#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yt8 s SER 2 N 0.00 0.58 0.27 1.61 1.04 -1.26 -5.16 113.70 110.78 2yt8 s SER 2 Ca 0.00 -0.14 -0.07 0.00 0.48 0.00 0.00 55.95 56.22 2yt8 s SER 2 Cb 0.00 -0.05 -0.01 0.00 0.10 0.00 0.00 66.02 66.06 2yt8 s SER 2 CO 0.00 0.02 0.41 -0.44 0.98 0.00 0.00 173.24 174.22 2yt8 s SER 3 N -0.28 0.25 0.04 7.02 0.01 -1.26 -5.18 113.70 114.30 2yt8 s SER 3 Ca 0.00 -1.18 -0.10 0.00 1.31 0.00 0.00 55.95 55.98 2yt8 s SER 3 Cb -0.03 0.57 0.01 0.00 0.21 0.00 0.00 66.02 66.78 2yt8 s SER 3 CO -0.00 -1.13 0.22 -0.83 0.41 0.00 0.00 173.24 171.90 2yt8 s GLY 4 N -3.11 0.00 0.25 3.44 0.00 -1.26 -5.18 107.32 101.47 2yt8 s GLY 4 Ca 0.28 -0.23 0.02 0.00 0.00 0.00 0.00 44.72 44.79 2yt8 s GLY 4 CO 0.13 -0.42 0.07 -0.56 0.00 0.00 0.00 173.10 172.32 2yt8 s SER 5 N -2.11 1.45 -0.11 1.64 0.01 -1.26 -5.16 113.70 108.17 2yt8 s SER 5 Ca -0.05 -1.34 0.02 0.00 1.31 0.00 0.00 55.95 55.90 2yt8 s SER 5 Cb -0.01 0.10 -0.01 0.00 0.21 0.00 0.00 66.02 66.31 2yt8 s SER 5 CO -0.04 -0.66 -0.18 -0.55 0.41 0.00 0.00 173.24 172.21 2yt8 s SER 6 N -3.32 3.58 0.00 2.44 0.15 -1.26 -4.92 113.70 110.37 2yt8 s SER 6 Ca 0.35 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.58 2yt8 s SER 6 Cb 0.07 -1.40 0.00 0.00 -1.71 0.00 0.00 66.02 62.99 2yt8 s SER 6 CO 0.12 0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.36 2yt8 n GLY 7 N 3.36 -1.69 3.72 9.45 0.00 -1.26 -5.12 105.19 113.65 2yt8 n GLY 7 Ca -0.18 0.60 -0.41 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 4.90 -0.28 1.61 1.01 -1.26 -5.00 120.40 121.38 2yt8 s VAL 8 Ca 0.00 1.78 -0.18 0.00 0.00 0.00 0.00 61.98 63.58 2yt8 s VAL 8 Cb 0.00 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 32.17 2yt8 s VAL 8 CO 0.00 0.23 0.51 -0.89 0.00 0.00 0.00 175.10 174.95 2yt8 s THR 9 N 0.74 5.06 0.01 3.92 2.01 -1.13 -5.03 115.64 121.21 2yt8 s THR 9 Ca 0.45 0.79 -0.01 0.00 0.31 0.00 0.00 61.69 63.23 2yt8 s THR 9 Cb -0.20 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 2yt8 s THR 9 CO 0.24 0.04 0.13 -0.89 -0.69 0.00 0.00 174.62 173.44 2yt8 s THR 10 N 2.32 5.01 0.00 -0.82 2.01 -1.26 -1.36 115.64 121.55 2yt8 s THR 10 Ca 0.21 -0.36 -0.03 0.00 0.31 0.00 0.00 61.69 61.82 2yt8 s THR 10 Cb -0.16 -3.33 -0.01 0.00 0.01 0.00 0.00 72.50 69.01 2yt8 s THR 10 CO 0.10 0.30 0.05 0.00 -0.69 0.00 0.00 174.62 174.38 2yt8 s ALA 11 N -1.29 -0.10 -0.04 7.40 0.00 -0.47 -4.96 121.76 122.30 2yt8 s ALA 11 Ca 0.26 -0.26 0.05 0.00 0.00 0.00 0.00 51.96 52.01 2yt8 s ALA 11 Cb -0.12 0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 2yt8 s ALA 11 CO 0.18 -0.15 -0.20 0.42 0.00 0.00 0.00 175.76 176.01 2yt8 s ILE 12 N -1.12 1.64 0.08 0.00 -1.09 -1.25 -0.49 121.20 118.97 2yt8 s ILE 12 Ca -0.12 -0.84 0.08 0.00 -2.23 0.00 0.00 60.65 57.54 2yt8 s ILE 12 Cb -0.07 -1.39 -0.04 0.00 -1.58 0.00 0.00 42.46 39.38 2yt8 s ILE 12 CO 0.00 0.47 -0.20 -0.63 -1.23 0.00 0.00 174.94 173.35 2yt8 s ILE 13 N -0.12 2.71 -0.48 2.92 -1.09 -0.28 -4.15 121.20 120.72 2yt8 s ILE 13 Ca -0.02 -1.39 -0.12 0.00 -2.23 0.00 0.00 60.65 56.90 2yt8 s ILE 13 Cb -0.11 -2.19 0.11 0.00 -1.58 0.00 0.00 42.46 38.69 2yt8 s ILE 13 CO 0.02 0.22 0.37 -1.00 -1.23 0.00 0.00 174.94 173.32 2yt8 s HIS 14 N -1.02 3.34 -0.73 3.97 3.76 -1.26 -1.33 115.29 122.02 2yt8 s HIS 14 Ca 0.16 -1.52 0.03 0.00 -0.15 0.00 0.00 55.06 53.58 2yt8 s HIS 14 Cb -0.10 -3.41 0.18 0.00 1.11 0.00 0.00 32.58 30.35 2yt8 s HIS 14 CO 0.07 -0.94 0.53 1.03 -0.85 0.00 0.00 174.74 174.58 2yt8 s ARG 15 N 1.48 2.61 0.52 1.40 0.52 -0.46 -4.90 118.95 120.11 2yt8 s ARG 15 Ca 0.04 -3.22 0.31 0.00 -0.52 0.00 0.00 55.73 52.34 2yt8 s ARG 15 Cb -0.26 -3.55 1.28 0.00 0.52 0.00 0.00 34.95 32.93 2yt8 s ARG 15 CO 0.02 -1.26 1.96 -1.00 0.02 0.00 0.00 175.30 175.04 2yt8 h PRO 16 N 5.73 0.00 -6.50 3.54 0.13 -1.94 0.64 132.00 133.60 2yt8 h PRO 16 Ca 0.12 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.60 2yt8 h PRO 16 Cb 0.79 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.66 2yt8 h PRO 16 CO 0.75 0.08 -0.86 -1.58 -0.23 0.00 0.00 178.00 176.15 2yt8 s HIS 17 N -3.73 2.12 -0.06 1.56 2.46 -1.26 -4.77 115.29 111.62 2yt8 s HIS 17 Ca 0.00 -0.40 -0.02 0.00 0.47 0.00 0.00 55.06 55.12 2yt8 s HIS 17 Cb 0.10 -1.26 -0.26 0.00 -0.13 0.00 0.00 32.58 31.03 2yt8 s HIS 17 CO 0.57 0.13 0.61 0.00 -2.47 0.00 0.00 174.74 173.58 2yt8 h ALA 18 N 4.74 0.44 -0.19 1.58 0.00 -1.92 -3.33 119.26 120.57 2yt8 h ALA 18 Ca -0.45 -1.30 -0.09 0.00 0.00 0.00 0.00 54.91 53.06 2yt8 h ALA 18 Cb 1.15 0.51 -0.06 0.00 0.00 0.00 0.00 17.79 19.39 2yt8 h ALA 18 CO 0.43 1.30 0.12 0.54 0.00 0.00 0.00 179.25 181.64 2yt8 n ARG 19 N -3.39 1.29 -5.20 0.00 1.74 -1.26 -4.80 116.66 105.05 2yt8 n ARG 19 Ca -0.23 -0.60 -0.32 0.00 -0.77 0.00 0.00 57.85 55.93 2yt8 n ARG 19 Cb 1.05 -1.27 -0.17 0.00 -1.02 0.00 0.00 32.46 31.06 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 -0.71 2.91 1.03 5.56 0.41 -1.25 -5.12 118.70 121.52 2yt8 s GLU 20 Ca 0.11 -0.87 -0.22 0.00 -0.41 0.00 0.00 54.97 53.58 2yt8 s GLU 20 Cb 0.09 -2.28 -0.04 0.00 -1.78 0.00 0.00 34.13 30.12 2yt8 s GLU 20 CO 0.02 0.25 -0.73 1.04 -0.49 0.00 0.00 175.26 175.36 2yt8 n GLN 21 N 3.32 -0.83 -0.11 1.61 6.02 -1.26 -4.97 117.38 121.15 2yt8 n GLN 21 Ca -0.18 -0.24 -0.22 0.00 -0.01 0.00 0.00 57.00 56.35 2yt8 n GLN 21 Cb 0.53 -1.31 -0.09 0.00 1.02 0.00 0.00 30.24 30.39 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 1.05 1.97 0.00 1.08 4.77 -1.26 -5.05 117.00 119.57 2yt8 n LEU 22 Ca -0.00 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 2yt8 n LEU 22 Cb 0.64 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2yt8 n LEU 22 CO 0.43 0.58 0.00 0.61 -1.33 0.00 0.00 177.39 177.68 2yt8 n GLY 23 N 1.81 3.16 3.87 -0.72 0.00 -1.26 -4.22 105.19 107.83 2yt8 n GLY 23 Ca -0.43 -1.00 -0.36 0.00 0.00 0.00 0.00 46.02 44.22 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 -0.20 3.62 -0.23 1.61 -0.71 -1.26 0.21 117.98 121.02 2yt8 s PHE 24 Ca 