#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 1.90 0.22 1.61 7.64 -1.26 -4.81 113.62 118.92 2yt8 n SER 2 Ca 0.00 -0.60 -0.14 0.00 1.01 0.00 0.00 58.87 59.14 2yt8 n SER 2 Cb 0.00 -1.50 -0.08 0.00 -1.01 0.00 0.00 64.21 61.62 2yt8 n SER 2 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2yt8 h SER 3 N 17.43 -0.48 0.00 6.43 0.02 -2.03 -3.49 113.55 131.43 2yt8 h SER 3 Ca -0.17 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 2yt8 h SER 3 Cb 1.23 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.89 2yt8 h SER 3 CO 1.17 -0.17 0.00 0.61 -1.14 0.00 0.00 176.83 177.30 2yt8 n GLY 4 N -0.69 0.90 3.62 -3.77 0.00 -1.26 -5.06 105.19 98.93 2yt8 n GLY 4 Ca -0.11 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.10 2yt8 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yt8 s SER 5 N -4.00 6.68 0.82 1.61 0.15 -1.26 -5.04 113.70 112.65 2yt8 s SER 5 Ca 0.00 0.76 -0.11 0.00 0.70 0.00 0.00 55.95 57.30 2yt8 s SER 5 Cb 0.00 -2.39 0.09 0.00 -1.71 0.00 0.00 66.02 62.00 2yt8 s SER 5 CO 0.00 -0.52 1.12 -0.94 1.20 0.00 0.00 173.24 174.10 2yt8 s SER 6 N 1.51 3.91 0.00 5.45 1.04 -1.26 -4.50 113.70 119.84 2yt8 s SER 6 Ca 0.31 2.01 0.00 0.00 0.48 0.00 0.00 55.95 58.75 2yt8 s SER 6 Cb -0.15 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.43 2yt8 s SER 6 CO 0.10 -2.44 0.00 0.61 0.98 0.00 0.00 173.24 172.49 2yt8 n GLY 7 N -0.52 1.99 3.67 7.32 0.00 -1.26 -5.07 105.19 111.33 2yt8 n GLY 7 Ca 0.11 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.24 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 4.38 0.17 1.61 1.01 -1.26 -5.05 120.40 121.26 2yt8 s VAL 8 Ca 0.00 -0.21 -0.25 0.00 0.00 0.00 0.00 61.98 61.52 2yt8 s VAL 8 Cb 0.00 -2.87 -0.08 0.00 0.00 0.00 0.00 36.38 33.43 2yt8 s VAL 8 CO 0.00 0.58 0.78 -0.89 0.00 0.00 0.00 175.10 175.57 2yt8 s THR 9 N -0.66 4.37 -0.09 3.92 2.01 -1.14 -5.00 115.64 119.05 2yt8 s THR 9 Ca 0.11 1.69 0.02 0.00 0.31 0.00 0.00 61.69 63.83 2yt8 s THR 9 Cb -0.12 -4.13 0.01 0.00 0.01 0.00 0.00 72.50 68.27 2yt8 s THR 9 CO 0.02 0.51 -0.16 -0.89 -0.69 0.00 0.00 174.62 173.42 2yt8 s THR 10 N -1.16 1.46 0.12 -0.82 2.01 -1.26 -1.37 115.64 114.61 2yt8 s THR 10 Ca 0.36 -0.65 0.10 0.00 0.31 0.00 0.00 61.69 61.81 2yt8 s THR 10 Cb -0.23 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.93 2yt8 s THR 10 CO 0.26 0.43 -0.26 0.00 -0.69 0.00 0.00 174.62 174.36 2yt8 s ALA 11 N 0.70 2.27 -0.09 7.40 0.00 0.19 -4.99 121.76 127.23 2yt8 s ALA 11 Ca -0.13 -1.42 0.04 0.00 0.00 0.00 0.00 51.96 50.45 2yt8 s ALA 11 Cb -0.16 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.60 2yt8 s ALA 11 CO 0.03 0.51 -0.22 0.42 0.00 0.00 0.00 175.76 176.49 2yt8 s ILE 12 N -1.07 1.92 0.07 0.00 1.01 -1.16 -0.57 121.20 121.40 2yt8 s ILE 12 Ca 0.12 -0.94 0.04 0.00 0.00 0.00 0.00 60.65 59.87 2yt8 s ILE 12 Cb -0.10 -1.67 -0.04 0.00 0.01 0.00 0.00 42.46 40.67 2yt8 s ILE 12 CO 0.06 0.53 -0.02 -0.63 0.00 0.00 0.00 174.94 174.88 2yt8 s ILE 13 N 0.35 3.94 -0.44 