#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 -0.02 -0.01 2.12 2.20 -1.26 -2.26 119.74 120.51 2dyy s LYS 2 Ca 0.00 0.23 0.01 0.00 -0.36 0.00 0.00 55.97 55.84 2dyy s LYS 2 Cb 0.00 -0.25 0.01 0.00 -1.51 0.00 0.00 37.83 36.08 2dyy s LYS 2 CO 0.00 -0.17 -0.01 -1.21 -0.36 0.00 0.00 175.35 173.59 2dyy s GLU 3 N 1.13 0.23 -0.13 4.03 8.01 -0.66 -4.97 118.70 126.33 2dyy s GLU 3 Ca -0.09 -0.02 -0.21 0.00 0.01 0.00 0.00 54.97 54.66 2dyy s GLU 3 Cb -0.13 -0.30 -0.03 0.00 -4.31 0.00 0.00 34.13 29.36 2dyy s GLU 3 CO -0.03 -0.02 0.62 0.54 0.01 0.00 0.00 175.26 176.37 2dyy s VAL 4 N 0.38 5.07 0.02 2.63 0.11 -1.26 -0.58 120.40 126.76 2dyy s VAL 4 Ca -0.03 1.23 -0.09 0.00 -2.93 0.00 0.00 61.98 60.15 2dyy s VAL 4 Cb -0.06 -3.95 -0.05 0.00 -1.53 0.00 0.00 36.38 30.79 2dyy s VAL 4 CO -0.01 0.21 0.33 -0.63 -3.33 0.00 0.00 175.10 171.67 2dyy s ILE 5 N 1.23 5.19 -0.28 7.04 -1.09 0.12 -4.99 121.20 128.42 2dyy s ILE 5 Ca 0.31 0.41 -0.10 0.00 -2.23 0.00 0.00 60.65 59.04 2dyy s ILE 5 Cb -0.16 -3.61 0.12 0.00 -1.58 0.00 0.00 42.46 37.23 2dyy s ILE 5 CO 0.13 0.41 0.62 0.12 -1.23 0.00 0.00 174.94 174.99 2dyy s PHE 6 N -1.26 -1.24 0.06 3.97 5.36 -1.26 -3.91 117.98 119.70 2dyy s PHE 6 Ca 0.27 2.20 0.04 0.00 -0.96 0.00 0.00 56.93 58.48 2dyy s PHE 6 Cb -0.14 0.72 -0.03 0.00 -0.34 0.00 0.00 43.02 43.23 2dyy s PHE 6 CO 0.15 -0.63 -0.13 -0.08 -1.46 0.00 0.00 175.22 173.08 2dyy s THR 7 N 2.73 0.97 -1.76 0.12 -1.32 -1.26 -5.02 115.64 110.09 2dyy s THR 7 Ca -0.06 -1.25 0.30 0.00 -1.21 0.00 0.00 61.69 59.47 2dyy s THR 7 Cb -0.11 -0.96 0.72 0.00 -1.51 0.00 0.00 72.50 70.64 2dyy s THR 7 CO -0.18 -0.27 2.10 1.21 -2.21 0.00 0.00 174.62 175.28 2dyy n GLU 8 N 1.32 0.73 -0.04 7.08 4.07 -1.26 -3.38 120.64 129.17 2dyy n GLU 8 Ca -0.22 0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.01 2dyy n GLU 8 Cb 0.54 -1.50 0.50 0.00 -0.06 0.00 0.00 31.44 30.93 2dyy n GLU 8 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2dyy n ASN 9 N -1.12 1.19 -4.18 4.31 3.02 -1.26 -4.56 115.26 112.66 2dyy n ASN 9 Ca 0.19 -1.53 -0.13 0.00 -0.03 0.00 0.00 54.58 53.08 2dyy n ASN 9 Cb 0.16 -0.05 -0.11 0.00 -0.61 0.00 0.00 39.78 39.18 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 -1.90 1.09 0.45 5.41 0.00 -1.22 -4.73 121.76 120.85 2dyy s ALA 10 Ca 0.35 -1.25 -0.22 0.00 0.00 0.00 0.00 51.96 50.84 2dyy s ALA 10 Cb 0.18 0.07 -0.11 0.00 0.00 0.00 0.00 23.12 23.26 2dyy s ALA 10 CO 0.29 -0.10 0.64 -2.30 0.00 0.00 0.00 175.76 174.29 2dyy n PRO 11 N 0.35 0.71 -3.17 0.00 -0.02 -1.26 -4.76 135.00 126.84 2dyy n PRO 11 Ca -0.15 0.26 -0.41 0.00 -2.02 0.00 0.00 63.50 61.18 2dyy n PRO 11 Cb 0.59 -1.65 -0.07 0.00 -0.02 0.00 0.00 33.50 32.35 2dyy n PRO 11 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2dyy s LYS 12 N -1.76 3.68 0.13 -0.52 2.20 -1.26 -4.95 119.74 