#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dyy s LYS 2 N 0.00 4.47 -0.06 2.12 2.20 -1.26 -3.85 119.74 123.37 2dyy s LYS 2 Ca 0.00 1.87 -0.03 0.00 -0.36 0.00 0.00 55.97 57.45 2dyy s LYS 2 Cb 0.00 -3.26 0.04 0.00 -1.51 0.00 0.00 37.83 33.10 2dyy s LYS 2 CO 0.00 -0.13 0.11 -2.00 -0.36 0.00 0.00 175.35 172.97 2dyy s GLU 3 N 0.03 -0.00 0.02 4.03 2.12 0.21 -4.97 118.70 120.15 2dyy s GLU 3 Ca 0.54 0.44 -0.27 0.00 0.36 0.00 0.00 54.97 56.05 2dyy s GLU 3 Cb -0.32 -0.33 -0.05 0.00 0.26 0.00 0.00 34.13 33.69 2dyy s GLU 3 CO 0.35 -0.28 0.84 0.54 -0.54 0.00 0.00 175.26 176.17 2dyy s VAL 4 N 1.97 4.79 -0.12 3.70 0.11 -1.26 0.01 120.40 129.60 2dyy s VAL 4 Ca 0.01 1.77 -0.04 0.00 -2.93 0.00 0.00 61.98 60.79 2dyy s VAL 4 Cb -0.12 -4.19 -0.03 0.00 -1.53 0.00 0.00 36.38 30.51 2dyy s VAL 4 CO -0.05 0.28 0.02 -0.63 -3.33 0.00 0.00 175.10 171.40 2dyy s ILE 5 N 0.38 4.42 -0.12 7.04 -1.09 0.03 -4.96 121.20 126.91 2dyy s ILE 5 Ca 0.43 -0.19 -0.07 0.00 -2.23 0.00 0.00 60.65 58.60 2dyy s ILE 5 Cb -0.21 -2.91 0.05 0.00 -1.58 0.00 0.00 42.46 37.81 2dyy s ILE 5 CO 0.24 0.55 0.28 0.12 -1.23 0.00 0.00 174.94 174.91 2dyy s PHE 6 N -0.38 -0.37 -0.02 3.97 5.36 -1.26 -3.75 117.98 121.53 2dyy s PHE 6 Ca 0.08 0.87 -0.02 0.00 -0.96 0.00 0.00 56.93 56.89 2dyy s PHE 6 Cb -0.12 0.10 0.01 0.00 -0.34 0.00 0.00 43.02 42.66 2dyy s PHE 6 CO 0.02 -0.24 0.06 -0.08 -1.46 0.00 0.00 175.22 173.52 2dyy s THR 7 N 1.09 0.00 -0.10 0.12 -1.32 -1.26 -5.01 115.64 109.16 2dyy s THR 7 Ca -0.08 -0.02 0.30 0.00 -1.21 0.00 0.00 61.69 60.69 2dyy s THR 7 Cb -0.09 -0.09 0.33 0.00 -1.51 0.00 0.00 72.50 71.15 2dyy s THR 7 CO -0.08 -0.01 1.89 -0.33 -2.21 0.00 0.00 174.62 173.88 2dyy h GLU 8 N 6.03 0.00 0.00 7.08 4.39 -1.99 -2.80 114.58 127.29 2dyy h GLU 8 Ca -0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.45 2dyy h GLU 8 Cb 1.21 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 2dyy h GLU 8 CO 0.47 0.00 0.00 0.09 -1.16 0.00 0.00 179.01 178.41 2dyy n ASN 9 N -2.72 0.00 -4.25 1.42 5.03 -1.26 -4.81 115.26 108.68 2dyy n ASN 9 Ca 0.01 -1.32 -0.14 0.00 0.87 0.00 0.00 54.58 54.00 2dyy n ASN 9 Cb 0.25 0.00 -0.10 0.00 -1.02 0.00 0.00 39.78 38.91 2dyy n ASN 9 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2dyy s ALA 10 N -2.00 1.43 0.14 5.41 0.00 -1.06 -4.79 121.76 120.89 2dyy s ALA 10 Ca 0.27 -1.49 -0.33 0.00 0.00 0.00 0.00 51.96 50.40 2dyy s ALA 10 Cb 0.12 0.07 -0.13 0.00 0.00 0.00 0.00 23.12 23.18 2dyy s ALA 10 CO 0.21 -0.11 1.65 -2.30 0.00 0.00 0.00 175.76 175.20 2dyy n PRO 11 N -0.19 2.29 -2.14 0.00 -0.02 -1.26 -4.85 135.00 128.82 2dyy n PRO 11 Ca -0.10 0.83 -0.41 0.00 -2.02 0.00 0.00 63.50 61.79 2dyy n PRO 11 Cb 0.61 -2.62 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 2dyy n PRO 11 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2dyy s LYS 12 N 1.40 4.34 -0.24 -0.52 1.02 -1.26 -4.96 119.74 119.52 2dyy s LYS 12 Ca 0.80 2.14 -0.29 0.00 0.02 0.00 0.00 55.97 58.64 2dyy s LYS 12 Cb -0.64 -3.17 0.01 0.00 -0.52 0.00 0.00 37.83 33.51 2dyy s LYS 12 CO 0.38 -0.32 1.03 -1.25 -0.92 0.00 0.00 175.35 174.27 2dyy s PRO 13 N -0.10 4.23 -0.41 -1.68 0.04 -1.26 -5.00 135.00 130.82 2dyy s PRO 13 Ca 0.58 1.30 -0.17 0.00 0.04 0.00 0.00 61.00 62.75 2dyy s PRO 13 Cb -0.38 -3.65 0.02 0.00 0.04 0.00 0.00 34.50 30.52 2dyy s PRO 13 CO 0.39 -0.65 0.45 0.42 0.04 0.00 0.00 177.00 177.64 2dyy s ILE 14 N 3.23 5.07 -0.53 0.56 1.09 -1.26 -4.91 121.20 124.46 2dyy s ILE 14 Ca 0.44 -0.26 0.00 0.00 -1.10 0.00 0.00 60.65 59.73 2dyy s ILE 14 Cb -0.15 -4.03 0.00 0.00 -1.06 0.00 0.00 42.46 37.22 2dyy s ILE 14 CO 0.07 -0.40 0.00 0.61 -0.10 0.00 0.00 174.94 175.12 2dyy n GLY 15 N 5.08 0.89 2.56 6.18 0.00 -1.26 -4.88 105.19 113.77 2dyy n GLY 15 Ca -0.07 -2.29 -0.33 0.00 0.00 0.00 0.00 46.02 43.33 2dyy n GLY 15 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dyy n PRO 16 N -1.10 2.71 -3.68 1.61 -0.04 -1.26 -4.84 135.00 128.39 2dyy n PRO 16 Ca 0.00 -1.90 -0.10 0.00 -0.04 0.00 0.00 63.50 61.46 2dyy n PRO 16 Cb 0.00 -2.72 -0.04 0.00 -0.04 0.00 0.00 33.50 30.70 2dyy n PRO 16 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2dyy s TYR 17 N 3.09 -0.16 0.24 0.54 1.13 -1.26 -5.17 117.35 115.75 2dyy s TYR 17 Ca 0.53 -0.16 0.09 0.00 -1.41 0.00 0.00 57.07 56.13 2dyy s TYR 17 Cb 0.14 0.33 -0.04 0.00 -1.10 0.00 0.00 41.96 41.29 2dyy s TYR 17 CO -0.03 -0.82 -0.05 -1.12 -2.51 0.00 0.00 175.55 171.02 2dyy s SER 18 N -2.84 4.39 0.45 -0.18 0.01 -1.26 -4.83 113.70 109.44 2dyy s SER 18 Ca 0.06 -0.64 0.11 0.00 1.31 0.00 0.00 55.95 56.79 2dyy s SER 18 Cb 0.00 -0.77 1.01 0.00 0.21 0.00 0.00 66.02 66.48 2dyy s SER 18 CO -0.07 0.04 2.07 1.56 0.41 0.00 0.00 173.24 177.25 2dyy h GLN 19 N 2.28 0.27 -1.78 12.44 4.20 -1.93 -3.40 115.11 127.18 2dyy h GLN 19 Ca -0.45 -0.02 0.16 0.00 0.06 0.00 0.00 58.65 58.39 2dyy h GLN 19 Cb 1.23 -0.06 -0.19 0.00 0.30 0.00 0.00 27.48 28.77 2dyy h GLN 19 CO 0.58 0.21 0.63 0.00 -0.67 0.00 0.00 178.83 179.59 2dyy s ALA 20 N -5.19 -1.95 -0.06 3.87 0.00 -1.25 -0.55 121.76 116.63 2dyy s ALA 20 Ca -0.06 1.39 0.03 0.00 0.00 0.00 0.00 51.96 53.32 2dyy s ALA 20 Cb 0.17 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.15 2dyy s ALA 20 CO 0.71 -0.54 -0.14 0.42 0.00 0.00 0.00 175.76 176.21 2dyy s ILE 21 N -2.27 1.27 -0.36 0.00 -1.09 -0.31 -0.79 121.20 117.65 2dyy s ILE 21 Ca 0.05 -0.57 -0.12 0.00 -2.23 0.00 0.00 60.65 57.78 2dyy s ILE 21 Cb -0.01 -1.14 0.02 0.00 -1.58 0.00 0.00 42.46 39.75 2dyy s ILE 21 CO -0.05 0.38 0.21 -0.75 -1.23 0.00 0.00 174.94 173.51 2dyy s LYS 22 N 0.51 3.01 -0.24 2.79 2.20 0.10 -0.59 119.74 127.52 2dyy s LYS 22 Ca -0.13 -0.96 0.02 0.00 -0.36 0.00 0.00 55.97 54.54 2dyy s LYS 22 Cb -0.15 -3.75 0.06 0.00 -1.51 0.00 0.00 37.83 32.48 2dyy s LYS 22 CO 0.04 -0.63 -0.08 0.00 -0.36 0.00 0.00 175.35 174.32 2dyy s ALA 23 N 1.60 2.24 0.00 3.13 0.00 0.35 -0.62 121.76 128.46 2dyy s ALA 23 Ca 0.03 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 50.46 2dyy s ALA 23 Cb -0.19 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.44 2dyy s ALA 23 CO 0.07 -1.18 0.00 0.41 0.00 0.00 0.00 175.76 175.07 2dyy n GLY 24 N 4.56 1.56 0.99 0.00 0.00 -1.25 -1.88 105.19 109.17 2dyy n GLY 24 Ca -0.13 -0.61 0.09 0.00 0.00 0.00 0.00 46.02 45.37 2dyy n GLY 24 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dyy n ASN 25 N 3.87 2.88 -4.78 1.61 3.02 -1.26 -4.84 115.26 115.76 2dyy n ASN 25 Ca 0.00 -1.98 -0.35 0.00 -0.03 0.00 0.00 54.58 52.22 2dyy n ASN 25 Cb 0.00 -0.34 -0.07 0.00 -0.61 0.00 0.00 39.78 38.75 2dyy n ASN 25 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2dyy s PHE 26 N -1.32 3.35 -0.11 3.10 0.08 -0.79 -1.72 117.98 120.58 2dyy s PHE 26 Ca 0.36 0.31 0.03 0.00 0.12 0.00 0.00 56.93 57.76 2dyy s PHE 26 Cb 0.19 -1.82 0.01 0.00 -0.57 0.00 0.00 43.02 40.83 2dyy s PHE 26 CO 0.25 0.59 -0.22 -1.17 -0.10 0.00 0.00 175.22 174.57 2dyy s LEU 27 N -1.24 2.03 -0.29 -0.37 2.96 0.04 -0.50 118.68 121.31 2dyy s LEU 27 Ca 0.17 -0.54 -0.03 0.00 -0.22 0.00 0.00 54.13 53.51 2dyy s LEU 27 Cb -0.12 -1.35 0.04 0.00 0.50 0.00 0.00 46.19 45.26 2dyy s LEU 27 CO 0.07 0.11 0.01 -0.36 -1.32 0.00 0.00 176.35 174.86 2dyy s PHE 28 N 0.58 3.20 -0.17 5.38 0.40 0.24 -1.58 117.98 126.03 2dyy s PHE 28 Ca -0.14 -1.64 -0.13 0.00 -0.60 0.00 0.00 56.93 54.43 2dyy s PHE 28 Cb -0.17 -2.13 -0.05 0.00 0.51 0.00 0.00 43.02 41.18 2dyy s PHE 28 CO 0.04 -0.75 0.24 0.42 0.70 0.00 0.00 175.22 175.87 2dyy s ILE 29 N 1.32 5.34 0.63 0.64 1.01 -0.74 -1.16 121.20 128.24 2dyy s ILE 29 Ca -0.03 0.44 -0.18 0.00 0.00 0.00 0.00 60.65 60.89 2dyy s ILE 29 Cb -0.19 -3.58 -0.02 0.00 0.01 0.00 0.00 42.46 38.69 2dyy s ILE 29 CO -0.01 0.41 1.24 0.00 0.00 0.00 0.00 174.94 176.58 2dyy s ALA 30 N 0.42 2.42 0.09 9.38 0.00 0.28 -3.72 121.76 130.64 2dyy s ALA 30 Ca 0.14 1.07 -0.35 0.00 0.00 0.00 0.00 51.96 52.82 2dyy s ALA 30 Cb -0.12 -3.50 -0.15 0.00 0.00 0.00 0.00 23.12 19.35 2dyy s ALA 30 CO 0.02 -1.44 1.54 0.41 0.00 0.00 0.00 175.76 176.30 2dyy n GLY 31 N 0.64 0.94 3.68 0.00 0.00 -1.26 -4.76 105.19 104.43 2dyy n GLY 31 Ca 0.14 0.70 -0.32 0.00 0.00 0.00 0.00 46.02 46.54 2dyy n GLY 31 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dyy s GLN 32 N 1.19 2.76 0.24 1.61 -1.52 0.06 -4.92 119.66 119.08 2dyy s GLN 32 Ca 0.83 -0.63 0.12 0.00 -1.95 0.00 0.00 55.36 53.72 2dyy s GLN 32 Cb -0.78 -2.65 -0.05 0.00 -0.22 0.00 0.00 33.01 