#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dyy s GLU 3 N 0.00 0.34 -0.08 1.64 2.12 0.29 -4.96 118.70 118.05 2dyy s GLU 3 Ca 0.00 0.41 -0.30 0.00 0.36 0.00 0.00 54.97 55.44 2dyy s GLU 3 Cb 0.00 0.20 -0.02 0.00 0.26 0.00 0.00 34.13 34.57 2dyy s GLU 3 CO 0.00 -0.57 1.11 0.54 -0.54 0.00 0.00 175.26 175.80 2dyy s VAL 4 N 2.90 4.50 0.11 3.70 0.11 -1.26 -0.17 120.40 130.30 2dyy s VAL 4 Ca 0.16 1.80 -0.14 0.00 -2.93 0.00 0.00 61.98 60.88 2dyy s VAL 4 Cb -0.08 -4.16 -0.06 0.00 -1.53 0.00 0.00 36.38 30.55 2dyy s VAL 4 CO -0.22 -0.00 0.50 -0.63 -3.33 0.00 0.00 175.10 171.42 2dyy s ILE 5 N 2.14 4.93 -0.14 7.04 -1.09 0.73 -4.96 121.20 129.84 2dyy s ILE 5 Ca 0.52 0.76 -0.12 0.00 -2.23 0.00 0.00 60.65 59.58 2dyy s ILE 5 Cb -0.22 -3.72 0.04 0.00 -1.58 0.00 0.00 42.46 36.98 2dyy s ILE 5 CO 0.20 0.31 0.37 0.12 -1.23 0.00 0.00 174.94 174.71 2dyy s PHE 6 N -1.38 -0.42 -0.15 3.97 5.36 -1.26 -3.93 117.98 120.16 2dyy s PHE 6 Ca 0.35 1.02 -0.17 0.00 -0.96 0.00 0.00 56.93 57.16 2dyy s PHE 6 Cb -0.15 0.15 0.04 0.00 -0.34 0.00 0.00 43.02 42.72 2dyy s PHE 6 CO 0.18 -0.21 0.47 -0.08 -1.46 0.00 0.00 175.22 174.12 2dyy s THR 7 N 0.32 0.01 0.26 0.12 -1.32 -1.26 -5.01 115.64 108.75 2dyy s THR 7 Ca -0.01 -0.06 0.17 0.00 -1.21 0.00 0.00 61.69 60.58 2dyy s THR 7 Cb -0.03 -0.68 0.11 0.00 -1.51 0.00 0.00 72.50 70.39 2dyy s THR 7 CO -0.01 -0.03 1.76 -0.33 -2.21 0.00 0.00 174.62 173.80 2dyy h GLU 8 N 5.05 0.00 0.00 7.08 4.39 -2.00 -2.83 114.58 126.28 2dyy h GLU 8 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 2dyy h GLU 8 Cb 1.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 2dyy h GLU 8 CO 0.24 0.40 0.09 0.09 -1.16 0.00 0.00 179.01 178.67 2dyy n ASN 9 N -3.72 0.49 -4.33 1.42 5.03 -1.26 -4.63 115.26 108.26 2dyy n ASN 9 Ca -0.01 0.70 -0.20 0.00 0.87 0.00 0.00 54.58 55.94 2dyy n ASN 9 Cb 0.48 -0.73 -0.11 0.00 -1.02 0.00 0.00 39.78 38.40 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 -3.47 1.98 0.01 5.41 0.00 -1.07 -4.74 121.76 119.88 2dyy s ALA 10 Ca -0.02 -1.54 -0.38 0.00 0.00 0.00 0.00 51.96 50.02 2dyy s ALA 10 Cb 0.05 -0.14 -0.17 0.00 0.00 0.00 0.00 23.12 22.87 2dyy s ALA 10 CO 0.17 0.16 1.40 -2.30 0.00 0.00 0.00 175.76 175.20 2dyy n PRO 11 N 0.05 1.09 -2.17 0.00 -0.02 -1.26 -4.85 135.00 127.83 2dyy n PRO 11 Ca -0.11 0.39 -0.42 0.00 -2.02 0.00 0.00 63.50 61.34 2dyy n PRO 11 Cb 0.58 -2.04 -0.03 0.00 -0.02 0.00 0.00 33.50 32.00 2dyy n PRO 11 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2dyy s LYS 12 N 1.04 4.22 0.25 -0.52 0.00 -1.26 -4.93 119.74 118.54 2dyy s LYS 12 Ca 0.87 2.00 -0.30 0.00 0.00 0.00 0.00 55.97 58.54 2dyy s LYS 12 Cb -0.99 -3.83 -0.11 0.00 0.00 0.00 0.00 37.83 32.90 2dyy s LYS 12 CO 0.51 -0.75 1.58 -1.25 0.00 0.00 0.00 175.35 175.44 2dyy s PRO 13 N 3.50 4.16 -0.67 1.78 0.04 -1.26 -4.97 135.00 137.59 2dyy s PRO 13 Ca 0.66 2.50 -0.07 0.00 0.04 0.00 0.00 61.00 64.13 2dyy s PRO 13 Cb -0.30 -3.07 0.17 0.00 0.04 0.00 0.00 34.50 31.35 2dyy s PRO 13 CO 0.25 -0.60 0.52 0.42 0.04 0.00 0.00 177.00 177.63 2dyy s ILE 14 N 0.32 4.30 -4.36 0.56 1.01 -1.26 -4.97 121.20 116.79 2dyy s ILE 14 Ca 0.65 -2.70 0.00 0.00 0.00 0.00 0.00 60.65 58.60 2dyy s ILE 14 Cb -0.46 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.25 2dyy s ILE 14 CO 0.42 -0.91 0.00 0.61 0.00 0.00 0.00 174.94 175.06 2dyy n GLY 15 N 3.77 0.92 1.95 6.18 0.00 -1.26 -4.91 105.19 111.84 2dyy n GLY 15 Ca 0.08 -1.94 -0.12 0.00 0.00 0.00 0.00 46.02 44.04 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 0.00 1.80 -4.04 1.61 -0.04 -1.26 -4.89 135.00 128.17 2dyy n PRO 16 Ca 0.00 -1.07 -0.09 0.00 -0.04 0.00 0.00 63.50 62.30 2dyy n PRO 16 Cb 0.00 -1.72 -0.09 0.00 -0.04 0.00 0.00 33.50 31.65 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 -0.14 0.55 0.20 0.54 1.13 -1.26 -5.17 117.35 113.21 2dyy s TYR 17 Ca 0.44 -0.98 0.10 0.00 -1.41 0.00 0.00 57.07 55.22 2dyy s TYR 17 Cb 0.24 -0.29 -0.04 0.00 -1.10 0.00 0.00 41.96 40.77 2dyy s TYR 17 CO -0.04 -0.53 -0.12 -1.12 -2.51 0.00 0.00 175.55 171.22 2dyy s SER 18 N -2.97 4.07 0.44 -0.18 0.01 -1.26 -4.82 113.70 109.00 2dyy s SER 18 Ca 0.15 -0.68 0.11 0.00 1.31 0.00 