117.26 2dyy s LYS 12 Ca 0.64 -0.01 -0.31 0.00 -0.36 0.00 0.00 55.97 55.93 2dyy s LYS 12 Cb -0.57 -3.80 -0.11 0.00 -1.51 0.00 0.00 37.83 31.84 2dyy s LYS 12 CO 0.57 -0.68 1.82 -0.35 -0.36 0.00 0.00 175.35 176.35 2dyy n PRO 13 N 5.90 2.77 0.02 4.03 -0.04 -1.26 -4.87 135.00 141.55 2dyy n PRO 13 Ca -0.03 1.01 -0.04 0.00 -0.04 0.00 0.00 63.50 64.40 2dyy n PRO 13 Cb 0.49 -2.89 -0.10 0.00 -0.04 0.00 0.00 33.50 30.95 2dyy n PRO 13 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2dyy h ILE 14 N 4.54 0.81 -2.10 0.52 2.04 -1.95 -3.47 117.51 117.90 2dyy h ILE 14 Ca -0.46 -2.47 0.00 0.00 1.00 0.00 0.00 64.86 62.93 2dyy h ILE 14 Cb 1.22 2.32 0.00 0.00 -0.74 0.00 0.00 36.82 39.62 2dyy h ILE 14 CO 0.95 0.46 0.00 0.61 0.00 0.00 0.00 178.15 180.17 2dyy n GLY 15 N 1.44 0.92 2.86 5.37 0.00 -1.26 -4.97 105.19 109.55 2dyy n GLY 15 Ca -0.11 -1.87 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 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 3.24 -3.54 1.61 -0.04 -1.26 -4.90 135.00 130.11 2dyy n PRO 16 Ca 0.00 -3.11 -0.08 0.00 -0.04 0.00 0.00 63.50 60.27 2dyy n PRO 16 Cb 0.00 -3.12 -0.02 0.00 -0.04 0.00 0.00 33.50 30.32 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 1.89 -0.35 0.30 0.54 1.13 -1.26 -5.18 117.35 114.42 2dyy s TYR 17 Ca 0.44 0.15 0.08 0.00 -1.41 0.00 0.00 57.07 56.33 2dyy s TYR 17 Cb 0.11 0.57 -0.03 0.00 -1.10 0.00 0.00 41.96 41.50 2dyy s TYR 17 CO -0.03 -0.70 0.20 -1.12 -2.51 0.00 0.00 175.55 171.39 2dyy s SER 18 N -2.64 5.17 0.12 -0.18 0.01 -1.26 -4.72 113.70 110.19 2dyy s SER 18 Ca 0.06 -0.48 -0.15 0.00 1.31 0.00 0.00 55.95 56.69 2dyy s SER 18 Cb -0.01 -1.06 -0.04 0.00 0.21 0.00 0.00 66.02 65.12 2dyy s SER 18 CO -0.07 -0.20 1.52 1.56 0.41 0.00 0.00 173.24 176.46 2dyy h GLN 19 N 1.46 0.71 -1.85 12.44 4.20 -1.93 -3.39 115.11 126.75 2dyy h GLN 19 Ca -0.46 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 57.97 2dyy h GLN 19 Cb 1.25 -0.04 -0.21 0.00 0.30 0.00 0.00 27.48 28.78 2dyy h GLN 19 CO 0.60 0.87 0.30 0.00 -0.67 0.00 0.00 178.83 179.93 2dyy s ALA 20 N -4.77 -1.83 -0.08 3.87 0.00 -1.25 0.18 121.76 117.88 2dyy s ALA 20 Ca -0.13 1.51 0.03 0.00 0.00 0.00 0.00 51.96 53.38 2dyy s ALA 20 Cb 0.10 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.79 2dyy s ALA 20 CO 0.81 -0.34 -0.19 0.42 0.00 0.00 0.00 175.76 176.46 2dyy s ILE 21 N -0.90 1.64 -0.31 0.00 1.01 -0.39 0.14 121.20 122.39 2dyy s ILE 21 Ca -0.06 -0.78 -0.14 0.00 0.00 0.00 0.00 60.65 59.66 2dyy s ILE 21 Cb -0.01 -1.44 -0.03 0.00 0.01 0.00 0.00 42.46 41.00 2dyy s ILE 21 CO 0.06 0.47 0.33 -0.75 0.00 0.00 0.00 174.94 175.05 2dyy s LYS 22 N 0.41 3.76 -0.31 2.79 2.20 0.26 -1.26 119.74 127.59 2dyy s LYS 22 Ca -0.15 -0.28 0.02 0.00 -0.36 0.00 0.00 55.97 55.21 2dyy s LYS 22 Cb -0.16 -3.74 0.08 0.00 -1.51 0.00 0.00 37.83 32.50 