0.00 0.65 -0.09 0.00 -1.04 0.00 0.00 56.93 56.45 2yt8 s PHE 24 Cb 0.00 -2.03 -0.04 0.00 -1.21 0.00 0.00 43.02 39.73 2yt8 s PHE 24 CO 0.00 0.67 0.11 0.00 -1.34 0.00 0.00 175.22 174.66 2yt8 s VAL 26 N 1.12 3.85 -0.22 0.00 1.01 -1.26 -1.12 120.40 123.79 2yt8 s VAL 26 Ca 0.06 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.69 2yt8 s VAL 26 Cb -0.14 -2.70 0.04 0.00 0.00 0.00 0.00 36.38 33.58 2yt8 s VAL 26 CO 0.04 0.47 -0.15 -1.61 0.00 0.00 0.00 175.10 173.85 2yt8 s GLU 27 N 0.59 2.59 -1.93 2.72 2.02 0.17 -4.66 118.70 120.21 2yt8 s GLU 27 Ca -0.02 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 53.88 2yt8 s GLU 27 Cb -0.14 -2.72 0.00 0.00 0.10 0.00 0.00 34.13 31.37 2yt8 s GLU 27 CO 0.02 -0.39 0.00 -0.25 0.02 0.00 0.00 175.26 174.66 2yt8 n ASP 28 N 4.53 -5.66 0.00 -0.19 9.92 -1.26 -1.32 116.55 122.57 2yt8 n ASP 28 Ca -0.17 0.21 0.00 0.00 -0.53 0.00 0.00 54.79 54.29 2yt8 n ASP 28 Cb 0.46 -4.79 0.00 0.00 -0.64 0.00 0.00 41.12 36.15 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 -0.78 0.67 2.66 0.44 0.00 -1.26 -4.85 105.19 102.07 2yt8 n GLY 29 Ca -0.23 -0.65 -0.23 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.05 0.44 -0.61 1.01 -0.44 -0.04 121.20 119.51 2yt8 s ILE 30 Ca 0.00 0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.54 2yt8 s ILE 30 Cb 0.00 -0.37 -0.08 0.00 0.01 0.00 0.00 42.46 42.02 2yt8 s ILE 30 CO 0.00 -0.00 1.42 -0.63 0.00 0.00 0.00 174.94 175.73 2yt8 s ILE 31 N 2.13 2.11 0.00 2.92 1.01 -1.06 -0.66 121.20 127.65 2yt8 s ILE 31 Ca 0.04 0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.78 2yt8 s ILE 31 Cb -0.14 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.28 2yt8 s ILE 31 CO -0.06 0.01 0.00 0.00 0.00 0.00 0.00 174.94 174.90 2yt8 s SER 33 N -4.83 3.05 -0.02 0.00 0.15 -1.25 -4.55 113.70 106.26 2yt8 s SER 33 Ca 0.00 -0.89 0.02 0.00 0.70 0.00 0.00 55.95 55.78 2yt8 s SER 33 Cb 0.00 -0.21 0.01 0.00 -1.71 0.00 0.00 66.02 64.11 2yt8 s SER 33 CO 0.00 0.02 -0.06 -0.22 1.20 0.00 0.00 173.24 174.19 2yt8 s LEU 34 N -2.79 1.75 -0.15 3.45 0.20 -1.26 -0.79 118.68 119.08 2yt8 s LEU 34 Ca 0.19 -0.12 -0.29 0.00 0.69 0.00 0.00 54.13 54.60 2yt8 s LEU 34 Cb -0.06 -0.38 -0.04 0.00 -0.43 0.00 0.00 46.19 45.27 2yt8 s LEU 34 CO 0.09 0.03 1.69 -0.22 -0.29 0.00 0.00 176.35 177.65 2yt8 s LEU 35 N 0.25 4.03 -0.47 -0.68 2.96 0.13 -4.93 118.68 119.97 2yt8 s LEU 35 Ca -0.03 1.89 -0.28 0.00 -0.22 0.00 0.00 54.13 55.49 2yt8 s LEU 35 Cb -0.07 -3.53 -0.00 0.00 0.50 0.00 0.00 46.19 43.08 2yt8 s LEU 35 CO -0.00 -1.19 1.62 -0.60 -1.32 0.00 0.00 176.35 174.86 2yt8 s ARG 36 N 4.58 3.23 0.00 1.98 3.52 -1.26 -3.16 118.95 127.85 2yt8 s ARG 36 Ca 0.75 0.88 0.00 0.00 -0.13 0.00 0.00 55.73 57.23 2yt8 s ARG 36 Cb -0.29 -4.18 0.00 0.00 -1.56 0.00 0.00 34.95 28.92 2yt8 s ARG 36 CO 0.30 -2.00 0.00 0.41 -0.81 0.00 0.00 175.30 173.20 2yt8 n GLY 37 N 5.36 0.84 0.00 8.12 0.00 -1.26 -5.11 105.19 113.14 2yt8 n GLY 37 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.07 