2.92 -1.09 -0.67 -3.97 121.20 122.24 2yt8 s ILE 13 Ca -0.17 -0.92 -0.07 0.00 -2.23 0.00 0.00 60.65 57.25 2yt8 s ILE 13 Cb -0.17 -2.83 0.11 0.00 -1.58 0.00 0.00 42.46 37.98 2yt8 s ILE 13 CO 0.08 0.19 0.29 -1.00 -1.23 0.00 0.00 174.94 173.27 2yt8 s HIS 14 N -1.23 3.46 -0.63 3.97 3.76 -1.26 -1.78 115.29 121.59 2yt8 s HIS 14 Ca 0.23 -1.98 -0.01 0.00 -0.15 0.00 0.00 55.06 53.16 2yt8 s HIS 14 Cb -0.12 -3.32 0.16 0.00 1.11 0.00 0.00 32.58 30.41 2yt8 s HIS 14 CO 0.15 -0.96 0.43 1.03 -0.85 0.00 0.00 174.74 174.53 2yt8 s ARG 15 N 1.31 2.48 0.30 1.40 0.52 0.24 -4.92 118.95 120.28 2yt8 s ARG 15 Ca 0.06 -2.67 0.09 0.00 -0.52 0.00 0.00 55.73 52.69 2yt8 s ARG 15 Cb -0.25 -3.63 0.48 0.00 0.52 0.00 0.00 34.95 32.08 2yt8 s ARG 15 CO -0.01 -1.17 1.70 -1.00 0.02 0.00 0.00 175.30 174.83 2yt8 h PRO 16 N 6.70 0.10 -6.83 3.54 0.13 -1.95 0.73 132.00 134.42 2yt8 h PRO 16 Ca -0.01 -0.05 -0.68 0.00 -0.87 0.00 0.00 66.00 64.39 2yt8 h PRO 16 Cb 0.91 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 31.83 2yt8 h PRO 16 CO 0.72 0.56 -0.86 -1.58 -0.23 0.00 0.00 178.00 176.60 2yt8 s HIS 17 N -3.96 2.26 -0.05 1.56 2.46 -1.26 -4.76 115.29 111.54 2yt8 s HIS 17 Ca -0.03 -0.38 0.05 0.00 0.47 0.00 0.00 55.06 55.17 2yt8 s HIS 17 Cb 0.13 -1.22 -0.24 0.00 -0.13 0.00 0.00 32.58 31.12 2yt8 s HIS 17 CO 0.76 0.34 0.64 0.00 -2.47 0.00 0.00 174.74 174.00 2yt8 h ALA 18 N 3.87 0.60 -0.19 1.58 0.00 -1.95 -3.34 119.26 119.83 2yt8 h ALA 18 Ca -0.50 -1.38 -0.09 0.00 0.00 0.00 0.00 54.91 52.94 2yt8 h ALA 18 Cb 1.17 0.49 -0.06 0.00 0.00 0.00 0.00 17.79 19.40 2yt8 h ALA 18 CO 0.39 1.44 0.12 0.54 0.00 0.00 0.00 179.25 181.75 2yt8 n ARG 19 N -3.23 1.29 -5.16 0.00 1.74 -1.26 -4.80 116.66 105.24 2yt8 n ARG 19 Ca -0.20 -0.59 -0.31 0.00 -0.77 0.00 0.00 57.85 55.98 2yt8 n ARG 19 Cb 1.04 -1.27 -0.17 0.00 -1.02 0.00 0.00 32.46 31.05 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 2.63 1.04 5.56 0.41 -1.25 -5.12 118.70 121.26 2yt8 s GLU 20 Ca 0.11 -0.83 -0.23 0.00 -0.41 0.00 0.00 54.97 53.60 2yt8 s GLU 20 Cb 0.09 -2.11 -0.09 0.00 -1.78 0.00 0.00 34.13 30.24 2yt8 s GLU 20 CO 0.02 0.26 -0.92 1.04 -0.49 0.00 0.00 175.26 175.18 2yt8 n GLN 21 N 3.26 -0.51 -0.12 1.61 6.02 -1.26 -4.97 117.38 121.42 2yt8 n GLN 21 Ca -0.18 -0.14 -0.21 0.00 -0.01 0.00 0.00 57.00 56.45 2yt8 n GLN 21 Cb 0.52 -1.26 -0.10 0.00 1.02 0.00 0.00 30.24 30.43 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 1.67 2.30 0.00 1.08 4.77 -1.26 -5.04 117.00 120.52 2yt8 n LEU 22 Ca -0.01 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2yt8 n LEU 22 Cb 0.69 -0.75 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 2yt8 n LEU 22 CO 0.47 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.82 2yt8 n GLY 23 N 1.92 3.15 3.63 -0.72 0.00 -1.26 -4.33 105.19 107.58 2yt8 n GLY 23 Ca -0.44 -0.87 -0.41 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 -0.05 3.29 -0.27 1.61 -0.71 -1.26 0.22 117.98 120.81 2yt8 s PHE 24 Ca 0.00 0.91 -0.26 