0.00 55.95 56.84 2dyy s SER 18 Cb 0.06 -0.61 0.98 0.00 0.21 0.00 0.00 66.02 66.66 2dyy s SER 18 CO -0.04 0.09 2.05 1.56 0.41 0.00 0.00 173.24 177.31 2dyy h GLN 19 N 2.77 0.26 -1.39 12.44 4.20 -1.92 -3.41 115.11 128.06 2dyy h GLN 19 Ca -0.46 -0.03 0.13 0.00 0.06 0.00 0.00 58.65 58.35 2dyy h GLN 19 Cb 1.22 -0.05 -0.26 0.00 0.30 0.00 0.00 27.48 28.69 2dyy h GLN 19 CO 0.54 0.24 0.66 0.00 -0.67 0.00 0.00 178.83 179.61 2dyy s ALA 20 N -5.11 -2.02 -0.04 3.87 0.00 -1.25 -1.56 121.76 115.64 2dyy s ALA 20 Ca -0.06 1.72 0.04 0.00 0.00 0.00 0.00 51.96 53.66 2dyy s ALA 20 Cb 0.17 -1.15 -0.00 0.00 0.00 0.00 0.00 23.12 22.13 2dyy s ALA 20 CO 0.71 -0.26 -0.17 0.42 0.00 0.00 0.00 175.76 176.46 2dyy s ILE 21 N -0.72 1.44 -0.19 0.00 1.01 -0.46 -0.19 121.20 122.08 2dyy s ILE 21 Ca 0.03 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 59.88 2dyy s ILE 21 Cb -0.02 -1.23 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 2dyy s ILE 21 CO -0.04 0.41 0.05 -0.75 0.00 0.00 0.00 174.94 174.62 2dyy s LYS 22 N -0.01 3.88 -0.25 2.79 2.20 0.77 -0.71 119.74 128.40 2dyy s LYS 22 Ca -0.03 -0.39 -0.03 0.00 -0.36 0.00 0.00 55.97 55.16 2dyy s LYS 22 Cb -0.11 -3.21 0.08 0.00 -1.51 0.00 0.00 37.83 33.09 2dyy s LYS 22 CO 0.02 0.18 0.09 0.00 -0.36 0.00 0.00 175.35 175.28 2dyy s ALA 23 N 0.62 0.86 0.00 3.13 0.00 0.17 -0.55 121.76 126.00 2dyy s ALA 23 Ca 0.03 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.02 2dyy s ALA 23 Cb -0.13 -1.32 0.00 0.00 0.00 0.00 0.00 23.12 21.67 2dyy s ALA 23 CO 0.02 -1.45 0.00 0.41 0.00 0.00 0.00 175.76 174.74 2dyy n GLY 24 N 5.12 0.06 0.09 0.00 0.00 -1.26 -2.20 105.19 107.01 2dyy n GLY 24 Ca -0.06 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.71 0.14 -4.64 1.61 3.02 -1.26 -4.78 115.26 108.62 2dyy n ASN 25 Ca 0.00 -1.53 -0.35 0.00 -0.03 0.00 0.00 54.58 52.68 2dyy n ASN 25 Cb 0.00 -0.07 -0.10 0.00 -0.61 0.00 0.00 39.78 39.00 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 -1.82 3.08 -0.16 3.10 0.08 -0.93 -2.42 117.98 118.90 2dyy s PHE 26 Ca 0.00 0.12 0.01 0.00 0.12 0.00 0.00 56.93 57.17 2dyy s PHE 26 Cb 0.00 -1.77 0.02 0.00 -0.57 0.00 0.00 43.02 40.70 2dyy s PHE 26 CO 0.00 0.40 -0.16 -1.17 -0.10 0.00 0.00 175.22 174.19 2dyy s LEU 27 N -0.79 1.85 -0.32 -0.37 2.96 -0.55 0.46 118.68 121.92 2dyy s LEU 27 Ca 0.12 -0.56 -0.08 0.00 -0.22 0.00 0.00 54.13 53.39 2dyy s LEU 27 Cb -0.11 -1.27 0.01 0.00 0.50 0.00 0.00 46.19 45.31 2dyy s LEU 27 CO 0.02 -0.04 0.12 -0.36 -1.32 0.00 0.00 176.35 174.77 2dyy s PHE 28 N 1.42 3.18 -0.09 5.38 0.40 0.11 -1.48 117.98 126.91 2dyy s PHE 28 Ca 0.05 -0.91 -0.11 0.00 -0.60 0.00 0.00 56.93 55.35 2dyy s PHE 28 Cb -0.13 -2.31 -0.05 0.00 0.51 0.00 0.00 43.02 41.04 2dyy s PHE 28 CO -0.11 -0.57 0.27 0.42 0.70 0.00 0.00 175.22 175.92 2dyy s ILE 29 N 1.53 5.29 0.96 0.64 1.01 -0.44 -1.35 121.20 128.84 2dyy s ILE 29 Ca 0.03 0.50 -0.12 0.00 0.00 0.00 0.00 60.65 61.06 2dyy s ILE 29 Cb -0.18 -3.56 0.17 0.00 0.01 0.00 0.00 42.46 38.90 2dyy s ILE 29 CO 0.04 0.55 1.09 0.00 0.00 0.00 0.00 174.94 176.62 2dyy s ALA 30 N -0.66 1.09 0.08 9.38 0.00 -0.60 -3.79 121.76 127.26 2dyy s ALA 30 Ca 0.18 -0.04 -0.31 0.00 0.00 0.00 0.00 51.96 51.79 2dyy s ALA 30 Cb -0.14 -3.22 -0.09 0.00 0.00 0.00 0.00 23.12 19.67 2dyy s ALA 30 CO 0.07 -2.73 1.75 0.20 0.00 0.00 0.00 175.76 175.05 2dyy s GLY 31 N -3.18 1.46 -0.15 0.00 0.00 -1.26 -4.65 107.32 99.54 2dyy s GLY 31 Ca 0.65 1.31 -0.06 0.00 0.00 0.00 0.00 44.72 46.62 2dyy s GLY 31 CO 0.59 3.05 0.06 1.20 0.00 0.00 0.00 173.10 177.99 2dyy s GLN 32 N 2.88 3.65 0.20 2.90 -1.52 0.11 -4.88 119.66 123.00 2dyy s GLN 32 Ca 0.78 -0.33 0.10 0.00 -1.95 0.00 0.00 55.36 53.96 2dyy s GLN 32 Cb -0.42 -3.10 -0.04 0.00 -0.22 0.00 0.00 33.01 29.22 2dyy s GLN 32 CO 0.35 0.45 -0.15 0.96 -0.25 0.00 0.00 175.29 176.65 2dyy s ILE 33 N -0.14 2.85 -0.88 1.08 -4.36 -1.26 -1.28 121.20 117.22 2dyy s ILE 33 Ca 0.07 -1.87 -0.26 0.00 -0.26 0.00 0.00 60.65 58.33 2dyy s ILE 33 Cb -0.12 -2.41 -0.25 0.00 1.25 0.00 0.00 42.46 40.93 2dyy s ILE 33 CO 0.01 -0.15 1.98 -0.81 0.24 0.00 0.00 174.94 176.21 2dyy n PRO 34 N 0.02 0.07 -4.66 0.37 -0.04 -1.26 -4.64 