88 Cb 0.40 0.78 -0.12 0.00 1.55 0.00 0.00 36.73 39.35 2yt8 h TYR 88 CO -0.68 -0.33 0.45 0.00 -1.32 0.00 0.00 178.16 176.28 2yt8 h ARG 89 N -0.07 0.46 0.00 1.82 3.08 -0.55 0.91 114.38 120.04 2yt8 h ARG 89 Ca 0.12 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 2yt8 h ARG 89 Cb 0.38 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.32 2yt8 h ARG 89 CO -0.74 0.31 -0.08 -0.07 -1.07 0.00 0.00 179.97 178.32 2yt8 h LEU 90 N 0.48 0.00 0.08 3.04 3.38 0.14 -2.27 115.31 120.16 2yt8 h LEU 90 Ca 0.57 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.54 2yt8 h LEU 90 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2yt8 h LEU 90 CO -0.49 0.08 -0.04 -0.07 0.09 0.00 0.00 178.44 178.01 2yt8 h LEU 91 N 0.00 -0.09 0.00 1.67 3.38 0.50 -3.29 115.31 117.48 2yt8 h LEU 91 Ca -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2yt8 h LEU 91 Cb 0.65 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.43 2yt8 h LEU 91 CO 0.01 0.45 0.00 1.07 0.09 0.00 0.00 178.44 180.06 2yt8 n THR 92 N -4.84 0.00 0.04 0.22 5.66 -0.28 -3.49 114.28 111.59 2yt8 n THR 92 Ca -0.03 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 60.94 2yt8 n THR 92 Cb 0.10 -0.68 -0.02 0.00 -1.55 0.00 0.00 70.33 68.18 2yt8 n THR 92 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 2yt8 h GLY 93 N 2.86 -0.22 -0.22 1.09 0.00 -1.47 -3.51 103.07 101.61 2yt8 h GLY 93 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2yt8 h GLY 93 CO 0.00 -0.08 0.00 0.61 0.00 0.00 0.00 176.54 177.07