0.00 -1.04 0.00 0.00 56.93 56.54 2yt8 s PHE 24 Cb 0.00 -2.90 0.00 0.00 -1.21 0.00 0.00 43.02 38.91 2yt8 s PHE 24 CO 0.00 -0.35 0.91 0.00 -1.34 0.00 0.00 175.22 174.44 2yt8 s VAL 26 N 3.10 4.16 -0.10 0.00 1.01 -1.26 -1.24 120.40 126.07 2yt8 s VAL 26 Ca 0.38 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.67 2yt8 s VAL 26 Cb -0.14 -2.88 0.05 0.00 0.00 0.00 0.00 36.38 33.41 2yt8 s VAL 26 CO 0.10 0.33 0.15 -1.61 0.00 0.00 0.00 175.10 174.07 2yt8 s GLU 27 N -1.70 0.04 -1.68 2.72 0.41 0.43 -4.84 118.70 114.07 2yt8 s GLU 27 Ca 0.21 0.46 0.00 0.00 -0.41 0.00 0.00 54.97 55.23 2yt8 s GLU 27 Cb -0.12 -0.51 0.00 0.00 -1.78 0.00 0.00 34.13 31.73 2yt8 s GLU 27 CO 0.12 -0.37 0.00 -0.25 -0.49 0.00 0.00 175.26 174.27 2yt8 n ASP 28 N 5.32 -5.12 0.00 -0.19 9.92 -1.26 -0.71 116.55 124.50 2yt8 n ASP 28 Ca -0.05 0.18 0.00 0.00 -0.53 0.00 0.00 54.79 54.40 2yt8 n ASP 28 Cb 0.50 -4.38 0.00 0.00 -0.64 0.00 0.00 41.12 36.59 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 -0.74 0.61 2.73 0.44 0.00 -1.26 -4.79 105.19 102.17 2yt8 n GLY 29 Ca -0.20 -0.75 -0.19 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.14 0.33 -0.61 1.01 0.11 -0.94 121.20 118.96 2yt8 s ILE 30 Ca 0.00 0.39 -0.28 0.00 0.00 0.00 0.00 60.65 60.76 2yt8 s ILE 30 Cb 0.00 -0.18 -0.10 0.00 0.01 0.00 0.00 42.46 42.19 2yt8 s ILE 30 CO 0.00 0.16 1.28 -0.63 0.00 0.00 0.00 174.94 175.75 2yt8 s ILE 31 N 2.09 2.81 -0.00 2.92 1.01 -0.94 -0.43 121.20 128.66 2yt8 s ILE 31 Ca 0.03 0.81 -0.00 0.00 0.00 0.00 0.00 60.65 61.49 2yt8 s ILE 31 Cb -0.12 -3.51 -0.00 0.00 0.01 0.00 0.00 42.46 38.84 2yt8 s ILE 31 CO -0.04 0.18 -0.00 0.00 0.00 0.00 0.00 174.94 175.08 2yt8 s SER 33 N -4.32 1.63 -0.03 0.00 0.15 -1.24 -4.48 113.70 105.42 2yt8 s SER 33 Ca -0.00 -0.88 0.03 0.00 0.70 0.00 0.00 55.95 55.80 2yt8 s SER 33 Cb 0.00 -0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.31 2yt8 s SER 33 CO 0.01 -0.27 -0.11 -0.22 1.20 0.00 0.00 173.24 173.85 2yt8 s LEU 34 N -2.67 1.83 -0.31 3.45 0.20 -1.26 -0.26 118.68 119.66 2yt8 s LEU 34 Ca 0.09 -0.23 -0.28 0.00 0.69 0.00 0.00 54.13 54.40 2yt8 s LEU 34 Cb -0.01 -0.65 -0.02 0.00 -0.43 0.00 0.00 46.19 45.08 2yt8 s LEU 34 CO 0.01 0.09 1.81 -0.22 -0.29 0.00 0.00 176.35 177.74 2yt8 s LEU 35 N 0.13 3.54 -0.22 -0.68 2.96 0.13 -4.92 118.68 119.63 2yt8 s LEU 35 Ca -0.03 1.39 -0.29 0.00 -0.22 0.00 0.00 54.13 54.98 2yt8 s LEU 35 Cb -0.09 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.04 2yt8 s LEU 35 CO 0.01 -1.67 1.80 -0.60 -1.32 0.00 0.00 176.35 174.56 2yt8 s ARG 36 N 5.59 3.61 0.00 1.98 6.06 -1.26 -2.84 118.95 132.09 2yt8 s ARG 36 Ca 0.81 1.77 0.00 0.00 -2.50 0.00 0.00 55.73 55.81 2yt8 s ARG 36 Cb -0.24 -4.15 0.00 0.00 0.06 0.00 0.00 34.95 30.63 2yt8 s ARG 36 CO 0.34 -1.53 0.00 0.41 -2.50 0.00 0.00 175.30 172.01 2yt8 n GLY 37 N 5.02 0.85 0.00 8.12 0.00 -1.26 -5.10 105.19 112.83 2yt8 n GLY 37 Ca 0.22 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.29 5.23 0.13 -0.02 0.00 -1.13 -5.08 105.19 104.03 2yt8 n GLY 38 Ca 0.00 -1.56 -0.21 0.00 0.00 0.00 0.00 46.02 44.25 2yt8 n GLY 38 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2yt8 n ILE 39 N 0.00 1.53 0.07 -0.61 5.41 -1.26 -4.40 119.36 120.10 2yt8 n ILE 39 Ca 0.00 -0.53 -0.15 0.00 1.00 0.00 0.00 62.75 63.07 2yt8 n ILE 39 Cb 0.00 -1.57 -0.09 0.00 -0.71 0.00 0.00 39.64 37.28 2yt8 n ILE 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2yt8 h ALA 40 N -0.21 -0.85 -1.03 -1.39 0.00 -1.90 0.13 119.26 114.01 2yt8 h ALA 40 Ca -0.58 -0.07 0.36 0.00 0.00 0.00 0.00 54.91 54.61 2yt8 h ALA 40 Cb 1.84 0.87 -0.16 0.00 0.00 0.00 0.00 17.79 20.34 2yt8 h ALA 40 CO -0.14 -1.06 0.59 1.49 0.00 0.00 0.00 179.25 180.13 2yt8 h GLU 41 N -0.65 0.21 0.00 0.00 4.22 -1.82 1.59 114.58 118.13 2yt8 h GLU 41 Ca 0.02 -0.01 -0.15 0.00 0.08 0.00 0.00 59.36 59.30 2yt8 h GLU 41 Cb 0.71 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 2yt8 h GLU 41 CO -0.33 0.14 -0.71 0.00 -2.18 0.00 0.00 179.01 175.93 2yt8 h ARG 42 N 0.21 0.00 -0.05 1.92 3.08 -1.36 -3.28 114.38 114.91 2yt8 h ARG 42 Ca 0.77 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 60.59 2yt8 h ARG 42 Cb 1.91 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.97 2yt8 h ARG 42 CO -0.63 0.71 -0.92 0.78 -1.07 0.00 0.00 179.97 178.84 2yt8 h GLY 43 N 2.82 0.69 0.00 0.04 0.00 0.47 -3.48 103.07 103.61 2yt8 h GLY 43 Ca -0.01 -1.11 0.00 0.00 0.00 0.00 0.00 47.33 46.21 2yt8 h GLY 43 CO 0.09 0.99 0.00 0.61 0.00 0.00 0.00 176.54 178.23 2yt8 n GLY 44 N 0.89 1.34 3.74 4.60 0.00 0.56 -2.97 105.19 113.35 2yt8 n GLY 44 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.34 4.33 -0.06 -0.61 -1.09 -1.08 -4.75 121.20 116.60 2yt8 s ILE 45 Ca 0.00 2.07 -0.00 0.00 -2.23 0.00 0.00 60.65 60.49 2yt8 s ILE 45 Cb 0.00 -4.32 0.02 0.00 -1.58 0.00 0.00 42.46 36.58 2yt8 s ILE 45 CO 0.00 0.39 -0.02 -0.13 -1.23 0.00 0.00 174.94 173.94 2yt8 s ARG 46 N -0.45 0.70 0.68 2.79 1.81 -1.26 -4.62 118.95 118.60 2yt8 s ARG 46 Ca 0.45 0.00 -0.17 0.00 -1.72 0.00 0.00 55.73 54.29 2yt8 s ARG 46 Cb -0.24 -0.88 0.01 0.00 -0.45 0.00 0.00 34.95 33.39 2yt8 s ARG 46 CO 0.31 -0.19 1.27 0.14 -0.68 0.00 0.00 175.30 176.15 2yt8 s VAL 47 N 1.40 2.08 0.00 3.52 -7.23 -1.26 -2.90 120.40 116.01 2yt8 s VAL 47 Ca -0.04 0.05 0.00 0.00 -1.81 0.00 0.00 61.98 60.18 2yt8 s VAL 47 Cb -0.13 -2.87 0.00 0.00 0.56 0.00 0.00 36.38 33.94 2yt8 s VAL 47 CO -0.03 -0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.36 2yt8 n GLY 48 N 0.76 3.06 3.81 2.32 0.00 -0.06 -4.96 105.19 110.12 2yt8 n GLY 48 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 3.14 -0.13 1.61 3.76 -1.14 -4.61 115.29 115.74 2yt8 s HIS 49 Ca 0.00 1.58 -0.05 0.00 -0.15 0.00 0.00 55.06 56.44 2yt8 s HIS 49 Cb 0.00 -2.97 -0.04 0.00 1.11 0.00 0.00 32.58 30.69 2yt8 s HIS 49 CO 0.00 -0.55 0.05 0.50 -0.85 0.00 0.00 174.74 173.89 2yt8 s ARG 50 N -3.31 3.51 -0.26 1.40 3.00 0.99 -2.22 118.95 122.07 2yt8 s ARG 50 Ca 0.65 -0.33 -0.25 