#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dyy n LYS 2 N 0.00 0.74 -4.86 0.03 4.81 -1.22 -4.48 118.16 113.18 2dyy n LYS 2 Ca 0.00 0.12 -0.27 0.00 -0.87 0.00 0.00 58.31 57.29 2dyy n LYS 2 Cb 0.00 -2.44 -0.15 0.00 0.02 0.00 0.00 35.03 32.46 2dyy n LYS 2 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2dyy s GLU 3 N 7.51 1.60 -0.26 1.64 2.12 0.96 -4.93 118.70 127.34 2dyy s GLU 3 Ca 1.14 -0.89 -0.22 0.00 0.36 0.00 0.00 54.97 55.36 2dyy s GLU 3 Cb -0.80 -1.64 -0.01 0.00 0.26 0.00 0.00 34.13 31.93 2dyy s GLU 3 CO 0.43 0.43 0.73 0.08 -0.54 0.00 0.00 175.26 176.40 2dyy s VAL 4 N -0.67 4.90 -0.18 3.70 1.01 -1.26 -0.76 120.40 127.15 2dyy s VAL 4 Ca 0.08 1.30 -0.17 0.00 0.00 0.00 0.00 61.98 63.19 2dyy s VAL 4 Cb -0.09 -4.03 -0.04 0.00 0.00 0.00 0.00 36.38 32.22 2dyy s VAL 4 CO 0.01 -0.05 0.45 -0.63 0.00 0.00 0.00 175.10 174.87 2dyy s ILE 5 N 2.70 5.17 -0.01 2.22 1.09 -0.30 -5.00 121.20 127.07 2dyy s ILE 5 Ca 0.30 0.84 -0.00 0.00 -1.10 0.00 0.00 60.65 60.70 2dyy s ILE 5 Cb -0.15 -3.78 0.01 0.00 -1.06 0.00 0.00 42.46 37.48 2dyy s ILE 5 CO 0.09 0.26 0.01 0.12 -0.10 0.00 0.00 174.94 175.32 2dyy s PHE 6 N 1.17 0.00 0.10 3.97 5.36 -1.26 -3.76 117.98 123.57 2dyy s PHE 6 Ca 0.22 0.05 -0.11 0.00 -0.96 0.00 0.00 56.93 56.14 2dyy s PHE 6 Cb -0.15 -0.08 0.01 0.00 -0.34 0.00 0.00 43.02 42.46 2dyy s PHE 6 CO 0.09 -0.03 0.25 -0.08 -1.46 0.00 0.00 175.22 173.99 2dyy s THR 7 N 0.35 0.12 -2.85 0.12 -1.32 -1.26 -5.03 115.64 105.77 2dyy s THR 7 Ca -0.03 -1.04 0.24 0.00 -1.21 0.00 0.00 61.69 59.65 2dyy s THR 7 Cb -0.04 -1.34 0.26 0.00 -1.51 0.00 0.00 72.50 69.88 2dyy s THR 7 CO -0.01 -0.54 1.31 -0.62 -2.21 0.00 0.00 174.62 172.56 2dyy n GLU 8 N -0.12 2.35 0.00 7.08 1.02 -1.26 -3.90 120.64 125.82 2dyy n GLU 8 Ca -0.15 -1.98 0.15 0.00 -0.02 0.00 0.00 57.16 55.16 2dyy n GLU 8 Cb 0.63 -1.47 0.68 0.00 -0.02 0.00 0.00 31.44 31.25 2dyy n GLU 8 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2dyy n ASN 9 N 1.34 0.67 -4.34 1.62 3.02 -1.26 -4.76 115.26 111.55 2dyy n ASN 9 Ca 0.16 -1.00 -0.20 0.00 -0.03 0.00 0.00 54.58 53.51 2dyy n ASN 9 Cb 0.59 -0.02 -0.11 0.00 -0.61 0.00 0.00 39.78 39.63 2dyy n ASN 9 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dyy s ALA 10 N -2.19 1.99 0.19 5.41 0.00 -1.25 -4.77 121.76 121.14 2dyy s ALA 10 Ca 0.37 -1.56 -0.33 0.00 0.00 0.00 0.00 51.96 50.44 2dyy s ALA 10 Cb 0.21 -0.13 -0.13 0.00 0.00 0.00 0.00 23.12 23.06 2dyy s ALA 10 CO 0.40 0.15 1.58 -2.30 0.00 0.00 0.00 175.76 175.59 2dyy n PRO 11 N -0.03 2.27 -2.50 0.00 -0.02 -1.26 -4.79 135.00 128.67 2dyy n PRO 11 Ca -0.11 0.82 -0.42 0.00 -2.02 0.00 0.00 63.50 61.77 2dyy n PRO 11 Cb 0.59 -2.59 -0.03 0.00 -0.02 0.00 0.00 33.50 31.45 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 0.72 4.46 -0.04 -0.52 1.02 -1.26 -4.93 119.74 119.19 2dyy s LYS 12 Ca 0.76 1.67 -0.30 0.00 0.02 0.00 0.00 55.97 58.12 2dyy s LYS 12 Cb -0.64 -3.40 -0.06 0.00 -0.52 0.00 0.00 37.83 33.22 2dyy s LYS 12 CO 0.39 -0.22 1.72 -1.25 -0.92 0.00 0.00 175.35 175.06 2dyy s PRO 13 N 1.17 4.16 -0.86 -1.68 0.04 -1.26 -4.90 135.00 131.67 2dyy s PRO 13 Ca 0.57 2.26 -0.02 0.00 0.04 0.00 0.00 61.00 63.85 2dyy s PRO 13 Cb -0.27 -4.02 0.35 0.00 0.04 0.00 0.00 34.50 30.60 2dyy s PRO 13 CO 0.28 -0.88 1.98 0.44 0.04 0.00 0.00 177.00 178.86 2dyy n ILE 14 N 5.52 3.89 -3.84 0.56 -5.35 -1.26 -4.92 119.36 113.96 2dyy n ILE 14 Ca 0.18 -4.54 -0.07 0.00 -0.27 0.00 0.00 62.75 58.05 2dyy n ILE 14 Cb 0.42 -1.28 0.03 0.00 -1.74 0.00 0.00 39.64 37.07 2dyy n ILE 14 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2dyy s GLY 15 N -1.18 0.33 0.00 3.28 0.00 -1.26 -5.02 107.32 103.47 2dyy s GLY 15 Ca 0.50 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.55 2dyy s GLY 15 CO -0.38 0.75 1.51 -1.55 0.00 0.00 0.00 173.10 173.44 2dyy n PRO 16 N -0.61 0.88 -4.54 2.90 -0.04 -1.26 -4.82 135.00 127.50 2dyy n PRO 16 Ca -0.07 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.14 2dyy n PRO 16 Cb 0.60 -1.06 -0.09 0.00 -0.04 0.00 0.00 33.50 32.90 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 0.21 1.98 0.15 0.54 -0.85 -1.26 -5.17 117.35 112.96 2dyy s TYR 17 Ca 0.00 -1.01 0.09 0.00 -0.52 0.00 0.00 57.07 55.64 2dyy s TYR 17 Cb 0.00 -1.38 -0.04 0.00 0.38 0.00 0.00 41.96 40.92 2dyy s TYR 17 CO 0.00 0.02 -0.21 -1.12 -1.52 0.00 0.00 175.55 172.72 2dyy s SER 18 N -3.62 2.84 0.40 -0.18 0.01 -1.26 -4.82 113.70 107.08 2dyy s SER 18 Ca 0.28 -0.80 0.10 0.00 1.31 0.00 0.00 55.95 56.84 2dyy s SER 18 Cb 0.06 -0.18 0.90 0.00 0.21 0.00 0.00 66.02 67.01 2dyy s SER 18 CO 0.14 0.05 1.96 1.56 0.41 0.00 0.00 173.24 177.35 2dyy h GLN 19 N 3.57 0.55 -1.40 12.44 4.20 -1.92 -3.40 115.11 129.14 2dyy h GLN 19 Ca -0.45 -0.03 0.21 0.00 0.06 0.00 0.00 58.65 58.43 2dyy h GLN 19 Cb 1.19 -0.12 -0.22 0.00 0.30 0.00 0.00 27.48 28.63 2dyy h GLN 19 CO 0.46 0.37 0.78 0.00 -0.67 0.00 0.00 178.83 179.76 2dyy s ALA 20 N -5.53 -2.05 -0.04 3.87 0.00 -1.25 -0.23 121.76 116.55 2dyy s ALA 20 Ca -0.09 1.66 0.02 0.00 0.00 0.00 0.00 51.96 53.56 2dyy s ALA 20 Cb 0.20 -0.64 0.01 0.00 0.00 0.00 0.00 23.12 22.68 2dyy s ALA 20 CO 0.76 -0.43 -0.09 0.42 0.00 0.00 0.00 175.76 176.42 2dyy s ILE 21 N -1.74 0.84 -0.27 0.00 1.01 -0.28 -1.15 121.20 119.60 2dyy s ILE 21 Ca 0.07 -0.36 -0.13 0.00 0.00 0.00 0.00 60.65 60.23 2dyy s ILE 21 Cb -0.01 -0.76 -0.04 0.00 0.01 0.00 0.00 42.46 41.66 2dyy s ILE 21 CO -0.04 0.27 0.27 -0.75 0.00 0.00 0.00 174.94 174.69 2dyy s LYS 22 N 0.39 3.99 -0.41 2.79 2.20 0.06 -0.62 119.74 128.14 2dyy s LYS 22 Ca -0.07 -0.16 0.03 0.00 -0.36 0.00 0.00 55.97 55.41 2dyy s LYS 22 Cb -0.11 -3.65 0.12 0.00 -1.51 0.00 0.00 37.83 32.68 2dyy s LYS 22 CO 0.01 -0.21 0.17 0.00 -0.36 0.00 0.00 175.35 174.96 2dyy s ALA 23 N 1.85 2.55 0.00 3.13 0.00 -0.18 -0.03 121.76 129.08 2dyy s ALA 23 Ca 0.11 -2.60 0.00 0.00 0.00 0.00 0.00 51.96 49.47 2dyy s ALA 23 Cb -0.16 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.03 2dyy s ALA 23 CO 0.10 -1.88 0.00 0.41 0.00 0.00 0.00 175.76 174.39 2dyy n GLY 24 N 3.85 0.42 0.31 0.00 0.00 -1.26 -3.19 105.19 105.31 2dyy n GLY 24 Ca 0.04 -0.86 0.13 0.00 0.00 0.00 0.00 46.02 45.33 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 5.35 1.23 -4.88 1.61 5.03 -1.26 -4.65 115.26 117.68 2dyy n ASN 25 Ca 0.00 -1.04 -0.32 0.00 0.87 0.00 0.00 54.58 54.09 2dyy n ASN 25 Cb 0.00 0.17 -0.05 0.00 -1.02 0.00 0.00 39.78 38.88 2dyy n ASN 25 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2dyy s PHE 26 N -2.45 3.45 -0.15 3.10 0.08 -1.19 -2.08 117.98 118.75 2dyy s PHE 26 Ca 0.25 0.74 0.01 0.00 0.12 0.00 0.00 56.93 58.05 2dyy s PHE 26 Cb 0.19 -2.15 0.02 0.00 -0.57 0.00 0.00 43.02 40.51 2dyy s PHE 26 CO 0.51 0.35 -0.15 -1.17 -0.10 0.00 0.00 175.22 174.65 2dyy s LEU 27 N -2.70 1.75 -0.35 -0.37 2.96 0.03 -1.02 118.68 118.99 2dyy s LEU 27 Ca 0.44 -0.50 -0.09 0.00 -0.22 0.00 0.00 54.13 53.76 2dyy s LEU 27 Cb -0.12 -1.21 0.03 0.00 0.50 0.00 0.00 46.19 45.39 2dyy s LEU 27 CO 0.22 -0.03 0.16 -0.36 -1.32 0.00 0.00 176.35 175.02 2dyy s PHE 28 N 1.36 3.23 -0.11 5.38 0.08 0.21 -1.32 117.98 126.82 2dyy s PHE 28 Ca 0.03 -1.07 -0.11 0.00 0.12 0.00 0.00 56.93 55.90 2dyy s PHE 28 Cb -0.13 -2.37 -0.05 0.00 -0.57 0.00 0.00 43.02 39.90 2dyy s PHE 28 CO -0.09 -0.65 0.26 0.42 -0.10 0.00 0.00 175.22 175.06 2dyy s ILE 29 N 1.51 5.31 0.56 0.64 1.01 -0.54 -1.13 121.20 128.55 2dyy s ILE 29 Ca 0.01 0.49 -0.18 0.00 0.00 0.00 0.00 60.65 60.97 2dyy s ILE 29 Cb -0.19 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.67 2dyy s ILE 29 CO 0.05 0.52 1.08 0.00 0.00 0.00 0.00 174.94 176.59 2dyy s ALA 30 N -0.46 2.72 -0.00 9.38 0.00 0.68 -3.76 121.76 130.33 2dyy s ALA 30 Ca 0.17 0.59 -0.36 0.00 0.00 0.00 0.00 51.96 52.36 2dyy s ALA 30 Cb -0.14 -3.28 -0.15 0.00 0.00 0.00 0.00 23.12 19.55 2dyy s ALA 30 CO 0.06 -0.73 1.60 0.41 0.00 0.00 0.00 175.76 177.10 2dyy n GLY 31 N -0.41 0.95 3.65 0.00 0.00 -1.26 -4.76 105.19 103.36 2dyy n GLY 31 Ca 0.10 0.77 -0.35 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 