135.00 124.86 2dyy n PRO 34 Ca -0.11 -1.52 -0.28 0.00 -0.04 0.00 0.00 63.50 61.55 2dyy n PRO 34 Cb 0.56 -3.59 -0.17 0.00 -0.04 0.00 0.00 33.50 30.26 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 15.16 1.51 -0.53 0.52 1.01 -1.26 -2.05 121.20 135.56 2dyy s ILE 35 Ca 0.76 -0.68 -0.28 0.00 0.00 0.00 0.00 60.65 60.45 2dyy s ILE 35 Cb -0.02 -1.36 0.03 0.00 0.01 0.00 0.00 42.46 41.12 2dyy s ILE 35 CO 0.20 0.44 1.15 -0.62 0.00 0.00 0.00 174.94 176.12 2dyy s ASP 36 N 0.74 6.54 0.20 3.58 -1.08 -1.12 -4.61 116.67 120.92 2dyy s ASP 36 Ca -0.12 0.27 0.13 0.00 -0.52 0.00 0.00 52.55 52.31 2dyy s ASP 36 Cb -0.16 -2.55 0.71 0.00 -1.46 0.00 0.00 42.92 39.47 2dyy s ASP 36 CO 0.02 -1.35 1.39 -0.81 0.52 0.00 0.00 175.17 174.94 2dyy n PRO 37 N 8.09 0.08 0.05 4.34 -0.04 -1.26 0.29 135.00 146.56 2dyy n PRO 37 Ca 0.10 0.58 -0.20 0.00 -0.04 0.00 0.00 63.50 63.94 2dyy n PRO 37 Cb 0.49 -1.80 -0.12 0.00 -0.04 0.00 0.00 33.50 32.03 2dyy n PRO 37 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2dyy h LYS 38 N 0.00 0.54 0.00 0.54 1.79 -1.90 -3.37 116.57 114.18 2dyy h LYS 38 Ca 0.00 -0.67 -0.17 0.00 -2.18 0.00 0.00 60.65 57.63 2dyy h LYS 38 Cb 0.04 0.21 -0.03 0.00 -1.58 0.00 0.00 32.23 30.86 2dyy h LYS 38 CO 0.00 1.27 -2.11 -2.37 -1.08 0.00 0.00 179.45 175.16 2dyy n THR 39 N -3.97 0.68 -0.97 -0.16 5.66 -0.40 -4.98 114.28 110.13 2dyy n THR 39 Ca -0.12 -0.67 0.00 0.00 -3.05 0.00 0.00 64.05 60.21 2dyy n THR 39 Cb 0.85 -0.25 0.00 0.00 -1.55 0.00 0.00 70.33 69.39 2dyy n THR 39 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2dyy n GLY 40 N 1.48 0.71 3.52 1.09 0.00 0.15 -5.00 105.19 107.13 2dyy n GLY 40 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 2dyy n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dyy s GLU 41 N -0.13 1.88 0.70 1.61 2.56 -1.25 -4.93 118.70 119.14 2dyy s GLU 41 Ca 0.00 -1.23 -0.16 0.00 0.00 0.00 0.00 54.97 53.58 2dyy s GLU 41 Cb 0.00 -2.12 0.02 0.00 2.00 0.00 0.00 34.13 34.03 2dyy s GLU 41 CO 0.00 0.46 1.23 0.42 -0.56 0.00 0.00 175.26 176.81 2dyy s ILE 42 N -1.40 2.26 -0.92 -3.70 1.01 -1.26 -2.80 121.20 114.39 2dyy s ILE 42 Ca 0.21 0.14 -0.00 0.00 0.00 0.00 0.00 60.65 60.99 2dyy s ILE 42 Cb -0.10 -2.82 0.33 0.00 0.01 0.00 0.00 42.46 39.89 2dyy s ILE 42 CO 0.12 -0.06 1.77 1.33 0.00 0.00 0.00 174.94 178.10 2dyy n VAL 43 N -2.45 5.06 -1.41 2.92 0.24 -0.87 -4.84 118.33 116.98 2dyy n VAL 43 Ca 0.14 -5.49 -0.48 0.00 -2.04 0.00 0.00 64.34 56.47 2dyy n VAL 43 Cb 0.50 -1.45 -0.03 0.00 -1.47 0.00 0.00 33.84 31.39 2dyy n VAL 43 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2dyy n LYS 44 N -0.21 0.03 0.00 7.34 0.00 -1.26 -4.67 118.16 119.39 2dyy n LYS 44 Ca 0.47 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.79 2dyy n LYS 44 Cb 0.28 -1.04 0.00 0.00 -0.00 0.00 0.00 35.03 34.28 2dyy n LYS 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2dyy n GLY 45 N 1.97 -0.58 3.95 2.58 0.00 -1.26 -5.04 105.19 106.81 2dyy n GLY 45 Ca 0.18 -0.19 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2dyy n GLY 45 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dyy s ASP 46 N -4.00 5.35 0.14 1.61 -4.77 -1.26 -4.96 116.67 108.78 2dyy s ASP 46 Ca 0.00 0.30 -0.17 0.00 -3.30 0.00 0.00 52.55 49.38 2dyy s ASP 46 Cb 0.00 -1.23 -0.00 0.00 -1.09 0.00 0.00 42.92 40.60 2dyy s ASP 46 CO 0.00 -1.14 1.78 -0.29 0.70 0.00 0.00 175.17 176.22 2dyy h ILE 47 N -0.06 1.11 -0.33 2.11 6.09 -2.00 -2.51 117.51 121.93 2dyy h ILE 47 Ca -0.44 -0.25 0.01 0.00 -1.37 0.00 0.00 64.86 62.81 2dyy h ILE 47 Cb 1.28 0.62 -0.02 0.00 0.47 0.00 0.00 36.82 39.18 2dyy h ILE 47 CO 0.57 0.11 0.22 0.11 -3.07 0.00 0.00 178.15 176.09 2dyy h LYS 48 N 0.49 0.41 0.03 2.19 1.57 -1.95 -0.64 116.57 118.66 2dyy h LYS 48 Ca 0.13 -0.02 -0.23 0.00 -1.87 0.00 0.00 60.65 58.66 2dyy h LYS 48 Cb -0.01 -0.09 0.02 0.00 0.08 0.00 0.00 32.23 32.22 2dyy h LYS 48 CO -0.03 0.27 -0.93 0.22 -0.57 0.00 0.00 179.45 178.42 2dyy h ASP 49 N 0.42 0.77 -0.11 0.86 3.58 -1.91 -2.77 116.42 117.26 2dyy h ASP 49 Ca 0.12 -0.77 -0.03 0.00 0.42 0.00 0.00 57.03 56.78 2dyy h ASP 49 Cb -0.02 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 40.79 