0.00 -1.00 0.00 0.00 55.73 54.80 2yt8 s ARG 50 Cb -0.13 -3.05 -0.00 0.00 0.00 0.00 0.00 34.95 31.77 2yt8 s ARG 50 CO 0.19 0.53 0.85 0.42 0.00 0.00 0.00 175.30 177.28 2yt8 s ILE 51 N -0.36 4.80 -0.08 4.11 -1.09 -0.11 -0.69 121.20 127.78 2yt8 s ILE 51 Ca 0.09 1.53 0.14 0.00 -2.23 0.00 0.00 60.65 60.18 2yt8 s ILE 51 Cb -0.12 -4.15 -0.21 0.00 -1.58 0.00 0.00 42.46 36.40 2yt8 s ILE 51 CO 0.02 -0.13 0.19 2.30 -1.23 0.00 0.00 174.94 176.09 2yt8 n ILE 52 N 5.35 0.51 -3.83 2.92 -5.35 -1.01 -4.50 119.36 113.44 2yt8 n ILE 52 Ca 0.06 -0.49 -0.12 0.00 -0.27 0.00 0.00 62.75 61.93 2yt8 n ILE 52 Cb 0.48 -0.25 -0.10 0.00 -1.74 0.00 0.00 39.64 38.03 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 -2.71 0.53 -0.03 6.28 2.12 -1.24 -0.65 118.70 123.01 2yt8 s GLU 53 Ca -0.06 -0.27 -0.10 0.00 0.36 0.00 0.00 54.97 54.90 2yt8 s GLU 53 Cb 0.07 0.23 0.02 0.00 0.26 0.00 0.00 34.13 34.70 2yt8 s GLU 53 CO 0.62 -0.13 0.23 0.96 -0.54 0.00 0.00 175.26 176.40 2yt8 s ILE 54 N -1.24 0.05 -1.29 -3.70 -5.25 -0.33 -0.82 121.20 108.63 2yt8 s ILE 54 Ca -0.13 -0.41 -0.11 0.00 -0.99 0.00 0.00 60.65 59.01 2yt8 s ILE 54 Cb -0.06 -0.47 0.11 0.00 2.95 0.00 0.00 42.46 44.99 2yt8 s ILE 54 CO 0.02 -0.23 0.28 0.59 -1.79 0.00 0.00 174.94 173.82 2yt8 n ASN 55 N 1.85 -0.61 -3.02 4.36 4.13 0.18 0.15 115.26 122.31 2yt8 n ASN 55 Ca -0.19 -0.92 -0.15 0.00 1.68 0.00 0.00 54.58 55.00 2yt8 n ASN 55 Cb 0.56 -1.16 0.07 0.00 -1.54 0.00 0.00 39.78 37.72 2yt8 n ASN 55 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2yt8 n GLY 56 N -1.35 -0.23 3.16 7.41 0.00 -1.26 -4.95 105.19 107.97 2yt8 n GLY 56 Ca -0.03 0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 -5.27 0.27 0.01 1.61 -1.52 0.39 -5.13 119.66 110.02 2yt8 s GLN 57 Ca 0.07 0.91 -0.30 0.00 -1.95 0.00 0.00 55.36 54.10 2yt8 s GLN 57 Cb -0.03 0.16 -0.07 0.00 -0.22 0.00 0.00 33.01 32.85 2yt8 s GLN 57 CO 0.60 -0.28 1.69 -1.54 -0.25 0.00 0.00 175.29 175.51 2yt8 s SER 58 N 2.55 6.62 -0.00 5.90 1.04 -1.26 -1.19 113.70 127.35 2yt8 s SER 58 Ca 0.00 2.39 0.00 0.00 0.48 0.00 0.00 55.95 58.82 2yt8 s SER 58 Cb -0.12 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.46 2yt8 s SER 58 CO -0.12 -0.92 0.81 1.33 0.98 0.00 0.00 173.24 175.32 2yt8 n VAL 59 N 5.18 0.62 0.24 5.02 0.24 0.18 -4.69 118.33 125.12 2yt8 n VAL 59 Ca 0.17 -0.63 0.13 0.00 -2.04 0.00 0.00 64.34 61.97 2yt8 n VAL 59 Cb 0.42 0.67 0.55 0.00 -1.47 0.00 0.00 33.84 34.01 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 1.27 0.06 0.00 3.34 3.04 -1.40 -1.16 116.25 121.42 2yt8 h VAL 60 Ca 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.68 2yt8 h VAL 60 Cb 0.72 0.42 -0.00 0.00 -2.01 0.00 0.00 31.29 30.42 2yt8 h VAL 60 CO 0.00 0.00 -1.05 0.00 -1.01 0.00 0.00 177.57 175.51 2yt8 n ALA 61 N -1.90 1.98 -1.66 3.17 0.00 -1.26 -5.03 120.51 115.83 2yt8 n ALA 61 Ca 0.03 -0.05 -0.44 0.00 0.00 0.00 0.00 53.44 52.98 2yt8 n ALA 61 Cb 0.70 0.22 -0.02 0.00 0.00 0.00 0.00 19.45 20.35 