1.97 3.31 0.26 1.61 -1.52 0.26 -4.90 119.66 120.65 2dyy s GLN 32 Ca 0.87 -0.40 0.12 0.00 -1.95 0.00 0.00 55.36 54.00 2dyy s GLN 32 Cb -0.84 -2.91 -0.05 0.00 -0.22 0.00 0.00 33.01 28.99 2dyy s GLN 32 CO 0.49 0.55 -0.20 0.96 -0.25 0.00 0.00 175.29 176.84 2dyy s ILE 33 N -0.45 2.40 -0.17 1.08 -4.36 -1.26 -1.23 121.20 117.20 2dyy s ILE 33 Ca 0.08 -2.35 -0.16 0.00 -0.26 0.00 0.00 60.65 57.96 2dyy s ILE 33 Cb -0.12 -2.26 -0.19 0.00 1.25 0.00 0.00 42.46 41.14 2dyy s ILE 33 CO 0.02 -0.39 1.46 -0.81 0.24 0.00 0.00 174.94 175.47 2dyy n PRO 34 N -0.51 0.37 -5.11 0.37 -0.04 -1.26 -4.67 135.00 124.14 2dyy n PRO 34 Ca -0.06 -0.96 -0.32 0.00 -0.04 0.00 0.00 63.50 62.12 2dyy n PRO 34 Cb 0.60 -2.36 -0.16 0.00 -0.04 0.00 0.00 33.50 31.53 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 5.71 2.37 -0.35 0.52 1.01 -1.26 -1.66 121.20 127.54 2dyy s ILE 35 Ca 0.40 -0.93 -0.21 0.00 0.00 0.00 0.00 60.65 59.90 2dyy s ILE 35 Cb 0.09 -1.91 0.00 0.00 0.01 0.00 0.00 42.46 40.65 2dyy s ILE 35 CO 0.16 0.56 0.68 -0.62 0.00 0.00 0.00 174.94 175.72 2dyy s ASP 36 N 0.03 6.48 0.45 3.58 2.15 -0.22 -4.63 116.67 124.51 2dyy s ASP 36 Ca -0.08 0.26 0.16 0.00 0.43 0.00 0.00 52.55 53.31 2dyy s ASP 36 Cb -0.15 -2.35 1.09 0.00 -0.30 0.00 0.00 42.92 41.21 2dyy s ASP 36 CO 0.05 -0.61 1.97 1.55 -0.17 0.00 0.00 175.17 177.96 2dyy h PRO 37 N 8.41 0.34 0.00 4.34 0.13 -1.87 1.31 132.00 144.67 2dyy h PRO 37 Ca -0.26 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2dyy h PRO 37 Cb 1.11 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2dyy h PRO 37 CO 0.85 0.22 0.00 -0.22 -0.23 0.00 0.00 178.00 178.63 2dyy h LYS 38 N 0.35 0.00 0.00 0.86 1.63 -1.93 -3.32 116.57 114.16 2dyy h LYS 38 Ca 0.29 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.09 2dyy h LYS 38 Cb 0.65 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.28 2dyy h LYS 38 CO -0.07 0.00 -0.83 0.25 -3.45 0.00 0.00 179.45 175.35 2dyy n THR 39 N -2.44 0.00 -0.20 1.00 -2.24 -0.62 -5.02 114.28 104.76 2dyy n THR 39 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2dyy n THR 39 Cb 0.31 -0.65 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 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 2.50 2.02 3.93 3.38 0.00 0.44 -5.02 105.19 112.44 2dyy n GLY 40 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.20 3.37 0.07 1.61 0.41 -1.25 -4.76 118.70 117.96 2dyy s GLU 41 Ca 0.00 -0.20 -0.25 0.00 -0.41 0.00 0.00 54.97 54.10 2dyy s GLU 41 Cb 0.00 -2.54 -0.06 0.00 -1.78 0.00 0.00 34.13 29.75 2dyy s GLU 41 CO 0.00 -0.09 0.78 0.42 -0.49 0.00 0.00 175.26 175.87 2dyy s ILE 42 N -2.53 4.64 1.26 -1.63 1.01 -1.26 -1.05 121.20 121.64 2dyy s ILE 42 Ca 0.45 1.67 -0.16 0.00 0.00 0.00 0.00 60.65 62.61 2dyy s ILE 42 Cb -0.10 -4.13 0.32 0.00 0.01 0.00 0.00 42.46 38.56 2dyy s ILE 42 CO 0.39 0.40 0.95 0.52 0.00 0.00 0.00 174.94 177.20 2dyy n VAL 43 N 2.54 0.00 -1.18 2.92 0.31 -0.66 -4.91 118.33 117.35 2dyy n VAL 43 Ca -0.03 -0.39 -0.37 0.00 -0.01 0.00 0.00 64.34 63.54 2dyy n VAL 43 Cb 0.50 -0.99 0.05 0.00 -0.91 0.00 0.00 33.84 32.49 2dyy n VAL 43 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2dyy n LYS 44 N -5.15 0.12 -0.58 5.55 4.01 -1.26 -4.76 118.16 116.08 2dyy n LYS 44 Ca 0.04 0.06 -0.05 0.00 -0.51 0.00 0.00 58.31 57.86 2dyy n LYS 44 Cb 0.55 -1.42 -0.07 0.00 -0.51 0.00 0.00 35.03 33.59 2dyy n LYS 44 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2dyy n GLY 45 N 2.28 2.31 3.00 0.72 0.00 -1.26 -4.59 105.19 107.64 2dyy n GLY 45 Ca 0.07 -0.47 -0.28 0.00 0.00 0.00 0.00 46.02 45.34 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 2.11 2.36 0.30 1.61 -1.08 -1.26 -5.04 116.67 115.66 2dyy s ASP 46 Ca 0.26 -0.39 0.03 0.00 -0.52 0.00 0.00 52.55 51.92 2dyy s ASP 46 Cb 0.12 -1.01 0.75 0.00 -1.46 0.00 0.00 42.92 41.32 2dyy s ASP 46 CO 0.00 -0.04 1.61 -0.29 0.52 0.00 0.00 175.17 176.97 2dyy h ILE 47 N 6.05 0.19 -0.68 4.11 6.09 -1.98 -0.07 117.51 131.21 2dyy h ILE 47 Ca -0.33 -0.04 -0.01 0.00 -1.37 