2dyy s LYS 22 CO 0.06 -0.39 -0.02 0.00 -0.36 0.00 0.00 175.35 174.64 2dyy s ALA 23 N 1.98 2.76 0.00 3.13 0.00 0.21 -1.65 121.76 128.19 2dyy s ALA 23 Ca 0.12 -2.11 0.00 0.00 0.00 0.00 0.00 51.96 49.97 2dyy s ALA 23 Cb -0.16 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.13 2dyy s ALA 23 CO 0.11 -1.43 0.00 0.41 0.00 0.00 0.00 175.76 174.85 2dyy n GLY 24 N 4.40 3.35 0.70 0.00 0.00 -0.96 -1.78 105.19 110.90 2dyy n GLY 24 Ca -0.06 -0.13 0.11 0.00 0.00 0.00 0.00 46.02 45.93 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 8.53 2.46 -4.89 1.61 3.02 -1.26 -4.88 115.26 119.84 2dyy n ASN 25 Ca 0.00 -1.73 -0.34 0.00 -0.03 0.00 0.00 54.58 52.48 2dyy n ASN 25 Cb 0.00 0.22 -0.05 0.00 -0.61 0.00 0.00 39.78 39.34 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 -2.12 3.57 -0.17 3.10 0.08 -0.73 -2.38 117.98 119.33 2dyy s PHE 26 Ca 0.22 0.53 0.01 0.00 0.12 0.00 0.00 56.93 57.81 2dyy s PHE 26 Cb 0.18 -1.96 0.02 0.00 -0.57 0.00 0.00 43.02 40.69 2dyy s PHE 26 CO 0.40 0.62 -0.20 -1.17 -0.10 0.00 0.00 175.22 174.78 2dyy s LEU 27 N -1.78 2.09 -0.35 -0.37 2.96 -0.31 -0.62 118.68 120.30 2dyy s LEU 27 Ca 0.27 -0.63 -0.10 0.00 -0.22 0.00 0.00 54.13 53.45 2dyy s LEU 27 Cb -0.13 -1.45 0.02 0.00 0.50 0.00 0.00 46.19 45.13 2dyy s LEU 27 CO 0.16 0.01 0.19 -0.36 -1.32 0.00 0.00 176.35 175.02 2dyy s PHE 28 N 1.23 3.22 -0.08 5.38 0.40 -0.39 -1.73 117.98 126.02 2dyy s PHE 28 Ca 0.03 -0.88 -0.15 0.00 -0.60 0.00 0.00 56.93 55.33 2dyy s PHE 28 Cb -0.13 -2.41 -0.05 0.00 0.51 0.00 0.00 43.02 40.94 2dyy s PHE 28 CO -0.11 -0.60 0.38 0.42 0.70 0.00 0.00 175.22 176.00 2dyy s ILE 29 N 1.56 5.17 0.86 0.64 1.01 -0.41 -1.26 121.20 128.78 2dyy s ILE 29 Ca 0.02 0.75 -0.10 0.00 0.00 0.00 0.00 60.65 61.32 2dyy s ILE 29 Cb -0.19 -3.70 0.11 0.00 0.01 0.00 0.00 42.46 38.70 2dyy s ILE 29 CO 0.06 0.47 1.11 0.00 0.00 0.00 0.00 174.94 176.58 2dyy s ALA 30 N -0.24 1.75 0.06 9.38 0.00 0.13 -3.68 121.76 129.16 2dyy s ALA 30 Ca 0.22 0.35 -0.33 0.00 0.00 0.00 0.00 51.96 52.20 2dyy s ALA 30 Cb -0.15 -3.34 -0.12 0.00 0.00 0.00 0.00 23.12 19.51 2dyy s ALA 30 CO 0.09 -2.32 1.77 0.41 0.00 0.00 0.00 175.76 175.72 2dyy n GLY 31 N -0.54 1.41 3.84 0.00 0.00 -1.26 -4.63 105.19 104.02 2dyy n GLY 31 Ca 0.10 0.75 -0.37 0.00 0.00 0.00 0.00 46.02 46.50 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 2.65 3.62 0.40 1.61 -1.52 0.19 -4.88 119.66 121.73 2dyy s GLN 32 Ca 0.85 -0.15 0.06 0.00 -1.95 0.00 0.00 55.36 54.18 2dyy s GLN 32 Cb -0.63 -3.24 -0.08 0.00 -0.22 0.00 0.00 33.01 28.85 2dyy s GLN 32 CO 0.43 0.67 0.02 0.96 -0.25 0.00 0.00 175.29 177.11 2dyy s ILE 33 N -0.71 1.85 -0.98 1.08 -4.36 -1.26 -1.28 121.20 115.54 2dyy s ILE 33 Ca 0.13 -2.00 -0.23 0.00 -0.26 0.00 0.00 60.65 58.29 2dyy s ILE 33 Cb -0.12 -2.94 0.06 0.00 1.25 0.00 0.00 42.46 40.70 2dyy s