5.25 0.11 -0.02 0.00 -1.19 -5.08 105.19 104.18 2yt8 n GLY 38 Ca 0.00 -1.51 -0.21 0.00 0.00 0.00 0.00 46.02 44.30 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 0.96 -0.20 -0.61 2.04 -1.87 -3.36 117.51 114.47 2yt8 h ILE 39 Ca 0.00 -2.22 0.03 0.00 1.00 0.00 0.00 64.86 63.67 2yt8 h ILE 39 Cb 0.00 2.36 -0.05 0.00 -0.74 0.00 0.00 36.82 38.39 2yt8 h ILE 39 CO 0.00 0.41 -0.37 0.00 0.00 0.00 0.00 178.15 178.19 2yt8 h ALA 40 N -0.37 -0.67 -0.92 1.87 0.00 -1.90 0.39 119.26 117.64 2yt8 h ALA 40 Ca -0.33 -0.02 0.18 0.00 0.00 0.00 0.00 54.91 54.75 2yt8 h ALA 40 Cb 1.38 0.94 -0.17 0.00 0.00 0.00 0.00 17.79 19.94 2yt8 h ALA 40 CO -0.15 -0.83 -0.24 1.49 0.00 0.00 0.00 179.25 179.51 2yt8 h GLU 41 N -0.32 -0.00 -0.32 0.00 4.81 -1.81 1.00 114.58 117.94 2yt8 h GLU 41 Ca 0.04 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 2yt8 h GLU 41 Cb 0.42 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 2yt8 h GLU 41 CO -0.35 -0.00 -0.13 0.00 -0.73 0.00 0.00 179.01 177.80 2yt8 h ARG 42 N -0.00 0.56 -0.23 1.92 3.08 -1.41 -3.08 114.38 115.22 2yt8 h ARG 42 Ca 0.43 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 60.29 2yt8 h ARG 42 Cb 0.67 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 2yt8 h ARG 42 CO -0.95 0.67 0.02 0.78 -1.07 0.00 0.00 179.97 179.42 2yt8 h GLY 43 N 0.95 0.42 0.00 0.04 0.00 0.52 -3.47 103.07 101.51 2yt8 h GLY 43 Ca 0.09 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2yt8 h GLY 43 CO 0.03 0.27 0.00 0.61 0.00 0.00 0.00 176.54 177.45 2yt8 n GLY 44 N -0.39 1.05 3.77 4.60 0.00 0.39 -3.93 105.19 110.69 2yt8 n GLY 44 Ca -0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.05 4.23 -0.12 -0.61 -1.09 -1.14 -4.78 121.20 116.65 2yt8 s ILE 45 Ca 0.00 1.83 -0.02 0.00 -2.23 0.00 0.00 60.65 60.24 2yt8 s ILE 45 Cb 0.00 -4.11 0.04 0.00 -1.58 0.00 0.00 42.46 36.81 2yt8 s ILE 45 CO 0.00 0.31 -0.00 -0.13 -1.23 0.00 0.00 174.94 173.88 2yt8 s ARG 46 N -1.66 0.81 0.64 2.79 1.81 -1.26 -4.72 118.95 117.36 2yt8 s ARG 46 Ca 0.45 -0.12 -0.18 0.00 -1.72 0.00 0.00 55.73 54.15 2yt8 s ARG 46 Cb -0.21 -1.43 -0.01 0.00 -0.45 0.00 0.00 34.95 32.85 2yt8 s ARG 46 CO 0.26 -0.40 1.26 0.14 -0.68 0.00 0.00 175.30 175.89 2yt8 s VAL 47 N 1.88 2.24 0.00 3.52 -7.23 -1.26 -3.34 120.40 116.21 2yt8 s VAL 47 Ca 0.03 0.14 0.00 0.00 -1.81 0.00 0.00 61.98 60.34 2yt8 s VAL 47 Cb -0.14 -3.01 0.00 0.00 0.56 0.00 0.00 36.38 33.80 2yt8 s VAL 47 CO -0.07 -0.04 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 2yt8 n GLY 48 N 0.72 0.67 3.96 2.32 0.00 -0.62 -4.97 105.19 107.27 2yt8 n GLY 48 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.18 3.18 -0.10 1.61 3.76 -1.21 -4.75 115.29 115.60 2yt8 s HIS 49 Ca 0.00 0.18 0.00 0.00 -0.15 0.00 0.00 55.06 55.09 2yt8 s HIS 49 Cb 0.00 -2.34 -0.02 0.00 1.11 0.00 0.00 32.58 31.33 2yt8 s HIS 49 CO 0.00 -0.39 -0.10 0.50 -0.85 0.00 0.00 174.74 173.90 2yt8 s ARG 50 N -4.55 3.07 -0.53 1.40 3.00 0.12 -2.58 118.95 