29.30 2dyy s GLN 32 CO 0.43 0.62 -0.21 0.96 -0.25 0.00 0.00 175.29 176.84 2dyy s ILE 33 N -1.10 2.39 0.00 1.08 -4.36 -1.26 -1.73 121.20 116.22 2dyy s ILE 33 Ca 0.20 -2.26 -0.00 0.00 -0.26 0.00 0.00 60.65 58.32 2dyy s ILE 33 Cb -0.12 -2.22 -0.02 0.00 1.25 0.00 0.00 42.46 41.36 2dyy s ILE 33 CO 0.11 -0.31 0.68 -0.81 0.24 0.00 0.00 174.94 174.85 2dyy n PRO 34 N -0.28 0.17 -3.66 0.37 -0.04 -1.26 -4.64 135.00 125.67 2dyy n PRO 34 Ca -0.08 -0.08 -0.36 0.00 -0.04 0.00 0.00 63.50 62.95 2dyy n PRO 34 Cb 0.59 -1.53 -0.06 0.00 -0.04 0.00 0.00 33.50 32.46 2dyy n PRO 34 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2dyy s ILE 35 N 2.61 5.20 -0.50 0.52 1.01 -1.26 -0.70 121.20 128.08 2dyy s ILE 35 Ca 0.05 0.43 -0.17 0.00 0.00 0.00 0.00 60.65 60.96 2dyy s ILE 35 Cb 0.02 -3.60 0.08 0.00 0.01 0.00 0.00 42.46 38.97 2dyy s ILE 35 CO 0.00 0.43 0.49 -0.62 0.00 0.00 0.00 174.94 175.23 2dyy s ASP 36 N -1.48 6.17 0.49 3.58 2.15 -0.79 -4.81 116.67 121.98 2dyy s ASP 36 Ca 0.27 -1.29 0.33 0.00 0.43 0.00 0.00 52.55 52.29 2dyy s ASP 36 Cb -0.14 -2.22 1.45 0.00 -0.30 0.00 0.00 42.92 41.71 2dyy s ASP 36 CO 0.14 -0.76 1.71 1.55 -0.17 0.00 0.00 175.17 177.64 2dyy h PRO 37 N 8.86 0.11 -0.67 4.34 0.13 -1.88 0.35 132.00 143.24 2dyy h PRO 37 Ca -0.28 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.79 2dyy h PRO 37 Cb 1.10 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.18 2dyy h PRO 37 CO 0.93 0.07 0.20 -0.22 -0.23 0.00 0.00 178.00 178.76 2dyy h LYS 38 N 0.11 1.02 0.00 0.86 3.64 -1.92 -3.27 116.57 117.01 2dyy h LYS 38 Ca 0.70 -0.21 -0.09 0.00 -1.27 0.00 0.00 60.65 59.79 2dyy h LYS 38 Cb 2.44 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 34.09 2dyy h LYS 38 CO -0.18 0.88 -1.93 0.25 -2.27 0.00 0.00 179.45 176.19 2dyy n THR 39 N -4.27 0.33 -0.98 1.00 -2.24 0.07 -5.00 114.28 103.19 2dyy n THR 39 Ca 0.05 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 2dyy n THR 39 Cb 0.22 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 2dyy n THR 39 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dyy n GLY 40 N 1.60 0.55 3.60 3.38 0.00 0.10 -5.02 105.19 109.40 2dyy n GLY 40 Ca -0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 2dyy n GLY 40 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dyy s GLU 41 N -0.23 2.03 0.49 1.61 2.02 -1.26 -4.90 118.70 118.46 2dyy s GLU 41 Ca 0.00 -1.68 -0.23 0.00 0.02 0.00 0.00 54.97 53.08 2dyy s GLU 41 Cb 0.00 -1.94 -0.07 0.00 0.10 0.00 0.00 34.13 32.22 2dyy s GLU 41 CO 0.00 0.23 1.30 0.42 0.02 0.00 0.00 175.26 177.23 2dyy s ILE 42 N -2.47 2.47 -0.26 -1.63 -1.09 -1.26 -1.88 121.20 115.08 2dyy s ILE 42 Ca 0.33 0.37 0.27 0.00 -2.23 0.00 0.00 60.65 59.39 2dyy s ILE 42 Cb -0.03 -3.20 0.35 0.00 -1.58 0.00 0.00 42.46 38.01 2dyy s ILE 42 CO 0.18 0.01 1.77 -0.37 -1.23 0.00 0.00 174.94 175.31 2dyy h VAL 43 N 1.83 0.00 0.00 2.92 -1.51 -1.25 -3.45 116.25 114.79 2dyy h VAL 43 Ca -0.50 -0.73 0.00 0.00 -1.23 0.00 0.00 66.70 64.24 2dyy h VAL 43 Cb 1.27 1.71 0.00 0.00 -2.13 0.00 0.00 31.29 32.14 2dyy h VAL 43 CO 0.59 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.54 2dyy n GLY 45 N 0.64 0.65 3.69 5.19 0.00 -1.26 -5.01 105.19 109.09 2dyy n GLY 45 Ca 0.03 -1.65 -0.35 0.00 0.00 0.00 0.00 46.02 44.04 2dyy n GLY 45 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dyy s ASP 46 N -4.00 6.04 0.27 1.61 2.15 -1.26 -4.96 116.67 116.52 2dyy s ASP 46 Ca 0.00 0.16 -0.03 0.00 0.43 0.00 0.00 52.55 53.11 2dyy s ASP 46 Cb 0.00 -2.06 0.55 0.00 -0.30 0.00 0.00 42.92 41.10 2dyy s ASP 46 CO 0.00 0.15 1.42 0.00 -0.17 0.00 0.00 175.17 176.57 2dyy n ILE 47 N 3.72 -0.38 -0.25 4.11 0.13 -1.26 0.98 119.36 126.41 2dyy n ILE 47 Ca -0.16 2.05 0.05 0.00 -1.10 0.00 0.00 62.75 63.58 2dyy n ILE 47 Cb 0.52 -2.90 0.28 0.00 -0.84 0.00 0.00 39.64 36.70 2dyy n ILE 47 CO 0.00 0.00 0.00 0.11 2.80 0.00 0.00 176.55 179.46 2dyy h LYS 48 N 0.00 0.90 0.11 9.51 6.56 -1.96 0.26 116.57 131.95 2dyy h LYS 48 Ca 0.49 -0.05 -0.30 0.00 -1.06 0.00 0.00 60.65 59.73 2dyy h LYS 48 Cb 0.88 -0.20 -0.01 0.00 -0.57 0.00 0.00 32.23 32.33 2dyy h LYS 48 CO -0.90 0.59 -1.49 -0.44 -2.06 0.00 0.00 179.45 175.16 2dyy h ASP 49 N 0.92 0.37 -0.17 0.86 5.19 