0.00 0.00 64.86 63.12 2dyy h ILE 47 Cb 1.15 0.07 -0.03 0.00 0.47 0.00 0.00 36.82 38.48 2dyy h ILE 47 CO 0.48 0.02 0.38 0.50 -3.07 0.00 0.00 178.15 176.46 2dyy h LYS 48 N 0.11 0.92 0.04 2.19 3.64 -1.96 -1.42 116.57 120.09 2dyy h LYS 48 Ca 0.58 -0.09 -0.20 0.00 -1.27 0.00 0.00 60.65 59.67 2dyy h LYS 48 Cb 1.21 -0.19 0.02 0.00 -0.41 0.00 0.00 32.23 32.86 2dyy h LYS 48 CO -0.76 0.67 -0.80 -0.44 -2.27 0.00 0.00 179.45 175.84 2dyy h ASP 49 N 0.94 0.64 0.17 4.20 3.32 -1.39 -3.11 116.42 121.18 2dyy h ASP 49 Ca 0.24 -0.79 -0.01 0.00 0.02 0.00 0.00 57.03 56.49 2dyy h ASP 49 Cb 0.00 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.35 2dyy h ASP 49 CO -0.04 1.36 -0.08 1.56 -1.72 0.00 0.00 179.24 180.32 2dyy h GLN 50 N -0.00 -0.22 -0.55 3.56 4.20 -1.17 -1.16 115.11 119.77 2dyy h GLN 50 Ca -0.11 0.01 0.10 0.00 0.06 0.00 0.00 58.65 58.71 2dyy h GLN 50 Cb 1.52 0.05 -0.08 0.00 0.30 0.00 0.00 27.48 29.27 2dyy h GLN 50 CO 0.16 -0.10 0.09 1.15 -0.67 0.00 0.00 178.83 179.45 2dyy h THR 51 N -0.29 0.65 -0.84 -0.54 2.02 -1.39 0.32 112.91 112.85 2dyy h THR 51 Ca -0.02 -0.07 0.03 0.00 0.77 0.00 0.00 66.41 67.11 2dyy h THR 51 Cb 0.22 0.42 -0.05 0.00 -1.74 0.00 0.00 68.15 67.00 2dyy h THR 51 CO 0.04 0.04 0.54 -0.09 0.37 0.00 0.00 175.52 176.42 2dyy h ARG 52 N 0.21 1.03 -0.49 6.66 9.65 -1.43 -0.23 114.38 129.79 2dyy h ARG 52 Ca 0.28 -0.06 -0.08 0.00 -1.10 0.00 0.00 59.98 59.02 2dyy h ARG 52 Cb 0.41 -0.23 -0.02 0.00 -1.39 0.00 0.00 29.97 28.74 2dyy h ARG 52 CO -0.39 0.68 0.00 0.37 2.80 0.00 0.00 179.97 183.44 2dyy h GLN 53 N 1.06 0.86 -0.58 0.20 5.75 0.25 -1.39 115.11 121.25 2dyy h GLN 53 Ca 0.33 -0.27 -0.01 0.00 -0.15 0.00 0.00 58.65 58.55 2dyy h GLN 53 Cb -0.01 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.44 2dyy h GLN 53 CO -0.11 0.90 0.34 0.28 -2.65 0.00 0.00 178.83 177.59 2dyy h VAL 54 N 0.71 1.18 -0.17 2.39 2.07 0.26 -0.15 116.25 122.55 2dyy h VAL 54 Ca 0.14 -0.43 -0.10 0.00 0.82 0.00 0.00 66.70 67.14 2dyy h VAL 54 Cb 0.51 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2dyy h VAL 54 CO 0.02 0.19 -0.32 -0.07 0.02 0.00 0.00 177.57 177.41 2dyy h LEU 55 N 0.79 0.34 -0.42 2.57 3.38 -0.96 -1.41 115.31 119.60 2dyy h LEU 55 Ca 0.21 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2dyy h LEU 55 Cb 0.01 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2dyy h LEU 55 CO -0.04 0.65 0.13 -0.33 0.09 0.00 0.00 178.44 178.94 2dyy h GLU 56 N 0.29 0.64 -0.56 1.13 4.39 -0.58 0.23 114.58 120.13 2dyy h GLU 56 Ca 0.04 -0.14 -0.05 0.00 0.34 0.00 0.00 59.36 59.55 2dyy h GLU 56 Cb 0.71 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 2dyy h GLU 56 CO 0.05 0.64 0.17 -0.91 -1.16 0.00 0.00 179.01 177.80 2dyy h ASN 57 N 0.53 0.82 -0.16 1.42 2.35 -0.75 0.11 115.58 119.90 2dyy h ASN 57 Ca 0.13 -0.21 -0.08 0.00 -0.55 0.00 0.00 56.30 55.60 2dyy h ASN 57 Cb 0.26 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 2dyy h ASN 57 CO -0.00 0.81 -0.13 0.40 -1.65 0.00 0.00 177.43 176.86 2dyy h ILE 58 N 0.78 1.24 -0.35 2.81 2.04 -1.04 -2.39 117.51 120.60 2dyy h ILE 58 Ca 0.18 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 64.95 2dyy h ILE 58 Cb 0.29 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2dyy h ILE 58 CO -0.01 0.35 0.10 0.50 0.00 0.00 0.00 178.15 179.09 2dyy h LYS 59 N 0.49 0.56 -0.67 2.37 3.64 0.37 -0.92 116.57 122.42 2dyy h LYS 59 Ca 0.09 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2dyy h LYS 59 Cb 0.52 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 2dyy h LYS 59 CO 0.03 0.60 0.31 0.00 -2.27 0.00 0.00 179.45 178.11 2dyy h ALA 60 N 0.94 1.29 -0.22 5.00 0.00 -0.59 -1.96 119.26 123.72 2dyy h ALA 60 Ca 0.11 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 2dyy h ALA 60 Cb 0.28 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2dyy h ALA 60 CO -0.00 0.55 -0.60 0.82 0.00 0.00 0.00 179.25 180.01 2dyy h ILE 61 N 0.95 1.30 0.13 0.00 2.04 -1.22 -2.10 117.51 118.60 2dyy h ILE 61 Ca 0.23 -1.82 0.00 0.00 1.00 