118.88 2yt8 s ARG 50 Ca 0.49 -0.63 -0.28 0.00 -1.00 0.00 0.00 55.73 54.32 2yt8 s ARG 50 Cb -0.10 -2.61 0.03 0.00 0.00 0.00 0.00 34.95 32.27 2yt8 s ARG 50 CO 0.37 0.43 1.11 0.42 0.00 0.00 0.00 175.30 177.63 2yt8 s ILE 51 N -0.19 4.17 -0.12 4.11 -1.09 0.94 -0.85 121.20 128.17 2yt8 s ILE 51 Ca 0.01 0.89 0.18 0.00 -2.23 0.00 0.00 60.65 59.50 2yt8 s ILE 51 Cb -0.13 -4.64 -0.21 0.00 -1.58 0.00 0.00 42.46 35.91 2yt8 s ILE 51 CO 0.03 -1.16 0.54 2.30 -1.23 0.00 0.00 174.94 175.42 2yt8 n ILE 52 N 6.63 1.05 -3.77 2.92 -5.35 -1.09 -4.21 119.36 115.54 2yt8 n ILE 52 Ca 0.08 -0.71 -0.11 0.00 -0.27 0.00 0.00 62.75 61.75 2yt8 n ILE 52 Cb 0.49 -0.54 -0.07 0.00 -1.74 0.00 0.00 39.64 37.78 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 -2.90 0.84 -0.12 6.28 2.12 -1.24 -1.34 118.70 122.34 2yt8 s GLU 53 Ca -0.06 -0.64 -0.10 0.00 0.36 0.00 0.00 54.97 54.54 2yt8 s GLU 53 Cb 0.09 0.36 0.04 0.00 0.26 0.00 0.00 34.13 34.87 2yt8 s GLU 53 CO 0.83 -0.27 0.32 0.96 -0.54 0.00 0.00 175.26 176.56 2yt8 s ILE 54 N -2.98 -0.01 -1.25 -3.70 -5.25 -0.02 -1.60 121.20 106.39 2yt8 s ILE 54 Ca -0.02 0.04 -0.16 0.00 -0.99 0.00 0.00 60.65 59.52 2yt8 s ILE 54 Cb 0.01 -0.46 0.16 0.00 2.95 0.00 0.00 42.46 45.12 2yt8 s ILE 54 CO -0.06 0.02 0.40 0.59 -1.79 0.00 0.00 174.94 174.09 2yt8 n ASN 55 N 3.37 -1.40 -1.61 4.36 3.02 0.69 0.90 115.26 124.60 2yt8 n ASN 55 Ca -0.17 -0.73 -0.05 0.00 -0.03 0.00 0.00 54.58 53.60 2yt8 n ASN 55 Cb 0.56 -1.24 0.02 0.00 -0.61 0.00 0.00 39.78 38.51 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 -0.85 0.28 3.13 7.41 0.00 -1.26 -4.99 105.19 108.91 2yt8 n GLY 56 Ca 0.08 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 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 -4.55 0.27 -0.15 1.61 -1.52 0.26 -5.12 119.66 110.46 2yt8 s GLN 57 Ca 0.03 0.87 -0.29 0.00 -1.95 0.00 0.00 55.36 54.01 2yt8 s GLN 57 Cb -0.01 0.08 -0.05 0.00 -0.22 0.00 0.00 33.01 32.81 2yt8 s GLN 57 CO 0.20 -0.32 1.81 0.45 -0.25 0.00 0.00 175.29 177.17 2yt8 s SER 58 N 2.54 6.24 0.00 5.90 0.15 -1.26 -0.84 113.70 126.43 2yt8 s SER 58 Ca 0.01 1.94 0.06 0.00 0.70 0.00 0.00 55.95 58.67 2yt8 s SER 58 Cb -0.13 -2.53 0.05 0.00 -1.71 0.00 0.00 66.02 61.70 2yt8 s SER 58 CO -0.12 -1.32 0.69 1.33 1.20 0.00 0.00 173.24 175.02 2yt8 n VAL 59 N 6.41 0.00 0.04 4.45 0.24 -0.45 -4.52 118.33 124.50 2yt8 n VAL 59 Ca 0.21 -0.50 0.20 0.00 -2.04 0.00 0.00 64.34 62.21 2yt8 n VAL 59 Cb 0.44 1.13 0.52 0.00 -1.47 0.00 0.00 33.84 34.47 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 1.22 0.12 0.00 3.34 3.04 -1.59 -0.37 116.25 122.01 2yt8 h VAL 60 Ca 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 66.70 65.62 2yt8 h VAL 60 Cb 0.26 0.30 -0.01 0.00 -2.01 0.00 0.00 31.29 29.83 2yt8 h VAL 60 CO 0.00 0.00 -1.26 0.00 -1.01 0.00 0.00 177.57 175.30 2yt8 n ALA 61 N -2.11 1.90 -1.67 3.17 0.00 -1.26 -5.04 120.51 115.51 2yt8 n ALA 61 Ca 0.11 -0.25 -0.44 0.00 0.00 0.00 0.00 53.44 52.86 2yt8 n ALA 61 Cb 1.00 