ILE 33 CO 0.03 0.00 1.39 -2.16 0.24 0.00 0.00 174.94 174.44 2dyy s PRO 34 N -3.74 3.54 -0.06 0.37 0.04 -1.26 -4.56 135.00 129.34 2dyy s PRO 34 Ca 0.34 -1.09 0.02 0.00 0.04 0.00 0.00 61.00 60.31 2dyy s PRO 34 Cb 0.10 -5.19 0.02 0.00 0.04 0.00 0.00 34.50 29.47 2dyy s PRO 34 CO 0.17 -2.16 -0.09 0.42 0.04 0.00 0.00 177.00 175.38 2dyy s ILE 35 N 4.82 0.89 -0.50 0.56 1.01 -1.26 -2.33 121.20 124.39 2dyy s ILE 35 Ca 0.43 -0.34 -0.28 0.00 0.00 0.00 0.00 60.65 60.46 2dyy s ILE 35 Cb -0.01 -0.84 0.03 0.00 0.01 0.00 0.00 42.46 41.64 2dyy s ILE 35 CO -0.07 0.30 1.13 -0.62 0.00 0.00 0.00 174.94 175.68 2dyy s ASP 36 N 0.74 6.58 0.22 3.58 -1.08 -0.89 -4.52 116.67 121.30 2dyy s ASP 36 Ca -0.13 0.35 -0.12 0.00 -0.52 0.00 0.00 52.55 52.13 2dyy s ASP 36 Cb -0.15 -2.54 0.28 0.00 -1.46 0.00 0.00 42.92 39.05 2dyy s ASP 36 CO 0.02 -1.28 1.63 1.55 0.52 0.00 0.00 175.17 177.61 2dyy h PRO 37 N 9.28 0.02 -0.90 4.34 0.13 -1.86 1.05 132.00 144.07 2dyy h PRO 37 Ca -0.23 -0.00 0.13 0.00 -0.87 0.00 0.00 66.00 65.02 2dyy h PRO 37 Cb 1.06 -0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.10 2dyy h PRO 37 CO 1.13 0.01 0.51 0.87 -0.23 0.00 0.00 178.00 180.30 2dyy h LYS 38 N 0.02 0.76 0.00 0.86 1.57 -1.92 -3.07 116.57 114.79 2dyy h LYS 38 Ca 0.33 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2dyy h LYS 38 Cb 0.52 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2dyy h LYS 38 CO -0.67 0.50 -1.12 -2.37 -0.57 0.00 0.00 179.45 175.23 2dyy n THR 39 N -4.76 0.00 -1.14 -0.16 5.66 -0.82 -5.00 114.28 108.07 2dyy n THR 39 Ca 0.17 -0.23 -0.05 0.00 -3.05 0.00 0.00 64.05 60.89 2dyy n THR 39 Cb 0.38 0.66 -0.02 0.00 -1.55 0.00 0.00 70.33 69.80 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 1.46 0.65 3.58 1.09 0.00 0.36 -5.00 105.19 107.33 2dyy n GLY 40 Ca 0.01 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.92 2.67 0.19 1.61 2.56 -1.24 -4.85 118.70 117.72 2dyy s GLU 41 Ca 0.00 -0.62 -0.31 0.00 0.00 0.00 0.00 54.97 54.05 2dyy s GLU 41 Cb 0.00 -2.55 -0.10 0.00 2.00 0.00 0.00 34.13 33.49 2dyy s GLU 41 CO 0.00 0.64 1.46 0.42 -0.56 0.00 0.00 175.26 177.22 2dyy s ILE 42 N -0.88 2.81 0.15 -3.70 1.09 -1.26 -2.09 121.20 117.32 2dyy s ILE 42 Ca 0.14 0.63 -0.30 0.00 -1.10 0.00 0.00 60.65 60.02 2dyy s ILE 42 Cb -0.11 -3.40 -0.07 0.00 -1.06 0.00 0.00 42.46 37.81 2dyy s ILE 42 CO 0.04 0.07 1.20 0.68 -0.10 0.00 0.00 174.94 176.83 2dyy s VAL 43 N 0.58 3.69 -0.89 2.92 -7.23 -0.98 -4.93 120.40 113.55 2dyy s VAL 43 Ca 0.63 1.36 0.00 0.00 -1.81 0.00 0.00 61.98 62.16 2dyy s VAL 43 Cb -0.41 -3.87 0.30 0.00 0.56 0.00 0.00 36.38 32.96 2dyy s VAL 43 CO 0.36 0.18 1.30 0.29 -0.31 0.00 0.00 175.10 176.93 2dyy n LYS 44 N 2.93 4.03 0.00 4.82 5.02 -1.26 -4.95 118.16 128.75 2dyy n LYS 44 Ca 0.06 -4.66 0.00 0.00 -2.02 0.00 0.00 58.31 51.69 2dyy n LYS 44 Cb 0.45 -2.