0.20 -2.88 116.42 120.92 2dyy h ASP 49 Ca 0.35 -0.49 -0.10 0.00 -0.62 0.00 0.00 57.03 56.17 2dyy h ASP 49 Cb 0.19 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.56 2dyy h ASP 49 CO -0.12 1.41 -0.21 1.56 -3.12 0.00 0.00 179.24 178.76 2dyy h GLN 50 N 0.06 0.60 0.00 3.56 4.20 -0.23 -0.91 115.11 122.40 2dyy h GLN 50 Ca -0.22 -0.22 -0.06 0.00 0.06 0.00 0.00 58.65 58.20 2dyy h GLN 50 Cb 2.00 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.73 2dyy h GLN 50 CO 0.16 0.77 -0.30 0.00 -0.67 0.00 0.00 178.83 178.79 2dyy h THR 51 N 0.54 0.68 0.05 -0.54 1.03 -0.57 -1.85 112.91 112.25 2dyy h THR 51 Ca 0.08 -1.39 -0.26 0.00 -0.01 0.00 0.00 66.41 64.83 2dyy h THR 51 Cb 0.66 1.91 0.01 0.00 -1.07 0.00 0.00 68.15 69.66 2dyy h THR 51 CO 0.05 0.30 -1.08 -0.09 -0.01 0.00 0.00 175.52 174.68 2dyy h ARG 52 N 0.00 0.47 -0.31 0.00 2.43 -1.16 -2.69 114.38 113.12 2dyy h ARG 52 Ca -0.00 -0.58 -0.10 0.00 -0.81 0.00 0.00 59.98 58.48 2dyy h ARG 52 Cb 0.89 0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 2dyy h ARG 52 CO 0.04 1.22 -0.21 0.37 -1.51 0.00 0.00 179.97 179.88 2dyy h GLN 53 N 0.24 0.69 -0.83 0.20 5.75 -1.02 -0.58 115.11 119.57 2dyy h GLN 53 Ca -0.12 -0.33 0.01 0.00 -0.15 0.00 0.00 58.65 58.07 2dyy h GLN 53 Cb 1.74 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 30.24 2dyy h GLN 53 CO 0.19 0.93 0.54 0.28 -2.65 0.00 0.00 178.83 178.13 2dyy h VAL 54 N 0.45 1.19 -0.25 2.39 2.07 -1.40 0.12 116.25 120.82 2dyy h VAL 54 Ca 0.06 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.11 2dyy h VAL 54 Cb 0.76 -0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2dyy h VAL 54 CO 0.06 0.20 -0.27 -0.07 0.02 0.00 0.00 177.57 177.51 2dyy h LEU 55 N 1.10 0.50 -0.44 2.57 4.07 -1.33 -1.58 115.31 120.21 2dyy h LEU 55 Ca 0.31 -0.18 -0.06 0.00 0.08 0.00 0.00 57.88 58.04 2dyy h LEU 55 Cb -0.09 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.49 2dyy h LEU 55 CO -0.08 0.76 0.05 -0.33 -1.08 0.00 0.00 178.44 177.77 2dyy h GLU 56 N 0.44 0.73 0.05 1.13 4.39 -0.01 -1.60 114.58 119.72 2dyy h GLU 56 Ca 0.06 -0.21 0.00 0.00 0.34 0.00 0.00 59.36 59.56 2dyy h GLU 56 Cb 0.70 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.26 2dyy h GLU 56 CO 0.05 0.77 -0.06 -0.91 -1.16 0.00 0.00 179.01 177.70 2dyy h ASN 57 N 0.59 -0.17 -0.53 1.42 2.35 -0.76 -0.45 115.58 118.03 2dyy h ASN 57 Ca 0.13 0.02 0.09 0.00 -0.55 0.00 0.00 56.30 55.99 2dyy h ASN 57 Cb 0.41 0.06 -0.07 0.00 0.05 0.00 0.00 38.32 38.77 2dyy h ASN 57 CO 0.01 -0.10 0.12 0.40 -1.65 0.00 0.00 177.43 176.21 2dyy h ILE 58 N -0.14 0.72 -0.49 2.81 2.04 -1.16 -1.79 117.51 119.49 2dyy h ILE 58 Ca 0.01 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 2dyy h ILE 58 Cb 0.14 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 2dyy h ILE 58 CO -0.03 0.05 0.28 0.50 0.00 0.00 0.00 178.15 178.95 2dyy h LYS 59 N 0.26 0.68 -0.70 2.37 3.64 -0.87 -1.14 116.57 120.82 2dyy h LYS 59 Ca 0.27 -0.07 0.10 0.00 -1.27 0.00 0.00 60.65 59.67 2dyy h LYS 59 Cb 0.36 -0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 31.97 2dyy h LYS 59 CO -0.33 0.52 0.34 0.00 -2.27 0.00 0.00 179.45 177.70 2dyy h ALA 60 N 1.13 0.96 -0.22 5.00 0.00 -0.28 -1.70 119.26 124.16 2dyy h ALA 60 Ca 0.18 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2dyy h ALA 60 Cb 0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2dyy h ALA 60 CO -0.03 -0.07 0.05 0.82 0.00 0.00 0.00 179.25 180.02 2dyy h ILE 61 N 0.57 1.21 -0.30 0.00 2.04 -0.86 -2.17 117.51 118.01 2dyy h ILE 61 Ca 0.35 -0.69 0.06 0.00 1.00 0.00 0.00 64.86 65.58 2dyy h ILE 61 Cb 0.39 1.