0.18 -0.02 0.00 0.00 0.00 0.00 19.45 20.61 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 -2.16 1.60 -2.26 0.00 -1.04 -0.15 -4.93 114.28 105.34 2yt8 n THR 62 Ca -0.06 -0.40 -0.37 0.00 -2.04 0.00 0.00 64.05 61.17 2yt8 n THR 62 Cb 0.62 -1.43 -0.01 0.00 -1.82 0.00 0.00 70.33 67.69 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 -1.27 3.79 0.17 -2.82 0.04 -1.26 -4.84 135.00 128.81 2yt8 s PRO 63 Ca 0.61 1.78 -0.24 0.00 0.04 0.00 0.00 61.00 63.19 2yt8 s PRO 63 Cb -0.62 -2.44 0.05 0.00 0.04 0.00 0.00 34.50 31.53 2yt8 s PRO 63 CO 0.57 -0.52 1.58 1.25 0.04 0.00 0.00 177.00 179.92 2yt8 h HIS 64 N 2.12 -1.13 -0.49 0.56 -0.00 -1.92 -1.54 115.15 112.76 2yt8 h HIS 64 Ca -0.49 0.07 0.04 0.00 -0.00 0.00 0.00 60.37 59.99 2yt8 h HIS 64 Cb 1.25 0.57 -0.06 0.00 -0.00 0.00 0.00 27.41 29.16 2yt8 h HIS 64 CO 0.53 -0.41 -0.29 0.00 -0.00 0.00 0.00 177.93 177.76 2yt8 n ALA 65 N -3.11 -0.32 0.12 5.26 0.00 -1.26 -0.20 120.51 121.00 2yt8 n ALA 65 Ca 0.02 0.42 -0.13 0.00 0.00 0.00 0.00 53.44 53.74 2yt8 n ALA 65 Cb 0.35 0.04 -0.07 0.00 0.00 0.00 0.00 19.45 19.77 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 -0.26 -1.03 0.00 1.12 -1.78 -2.45 114.38 109.99 2yt8 h ARG 66 Ca 0.08 0.02 0.38 0.00 -1.11 0.00 0.00 59.98 59.34 2yt8 h ARG 66 Cb 0.20 0.06 -0.16 0.00 -0.01 0.00 0.00 29.97 30.06 2yt8 h ARG 66 CO -0.46 -0.17 0.58 0.82 -3.11 0.00 0.00 179.97 177.63 2yt8 h ILE 67 N -0.27 0.14 -0.58 1.20 2.04 0.39 1.19 117.51 121.63 2yt8 h ILE 67 Ca -0.01 -0.05 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 2yt8 h ILE 67 Cb 0.23 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 2yt8 h ILE 67 CO 0.00 0.03 0.09 0.40 0.00 0.00 0.00 178.15 178.67 2yt8 h ILE 68 N 0.15 1.25 -0.49 -0.67 1.08 -0.48 -1.85 117.51 116.50 2yt8 h ILE 68 Ca 0.80 -0.96 -0.12 0.00 -0.39 0.00 0.00 64.86 64.18 2yt8 h ILE 68 Cb 2.02 0.71 -0.02 0.00 -3.07 0.00 0.00 36.82 36.47 2yt8 h ILE 68 CO -0.67 0.35 -0.17 -0.33 -0.69 0.00 0.00 178.15 176.64 2yt8 h GLU 69 N 0.88 0.98 0.09 2.37 4.39 0.15 -2.59 114.58 120.85 2yt8 h GLU 69 Ca 0.18 -0.39 -0.00 0.00 0.34 0.00 0.00 59.36 59.48 2yt8 h GLU 69 Cb 0.40 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 2yt8 h GLU 69 CO 0.01 1.07 -0.04 -0.07 -1.16 0.00 0.00 179.01 178.81 2yt8 h LEU 70 N 0.86 -0.10 -0.94 1.33 3.38 -1.02 0.63 115.31 119.43 2yt8 h LEU 70 Ca 0.12 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.26 2yt8 h LEU 70 Cb 0.74 0.03 -0.16 0.00 0.09 0.00 0.00 40.66 41.35 2yt8 h LEU 70 CO 0.06 -0.05 -0.33 -0.07 0.09 0.00 0.00 178.44 178.13 2yt8 h LEU 71 N -0.16 -1.22 -0.55 1.67 3.38 -1.45 0.44 115.31 117.41 2yt8 h LEU 71 Ca -0.01 0.29 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 2yt8 h LEU 71 Cb 0.09 0.68 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 2yt8 h LEU 71 CO 0.02 -0.30 0.31 0.74 0.09 0.00 0.00 178.44 179.30 2yt8 h THR 72 N -0.02 1.18 -0.40 0.22 2.02 -1.53 -2.15 112.91 112.23 2yt8 h THR 72 Ca 0.37 -0.43 0.08 