0.00 0.00 64.86 64.27 2dyy h ILE 61 Cb 0.12 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 2dyy h ILE 61 CO -0.03 0.58 -0.10 -0.07 0.00 0.00 0.00 178.15 178.53 2dyy h LEU 62 N 0.55 -0.27 -0.50 1.44 3.38 -0.85 -2.50 115.31 116.57 2dyy h LEU 62 Ca -0.00 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2dyy h LEU 62 Cb 1.19 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.99 2dyy h LEU 62 CO 0.12 -0.17 0.25 -0.33 0.09 0.00 0.00 178.44 178.41 2dyy h GLU 63 N -0.25 0.48 -0.75 1.13 5.08 -1.27 0.26 114.58 119.27 2dyy h GLU 63 Ca -0.00 -0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.42 2dyy h GLU 63 Cb 0.22 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.30 2dyy h GLU 63 CO -0.01 0.32 0.40 0.00 -1.00 0.00 0.00 179.01 178.71 2dyy h ALA 64 N 1.27 1.04 0.00 3.43 0.00 -1.15 -0.14 119.26 123.70 2dyy h ALA 64 Ca 0.22 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2dyy h ALA 64 Cb 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2dyy h ALA 64 CO -0.15 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.11 2dyy n ALA 65 N -2.39 2.23 -0.31 0.00 0.00 -0.96 -4.85 120.51 114.23 2dyy n ALA 65 Ca 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2dyy n ALA 65 Cb 0.27 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 0.89 0.83 3.97 0.00 0.00 -0.07 -5.08 105.19 105.74 2dyy n GLY 66 Ca 0.10 -0.16 -0.18 0.00 0.00 0.00 0.00 46.02 45.79 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 2.82 0.32 1.61 4.12 0.89 -4.97 117.35 120.15 2dyy s TYR 67 Ca 0.00 -0.40 0.03 0.00 0.02 0.00 0.00 57.07 56.73 2dyy s TYR 67 Cb 0.00 -2.27 -0.06 0.00 -1.52 0.00 0.00 41.96 38.11 2dyy s TYR 67 CO 0.00 -0.29 0.07 -1.54 0.02 0.00 0.00 175.55 173.81 2dyy s SER 68 N -4.27 2.24 0.43 2.29 1.04 -1.26 -3.01 113.70 111.16 2dyy s SER 68 Ca 0.52 -1.39 0.12 0.00 0.48 0.00 0.00 55.95 55.68 2dyy s SER 68 Cb -0.08 -0.02 0.95 0.00 0.10 0.00 0.00 66.02 66.97 2dyy s SER 68 CO 0.31 -0.64 2.00 -0.07 0.98 0.00 0.00 173.24 175.82 2dyy h LEU 69 N 2.13 0.13 0.00 2.42 3.38 -1.94 -2.33 115.31 119.09 2dyy h LEU 69 Ca -0.40 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.55 2dyy h LEU 69 Cb 1.25 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2dyy h LEU 69 CO 0.68 0.24 0.00 -0.46 0.09 0.00 0.00 178.44 178.99 2dyy n ASN 70 N -4.36 0.00 -0.37 -0.43 0.23 -1.26 -2.22 115.26 106.85 2dyy n ASN 70 Ca -0.01 -0.85 0.11 0.00 -0.53 0.00 0.00 54.58 53.30 2dyy n ASN 70 Cb 0.21 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 37.90 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 -0.93 1.73 -4.68 0.53 10.43 -0.88 -4.86 116.55 117.90 2dyy n ASP 71 Ca 0.15 -1.35 -0.42 0.00 2.57 0.00 0.00 54.79 55.74 2dyy n ASP 71 Cb 0.07 0.57 -0.03 0.00 1.84 0.00 0.00 41.12 43.58 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 -2.60 4.15 -0.17 2.53 1.01 -0.94 0.19 120.40 124.57 2dyy s VAL 72 Ca 0.16 1.46 0.16 0.00 0.00 0.00 0.00 61.98 63.77 2dyy s VAL 72 Cb 0.18 -3.94 -0.23 0.00 0.00 0.00 0.00 36.38 32.38 2dyy s VAL 72 CO 0.64 -0.04 0.41 2.30 0.00 0.00 0.00 175.10 178.41 2dyy n ILE 73 N 4.85 0.00 -3.66 2.22 -5.35 -0.12 -4.43 119.36 112.88 2dyy n ILE 73 Ca 0.12 -0.32 -0.07 0.00 -0.27 0.00 0.00 62.75 62.22 2dyy n ILE 73 Cb 0.45 0.31 -0.08 0.00 -1.74 0.00 0.00 39.64 38.59 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 -2.97 0.50 -0.10 6.28 2.20 -1.02 -0.95 119.74 123.68 2dyy s LYS 74 Ca -0.03 1.12 0.02 0.00 -0.36 0.00 0.00 55.97 56.71 2dyy s LYS 74 Cb 0.10 0.31 -0.02 0.00 -1.51 0.00 0.00 37.83 36.72 2dyy s LYS 74 CO 0.65 -0.19 -0.15 0.08 -0.36 0.00 0.00 175.35 175.38 2dyy s VAL 75 N 2.11 2.88 -0.25 4.02 1.01 0.47 -1.09 120.40 129.54 2dyy s VAL 75 Ca -0.07 -0.75 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 2dyy s VAL 75 Cb -0.09 -2.16 0.03 0.00 0.00 0.00 0.00 36.38 34.16 2dyy s VAL 75 CO -0.16 0.55 -0.09 -0.89 0.00 0.00 0.00 175.10 174.51 2dyy s THR 76 N 0.01 2.62 -0.20 3.92 2.01 0.83 -1.54 115.64 123.28 2dyy s THR 76 Ca -0.05 -1.18 -0.08 