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.66 2dyy h ILE 61 CO -0.28 0.22 -0.10 -0.07 0.00 0.00 0.00 178.15 177.92 2dyy h LEU 62 N 0.17 -0.36 -1.36 1.44 3.38 -0.56 -2.01 115.31 116.02 2dyy h LEU 62 Ca 0.07 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 2dyy h LEU 62 Cb 0.28 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2dyy h LEU 62 CO 0.00 -0.13 -0.20 -0.33 0.09 0.00 0.00 178.44 177.87 2dyy h GLU 63 N -0.04 0.17 0.00 1.13 5.08 -1.30 0.33 114.58 119.95 2dyy h GLU 63 Ca 0.15 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2dyy h GLU 63 Cb 0.26 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2dyy h GLU 63 CO -0.33 0.38 0.00 0.00 -1.00 0.00 0.00 179.01 178.06 2dyy n ALA 64 N -2.49 1.58 -0.02 3.43 0.00 -0.78 -2.57 120.51 119.66 2dyy n ALA 64 Ca -0.01 0.11 0.07 0.00 0.00 0.00 0.00 53.44 53.61 2dyy n ALA 64 Cb 0.31 -1.39 -0.14 0.00 0.00 0.00 0.00 19.45 18.23 2dyy n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dyy n ALA 65 N -1.79 2.54 0.00 0.00 0.00 -0.56 -4.92 120.51 115.78 2dyy n ALA 65 Ca 0.02 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.96 2dyy n ALA 65 Cb 0.21 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.10 2dyy n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dyy n GLY 66 N 1.54 1.88 3.74 0.00 0.00 -0.62 -5.11 105.19 106.62 2dyy n GLY 66 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 2dyy n GLY 66 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dyy s TYR 67 N -2.00 2.00 0.08 1.61 4.12 -0.00 -4.99 117.35 118.17 2dyy s TYR 67 Ca 0.00 -0.88 -0.03 0.00 0.02 0.00 0.00 57.07 56.17 2dyy s TYR 67 Cb 0.00 -1.67 -0.03 0.00 -1.52 0.00 0.00 41.96 38.74 2dyy s TYR 67 CO 0.00 0.24 0.05 -1.54 0.02 0.00 0.00 175.55 174.32 2dyy s SER 68 N -3.87 0.35 0.61 2.29 1.04 -1.26 -3.60 113.70 109.26 2dyy s SER 68 Ca 0.14 -0.95 0.28 0.00 0.48 0.00 0.00 55.95 55.90 2dyy s SER 68 Cb 0.03 0.26 1.46 0.00 0.10 0.00 0.00 66.02 67.87 2dyy s SER 68 CO 0.07 -0.67 1.86 -0.07 0.98 0.00 0.00 173.24 175.41 2dyy h LEU 69 N 2.97 0.00 -1.11 2.42 3.38 -1.95 0.49 115.31 121.51 2dyy h LEU 69 Ca -0.34 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.60 2dyy h LEU 69 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 2dyy h LEU 69 CO 0.61 0.00 -0.15 0.78 0.09 0.00 0.00 178.44 179.78 2dyy h ASN 70 N 0.00 0.00 1.59 -0.43 4.21 -1.90 -3.16 115.58 115.89 2dyy h ASN 70 Ca 0.16 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.61 2dyy h ASN 70 Cb 1.12 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.31 2dyy h ASN 70 CO -0.00 0.15 -0.42 0.44 -1.29 0.00 0.00 177.43 176.30 2dyy h ASP 71 N 0.00 0.00 -2.10 5.81 3.45 -0.27 -3.44 116.42 119.86 2dyy h ASP 71 Ca -0.00 0.00 -0.60 0.00 0.43 0.00 0.00 57.03 56.85 2dyy h ASP 71 Cb 0.71 0.00 0.03 0.00 -0.56 0.00 0.00 39.33 39.51 2dyy h ASP 71 CO 0.02 0.27 1.01 0.52 -1.57 0.00 0.00 179.24 179.49 2dyy n VAL 72 N -3.10 0.42 -0.04 -1.35 0.31 -1.20 -1.57 118.33 111.80 2dyy n VAL 72 Ca 0.02 -0.08 -0.02 0.00 -0.01 0.00 0.00 64.34 64.25 2dyy n VAL 72 Cb 0.65 -1.78 -0.08 0.00 -0.91 0.00 0.00 33.84 31.71 2dyy n VAL 72 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 2dyy n ILE 73 N 4.66 0.48 -3.78 2.52 -5.35 0.45 -4.35 119.36 113.98 2dyy n ILE 73 Ca 0.21 -0.37 -0.13 0.00 -0.27 0.00 0.00 62.75 62.19 2dyy n ILE 73 Cb 0.29 -0.42 -0.13 0.00 -1.74 0.00 0.00 39.64 37.64 2dyy n ILE 73 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 2dyy s LYS 74 N -2.41 0.14 -0.01 6.28 2.20 -1.03 -0.90 119.74 124.01 2dyy s LYS 74 Ca -0.05 0.31 0.04 0.00 -0.36 0.00 0.00 55.97 55.91 2dyy s LYS 74 Cb 0.04 -0.05 -0.01 0.00 -1.51 0.00 0.00 37.83 36.30 2dyy s LYS 74 CO 0.43 -0.10 -0.13 0.08 -0.36 0.00 0.00 175.35 175.27 2dyy s VAL 75 N 0.67 1.05 -0.20 4.02 1.01 -0.20 -0.59 120.40 126.16 2dyy s VAL 75 Ca -0.05 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.38 2dyy s VAL 75 Cb -0.06 -0.88 0.04 0.00 0.00 0.00 0.00 36.38 35.47 2dyy s VAL 75 CO -0.03 0.30 -0.12 -0.89 0.00 0.00 0.00 175.10 174.35 2dyy s THR 76 N -0.26 1.81 -0.27 3.92 2.01 0.74 -1.35 115.64 122.23 2dyy s THR 76 Ca 0.04 -1.09 -0.09 0.00 0.31 0.00 0.00 61.69 60.86 2dyy s THR 76 Cb -0.06 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.59 2dyy s THR 76 CO -0.00 0.22 0.12 -0.69 -0.69 0.00 0.00 174.62 173.57 2dyy s VAL 77 N 1.33 4.60 -0.23 3.82 1.01 0.22 -1.00 120.40 130.15 2dyy s VAL 77 Ca -0.01 -0.15 -0.08 0.00 0.00 0.00 0.00 61.98 61.73 2dyy s VAL 77 Cb -0.16 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 2dyy s VAL 77 CO -0.09 0.26 0.10 -0.31 0.00 0.00 0.00 175.10 175.06 2dyy s TYR 78 N 1.65 3.18 0.28 5.22 1.51 0.17 -1.84 117.35 127.52 2dyy s TYR 78 Ca 0.06 -0.10 0.10 0.00 -1.01 0.00 0.00 57.07 56.12 2dyy s TYR 78 Cb -0.16 -2.22 -0.05 0.00 -0.11 0.00 