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 -2.00 1.61 -1.98 0.00 -1.04 -0.44 -4.94 114.28 105.50 2yt8 n THR 62 Ca -0.01 -0.40 -0.34 0.00 -2.04 0.00 0.00 64.05 61.26 2yt8 n THR 62 Cb 0.49 -1.36 0.03 0.00 -1.82 0.00 0.00 70.33 67.67 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 -1.26 3.04 0.13 -2.82 0.04 -1.26 -4.81 135.00 128.06 2yt8 s PRO 63 Ca 0.61 1.49 -0.25 0.00 0.04 0.00 0.00 61.00 62.89 2yt8 s PRO 63 Cb -0.64 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 31.89 2yt8 s PRO 63 CO 0.57 -1.07 1.64 1.25 0.04 0.00 0.00 177.00 179.42 2yt8 h HIS 64 N 0.54 -0.65 -1.00 0.56 -0.00 -1.92 0.03 115.15 112.71 2yt8 h HIS 64 Ca -0.48 0.03 0.37 0.00 -0.00 0.00 0.00 60.37 60.28 2yt8 h HIS 64 Cb 1.25 0.30 -0.18 0.00 -0.00 0.00 0.00 27.41 28.78 2yt8 h HIS 64 CO 0.53 -0.33 0.37 0.00 -0.00 0.00 0.00 177.93 178.50 2yt8 h ALA 65 N 0.57 1.83 0.21 5.26 0.00 -2.00 0.63 119.26 125.75 2yt8 h ALA 65 Ca 0.09 0.29 -0.31 0.00 0.00 0.00 0.00 54.91 54.98 2yt8 h ALA 65 Cb 0.46 0.42 0.03 0.00 0.00 0.00 0.00 17.79 18.70 2yt8 h ALA 65 CO -0.27 -0.82 -1.34 -0.09 0.00 0.00 0.00 179.25 176.73 2yt8 h ARG 66 N 0.01 0.54 -0.57 0.00 9.65 -1.67 -3.28 114.38 119.07 2yt8 h ARG 66 Ca 0.76 -0.86 0.12 0.00 -1.10 0.00 0.00 59.98 58.90 2yt8 h ARG 66 Cb 1.90 0.31 -0.03 0.00 -1.39 0.00 0.00 29.97 30.76 2yt8 h ARG 66 CO -0.82 1.40 0.39 0.82 2.80 0.00 0.00 179.97 184.56 2yt8 h ILE 67 N 0.12 0.84 -0.22 1.20 2.04 0.20 0.07 117.51 121.77 2yt8 h ILE 67 Ca -0.23 -0.09 -0.12 0.00 1.00 0.00 0.00 64.86 65.43 2yt8 h ILE 67 Cb 2.04 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 2yt8 h ILE 67 CO 0.25 0.05 -0.35 0.40 0.00 0.00 0.00 178.15 178.50 2yt8 h ILE 68 N 0.27 1.29 -0.02 -0.67 1.08 -0.94 -1.63 117.51 116.88 2yt8 h ILE 68 Ca 0.27 -1.46 -0.14 0.00 -0.39 0.00 0.00 64.86 63.14 2yt8 h ILE 68 Cb 0.69 1.50 -0.02 0.00 -3.07 0.00 0.00 36.82 35.92 2yt8 h ILE 68 CO -0.06 0.46 -0.64 -0.33 -0.69 0.00 0.00 178.15 176.89 2yt8 h GLU 69 N 0.41 0.09 0.22 2.37 5.08 -1.08 -2.59 114.58 119.08 2yt8 h GLU 69 Ca 0.05 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2yt8 h GLU 69 Cb 0.81 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2yt8 h GLU 69 CO 0.07 0.70 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.59 2yt8 h LEU 70 N 0.06 -0.25 -0.40 1.33 3.38 -1.18 -2.27 115.31 115.98 2yt8 h LEU 70 Ca -0.01 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.05 2yt8 h LEU 70 Cb 1.14 0.07 -0.09 0.00 0.09 0.00 0.00 40.66 41.87 2yt8 h LEU 70 CO 0.09 0.14 -0.26 -0.07 0.09 0.00 0.00 178.44 178.44 2yt8 h LEU 71 N -0.95 -0.86 -1.27 1.67 3.38 -1.41 0.39 115.31 116.27 2yt8 h LEU 71 Ca -0.03 0.17 0.03 0.00 0.09 0.00 0.00 57.88 58.14 2yt8 h LEU 71 Cb 0.23 0.43 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 2yt8 h LEU 71 CO 0.05 -0.28 0.51 0.74 0.09 0.00 0.00 178.44 179.55 2yt8 h THR 72 N -0.19 1.14 0.00 0.22 2.02 -1.60 -0.34 112.91 114.16 2yt8 h THR 72 Ca 0.19 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 