0.00 0.31 0.00 0.00 61.69 60.69 2dyy s THR 76 Cb -0.14 -2.36 -0.04 0.00 0.01 0.00 0.00 72.50 69.97 2dyy s THR 76 CO 0.04 0.17 0.07 -0.69 -0.69 0.00 0.00 174.62 173.52 2dyy s VAL 77 N 1.26 4.74 -0.25 3.82 1.01 0.13 -0.60 120.40 130.51 2dyy s VAL 77 Ca -0.02 -0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 2dyy s VAL 77 Cb -0.17 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.06 2dyy s VAL 77 CO -0.05 0.43 -0.01 -0.31 0.00 0.00 0.00 175.10 175.15 2dyy s TYR 78 N 0.62 3.06 0.47 5.22 1.51 0.29 -2.17 117.35 126.35 2dyy s TYR 78 Ca 0.04 -1.21 0.06 0.00 -1.01 0.00 0.00 57.07 54.95 2dyy s TYR 78 Cb -0.13 -2.13 -0.01 0.00 -0.11 0.00 0.00 41.96 39.58 2dyy s TYR 78 CO 0.01 -0.63 0.27 -0.51 -1.11 0.00 0.00 175.55 173.58 2dyy s LEU 79 N 1.42 2.92 0.00 -1.29 1.43 0.15 -1.27 118.68 122.04 2dyy s LEU 79 Ca 0.02 -1.16 0.00 0.00 -1.03 0.00 0.00 54.13 51.97 2dyy s LEU 79 Cb -0.16 -1.36 0.00 0.00 0.03 0.00 0.00 46.19 44.70 2dyy s LEU 79 CO -0.02 -0.79 0.00 2.29 0.23 0.00 0.00 176.35 178.06 2dyy n LYS 80 N -1.47 0.00 -2.73 1.70 -0.00 -1.13 0.48 118.16 115.01 2dyy n LYS 80 Ca -0.03 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.21 2dyy n LYS 80 Cb 0.64 0.00 0.06 0.00 -0.00 0.00 0.00 35.03 35.74 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 0.00 -2.56 0.00 -5.58 9.92 -1.26 -3.76 116.55 113.31 2dyy n ASP 81 Ca 0.00 -3.18 0.00 0.00 -0.53 0.00 0.00 54.79 51.08 2dyy n ASP 81 Cb 0.00 1.72 0.00 0.00 -0.64 0.00 0.00 41.12 42.20 2dyy n ASP 81 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2dyy n ASN 89 N 1.31 0.00 0.19 -2.24 3.02 -1.26 -5.18 115.26 111.11 2dyy n ASN 89 Ca 0.07 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.67 2dyy n ASN 89 Cb 0.66 0.00 0.37 0.00 -0.61 0.00 0.00 39.78 40.19 2dyy n ASN 89 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2dyy h GLU 90 N 0.00 0.00 -0.49 3.52 4.81 -2.02 -3.22 114.58 117.18 2dyy h GLU 90 Ca 0.00 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 2dyy h GLU 90 Cb 0.00 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 2dyy h GLU 90 CO 0.00 0.38 0.12 -0.39 -0.73 0.00 0.00 179.01 178.39 2dyy h VAL 91 N 0.00 0.76 -0.88 0.32 -1.51 -2.01 -2.10 116.25 110.83 2dyy h VAL 91 Ca -0.00 -0.09 0.09 0.00 -1.23 0.00 0.00 66.70 65.46 2dyy h VAL 91 Cb 0.80 0.46 -0.07 0.00 -2.13 0.00 0.00 31.29 30.36 2dyy h VAL 91 CO 0.05 0.05 0.53 1.88 -1.23 0.00 0.00 177.57 178.85 2dyy h TYR 92 N 0.27 0.96 0.00 5.19 0.05 -1.96 -1.28 116.97 120.20 2dyy h TYR 92 Ca 0.24 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 59.05 2dyy h TYR 92 Cb 0.31 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 37.74 2dyy h TYR 92 CO -0.20 0.42 -0.01 0.00 -1.05 0.00 0.00 178.16 177.32 2dyy h ALA 93 N 1.46 1.08 0.05 3.88 0.00 -1.53 0.80 119.26 125.01 2dyy h ALA 93 Ca 0.41 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 55.08 2dyy h ALA 93 Cb 0.33 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2dyy h ALA 93 CO -0.23 0.02 -1.06 0.93 0.00 0.00 0.00 179.25 178.91 2dyy h GLU 94 N 0.00 0.21 0.00 0.00 5.08 -1.16 -2.29 114.58 116.42 2dyy h GLU 94 Ca -0.00 -0.29 -0.33 0.00 -1.00 0.00 0.00 59.36 57.73 2dyy h GLU 94 Cb 0.15 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 2dyy h GLU 94 CO 0.00 1.08 -2.04 0.66 -1.00 0.00 0.00 179.01 177.71 2dyy n TYR 95 N -3.55 0.54 -1.18 4.33 4.02 -0.90 -4.43 117.16 115.98 2dyy n TYR 95 Ca -0.05 0.19 0.04 0.00 -0.01 0.00 0.00 57.90 58.07 2dyy n TYR 95 Cb 0.92 -1.10 0.22 0.00 -0.02 0.00 0.00 39.34 39.37 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 -2.93 0.87 0.00 -0.72 3.72 0.23 -4.79 117.46 113.83 2dyy n PHE 96 Ca -0.25 -1.16 0.00 0.00 -0.05 0.00 0.00 57.45 55.98 2dyy n PHE 96 Cb 1.10 -0.36 0.00 0.00 -0.94 0.00 0.00 39.48 39.28 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 -0.86 -2.70 0.23 1.37 0.00 -0.86 -1.38 105.19 100.99 2dyy n GLY 97 Ca 0.25 0.21 0.11 0.00 0.00 0.00 0.00 46.02 46.59 2dyy n GLY 97 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2dyy