0.00 41.96 39.43 2dyy s TYR 78 CO 0.06 -0.12 -0.06 -0.51 -1.11 0.00 0.00 175.55 173.80 2dyy s LEU 79 N 1.20 2.97 -0.56 -1.29 1.43 0.72 -1.04 118.68 122.11 2dyy s LEU 79 Ca 0.05 -0.82 0.02 0.00 -1.03 0.00 0.00 54.13 52.35 2dyy s LEU 79 Cb -0.14 -1.46 0.41 0.00 0.03 0.00 0.00 46.19 45.03 2dyy s LEU 79 CO 0.04 -0.02 1.54 2.29 0.23 0.00 0.00 176.35 180.43 2dyy n LYS 80 N -0.82 3.16 -2.67 1.70 -0.00 -1.22 0.12 118.16 118.44 2dyy n LYS 80 Ca -0.06 -3.96 -0.10 0.00 -0.00 0.00 0.00 58.31 54.20 2dyy n LYS 80 Cb 0.60 -2.27 0.05 0.00 -0.00 0.00 0.00 35.03 33.41 2dyy n LYS 80 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2dyy n ASP 81 N -0.62 -4.61 -4.98 -5.58 10.43 -1.26 -4.92 116.55 105.00 2dyy n ASP 81 Ca 0.48 -0.45 -0.22 0.00 2.57 0.00 0.00 54.79 57.17 2dyy n ASP 81 Cb 0.61 -3.54 0.04 0.00 1.84 0.00 0.00 41.12 40.06 2dyy n ASP 81 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 2dyy s PHE 85 N -3.25 1.45 -1.91 1.24 2.99 -1.26 -5.15 117.98 112.09 2dyy s PHE 85 Ca 0.26 -0.78 0.00 0.00 0.00 0.00 0.00 56.93 56.40 2dyy s PHE 85 Cb -0.03 -2.08 0.00 0.00 0.00 0.00 0.00 43.02 40.90 2dyy s PHE 85 CO 0.48 -0.90 0.93 0.00 -0.00 0.00 0.00 175.22 175.73 2dyy n ALA 86 N -2.06 2.48 -1.91 5.36 0.00 -1.26 -3.87 120.51 119.25 2dyy n ALA 86 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.18 2dyy n ALA 86 Cb 0.63 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 19.12 2dyy n ALA 86 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2dyy n LYS 87 N -0.45 2.96 0.00 0.00 2.85 -1.26 -4.67 118.16 117.58 2dyy n LYS 87 Ca 0.00 -3.73 0.00 0.00 -1.05 0.00 0.00 58.31 53.53 2dyy n LYS 87 Cb 0.02 -2.27 0.00 0.00 -0.65 0.00 0.00 35.03 32.13 2dyy n LYS 87 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2dyy n MET 88 N -0.63 0.83 -0.15 -1.58 0.00 -1.25 -4.76 117.12 109.58 2dyy n MET 88 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 57.70 58.22 2dyy n MET 88 Cb 0.48 -1.09 0.00 0.00 0.00 0.00 0.00 33.22 32.62 2dyy n MET 88 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2dyy n ASN 89 N -0.38 0.00 0.00 3.17 3.02 -1.26 -3.79 115.26 116.02 2dyy n ASN 89 Ca 0.00 -0.55 0.00 0.00 -0.03 0.00 0.00 54.58 54.00 2dyy n ASN 89 Cb 0.04 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 2dyy n ASN 89 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2dyy n GLU 90 N -0.55 0.00 -0.05 3.52 0.00 -1.26 -3.95 120.64 118.35 2dyy n GLU 90 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 57.16 57.02 2dyy n GLU 90 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 31.44 31.36 2dyy n GLU 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 2dyy h VAL 91 N 0.00 1.37 -0.95 6.31 2.07 -1.92 -2.87 116.25 120.26 2dyy h VAL 91 Ca 0.00 -1.57 0.09 0.00 0.82 0.00 0.00 66.70 66.04 2dyy h VAL 91 Cb 0.00 2.03 -0.07 0.00 -1.52 0.00 0.00 31.29 31.73 2dyy h VAL 91 CO 0.00 0.47 0.61 0.22 0.02 0.00 0.00 177.57 178.89 2dyy h TYR 92 N 0.05 1.07 -0.10 1.57 3.20 -1.69 -2.49 116.97 118.59 2dyy h TYR 92 Ca 0.00 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.93 2dyy h TYR 92 Cb 0.90 -0.35 -0.03 0.00 1.54 0.00 0.00 36.73 38.79 2dyy h TYR 92 CO 0.10 0.50 -0.05 0.00 -1.64 0.00 0.00 178.16 177.07 2dyy h ALA 93 N 1.52 0.04 0.00 1.82 0.00 -1.81 0.35 119.26 121.18 2dyy h ALA 93 Ca 0.44 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2dyy h ALA 93 Cb 0.35 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2dyy h ALA 93 CO -0.20 -0.51 0.00 -0.85 0.00 0.00 0.00 179.25 177.69 2dyy n GLU 94 N -5.18 0.01 -0.11 0.00 0.28 -0.95 -2.62 120.64 112.07 2dyy n GLU 94 Ca -0.04 0.38 -0.16 0.00 -0.16 0.00 0.00 57.16 57.17 2dyy n GLU 94 Cb 0.11 -1.52 -0.13 0.00 1.43 0.00 0.00 31.44 31.33 2dyy n GLU 94 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2dyy n TYR 95 N -1.53 0.09 -2.82 -1.84 4.01 -0.51 -4.63 117.16 109.93 2dyy n TYR 95 Ca 0.02 0.02 -0.36 0.00 -0.16 0.00 0.00 57.90 57.42 2dyy n TYR 95 Cb 0.09 -1.01 -0.01 0.00 -0.31 0.00 0.00 39.34 38.10 2dyy n TYR 95 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2dyy n PHE 96 N -3.16 3.22 -4.02 -0.72 3.01 -0.01 -4.94 117.46 110.85 2dyy n PHE 96 Ca -0.42 -3.15 -0.35 0.00 1.01 0.00 0.00 57.45 54.54 