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.06 2dyy n LYS 44 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dyy n GLY 45 N 0.69 6.90 3.95 0.72 0.00 -1.26 -5.13 105.19 111.05 2dyy n GLY 45 Ca 0.32 -1.92 -0.23 0.00 0.00 0.00 0.00 46.02 44.19 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 1.00 5.53 0.48 1.61 -4.77 -1.26 -4.86 116.67 114.41 2dyy s ASP 46 Ca 0.00 0.27 0.30 0.00 -3.30 0.00 0.00 52.55 49.82 2dyy s ASP 46 Cb 0.00 -1.31 1.39 0.00 -1.09 0.00 0.00 42.92 41.92 2dyy s ASP 46 CO 0.00 -0.97 1.77 -0.29 0.70 0.00 0.00 175.17 176.37 2dyy h ILE 47 N 0.12 0.41 -0.08 2.11 6.09 -1.99 -0.58 117.51 123.58 2dyy h ILE 47 Ca -0.45 -0.05 -0.21 0.00 -1.37 0.00 0.00 64.86 62.79 2dyy h ILE 47 Cb 1.27 0.25 0.00 0.00 0.47 0.00 0.00 36.82 38.81 2dyy h ILE 47 CO 0.56 0.03 -0.79 0.11 -3.07 0.00 0.00 178.15 174.99 2dyy h LYS 48 N 0.14 0.53 -0.13 2.19 1.57 -1.98 -0.30 116.57 118.60 2dyy h LYS 48 Ca 0.61 -0.46 -0.19 0.00 -1.87 0.00 0.00 60.65 58.75 2dyy h LYS 48 Cb 2.09 0.10 -0.00 0.00 0.08 0.00 0.00 32.23 34.50 2dyy h LYS 48 CO -0.15 1.09 -0.69 -0.44 -0.57 0.00 0.00 179.45 178.69 2dyy h ASP 49 N 0.35 0.63 -0.11 0.86 3.45 -1.51 -1.98 116.42 118.12 2dyy h ASP 49 Ca -0.05 -0.40 -0.08 0.00 0.43 0.00 0.00 57.03 56.94 2dyy h ASP 49 Cb 1.39 -0.19 0.00 0.00 -0.56 0.00 0.00 39.33 39.98 2dyy h ASP 49 CO 0.14 1.14 -0.23 1.56 -1.57 0.00 0.00 179.24 180.28 2dyy h GLN 50 N 0.38 0.35 -0.63 3.56 4.20 -1.36 -2.39 115.11 119.22 2dyy h GLN 50 Ca -0.03 -0.23 -0.02 0.00 0.06 0.00 0.00 58.65 58.44 2dyy h GLN 50 Cb 1.27 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 29.06 2dyy h GLN 50 CO 0.13 0.83 0.32 0.00 -0.67 0.00 0.00 178.83 179.44 2dyy h THR 51 N -0.09 1.20 -0.48 -0.54 1.03 -1.07 -1.19 112.91 111.77 2dyy h THR 51 Ca 0.00 -0.54 -0.13 0.00 -0.01 0.00 0.00 66.41 65.74 2dyy h THR 51 Cb 0.83 0.38 -0.01 0.00 -1.07 0.00 0.00 68.15 68.28 2dyy h THR 51 CO 0.05 0.23 -0.20 -0.09 -0.01 0.00 0.00 175.52 175.50 2dyy h ARG 52 N 0.88 0.98 -0.59 0.00 2.43 -1.35 -1.32 114.38 115.41 2dyy h ARG 52 Ca 0.22 -0.41 -0.02 0.00 -0.81 0.00 0.00 59.98 58.96 2dyy h ARG 52 Cb 0.07 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 2dyy h ARG 52 CO -0.03 1.09 0.31 0.37 -1.51 0.00 0.00 179.97 180.19 2dyy h GLN 53 N 0.83 0.83 0.21 0.20 5.75 -0.88 0.23 115.11 122.28 2dyy h GLN 53 Ca 0.11 -0.11 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2dyy h GLN 53 Cb 0.78 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 29.16 2dyy h GLN 53 CO 0.06 0.65 -0.16 0.28 -2.65 0.00 0.00 178.83 177.01 2dyy h VAL 54 N 0.79 0.66 -0.35 2.39 2.07 -1.02 -0.57 116.25 120.22 2dyy h VAL 54 Ca 0.20 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.72 2dyy h VAL 54 Cb 0.07 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2dyy h VAL 