n GLU 98 N -2.33 1.31 -0.10 1.61 0.28 -1.26 -3.91 120.64 116.23 2dyy n GLU 98 Ca 0.00 -0.46 -0.24 0.00 -0.16 0.00 0.00 57.16 56.30 2dyy n GLU 98 Cb 0.00 -1.38 -0.11 0.00 1.43 0.00 0.00 31.44 31.37 2dyy n GLU 98 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2dyy n SER 99 N -0.36 1.93 -3.79 -1.84 2.88 -1.14 -4.96 113.62 106.33 2dyy n SER 99 Ca 0.17 0.34 -0.26 0.00 -1.33 0.00 0.00 58.87 57.79 2dyy n SER 99 Cb 0.19 -0.88 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 2dyy n SER 99 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2dyy n LYS 100 N -4.21 -1.33 -1.97 -1.46 5.02 -0.48 -4.95 118.16 108.77 2dyy n LYS 100 Ca -0.39 0.69 -0.29 0.00 -2.02 0.00 0.00 58.31 56.30 2dyy n LYS 100 Cb 0.80 -2.57 0.11 0.00 -0.02 0.00 0.00 35.03 33.35 2dyy n LYS 100 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 2dyy s PRO 101 N -5.22 1.68 0.23 1.97 0.02 -1.26 -5.01 135.00 127.41 2dyy s PRO 101 Ca 0.08 -0.11 -0.30 0.00 0.02 0.00 0.00 61.00 60.70 2dyy s PRO 101 Cb -0.04 -1.97 -0.09 0.00 0.02 0.00 0.00 34.50 32.41 2dyy s PRO 101 CO 0.90 -1.73 1.28 0.00 -0.33 0.00 0.00 177.00 177.12 2dyy s ALA 102 N -3.59 3.50 0.12 -1.55 0.00 -0.12 -4.83 121.76 115.30 2dyy s ALA 102 Ca 0.65 1.11 0.10 0.00 0.00 0.00 0.00 51.96 53.82 2dyy s ALA 102 Cb -0.09 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.53 2dyy s ALA 102 CO 0.49 -0.51 -0.25 0.50 0.00 0.00 0.00 175.76 175.99 2dyy s ARG 103 N -0.58 1.32 -0.03 0.00 3.52 -1.26 -0.40 118.95 121.52 2dyy s ARG 103 Ca 0.54 -1.30 -0.01 0.00 -0.13 0.00 0.00 55.73 54.82 2dyy s ARG 103 Cb -0.36 -1.76 0.03 0.00 -1.56 0.00 0.00 34.95 31.30 2dyy s ARG 103 CO 0.41 0.41 0.07 0.08 -0.81 0.00 0.00 175.30 175.47 2dyy s VAL 104 N -1.10 -0.04 -0.04 7.11 1.01 -0.59 -4.97 120.40 121.77 2dyy s VAL 104 Ca 0.12 0.15 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 2dyy s VAL 104 Cb -0.10 -0.13 0.02 0.00 0.00 0.00 0.00 36.38 36.17 2dyy s VAL 104 CO 0.06 0.06 0.11 0.00 0.00 0.00 0.00 175.10 175.33 2dyy s ALA 105 N 0.85 -0.25 0.08 5.51 0.00 -1.26 0.19 121.76 126.88 2dyy s ALA 105 Ca -0.07 0.37 -0.14 0.00 0.00 0.00 0.00 51.96 52.12 2dyy s ALA 105 Cb -0.10 -0.23 0.02 0.00 0.00 0.00 0.00 23.12 22.82 2dyy s ALA 105 CO -0.03 -0.07 0.33 0.14 0.00 0.00 0.00 175.76 176.13 2dyy s VAL 106 N 0.28 0.08 -0.07 0.00 -7.23 -0.92 -5.00 120.40 107.54 2dyy s VAL 106 Ca -0.02 -0.70 -0.00 0.00 -1.81 0.00 0.00 61.98 59.45 2dyy s VAL 106 Cb -0.03 -1.08 -0.03 0.00 0.56 0.00 0.00 36.38 35.79 2dyy s VAL 106 CO -0.01 -0.39 -0.04 -1.61 -0.31 0.00 0.00 175.10 172.75 2dyy s GLU 107 N -3.17 2.84 0.33 4.82 2.02 -1.26 -0.67 118.70 123.61 2dyy s GLU 107 Ca -0.01 -0.50 0.05 0.00 0.02 0.00 0.00 54.97 54.54 2dyy s GLU 107 Cb 0.01 -2.67 -0.07 0.00 0.10 0.00 0.00 34.13 31.50 2dyy s GLU 107 CO -0.07 0.68 0.01 0.14 0.02 0.00 0.00 175.26 176.04 2dyy s VAL 108 N -0.86 1.50 0.07 2.63 -7.23 0.18 -4.88 120.40 111.80 2dyy s VAL 108 Ca 0.13 -2.04 -0.34 0.00 -1.81 0.00 0.00 61.98 57.93 2dyy s VAL 108 Cb -0.11 -2.73 -0.19 0.00 0.56 0.00 0.00 36.38 33.91 2dyy s VAL 108 CO 0.02 -0.09 1.62 0.77 -0.31 0.00 0.00 175.10 177.11 2dyy h SER 109 N 2.10 -0.85 -5.03 4.85 4.64 -1.87 -3.40 113.55 113.99 2dyy h SER 109 Ca -0.41 0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 60.81 2dyy h SER 109 Cb 1.24 0.23 -0.19 0.00 -0.31 0.00 0.00 62.40 63.37 2dyy h SER 109 CO 0.71 -0.59 -0.46 0.00 -0.87 0.00 0.00 176.83 175.63 2dyy s ARG 110 N -6.04 0.57 0.30 4.77 1.04 -1.26 -5.00 118.95 113.34 2dyy s ARG 110 Ca -0.18 -0.53 0.10 0.00 -1.04 0.00 0.00 55.73 54.08 2dyy s ARG 110 Cb 0.03 0.24 -0.05 0.00 -2.04 0.00 0.00 34.95 33.13 2dyy s ARG 110 CO 0.62 -0.15 -0.07 -0.51 -0.04 0.00 0.00 175.30 175.15 2dyy s LEU 111 N -1.74 2.88 -0.26 -1.89 1.43 -1.26 -4.99 118.68 112.85 2dyy s LEU 111 Ca -0.10 -0.94 -0.40 0.00 -1.03 0.00 0.00 54.13 51.66 2dyy s LEU 111 Cb -0.04 -1.32 -0.16 0.00 0.03 0.00 0.00 46.19 44.70 2dyy s LEU 111 CO -0.01 -0.09 1.74 -2.65 0.23 0.00 0.00 