2dyy n PHE 96 Cb 1.03 -0.92 -0.09 0.00 -0.01 0.00 0.00 39.48 39.49 2dyy n PHE 96 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2dyy s GLY 97 N -2.19 1.96 0.00 1.37 0.00 -1.23 -3.26 107.32 103.98 2dyy s GLY 97 Ca 0.42 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 44.41 2dyy s GLY 97 CO -0.11 -0.13 0.00 -2.21 0.00 0.00 0.00 173.10 170.65 2dyy n GLU 98 N 2.97 0.00 0.00 2.90 2.13 -1.26 -4.85 120.64 122.54 2dyy n GLU 98 Ca -0.18 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.64 2dyy n GLU 98 Cb 0.53 -2.03 0.00 0.00 0.27 0.00 0.00 31.44 30.21 2dyy n GLU 98 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2dyy n SER 99 N 0.00 0.01 -3.27 4.31 2.88 -1.26 -4.89 113.62 111.40 2dyy n SER 99 Ca 0.00 0.01 -0.08 0.00 -1.33 0.00 0.00 58.87 57.48 2dyy n SER 99 Cb 0.00 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 2dyy n SER 99 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2dyy n LYS 100 N -2.53 -1.40 -1.24 -1.46 2.85 -1.20 -4.98 118.16 108.19 2dyy n LYS 100 Ca 0.00 1.26 -0.29 0.00 -1.05 0.00 0.00 58.31 58.23 2dyy n LYS 100 Cb 0.00 -4.87 0.18 0.00 -0.65 0.00 0.00 35.03 29.69 2dyy n LYS 100 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2dyy s PRO 101 N -3.63 0.26 0.40 -1.58 0.04 -1.26 -5.01 135.00 124.21 2dyy s PRO 101 Ca 0.04 0.34 -0.25 0.00 0.04 0.00 0.00 61.00 61.16 2dyy s PRO 101 Cb -0.01 -1.73 -0.09 0.00 0.04 0.00 0.00 34.50 32.71 2dyy s PRO 101 CO 0.79 -2.81 1.13 0.00 0.04 0.00 0.00 177.00 176.15 2dyy s ALA 102 N -3.06 3.14 0.06 8.56 0.00 -0.08 -4.88 121.76 125.50 2dyy s ALA 102 Ca 0.66 0.87 0.04 0.00 0.00 0.00 0.00 51.96 53.53 2dyy s ALA 102 Cb -0.16 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 2dyy s ALA 102 CO 0.56 -0.41 -0.11 0.50 0.00 0.00 0.00 175.76 176.30 2dyy s ARG 103 N -2.33 0.70 -0.04 0.00 3.52 -1.26 -1.03 118.95 118.51 2dyy s ARG 103 Ca 0.57 -0.89 0.02 0.00 -0.13 0.00 0.00 55.73 55.30 2dyy s ARG 103 Cb -0.28 -0.58 0.01 0.00 -1.56 0.00 0.00 34.95 32.55 2dyy s ARG 103 CO 0.35 0.12 -0.08 0.08 -0.81 0.00 0.00 175.30 174.95 2dyy s VAL 104 N -1.42 0.79 0.02 7.11 1.01 -0.46 -4.98 120.40 122.48 2dyy s VAL 104 Ca -0.05 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.64 2dyy s VAL 104 Cb -0.09 -0.73 -0.02 0.00 0.00 0.00 0.00 36.38 35.54 2dyy s VAL 104 CO 0.01 0.26 -0.09 0.00 0.00 0.00 0.00 175.10 175.29 2dyy s ALA 105 N 0.51 0.71 0.11 5.51 0.00 -1.26 -0.61 121.76 126.73 2dyy s ALA 105 Ca -0.08 -0.57 -0.14 0.00 0.00 0.00 0.00 51.96 51.16 2dyy s ALA 105 Cb -0.12 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 22.93 2dyy s ALA 105 CO 0.01 0.11 0.34 0.14 0.00 0.00 0.00 175.76 176.35 2dyy s VAL 106 N -0.72 0.09 -0.25 0.00 -7.23 -0.77 -4.99 120.40 106.54 2dyy s VAL 106 Ca -0.02 -0.75 0.00 0.00 -1.81 0.00 0.00 61.98 59.41 2dyy s VAL 106 Cb -0.06 -1.20 0.04 0.00 0.56 0.00 0.00 36.38 35.72 2dyy s VAL 106 CO 0.00 -0.41 -0.09 -1.61 -0.31 0.00 0.00 175.10 172.68 2dyy s GLU 107 N -3.72 2.60 0.52 4.82 2.02 -1.26 -0.20 118.70 123.49 2dyy s GLU 107 Ca 0.03 -1.12 0.08 0.00 0.02 0.00 0.00 54.97 53.98 2dyy s GLU 107 Cb 0.03 -2.91 0.05 0.00 0.10 0.00 0.00 34.13 31.40 2dyy s GLU 107 CO -0.11 -0.46 0.71 0.14 0.02 0.00 0.00 175.26 175.56 2dyy s VAL 108 N 1.23 2.53 0.00 2.63 -7.23 0.33 -4.84 120.40 115.06 2dyy s VAL 108 Ca -0.03 -0.96 0.00 0.00 -1.81 0.00 0.00 61.98 59.18 2dyy s VAL 108 Cb -0.18 -2.57 0.00 0.00 0.56 0.00 0.00 36.38 34.19 2dyy s VAL 108 CO -0.06 0.00 0.40 -1.20 -0.31 0.00 0.00 175.10 173.93 2dyy n SER 109 N -2.12 0.00 -4.27 4.85 7.64 -1.26 -4.39 113.62 114.07 2dyy n SER 109 Ca 0.12 0.40 -0.24 0.00 1.01 0.00 0.00 58.87 60.16 2dyy n SER 109 Cb 0.60 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.68 2dyy n SER 109 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2dyy s ARG 110 N -0.79 1.15 0.25 1.43 3.52 -1.26 -4.92 118.95 118.33 2dyy s ARG 110 Ca 0.00 -1.11 0.09 0.00 -0.13 0.00 0.00 55.73 54.58 2dyy s ARG 110 Cb 0.00 -1.38 -0.04 0.00 -1.56 0.00 0.00 34.95 31.96 2dyy s ARG 110 CO 0.00 0.33 0.00 -0.51 -0.81 0.00 0.00 175.30 174.31 2dyy s LEU 111 N -1.77 3.23 0.11 -0.88 1.43 -1.20 -5.04 118.68 114.56 2dyy s LEU 111 Ca 0.06 -0.58 -0.34 0.00 -1.03 