0.00 0.77 0.00 0.00 66.41 67.20 2yt8 h THR 72 Cb 0.63 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 2yt8 h THR 72 CO -0.96 0.19 0.27 -0.33 0.37 0.00 0.00 175.52 175.06 2yt8 h GLU 73 N 0.74 0.20 -6.21 6.66 4.39 0.22 -3.40 114.58 117.18 2yt8 h GLU 73 Ca 0.19 -0.01 -0.56 0.00 0.34 0.00 0.00 59.36 59.32 2yt8 h GLU 73 Cb 0.02 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 2yt8 h GLU 73 CO -0.03 0.13 0.88 0.00 -1.16 0.00 0.00 179.01 178.83 2yt8 s ALA 74 N -5.22 3.62 0.45 3.43 0.00 0.00 -5.02 121.76 119.02 2yt8 s ALA 74 Ca -0.06 0.56 0.08 0.00 0.00 0.00 0.00 51.96 52.54 2yt8 s ALA 74 Cb 0.19 -3.61 -0.00 0.00 0.00 0.00 0.00 23.12 19.69 2yt8 s ALA 74 CO 0.72 -1.10 0.42 0.71 0.00 0.00 0.00 175.76 176.51 2yt8 s TYR 75 N 3.23 2.47 0.00 0.00 1.51 -1.26 -4.87 117.35 118.43 2yt8 s TYR 75 Ca 0.57 -0.55 0.00 0.00 -1.01 0.00 0.00 57.07 56.08 2yt8 s TYR 75 Cb -0.24 -2.15 0.00 0.00 -0.11 0.00 0.00 41.96 39.46 2yt8 s TYR 75 CO 0.18 -0.26 0.00 0.41 -1.11 0.00 0.00 175.55 174.77 2yt8 n GLY 76 N -1.64 2.66 3.60 0.71 0.00 0.22 -4.34 105.19 106.41 2yt8 n GLY 76 Ca 0.04 0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.97 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 3.51 -0.40 1.61 2.12 -1.26 -1.35 118.70 122.92 2yt8 s GLU 77 Ca 0.00 1.15 -0.03 0.00 0.36 0.00 0.00 54.97 56.45 2yt8 s GLU 77 Cb 0.00 -4.08 0.11 0.00 0.26 0.00 0.00 34.13 30.42 2yt8 s GLU 77 CO 0.00 -1.64 0.20 0.08 -0.54 0.00 0.00 175.26 173.35 2yt8 s VAL 78 N 5.90 3.27 0.22 3.70 1.01 -0.44 -4.97 120.40 129.09 2yt8 s VAL 78 Ca 0.68 -2.04 -0.30 0.00 0.00 0.00 0.00 61.98 60.33 2yt8 s VAL 78 Cb -0.17 -3.23 -0.08 0.00 0.00 0.00 0.00 36.38 32.89 2yt8 s VAL 78 CO 0.33 -0.67 1.01 -1.00 0.00 0.00 0.00 175.10 174.76 2yt8 s HIS 79 N 1.14 3.81 -0.04 5.22 3.76 -1.26 -1.12 115.29 126.79 2yt8 s HIS 79 Ca 0.08 1.80 -0.02 0.00 -0.15 0.00 0.00 55.06 56.77 2yt8 s HIS 79 Cb -0.23 -3.11 0.03 0.00 1.11 0.00 0.00 32.58 30.39 2yt8 s HIS 79 CO -0.04 0.02 0.07 0.42 -0.85 0.00 0.00 174.74 174.36 2yt8 s ILE 80 N -0.88 -0.12 -0.48 0.60 1.01 0.36 -0.22 121.20 121.48 2yt8 s ILE 80 Ca 0.44 0.41 -0.19 0.00 0.00 0.00 0.00 60.65 61.30 2yt8 s ILE 80 Cb -0.28 -0.16 0.04 0.00 0.01 0.00 0.00 42.46 42.08 2yt8 s ILE 80 CO 0.34 0.17 0.60 -0.75 0.00 0.00 0.00 174.94 175.30 2yt8 s LYS 81 N 2.11 3.15 -0.18 2.79 2.20 -0.63 -1.37 119.74 127.82 2yt8 s LYS 81 Ca 0.04 -0.74 -0.09 0.00 -0.36 0.00 0.00 55.97 54.81 2yt8 s LYS 81 Cb -0.12 -4.04 -0.05 0.00 -1.51 0.00 0.00 37.83 32.11 2yt8 s LYS 81 CO -0.03 -1.11 0.12 0.95 -0.36 0.00 0.00 175.35 174.92 2yt8 s THR 82 N 2.59 5.35 -0.03 3.43 -4.23 -0.46 -2.68 115.64 119.60 2yt8 s THR 82 Ca 0.16 0.16 -0.03 0.00 -1.18 0.00 0.00 61.69 60.81 2yt8 s THR 82 Cb -0.18 -3.41 0.01 0.00 1.34 0.00 0.00 72.50 70.26 2yt8 s THR 82 CO 0.14 0.48 0.09 -0.32 -0.54 0.00 0.00 174.62 174.47 2yt8 s MET 83 N 0.03 0.10 -0.33 3.99 0.00 -0.03 -2.85 119.30 120.22 2yt8 s MET 83 Ca 0.09 0.13 -0.29 0.00 0.00 0.00 