2dyy h ASP 49 CO -0.03 1.44 -0.03 1.56 -2.88 0.00 0.00 179.24 179.30 2dyy h GLN 50 N 0.18 0.22 -0.24 0.28 4.20 -1.15 -2.57 115.11 116.02 2dyy h GLN 50 Ca -0.12 -0.09 0.06 0.00 0.06 0.00 0.00 58.65 58.56 2dyy h GLN 50 Cb 1.61 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.37 2dyy h GLN 50 CO 0.18 0.53 0.17 0.00 -0.67 0.00 0.00 178.83 179.04 2dyy h THR 51 N -0.12 0.91 -0.01 -0.54 1.03 -1.24 0.40 112.91 113.35 2dyy h THR 51 Ca 0.03 -0.02 -0.12 0.00 -0.01 0.00 0.00 66.41 66.29 2dyy h THR 51 Cb 0.46 0.85 -0.02 0.00 -1.07 0.00 0.00 68.15 68.37 2dyy h THR 51 CO 0.01 0.01 -0.55 -0.09 -0.01 0.00 0.00 175.52 174.89 2dyy h ARG 52 N 0.06 0.03 0.23 0.00 1.12 -1.18 -2.50 114.38 112.14 2dyy h ARG 52 Ca 0.11 -0.02 -0.31 0.00 -1.11 0.00 0.00 59.98 58.65 2dyy h ARG 52 Cb 0.36 0.00 0.04 0.00 -0.01 0.00 0.00 29.97 30.36 2dyy h ARG 52 CO -0.01 0.57 -1.36 0.37 -3.11 0.00 0.00 179.97 176.44 2dyy h GLN 53 N 0.03 0.51 -0.61 0.20 5.75 -0.57 -2.85 115.11 117.56 2dyy h GLN 53 Ca -0.00 -0.86 -0.00 0.00 -0.15 0.00 0.00 58.65 57.63 2dyy h GLN 53 Cb 0.98 0.32 -0.03 0.00 1.07 0.00 0.00 27.48 29.82 2dyy h GLN 53 CO 0.07 1.41 0.38 0.28 -2.65 0.00 0.00 178.83 178.32 2dyy h VAL 54 N 0.06 1.18 -0.45 2.39 2.07 -1.30 -0.88 116.25 119.32 2dyy h VAL 54 Ca -0.24 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 66.80 2dyy h VAL 54 Cb 2.07 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 2dyy h VAL 54 CO 0.26 0.18 -0.13 -0.07 0.02 0.00 0.00 177.57 177.82 2dyy h LEU 55 N 0.83 0.84 -0.50 2.57 4.07 -1.54 0.09 115.31 121.67 2dyy h LEU 55 Ca 0.22 -0.27 -0.14 0.00 0.08 0.00 0.00 57.88 57.78 2dyy h LEU 55 Cb -0.04 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.47 2dyy h LEU 55 CO -0.04 0.98 -0.27 -0.33 -1.08 0.00 0.00 178.44 177.70 2dyy h GLU 56 N 0.75 0.94 -0.13 1.13 5.08 -1.29 0.96 114.58 122.02 2dyy h GLU 56 Ca 0.12 -0.43 -0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2dyy h GLU 56 Cb 0.64 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 2dyy h GLU 56 CO 0.04 1.09 0.07 -0.91 -1.00 0.00 0.00 179.01 178.30 2dyy h ASN 57 N 0.80 0.17 -0.13 1.42 4.21 -0.93 0.14 115.58 121.26 2dyy h ASN 57 Ca 0.09 -0.09 -0.06 0.00 1.21 0.00 0.00 56.30 57.46 2dyy h ASN 57 Cb 0.84 -0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 37.98 2dyy h ASN 57 CO 0.07 0.21 -0.09 0.40 -1.29 0.00 0.00 177.43 176.73 2dyy h ILE 58 N 0.12 1.21 -0.48 2.81 2.04 -0.88 -1.83 117.51 120.49 2dyy h ILE 58 Ca 0.05 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 65.01 2dyy h ILE 58 Cb 0.08 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 2dyy h ILE 58 CO -0.01 0.29 0.30 0.50 0.00 0.00 0.00 178.15 179.24 2dyy h LYS 59 N 0.42 0.65 0.58 2.37 3.64 -0.04 -0.70 116.57 123.50 2dyy h LYS 59 Ca 0.08 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2dyy h LYS 59 Cb 0.42 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2dyy h LYS 59 CO 0.02 0.47 -0.38 0.00 -2.27 0.00 0.00 179.45 177.29 2dyy h ALA 60 N 1.15 -1.17 -0.91 5.00 0.00 -0.10 -1.43 119.26 121.79 2dyy h ALA 60 Ca 0.17 -0.19 0.24 0.00 0.00 0.00 0.00 54.91 55.14 2dyy h ALA 60 Cb -0.02 0.51 -0.13 0.00 0.00 0.00 0.00 17.79 18.15 2dyy h ALA 60 CO -0.03 -1.15 0.39 0.82 0.00 0.00 0.00 179.25 179.28 2dyy h ILE 61 N -0.91 0.41 -0.20 0.00 2.04 -1.23 0.24 117.51 117.86 2dyy h ILE 61 Ca -0.08 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 2dyy h ILE 61 Cb 0.73 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 2dyy h ILE 61 CO 0.06 0.06 0.11 -0.07 0.00 0.00 0.00 178.15 178.31 2dyy h LEU 62 N 0.35 0.26 0.09 1.44 3.38 -0.86 -3.08 115.31 116.89 2dyy h LEU 62 Ca 0.59 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.47 2dyy h LEU 62 Cb 1.17 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 2dyy h LEU 62 CO -0.57 0.28 -0.15 -0.33 0.09 0.00 0.00 178.44 177.76 2dyy h GLU 63 N 0.21 -0.29 -1.13 1.13 5.08 0.47 -1.71 114.58 118.35 2dyy h GLU 63 Ca 0.07 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2dyy h GLU 63 Cb 0.08 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2dyy h GLU 63 CO -0.01 -0.19 0.00 0.00 -1.00 0.00 0.00 179.01 177.81 2dyy n ALA 64 