0.00 0.00 54.13 52.24 2dyy s LEU 111 Cb -0.10 -1.78 -0.14 0.00 0.03 0.00 0.00 46.19 44.20 2dyy s LEU 111 CO 0.04 0.02 1.60 -2.65 0.23 0.00 0.00 176.35 175.59 2dyy n PRO 112 N -0.74 2.02 -3.01 1.29 -0.02 -1.26 -0.74 135.00 132.54 2dyy n PRO 112 Ca -0.07 0.73 -0.22 0.00 -2.02 0.00 0.00 63.50 61.92 2dyy n PRO 112 Cb 0.58 -2.50 0.02 0.00 -0.02 0.00 0.00 33.50 31.58 2dyy n PRO 112 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 2dyy n LYS 113 N 3.86 -4.08 0.00 -0.52 -0.00 -1.26 -3.89 118.16 112.27 2dyy n LYS 113 Ca 0.18 0.80 0.00 0.00 -0.00 0.00 0.00 58.31 59.29 2dyy n LYS 113 Cb 0.27 -5.59 0.00 0.00 -0.00 0.00 0.00 35.03 29.72 2dyy n LYS 113 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2dyy n ASP 114 N -2.38 0.00 -1.49 -5.58 2.03 0.08 -4.98 116.55 104.23 2dyy n ASP 114 Ca -0.10 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.22 2dyy n ASP 114 Cb 0.61 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 41.00 2dyy n ASP 114 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2dyy n VAL 115 N 0.00 -2.30 0.66 5.18 0.31 -1.25 -3.21 118.33 117.72 2dyy n VAL 115 Ca 0.00 1.20 0.07 0.00 -0.01 0.00 0.00 64.34 65.60 2dyy n VAL 115 Cb 0.00 -1.98 -0.00 0.00 -0.91 0.00 0.00 33.84 30.94 2dyy n VAL 115 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2dyy n LEU 116 N -2.73 1.52 -3.62 7.52 4.32 -1.26 -4.58 117.00 118.17 2dyy n LEU 116 Ca -0.01 -0.76 -0.12 0.00 -0.02 0.00 0.00 56.01 55.10 2dyy n LEU 116 Cb 0.44 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.17 2dyy n LEU 116 CO 0.00 0.29 0.59 -0.51 -1.22 0.00 0.00 177.39 176.55 2dyy s ILE 117 N -1.81 0.00 -0.04 -0.08 2.07 -1.26 -3.42 121.20 116.66 2dyy s ILE 117 Ca 0.12 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.37 2dyy s ILE 117 Cb 0.12 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.73 2dyy s ILE 117 CO 0.38 0.00 -0.02 -0.70 -1.91 0.00 0.00 174.94 172.69 2dyy s GLU 118 N 0.03 0.53 -0.06 3.50 2.12 -0.21 -4.24 118.70 120.37 2dyy s GLU 118 Ca 0.00 0.00 0.04 0.00 0.36 0.00 0.00 54.97 55.37 2dyy s GLU 118 Cb -0.04 -0.64 0.00 0.00 0.26 0.00 0.00 34.13 33.71 2dyy s GLU 118 CO -0.01 -0.12 -0.17 0.42 -0.54 0.00 0.00 175.26 174.84 2dyy s ILE 119 N 1.02 1.45 0.08 -3.70 1.01 -0.71 0.41 121.20 120.75 2dyy s ILE 119 Ca -0.10 -0.69 0.07 0.00 0.00 0.00 0.00 60.65 59.94 2dyy s ILE 119 Cb -0.14 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 2dyy s ILE 119 CO -0.01 0.42 -0.15 -1.83 0.00 0.00 0.00 174.94 173.37 2dyy s GLU 120 N 0.31 2.03 0.05 2.79 -1.05 -0.17 -0.76 118.70 121.91 2dyy s GLU 120 Ca -0.10 -1.03 -0.12 0.00 -0.15 0.00 0.00 54.97 53.56 2dyy s GLU 120 Cb -0.14 -2.22 0.01 0.00 -0.44 0.00 0.00 34.13 31.34 2dyy s GLU 120 CO 0.04 0.52 0.26 0.00 0.95 0.00 0.00 175.26 177.03 2dyy s ALA 121 N -1.07 -0.55 -0.03 -0.84 0.00 -1.24 -0.19 121.76 117.84 2dyy s ALA 121 Ca 0.17 -0.14 0.06 0.00 0.00 0.00 0.00 51.96 52.05 2dyy s ALA 121 Cb -0.11 0.34 -0.01 0.00 0.00 0.00 0.00 23.12 23.34 2dyy s ALA 121 CO 0.09 -0.41 -0.21 0.42 0.00 0.00 0.00 175.76 175.65 2dyy s ILE 122 N -2.72 1.66 0.13 0.00 1.01 0.24 -1.80 121.20 119.72 2dyy s ILE 122 Ca -0.04 -0.87 0.06 0.00 0.00 0.00 0.00 60.65 59.80 2dyy s ILE 122 Cb -0.00 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 2dyy s ILE 122 CO -0.05 0.47 -0.13 0.00 0.00 0.00 0.00 174.94 175.23 2dyy s ALA 123 N -0.27 1.50 0.02 9.38 0.00 -0.62 -0.41 121.76 131.36 2dyy s ALA 123 Ca 0.02 -1.35 0.03 0.00 0.00 0.00 0.00 51.96 50.67 2dyy s ALA 123 Cb -0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 2dyy s ALA 123 CO 0.01 0.05 -0.09 -0.47 0.00 0.00 0.00 175.76 175.26 2dyy s TYR 124 N -2.43 0.79 -0.22 0.00 5.04 -0.61 -0.78 117.35 119.15 2dyy s TYR 124 Ca 0.11 -0.28 -0.07 0.00 -2.44 0.00 0.00 57.07 54.38 2dyy s TYR 124 Cb -0.03 -0.49 0.10 0.00 0.35 0.00 0.00 41.96 41.89 2dyy s TYR 124 CO 0.03 -0.02 0.45 0.21 -1.34 0.00 0.00 175.55 174.88 2dyy s LYS 125 N -0.81 0.36 0.00 4.97 2.20 -0.70 -4.63 119.74 121.13 2dyy s LYS 125 Ca -0.01 1.07 0.26 0.00 -0.36 0.00 0.00 55.97 56.93 2dyy s LYS 125 Cb -0.06 0.38 1.56 0.00 -1.51 0.00 0.00 37.83 38.19 2dyy s LYS 125 CO 0.00 -0.27 1.91 0.39 -0.36 0.00 0.00 175.35 177.02