54 CO -0.03 0.00 0.18 -0.07 0.02 0.00 0.00 177.57 177.67 2dyy h LEU 55 N -0.38 0.42 -0.57 2.57 4.07 -1.08 -0.68 115.31 119.68 2dyy h LEU 55 Ca -0.01 -0.03 -0.08 0.00 0.08 0.00 0.00 57.88 57.84 2dyy h LEU 55 Cb 0.33 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 41.94 2dyy h LEU 55 CO -0.01 0.35 0.04 -0.33 -1.08 0.00 0.00 178.44 177.41 2dyy h GLU 56 N 0.48 0.97 -0.10 1.13 5.08 -0.44 -2.08 114.58 119.63 2dyy h GLU 56 Ca 0.13 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 2dyy h GLU 56 Cb 0.03 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 2dyy h GLU 56 CO -0.02 0.96 0.02 -0.91 -1.00 0.00 0.00 179.01 178.06 2dyy h ASN 57 N 0.86 0.15 -0.68 1.42 -0.26 -0.19 -2.05 115.58 114.83 2dyy h ASN 57 Ca 0.16 -0.24 0.10 0.00 -0.56 0.00 0.00 56.30 55.76 2dyy h ASN 57 Cb 0.49 -0.04 -0.07 0.00 -1.06 0.00 0.00 38.32 37.64 2dyy h ASN 57 CO 0.02 0.36 0.31 0.40 -1.06 0.00 0.00 177.43 177.45 2dyy h ILE 58 N -0.05 0.80 -0.90 2.81 2.04 -1.08 -0.46 117.51 120.67 2dyy h ILE 58 Ca 0.03 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 2dyy h ILE 58 Cb 0.26 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 36.54 2dyy h ILE 58 CO 0.00 0.09 0.50 0.50 0.00 0.00 0.00 178.15 179.24 2dyy h LYS 59 N 0.52 1.25 -0.14 2.37 3.64 -1.22 0.09 116.57 123.07 2dyy h LYS 59 Ca 0.34 -0.14 0.02 0.00 -1.27 0.00 0.00 60.65 59.60 2dyy h LYS 59 Cb 0.40 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 2dyy h LYS 59 CO -0.29 0.91 0.02 0.00 -2.27 0.00 0.00 179.45 177.81 2dyy h ALA 60 N 1.29 0.13 -0.41 5.00 0.00 -0.38 -0.68 119.26 124.21 2dyy h ALA 60 Ca 0.32 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 2dyy h ALA 60 Cb 0.02 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2dyy h ALA 60 CO -0.05 -0.43 0.25 0.82 0.00 0.00 0.00 179.25 179.84 2dyy h ILE 61 N 0.07 1.13 -0.49 0.00 2.04 -0.77 0.46 117.51 119.96 2dyy h ILE 61 Ca 0.06 -0.29 0.07 0.00 1.00 0.00 0.00 64.86 65.70 2dyy h ILE 61 Cb 0.06 0.59 -0.06 0.00 -0.74 0.00 0.00 36.82 36.67 2dyy h ILE 61 CO -0.09 0.13 0.14 -0.07 0.00 0.00 0.00 178.15 178.26 2dyy h LEU 62 N 0.54 0.10 -0.24 1.44 3.38 -0.60 0.92 115.31 120.84 2dyy h LEU 62 Ca 0.15 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 2dyy h LEU 62 Cb -0.01 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2dyy h LEU 62 CO -0.03 0.08 0.09 -0.33 0.09 0.00 0.00 178.44 178.34 2dyy h GLU 63 N 0.29 0.36 -0.30 1.13 5.08 -0.71 0.76 114.58 121.20 2dyy h GLU 63 Ca 0.24 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.50 2dyy h GLU 63 Cb 0.28 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2dyy h GLU 63 CO -0.27 0.42 0.04 0.00 -1.00 0.00 0.00 179.01 178.20 2dyy h ALA 64 N 0.92 1.53 0.00 3.43 0.00 -0.52 0.25 119.26 124.87 2dyy h ALA 64 Ca 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2dyy h