N -2.41 1.49 -1.41 3.43 0.00 0.14 -1.31 120.51 120.43 2dyy n ALA 64 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2dyy n ALA 64 Cb 0.20 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 0.71 0.40 -0.86 0.00 0.00 -0.92 -4.78 120.51 115.05 2dyy n ALA 65 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2dyy n ALA 65 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 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 0.00 0.52 3.69 0.00 0.00 -0.43 -5.04 105.19 103.93 2dyy n GLY 66 Ca 0.00 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 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 2.99 0.45 1.61 2.02 -0.69 -5.03 117.35 116.69 2dyy s TYR 67 Ca 0.00 -0.03 0.05 0.00 -0.37 0.00 0.00 57.07 56.73 2dyy s TYR 67 Cb 0.00 -1.53 -0.05 0.00 -0.40 0.00 0.00 41.96 39.98 2dyy s TYR 67 CO 0.00 0.48 0.07 -1.54 -1.57 0.00 0.00 175.55 172.99 2dyy s SER 68 N -2.32 4.10 0.49 2.29 1.04 -1.26 -3.08 113.70 114.96 2dyy s SER 68 Ca 0.26 -1.38 0.14 0.00 0.48 0.00 0.00 55.95 55.44 2dyy s SER 68 Cb -0.12 -0.12 1.14 0.00 0.10 0.00 0.00 66.02 67.03 2dyy s SER 68 CO 0.18 -0.62 2.11 -0.07 0.98 0.00 0.00 173.24 175.83 2dyy h LEU 69 N 1.53 0.11 0.00 2.42 3.38 -1.94 -0.72 115.31 120.09 2dyy h LEU 69 Ca -0.43 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2dyy h LEU 69 Cb 1.27 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2dyy h LEU 69 CO 0.76 0.10 0.00 -0.46 0.09 0.00 0.00 178.44 178.93 2dyy n ASN 70 N -4.50 0.00 0.04 -0.43 0.23 -1.26 -2.80 115.26 106.53 2dyy n ASN 70 Ca -0.02 -0.32 0.12 0.00 -0.53 0.00 0.00 54.58 53.83 2dyy n ASN 70 Cb 0.10 -0.18 0.22 0.00 -2.08 0.00 0.00 39.78 37.84 2dyy n ASN 70 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2dyy n ASP 71 N -1.18 0.60 -4.70 0.53 10.43 -0.28 -4.83 116.55 117.12 2dyy n ASP 71 Ca 0.14 0.02 -0.42 0.00 2.57 0.00 0.00 54.79 57.10 2dyy n ASP 71 Cb 0.15 0.16 -0.03 0.00 1.84 0.00 0.00 41.12 43.24 2dyy n ASP 71 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2dyy s VAL 72 N -3.11 3.12 -0.03 2.53 1.01 -1.12 0.53 120.40 123.33 2dyy s VAL 72 Ca 0.08 0.66 0.11 0.00 0.00 0.00 0.00 61.98 62.83 2dyy s VAL 72 Cb 0.15 -3.42 -0.16 0.00 0.00 0.00 0.00 36.38 32.94 2dyy s VAL 72 CO 0.70 0.02 0.21 2.30 0.00 0.00 0.00 175.10 178.33 2dyy n ILE 73 N 4.44 0.11 -3.76 2.22 -5.35 0.05 -4.55 119.36 112.53 2dyy n ILE 73 Ca 0.14 -0.28 -0.13 0.00 -0.27 0.00 0.00 62.75 62.21 2dyy n ILE 73 Cb 0.41 0.09 -0.11 0.00 -1.74 0.00 0.00 39.64 38.29 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 -2.68 0.38 0.01 6.28 2.20 -1.08 -1.55 119.74 123.30 2dyy s LYS 74 Ca -0.04 0.46 0.02 0.00 -0.36 0.00 0.00 55.97 56.05 2dyy s LYS 74 Cb 0.06 0.18 -0.01 0.00 -1.51 0.00 0.00 37.83 36.55 2dyy s LYS 74 CO 0.45 -0.05 -0.06 0.08 -0.36 0.00 0.00 175.35 175.41 2dyy s VAL 75 N 0.22 0.47 -0.10 4.02 1.01 0.06 -1.35 120.40 124.73 2dyy s VAL 75 Ca -0.00 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.53 2dyy s VAL 75 Cb -0.03 -0.44 0.01 0.00 0.00 0.00 0.00 36.38 35.93 2dyy s VAL 75 CO 0.00 -0.01 -0.15 -0.89 0.00 0.00 0.00 175.10 174.06 2dyy s THR 76 N -0.46 1.42 -0.17 3.92 2.01 -0.29 -1.44 115.64 120.63 2dyy s THR 76 Ca -0.01 -0.61 -0.04 0.00 0.31 0.00 0.00 61.69 61.35 2dyy s THR 76 Cb -0.04 -1.30 -0.02 0.00 0.01 0.00 0.00 72.50 71.15 2dyy s THR 76 CO -0.00 0.42 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.63 2dyy s VAL 77 N 0.91 3.79 -0.25 3.82 1.01 0.19 -0.88 120.40 128.98 2dyy s VAL 77 Ca -0.09 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 2dyy s VAL 77 Cb -0.15 -2.67 0.03 0.00 0.00 0.00 0.00 36.38 33.59 2dyy s VAL 77 CO 0.00 0.47 -0.07 -0.31 0.00 0.00 0.00 175.10 175.20 2dyy s TYR 78 N 0.60 3.10 0.41 5.22 1.51 -0.39 -1.57 117.35 126.23 2dyy s TYR 78 Ca -0.03 -1.70 0.07 0.00 -1.01 0.00 0.00 57.07 54.41 2dyy s TYR 78 Cb -0.14 -2.04 -0.05 0.00 -0.11 0.00 0.00 41.96 39.62 2dyy s TYR 78 CO 0.02 -0.76 0.21 -0.51 -1.11 0.00 0.00 175.55 173.40 2dyy s LEU 79 N 1.29 3.17 -0.47 -1.29 1.43 -0.76 -1.60 118.68 120.44 2dyy s LEU 79 Ca -0.01 -1.01 0.03 0.00 -1.03 0.00 0.00 54.13 52.11 2dyy s LEU 79 Cb -0.17 -1.55 0.13 0.00 0.03 0.00 0.00 46.19 