2yt8 h THR 72 Cb 0.49 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2yt8 h THR 72 CO -0.51 0.18 -0.04 -0.33 0.37 0.00 0.00 175.52 175.18 2yt8 h GLU 73 N 0.97 0.00 -5.64 6.66 5.08 -0.33 -3.40 114.58 117.91 2yt8 h GLU 73 Ca 0.30 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 58.05 2yt8 h GLU 73 Cb 0.01 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.15 2yt8 h GLU 73 CO -0.08 0.04 0.29 0.00 -1.00 0.00 0.00 179.01 178.26 2yt8 s ALA 74 N -4.09 3.55 0.44 3.43 0.00 -0.14 -5.05 121.76 119.90 2yt8 s ALA 74 Ca -0.03 -0.47 0.08 0.00 0.00 0.00 0.00 51.96 51.54 2yt8 s ALA 74 Cb 0.12 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 20.05 2yt8 s ALA 74 CO 0.51 -1.07 0.47 0.71 0.00 0.00 0.00 175.76 176.38 2yt8 s TYR 75 N 2.76 2.58 0.00 0.00 1.51 -1.26 -4.91 117.35 118.04 2yt8 s TYR 75 Ca 0.29 -0.50 0.00 0.00 -1.01 0.00 0.00 57.07 55.85 2yt8 s TYR 75 Cb -0.15 -2.23 0.00 0.00 -0.11 0.00 0.00 41.96 39.47 2yt8 s TYR 75 CO 0.11 -0.32 0.00 0.41 -1.11 0.00 0.00 175.55 174.64 2yt8 n GLY 76 N -1.71 1.27 3.72 0.71 0.00 0.25 -4.53 105.19 104.90 2yt8 n GLY 76 Ca 0.06 0.49 -0.41 0.00 0.00 0.00 0.00 46.02 46.15 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 4.65 -0.25 1.61 2.12 -1.26 -0.59 118.70 124.98 2yt8 s GLU 77 Ca 0.00 1.46 -0.01 0.00 0.36 0.00 0.00 54.97 56.78 2yt8 s GLU 77 Cb 0.00 -3.39 0.08 0.00 0.26 0.00 0.00 34.13 31.07 2yt8 s GLU 77 CO 0.00 0.13 0.04 0.08 -0.54 0.00 0.00 175.26 174.97 2yt8 s VAL 78 N 0.28 0.90 -0.56 3.70 1.01 -0.73 -4.96 120.40 120.04 2yt8 s VAL 78 Ca 0.49 -1.05 -0.26 0.00 0.00 0.00 0.00 61.98 61.16 2yt8 s VAL 78 Cb -0.23 -1.46 0.04 0.00 0.00 0.00 0.00 36.38 34.72 2yt8 s VAL 78 CO 0.30 -0.37 1.05 -1.00 0.00 0.00 0.00 175.10 175.07 2yt8 s HIS 79 N 1.65 2.72 -0.19 5.22 3.76 -1.26 -1.67 115.29 125.52 2yt8 s HIS 79 Ca 0.02 0.19 -0.03 0.00 -0.15 0.00 0.00 55.06 55.08 2yt8 s HIS 79 Cb -0.18 -4.25 -0.01 0.00 1.11 0.00 0.00 32.58 29.24 2yt8 s HIS 79 CO -0.14 -1.44 -0.05 0.42 -0.85 0.00 0.00 174.74 172.68 2yt8 s ILE 80 N 4.36 3.49 -0.45 0.60 1.01 0.27 0.52 121.20 131.00 2yt8 s ILE 80 Ca 0.36 -0.47 -0.18 0.00 0.00 0.00 0.00 60.65 60.36 2yt8 s ILE 80 Cb -0.10 -2.56 0.04 0.00 0.01 0.00 0.00 42.46 39.84 2yt8 s ILE 80 CO 0.22 0.45 0.49 -0.75 0.00 0.00 0.00 174.94 175.35 2yt8 s LYS 81 N 1.05 3.09 -0.02 2.79 2.20 -0.00 -0.64 119.74 128.22 2yt8 s LYS 81 Ca 0.01 -0.85 -0.10 0.00 -0.36 0.00 0.00 55.97 54.68 2yt8 s LYS 81 Cb -0.15 -4.02 -0.05 0.00 -1.51 0.00 0.00 37.83 32.11 2yt8 s LYS 81 CO 0.00 -0.97 0.29 0.95 -0.36 0.00 0.00 175.35 175.27 2yt8 s THR 82 N 2.22 5.25 -0.11 3.43 -4.23 -0.47 -2.41 115.64 119.31 2yt8 s THR 82 Ca 0.12 0.43 -0.08 0.00 -1.18 0.00 0.00 61.69 60.98 2yt8 s THR 82 Cb -0.18 -3.58 0.04 0.00 1.34 0.00 0.00 72.50 70.12 2yt8 s THR 82 CO 0.13 0.49 0.27 -0.32 -0.54 0.00 0.00 174.62 174.65 2yt8 s MET 83 N -1.36 0.29 -0.18 3.99 0.00 0.13 -2.90 119.30 119.27 2yt8 s MET 83 Ca 0.24 0.46 -0.29 0.00 0.00 0.00 