ALA 64 Cb 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2dyy h ALA 64 CO -0.01 0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.59 2dyy n ALA 65 N -2.48 2.39 -0.98 0.00 0.00 0.28 -4.90 120.51 114.83 2dyy n ALA 65 Ca 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2dyy n ALA 65 Cb 0.19 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.17 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 1.25 0.75 3.77 0.00 0.00 0.07 -5.06 105.19 105.99 2dyy n GLY 66 Ca 0.12 -0.66 -0.27 0.00 0.00 0.00 0.00 46.02 45.21 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 2.20 0.37 1.61 2.02 0.25 -4.98 117.35 116.83 2dyy s TYR 67 Ca 0.00 -0.74 0.04 0.00 -0.37 0.00 0.00 57.07 56.00 2dyy s TYR 67 Cb 0.00 -1.85 -0.05 0.00 -0.40 0.00 0.00 41.96 39.65 2dyy s TYR 67 CO 0.00 0.06 0.06 -1.54 -1.57 0.00 0.00 175.55 172.56 2dyy s SER 68 N -3.97 2.84 0.50 2.29 1.04 -1.26 -3.53 113.70 111.61 2dyy s SER 68 Ca 0.31 -1.48 0.18 0.00 0.48 0.00 0.00 55.95 55.44 2dyy s SER 68 Cb 0.02 0.08 1.24 0.00 0.10 0.00 0.00 66.02 67.47 2dyy s SER 68 CO 0.17 -0.69 2.10 -0.07 0.98 0.00 0.00 173.24 175.73 2dyy h LEU 69 N 1.91 0.00 -0.02 2.42 3.38 -1.95 -2.21 115.31 118.84 2dyy h LEU 69 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2dyy h LEU 69 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2dyy h LEU 69 CO 0.69 0.07 0.00 -0.46 0.09 0.00 0.00 178.44 178.83 2dyy n ASN 70 N -4.33 0.03 0.01 -0.43 0.23 -1.26 -2.70 115.26 106.81 2dyy n ASN 70 Ca -0.03 -1.77 0.11 0.00 -0.53 0.00 0.00 54.58 52.36 2dyy n ASN 70 Cb 0.16 -0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 37.85 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 -0.60 0.68 -4.69 0.53 10.43 -0.83 -4.78 116.55 117.29 2dyy n ASP 71 Ca 0.06 -0.49 -0.42 0.00 2.57 0.00 0.00 54.79 56.51 2dyy n ASP 71 Cb 0.03 0.87 -0.03 0.00 1.84 0.00 0.00 41.12 43.83 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 -3.12 3.26 -0.09 2.53 1.01 -1.10 -0.28 120.40 122.62 2dyy s VAL 72 Ca 0.06 0.68 0.08 0.00 0.00 0.00 0.00 61.98 62.80 2dyy s VAL 72 Cb 0.15 -3.44 -0.11 0.00 0.00 0.00 0.00 36.38 32.99 2dyy s VAL 72 CO 0.82 -0.00 0.02 2.30 0.00 0.00 0.00 175.10 178.24 2dyy n ILE 73 N 4.73 0.62 -3.81 2.22 -5.35 -0.08 -4.23 119.36 113.47 2dyy n ILE 73 Ca 0.15 -0.38 -0.13 0.00 -0.27 0.00 0.00 62.75 62.12 2dyy n ILE 73 Cb 0.42 -0.77 -0.14 0.00 -1.74 0.00 0.00 39.64 37.40 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 -2.22 0.04 -0.04 6.28 2.20 -1.13 -0.33 119.74 124.54 2dyy s LYS 74 Ca -0.05 0.17 0.02 0.00 -0.36 0.00 0.00 55.97 55.75 2dyy s LYS 74 Cb 0.03 -0.10 0.01 0.00 -1.51 0.00 0.00 37.83 36.26 2dyy s LYS 74 CO 0.36 -0.09 -0.08 0.08 -0.36 0.00 0.00 175.35 175.26 2dyy s VAL 75 N 0.59 0.76 -0.13 4.02 1.01 -0.38 -1.89 120.40 124.39 2dyy s VAL 75 Ca -0.05 -0.30 -0.00 0.00 