44.63 2dyy s LEU 79 CO -0.05 -0.55 0.23 -0.75 0.23 0.00 0.00 176.35 175.47 2dyy s LYS 80 N -3.93 1.60 -0.05 1.70 2.20 -1.10 -0.23 119.74 119.92 2dyy s LYS 80 Ca 0.42 -2.26 -0.04 0.00 -0.36 0.00 0.00 55.97 53.73 2dyy s LYS 80 Cb 0.02 -2.82 0.02 0.00 -1.51 0.00 0.00 37.83 33.54 2dyy s LYS 80 CO 0.23 -1.12 0.08 -3.47 -0.36 0.00 0.00 175.35 170.72 2dyy n ASP 81 N 3.41 -5.23 0.00 1.43 -0.08 -1.26 -5.04 116.55 109.78 2dyy n ASP 81 Ca 0.06 1.53 0.00 0.00 -1.51 0.00 0.00 54.79 54.87 2dyy n ASP 81 Cb 0.34 -4.47 0.00 0.00 2.34 0.00 0.00 41.12 39.33 2dyy n ASP 81 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2dyy n ASP 84 N 1.90 3.39 -0.96 1.67 10.43 -1.26 -5.18 116.55 126.53 2dyy n ASP 84 Ca -0.14 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.22 2dyy n ASP 84 Cb 0.22 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.18 2dyy n ASP 84 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 2dyy n PHE 85 N 0.00 0.00 -0.00 1.24 0.99 -1.26 -1.97 117.46 116.46 2dyy n PHE 85 Ca 0.00 -0.19 0.00 0.00 -0.00 0.00 0.00 57.45 57.26 2dyy n PHE 85 Cb 0.00 -0.15 -0.00 0.00 -1.00 0.00 0.00 39.48 38.33 2dyy n PHE 85 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2dyy n ALA 86 N 0.76 2.01 -0.01 4.37 0.00 -1.26 -4.66 120.51 121.72 2dyy n ALA 86 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 53.44 53.44 2dyy n ALA 86 Cb 0.19 0.04 -0.12 0.00 0.00 0.00 0.00 19.45 19.57 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 -1.61 0.65 0.14 0.00 -0.00 -0.83 -4.00 118.16 112.50 2dyy n LYS 87 Ca -0.00 0.05 0.07 0.00 -0.00 0.00 0.00 58.31 58.43 2dyy n LYS 87 Cb 0.11 -1.66 0.56 0.00 -0.00 0.00 0.00 35.03 34.04 2dyy n LYS 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dyy h MET 88 N 0.00 0.21 0.00 -1.58 3.00 -1.83 -3.40 114.93 111.34 2dyy h MET 88 Ca -0.20 -0.01 -0.21 0.00 0.00 0.00 0.00 59.70 59.27 2dyy h MET 88 Cb 1.54 -0.05 0.10 0.00 0.00 0.00 0.00 31.60 33.19 2dyy h MET 88 CO 0.03 0.14 0.08 0.09 0.00 0.00 0.00 176.91 177.25 2dyy n ASN 89 N -4.51 -1.43 0.00 -0.10 3.02 -1.26 -1.44 115.26 109.55 2dyy n ASN 89 Ca 0.00 -0.90 0.00 0.00 -0.03 0.00 0.00 54.58 53.66 2dyy n ASN 89 Cb 0.12 -0.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.75 2dyy n ASN 89 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2dyy n GLU 90 N -3.21 0.00 -0.01 3.52 -0.58 -1.26 -3.82 120.64 115.28 2dyy n GLU 90 Ca 0.08 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.69 2dyy n GLU 90 Cb 0.31 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 31.08 2dyy n GLU 90 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2dyy h VAL 91 N 0.00 1.39 0.01 2.62 2.07 -1.77 -2.80 116.25 117.77 2dyy h VAL 91 Ca 0.00 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.29 2dyy h VAL 91 Cb 0.00 2.22 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2dyy h VAL 91 CO 0.00 0.32 -0.02 0.22 0.02 0.00 0.00 177.57 178.11 2dyy h TYR 92 N -0.55 -0.05 -1.01 1.57 3.20 -1.35 -2.64 116.97 116.14 2dyy h TYR 92 Ca -0.00 0.00 0.27 0.00 3.14 0.00 0.00 58.73 62.14 2dyy h TYR 92 Cb 0.53 0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.76 2dyy h TYR 92 CO 0.11 -0.03 0.69 0.00 -1.64 0.00 0.00 178.16 177.29 2dyy h ALA 93 N 0.94 2.63 0.00 1.82 0.00 -1.80 0.29 119.26 123.13 2dyy h ALA 93 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2dyy h ALA 93 Cb 0.05 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2dyy h ALA 93 CO -0.01 -0.96 -0.15 1.05 0.00 0.00 0.00 179.25 179.18 2dyy h GLU 94 N 0.18 0.00 0.00 0.00 4.11 -1.19 0.17 114.58 117.84 2dyy h GLU 94 Ca 0.51 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.87 2dyy h GLU 94 Cb 1.