0.00 55.69 56.09 2yt8 s MET 83 Cb -0.14 0.06 -0.03 0.00 0.00 0.00 0.00 34.83 34.71 2yt8 s MET 83 CO 0.12 -0.09 1.58 -1.25 0.00 0.00 0.00 175.02 175.38 2yt8 s PRO 84 N 0.59 3.93 0.34 4.11 0.04 -1.26 -0.01 135.00 142.73 2yt8 s PRO 84 Ca -0.04 1.77 0.14 0.00 0.04 0.00 0.00 61.00 62.91 2yt8 s PRO 84 Cb -0.05 -3.99 1.10 0.00 0.04 0.00 0.00 34.50 31.60 2yt8 s PRO 84 CO -0.03 -1.13 1.62 0.00 0.04 0.00 0.00 177.00 177.50 2yt8 h ALA 85 N 10.16 1.86 -0.01 8.56 0.00 -1.91 -1.46 119.26 136.46 2yt8 h ALA 85 Ca -0.34 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2yt8 h ALA 85 Cb 1.15 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 2yt8 h ALA 85 CO 0.99 -0.70 -0.10 0.00 0.00 0.00 0.00 179.25 179.44 2yt8 h ALA 86 N 1.91 -0.54 0.11 0.00 0.00 -1.95 0.15 119.26 118.94 2yt8 h ALA 86 Ca 0.74 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.63 2yt8 h ALA 86 Cb 1.77 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 20.18 2yt8 h ALA 86 CO -0.71 -0.57 -0.13 1.15 0.00 0.00 0.00 179.25 179.00 2yt8 h THR 87 N -0.11 0.00 -0.81 0.00 2.02 -1.69 -0.46 112.91 111.85 2yt8 h THR 87 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.26 2yt8 h THR 87 Cb 0.12 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.44 2yt8 h THR 87 CO -0.07 0.00 -0.48 0.00 0.37 0.00 0.00 175.52 175.34 2yt8 n TYR 88 N -3.07 -0.36 -0.20 3.16 9.36 -0.87 0.76 117.16 125.94 2yt8 n TYR 88 Ca -0.03 1.02 0.01 0.00 3.32 0.00 0.00 57.90 62.22 2yt8 n TYR 88 Cb 0.11 -0.56 0.11 0.00 -0.63 0.00 0.00 39.34 38.37 2yt8 n TYR 88 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2yt8 h ARG 89 N 0.00 0.28 0.00 2.98 2.47 -0.61 0.33 114.38 119.83 2yt8 h ARG 89 Ca 0.13 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.82 2yt8 h ARG 89 Cb 0.33 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 28.59 2yt8 h ARG 89 CO -0.77 0.19 -0.07 -0.07 0.56 0.00 0.00 179.97 179.81 2yt8 h LEU 90 N 0.29 0.00 0.21 3.04 3.38 0.21 -1.94 115.31 120.50 2yt8 h LEU 90 Ca 0.32 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.96 2yt8 h LEU 90 Cb 0.46 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.23 2yt8 h LEU 90 CO -0.38 0.07 -1.47 -0.07 0.09 0.00 0.00 178.44 176.68 2yt8 h LEU 91 N 0.00 0.70 -2.91 1.67 3.38 0.35 -3.27 115.31 115.22 2yt8 h LEU 91 Ca -0.00 -0.79 -0.07 0.00 0.09 0.00 0.00 57.88 57.11 2yt8 h LEU 91 Cb 0.30 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2yt8 h LEU 91 CO 0.01 1.63 0.09 0.35 0.09 0.00 0.00 178.44 180.60 2yt8 n THR 92 N -3.64 2.05 -1.21 0.22 -2.24 -0.05 -4.94 114.28 104.48 2yt8 n THR 92 Ca -0.16 -1.05 -0.17 0.00 -2.27 0.00 0.00 64.05 60.41 2yt8 n THR 92 Cb 1.08 -0.40 0.13 0.00 -2.10 0.00 0.00 70.33 69.04 2yt8 n THR 92 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yt8 n GLY 93 N 0.23 -1.91 0.35 3.38 0.00 -0.77 -5.02 105.19 101.45 2yt8 n GLY 93 Ca 0.24 -1.60 0.15 0.00 0.00 0.00 0.00 46.02 44.81 2yt8 n GLY 93 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14