0.00 55.69 55.63 2yt8 s MET 83 Cb -0.11 0.04 -0.01 0.00 0.00 0.00 0.00 34.83 34.74 2yt8 s MET 83 CO -0.00 -0.02 1.68 -1.25 0.00 0.00 0.00 175.02 175.43 2yt8 s PRO 84 N 0.10 3.46 0.39 4.11 0.04 -1.26 0.13 135.00 141.96 2yt8 s PRO 84 Ca -0.00 1.36 0.30 0.00 0.04 0.00 0.00 61.00 62.70 2yt8 s PRO 84 Cb -0.01 -4.13 1.28 0.00 0.04 0.00 0.00 34.50 31.68 2yt8 s PRO 84 CO -0.00 -1.70 1.29 0.00 0.04 0.00 0.00 177.00 176.63 2yt8 n ALA 85 N 9.66 1.24 0.17 8.56 0.00 -1.26 -0.40 120.51 138.48 2yt8 n ALA 85 Ca 0.21 0.68 -0.08 0.00 0.00 0.00 0.00 53.44 54.25 2yt8 n ALA 85 Cb 0.47 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 18.99 2yt8 n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yt8 h ALA 86 N 1.20 -1.05 0.31 0.00 0.00 -1.96 -0.53 119.26 117.22 2yt8 h ALA 86 Ca 0.74 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.55 2yt8 h ALA 86 Cb 2.53 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 20.59 2yt8 h ALA 86 CO -0.30 -1.03 -0.48 1.15 0.00 0.00 0.00 179.25 178.59 2yt8 h THR 87 N -0.48 0.00 -0.73 0.00 2.02 -1.12 -0.70 112.91 111.90 2yt8 h THR 87 Ca -0.04 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.22 2yt8 h THR 87 Cb 0.38 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.68 2yt8 h THR 87 CO 0.05 0.00 -0.52 0.22 0.37 0.00 0.00 175.52 175.64 2yt8 h TYR 88 N -0.83 -1.59 -0.41 3.16 3.20 -1.51 0.35 116.97 119.34 2yt8 h TYR 88 Ca -0.03 0.10 0.08 0.00 3.14 0.00 0.00 58.73 62.02 2yt8 h TYR 88 Cb 0.76 0.80 -0.08 0.00 1.54 0.00 0.00 36.73 39.75 2yt8 h TYR 88 CO -0.33 -0.42 -0.11 0.00 -1.64 0.00 0.00 178.16 175.65 2yt8 h ARG 89 N -0.17 -0.01 -0.68 1.82 2.47 -0.87 0.46 114.38 117.39 2yt8 h ARG 89 Ca 0.16 0.00 0.04 0.00 -1.26 0.00 0.00 59.98 58.92 2yt8 h ARG 89 Cb 0.52 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.81 2yt8 h ARG 89 CO -0.79 -0.01 0.45 -0.07 0.56 0.00 0.00 179.97 180.11 2yt8 h LEU 90 N -0.01 0.69 0.02 3.04 3.38 0.63 0.17 115.31 123.23 2yt8 h LEU 90 Ca 0.20 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 2yt8 h LEU 90 Cb 0.32 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2yt8 h LEU 90 CO -0.43 0.47 -0.01 -0.07 0.09 0.00 0.00 178.44 178.49 2yt8 h LEU 91 N 0.80 -0.03 -2.46 1.67 3.38 0.15 -2.98 115.31 115.84 2yt8 h LEU 91 Ca 0.28 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 2yt8 h LEU 91 Cb 0.11 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 2yt8 h LEU 91 CO -0.08 0.34 0.08 1.07 0.09 0.00 0.00 178.44 179.93 2yt8 n THR 92 N -4.93 1.57 0.00 0.22 5.66 -0.05 -4.74 114.28 112.01 2yt8 n THR 92 Ca -0.08 -0.77 0.00 0.00 -3.05 0.00 0.00 64.05 60.15 2yt8 n THR 92 Cb 0.20 -0.47 0.00 0.00 -1.55 0.00 0.00 70.33 68.51 2yt8 n THR 92 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2yt8 n GLY 93 N 0.17 0.43 0.39 1.09 0.00 0.57 -5.00 105.19 102.85 2yt8 n GLY 93 Ca 0.18 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.34 2yt8 n GLY 93 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14