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.93 2dyy h GLU 94 CO -0.12 0.08 -1.47 0.66 0.07 0.00 0.00 179.01 178.23 2dyy n TYR 95 N -3.09 0.67 -0.38 2.06 4.02 0.82 -4.59 117.16 116.67 2dyy n TYR 95 Ca 0.03 0.21 0.00 0.00 -0.01 0.00 0.00 57.90 58.13 2dyy n TYR 95 Cb 0.57 -0.89 0.00 0.00 -0.02 0.00 0.00 39.34 38.99 2dyy n TYR 95 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2dyy n PHE 96 N -2.65 0.00 0.04 -0.72 3.72 -0.14 -4.69 117.46 113.02 2dyy n PHE 96 Ca -0.06 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.36 2dyy n PHE 96 Cb 0.69 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 39.33 2dyy n PHE 96 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dyy n GLY 97 N 0.13 -0.47 0.00 1.37 0.00 0.58 0.12 105.19 106.91 2dyy n GLY 97 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2dyy n GLY 97 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2dyy n GLU 98 N -1.56 0.00 0.10 1.61 2.13 -1.26 -4.44 120.64 117.21 2dyy n GLU 98 Ca -0.00 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.94 2dyy n GLU 98 Cb 0.12 -0.43 0.45 0.00 0.27 0.00 0.00 31.44 31.85 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 -0.32 0.63 -3.30 4.31 2.88 -1.16 -4.95 113.62 111.71 2dyy n SER 99 Ca 0.00 0.60 -0.16 0.00 -1.33 0.00 0.00 58.87 57.97 2dyy n SER 99 Cb 0.00 -0.75 0.00 0.00 -0.75 0.00 0.00 64.21 62.71 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 -2.13 -1.00 -1.42 -1.46 2.85 0.12 -4.92 118.16 110.20 2dyy n LYS 100 Ca 0.04 0.50 -0.29 0.00 -1.05 0.00 0.00 58.31 57.50 2dyy n LYS 100 Cb 0.33 -1.40 0.12 0.00 -0.65 0.00 0.00 35.03 33.43 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 -3.78 1.43 0.42 -1.58 0.04 -1.26 -5.00 135.00 125.27 2dyy s PRO 101 Ca 0.01 0.57 -0.26 0.00 0.04 0.00 0.00 61.00 61.36 2dyy s PRO 101 Cb -0.00 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.60 2dyy s PRO 101 CO 0.57 -2.06 1.40 0.00 0.04 0.00 0.00 177.00 176.96 2dyy s ALA 102 N -3.11 3.31 0.07 8.56 0.00 -0.59 -4.82 121.76 125.18 2dyy s ALA 102 Ca 0.63 1.42 0.03 0.00 0.00 0.00 0.00 51.96 54.04 2dyy s ALA 102 Cb -0.16 -3.56 -0.03 0.00 0.00 0.00 0.00 23.12 19.37 2dyy s ALA 102 CO 0.55 -1.06 -0.09 0.50 0.00 0.00 0.00 175.76 175.66 2dyy s ARG 103 N -2.31 0.73 -0.05 0.00 3.00 -1.26 -0.76 118.95 118.30 2dyy s ARG 103 Ca 0.58 -1.01 -0.02 0.00 -1.00 0.00 0.00 55.73 54.28 2dyy s ARG 103 Cb -0.43 -0.45 0.03 0.00 0.00 0.00 0.00 34.95 34.10 2dyy s ARG 103 CO 0.55 0.07 0.04 0.08 0.00 0.00 0.00 175.30 176.04 2dyy s VAL 104 N -2.05 0.08 -0.24 7.11 1.01 -0.52 -4.96 120.40 120.83 2dyy s VAL 104 Ca -0.00 0.30 0.01 0.00 0.00 0.00 0.00 61.98 62.29 2dyy s VAL 104 Cb -0.05 -0.30 0.06 0.00 0.00 0.00 0.00 36.38 36.09 2dyy s VAL 104 CO -0.00 0.21 -0.07 0.00 0.00 0.00 0.00 175.10 175.24 2dyy s ALA 105 N 2.05 2.14 0.14 5.51 0.00 -1.26 0.57 121.76 130.91 2dyy s ALA 105 Ca 0.04 -1.48 0.09 0.00 0.00 0.00 0.00 51.96 50.62 2dyy s ALA 105 Cb -0.12 -1.48 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 2dyy s ALA 105 CO -0.04 -1.20 -0.22 0.14 0.00 0.00 0.00 175.76 174.45 2dyy s VAL 106 N 1.31 1.94 -0.30 0.00 -7.23 -0.61 -5.00 120.40 110.51 2dyy s VAL 106 Ca -0.07 -1.76 -0.14 0.00 -1.81 0.00 0.00 61.98 58.21 2dyy s VAL 106 Cb -0.19 -1.80 -0.03 0.00 0.56 0.00 0.00 36.38 34.92 2dyy s VAL 106 CO -0.06 -0.11 0.31 -0.70 -0.31 0.00 0.00 175.10 174.23 2dyy s GLU 107 N -2.30 3.81 0.22 4.82 2.12 -1.26 -1.83 118.70 124.28 2dyy s GLU 107 Ca 0.13 -0.26 0.06 0.00 0.36 0.00 0.00 54.97 55.25 2dyy s GLU 107 Cb -0.08 -3.72 -0.03 0.00 0.26 0.00 0.00 34.13 30.55 2dyy s GLU 107 CO 0.06 -0.35 0.23 0.14 -0.54 0.00 0.00 175.26 174.81 2dyy s VAL 108 N 1.94 4.73 0.23 3.70 -7.23 0.67 -4.94 120.40 119.51 2dyy s VAL 108 Ca 0.11 -1.17 -0.06 0.00 -1.81 0.00 0.00 61.98 59.05 2dyy s VAL 108 Cb -0.16 -3.52 0.18 0.00 0.56 0.00 0.00 36.38 33.44 2dyy s VAL 108 CO 0.11 -0.27 1.82 0.28 -0.31 0.00 0.00 175.10 176.73 2dyy h SER 109 N 1.68 1.07 -4.73 4.85 0.02 -1.98 -3.40 113.55 111.06 2dyy h SER 109 Ca -0.49 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.31 2dyy h SER 109 Cb 1.22 -0.27 -0.19 0.00 0.14 0.00 0.00 62.40 63.30 2dyy h SER 109 CO 0.62 0.92 0.31 -0.60 -1.14 0.00 0.00 176.83 176.94 2dyy s ARG 110 N -5.61 0.94 0.30 3.45 3.52 -1.26 -5.02 118.95 115.27 2dyy s ARG 110 Ca -0.12 0.11 0.09 0.00 -0.13 0.00 0.00 55.73 55.69 2dyy s ARG 110 Cb 0.16 0.44 -0.06 0.00 -1.56 0.00 0.00 34.95 33.93 2dyy s ARG 110 CO 0.83 -0.32 -0.12 -0.51 -0.81 0.00 0.00 175.30 174.38 2dyy s LEU 111 N -1.42 2.62 -0.01 -0.88 1.43 -1.26 -5.04 118.68 114.12 2dyy s LEU 111 Ca -0.06 -1.14 -0.37 0.00 -1.03 0.00 0.00 54.13 