176.35 175.57 2dyy n PRO 112 N -0.81 1.19 -2.00 1.29 -0.02 -1.26 0.11 135.00 133.50 2dyy n PRO 112 Ca -0.05 0.44 -0.11 0.00 -2.02 0.00 0.00 63.50 61.76 2dyy n PRO 112 Cb 0.61 -2.12 -0.01 0.00 -0.02 0.00 0.00 33.50 31.95 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 5.32 -0.83 -4.10 -0.52 -0.00 -1.26 -3.48 118.16 113.28 2dyy n LYS 113 Ca 0.26 0.60 -0.28 0.00 -0.00 0.00 0.00 58.31 58.89 2dyy n LYS 113 Cb 0.14 -4.67 -0.05 0.00 -0.00 0.00 0.00 35.03 30.45 2dyy n LYS 113 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2dyy n ASP 114 N 0.02 0.12 -4.77 -5.58 9.92 0.31 -4.96 116.55 111.61 2dyy n ASP 114 Ca -0.12 -1.12 -0.26 0.00 -0.53 0.00 0.00 54.79 52.75 2dyy n ASP 114 Cb 0.54 -2.43 0.09 0.00 -0.64 0.00 0.00 41.12 38.68 2dyy n ASP 114 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2dyy s VAL 115 N -4.13 2.19 -0.18 2.53 -7.23 -1.23 -4.88 120.40 107.48 2dyy s VAL 115 Ca 0.01 -0.24 0.18 0.00 -1.81 0.00 0.00 61.98 60.13 2dyy s VAL 115 Cb -0.01 -2.95 -0.03 0.00 0.56 0.00 0.00 36.38 33.96 2dyy s VAL 115 CO 0.94 0.00 1.06 -0.07 -0.31 0.00 0.00 175.10 176.71 2dyy h LEU 116 N -0.80 0.00 -7.15 1.32 3.38 -1.94 -3.40 115.31 106.73 2dyy h LEU 116 Ca -0.44 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.46 2dyy h LEU 116 Cb 1.30 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.85 2dyy h LEU 116 CO 0.55 0.36 0.02 -0.51 0.09 0.00 0.00 178.44 178.96 2dyy s ILE 117 N -3.07 0.01 -0.03 1.22 2.07 -1.26 -2.82 121.20 117.32 2dyy s ILE 117 Ca -0.00 -0.10 0.01 0.00 -1.41 0.00 0.00 60.65 59.15 2dyy s ILE 117 Cb 0.08 -0.86 0.02 0.00 0.13 0.00 0.00 42.46 41.83 2dyy s ILE 117 CO 0.78 -0.05 -0.03 -0.70 -1.91 0.00 0.00 174.94 173.03 2dyy s GLU 118 N -0.68 0.51 -0.08 3.50 2.12 -0.39 -4.28 118.70 119.40 2dyy s GLU 118 Ca -0.08 -0.04 0.04 0.00 0.36 0.00 0.00 54.97 55.25 2dyy s GLU 118 Cb -0.03 -0.58 -0.00 0.00 0.26 0.00 0.00 34.13 33.78 2dyy s GLU 118 CO 0.06 -0.06 -0.22 0.42 -0.54 0.00 0.00 175.26 174.91 2dyy s ILE 119 N 0.73 1.86 0.01 -3.70 1.01 -0.37 -0.55 121.20 120.20 2dyy s ILE 119 Ca -0.08 -0.93 0.04 0.00 0.00 0.00 0.00 60.65 59.68 2dyy s ILE 119 Cb -0.12 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.71 2dyy s ILE 119 CO -0.01 0.52 -0.08 -0.70 0.00 0.00 0.00 174.94 174.67 2dyy s GLU 120 N 0.22 2.49 0.03 2.79 2.12 0.23 -0.57 118.70 126.00 2dyy s GLU 120 Ca -0.13 -0.75 -0.14 0.00 0.36 0.00 0.00 54.97 54.31 2dyy s GLU 120 Cb -0.16 -2.46 0.02 0.00 0.26 0.00 0.00 34.13 31.79 2dyy s GLU 120 CO 0.06 0.59 0.31 0.00 -0.54 0.00 0.00 175.26 175.69 2dyy s ALA 121 N -0.98 -0.73 -0.05 6.30 0.00 -1.25 -0.12 121.76 124.94 2dyy s ALA 121 Ca 0.17 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.27 2dyy s ALA 121 Cb -0.11 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.26 2dyy s ALA 121 CO 0.07 -0.37 -0.16 0.42 0.00 0.00 0.00 175.76 175.72 2dyy s ILE 122 N -2.22 1.36 0.18 0.00 1.01 -0.25 -1.46 121.20 119.82 2dyy s ILE 122 Ca -0.07 -0.66 0.08 0.00 0.00 0.00 0.00 60.65 59.99 2dyy s ILE 122 Cb -0.02 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 2dyy s ILE 122 CO -0.01 0.40 -0.16 0.00 0.00 0.00 0.00 174.94 175.17 2dyy s ALA 123 N 0.16 1.96 -0.03 9.38 0.00 -0.44 -0.94 121.76 131.85 2dyy s ALA 123 Ca -0.06 -1.56 -0.00 0.00 0.00 0.00 0.00 51.96 50.33 2dyy s ALA 123 Cb -0.12 -0.12 0.03 0.00 0.00 0.00 0.00 23.12 22.91 2dyy s ALA 123 CO 0.03 0.13 0.01 -0.47 0.00 0.00 0.00 175.76 175.46 2dyy s TYR 124 N -2.56 0.26 -0.12 0.00 5.04 0.13 -0.79 117.35 119.31 2dyy s TYR 124 Ca 0.19 0.05 -0.02 0.00 -2.44 0.00 0.00 57.07 54.84 2dyy s TYR 124 Cb -0.03 -0.42 -0.03 0.00 0.35 0.00 0.00 41.96 41.83 2dyy s TYR 124 CO 0.06 -0.15 -0.05 0.21 -1.34 0.00 0.00 175.55 174.29 2dyy s LYS 125 N 1.27 3.35 0.00 4.97 2.20 -0.88 -4.68 119.74 125.97 2dyy s LYS 125 Ca -0.06 -0.53 0.05 0.00 -0.36 0.00 0.00 55.97 55.07 2dyy s LYS 125 Cb -0.13 -2.80 0.31 0.00 -1.51 0.00 0.00 37.83 33.70 2dyy s LYS 125 CO -0.02 0.40 0.78 0.39 -0.36 0.00 0.00 175.35 176.53