51.53 2dyy s LEU 111 Cb -0.00 -0.91 -0.16 0.00 0.03 0.00 0.00 46.19 45.15 2dyy s LEU 111 CO 0.04 -0.18 1.48 -2.65 0.23 0.00 0.00 176.35 175.28 2dyy n PRO 112 N -0.66 1.26 -2.87 1.29 -0.02 -1.26 -0.87 135.00 131.86 2dyy n PRO 112 Ca -0.05 0.46 -0.21 0.00 -2.02 0.00 0.00 63.50 61.67 2dyy n PRO 112 Cb 0.62 -2.13 0.03 0.00 -0.02 0.00 0.00 33.50 32.00 2dyy n PRO 112 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2dyy n LYS 113 N 3.49 -4.14 -2.25 -0.52 5.02 -1.26 -2.35 118.16 116.15 2dyy n LYS 113 Ca 0.21 0.89 -0.11 0.00 -2.02 0.00 0.00 58.31 57.27 2dyy n LYS 113 Cb 0.18 -5.62 -0.01 0.00 -0.02 0.00 0.00 35.03 29.56 2dyy n LYS 113 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2dyy n ASP 114 N -2.21 -3.57 -4.70 4.39 8.00 -0.05 -4.92 116.55 113.49 2dyy n ASP 114 Ca -0.13 0.23 -0.31 0.00 0.71 0.00 0.00 54.79 55.28 2dyy n ASP 114 Cb 0.63 -3.10 0.14 0.00 -0.02 0.00 0.00 41.12 38.76 2dyy n ASP 114 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2dyy s VAL 115 N -2.47 2.42 0.04 2.53 1.01 -0.99 -4.88 120.40 118.06 2dyy s VAL 115 Ca 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 61.98 62.11 2dyy s VAL 115 Cb 0.00 -2.35 -0.27 0.00 0.00 0.00 0.00 36.38 33.76 2dyy s VAL 115 CO 0.00 -0.17 1.00 0.25 0.00 0.00 0.00 175.10 176.18 2dyy h LEU 116 N -1.49 0.34 -7.37 3.92 5.85 -1.91 -3.39 115.31 111.26 2dyy h LEU 116 Ca -0.44 -0.42 -0.14 0.00 0.84 0.00 0.00 57.88 57.72 2dyy h LEU 116 Cb 1.26 -0.11 -0.25 0.00 0.37 0.00 0.00 40.66 41.93 2dyy h LEU 116 CO 0.45 1.34 -0.33 -0.51 -0.34 0.00 0.00 178.44 179.05 2dyy s ILE 117 N -2.64 -0.01 -0.04 4.05 2.07 -1.26 -2.72 121.20 120.66 2dyy s ILE 117 Ca -0.06 0.02 0.04 0.00 -1.41 0.00 0.00 60.65 59.24 2dyy s ILE 117 Cb 0.07 -0.48 -0.00 0.00 0.13 0.00 0.00 42.46 42.18 2dyy s ILE 117 CO 0.86 0.01 -0.14 -0.70 -1.91 0.00 0.00 174.94 173.06 2dyy s GLU 118 N 0.42 1.46 -0.04 3.50 2.12 -0.63 -4.16 118.70 121.36 2dyy s GLU 118 Ca -0.02 -0.49 0.04 0.00 0.36 0.00 0.00 54.97 54.86 2dyy s GLU 118 Cb -0.04 -1.30 -0.00 0.00 0.26 0.00 0.00 34.13 33.05 2dyy s GLU 118 CO -0.02 0.19 -0.17 0.42 -0.54 0.00 0.00 175.26 175.14 2dyy s ILE 119 N 0.09 1.46 0.08 -3.70 1.01 -0.40 -1.27 121.20 118.47 2dyy s ILE 119 Ca -0.03 -0.73 0.06 0.00 0.00 0.00 0.00 60.65 59.94 2dyy s ILE 119 Cb -0.10 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.08 2dyy s ILE 119 CO 0.01 0.42 -0.08 -0.70 0.00 0.00 0.00 174.94 174.59 2dyy s GLU 120 N 0.04 2.28 -0.06 2.79 2.12 -0.06 -0.71 118.70 125.09 2dyy s GLU 120 Ca -0.04 -0.93 -0.17 0.00 0.36 0.00 0.00 54.97 54.19 2dyy s GLU 120 Cb -0.12 -2.38 0.04 0.00 0.26 0.00 0.00 34.13 31.93 2dyy s GLU 120 CO 0.02 0.53 0.40 0.00 -0.54 0.00 0.00 175.26 175.68 2dyy s ALA 121 N -1.17 -1.02 -0.05 6.30 0.00 -1.25 -1.14 121.76 123.43 2dyy s ALA 121 Ca 0.21 0.74 0.05 0.00 0.00 0.00 0.00 51.96 52.96 2dyy s ALA 121 Cb -0.11 -0.17 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 2dyy s ALA 121 CO 0.13 -0.26 -0.19 0.42 0.00 0.00 0.00 175.76 175.86 2dyy s ILE 122 N -0.84 1.61 0.19 0.00 1.01 -0.46 -1.33 121.20 121.39 2dyy s ILE 122 Ca -0.09 -0.81 0.08 0.00 0.00 0.00 0.00 60.65 59.83 2dyy s ILE 122 Cb -0.04 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 2dyy s ILE 122 CO 0.04 0.46 -0.15 0.00 0.00 0.00 0.00 174.94 175.29 2dyy s ALA 123 N 0.07 1.95 -0.02 9.38 0.00 -0.55 -0.77 121.76 131.82 2dyy s ALA 123 Ca -0.06 -1.58 0.00 0.00 0.00 0.00 0.00 51.96 50.32 2dyy s ALA 123 Cb -0.13 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 22.91 2dyy s ALA 123 CO 0.03 0.10 0.02 -0.47 0.00 0.00 0.00 175.76 175.44 2dyy s TYR 124 N -2.71 0.06 -0.16 0.00 5.04 0.19 -1.49 117.35 118.29 2dyy s TYR 124 Ca 0.20 0.09 -0.04 0.00 -2.44 0.00 0.00 57.07 54.87 2dyy s TYR 124 Cb -0.02 -0.21 0.07 0.00 0.35 0.00 0.00 41.96 42.14 2dyy s TYR 124 CO 0.06 -0.07 0.14 0.21 -1.34 0.00 0.00 175.55 174.55 2dyy s LYS 125 N 0.84 0.09 0.00 4.97 2.36 -1.02 -4.66 119.74 122.31 2dyy s LYS 125 Ca -0.07 0.16 0.30 0.00 -2.55 0.00 0.00 55.97 53.80 2dyy s LYS 125 Cb -0.10 -1.26 1.38 0.00 -1.05 0.00 0.00 37.83 36.80 2dyy s LYS 125 CO -0.02 -0.58 1.93 -1.91 1.55 0.00 0.00 175.35 176.32