0.00 0.00 0.00 61.98 61.63 2dyy s VAL 75 Cb -0.07 -0.72 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 2dyy s VAL 75 CO -0.02 0.26 -0.13 -0.89 0.00 0.00 0.00 175.10 174.32 2dyy s THR 76 N 0.56 3.07 -0.19 3.92 2.01 -0.82 -0.83 115.64 123.37 2dyy s THR 76 Ca -0.09 -0.65 -0.00 0.00 0.31 0.00 0.00 61.69 61.25 2dyy s THR 76 Cb -0.12 -2.29 0.01 0.00 0.01 0.00 0.00 72.50 70.11 2dyy s THR 76 CO 0.01 0.52 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.62 2dyy s VAL 77 N 0.35 2.48 -0.18 3.82 1.01 0.74 -2.54 120.40 126.07 2dyy s VAL 77 Ca -0.11 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.03 2dyy s VAL 77 Cb -0.16 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 2dyy s VAL 77 CO 0.06 0.51 -0.02 -0.31 0.00 0.00 0.00 175.10 175.33 2dyy s TYR 78 N 1.26 3.02 0.17 5.22 1.51 0.05 -1.06 117.35 127.51 2dyy s TYR 78 Ca 0.03 -0.43 0.10 0.00 -1.01 0.00 0.00 57.07 55.76 2dyy s TYR 78 Cb -0.14 -2.03 -0.04 0.00 -0.11 0.00 0.00 41.96 39.64 2dyy s TYR 78 CO -0.08 -0.18 -0.22 -0.51 -1.11 0.00 0.00 175.55 173.45 2dyy s LEU 79 N 0.76 2.41 -0.06 -1.29 1.02 -0.52 -0.73 118.68 120.26 2dyy s LEU 79 Ca -0.01 -0.84 -0.28 0.00 0.02 0.00 0.00 54.13 53.02 2dyy s LEU 79 Cb -0.14 -1.01 -0.02 0.00 0.02 0.00 0.00 46.19 45.03 2dyy s LEU 79 CO 0.02 0.06 0.93 -0.75 0.02 0.00 0.00 176.35 176.63 2dyy s LYS 80 N -2.58 4.47 -0.65 1.70 2.20 -0.55 -0.56 119.74 123.77 2dyy s LYS 80 Ca 0.17 1.29 -0.13 0.00 -0.36 0.00 0.00 55.97 56.94 2dyy s LYS 80 Cb -0.07 -3.50 -0.17 0.00 -1.51 0.00 0.00 37.83 32.58 2dyy s LYS 80 CO 0.08 -0.16 1.81 -0.40 -0.36 0.00 0.00 175.35 176.31 2dyy n ASP 81 N 4.42 -0.49 0.00 1.43 5.68 -1.18 -4.90 116.55 121.52 2dyy n ASP 81 Ca 0.06 -1.41 0.00 0.00 -0.50 0.00 0.00 54.79 52.94 2dyy n ASP 81 Cb 0.50 -1.01 0.00 0.00 -1.14 0.00 0.00 41.12 39.47 2dyy n ASP 81 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2dyy n ASN 89 N 10.57 0.00 0.00 -1.12 3.02 -1.26 -5.08 115.26 121.39 2dyy n ASN 89 Ca 0.36 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 55.01 2dyy n ASN 89 Cb 0.38 0.00 0.47 0.00 -0.61 0.00 0.00 39.78 40.02 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 0.00 0.15 -0.22 3.52 4.07 -1.26 -3.02 120.64 123.88 2dyy n GLU 90 Ca 0.00 0.12 -0.02 0.00 -0.06 0.00 0.00 57.16 57.20 2dyy n GLU 90 Cb 0.00 -1.50 0.09 0.00 -0.06 0.00 0.00 31.44 29.97 2dyy n GLU 90 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 2dyy h VAL 91 N 0.00 0.96 -0.42 6.31 2.07 -2.02 -2.59 116.25 120.56 2dyy h VAL 91 Ca 0.00 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.25 2dyy h VAL 91 Cb 0.27 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 2dyy h VAL 91 CO 0.00 0.12 0.06 1.88 0.02 0.00 0.00 177.57 179.65 2dyy h TYR 92 N 0.65 0.67 -0.54 1.57 -1.99 -1.97 -3.19 116.97 112.17 2dyy h TYR 92 Ca 0.29 -0.06 0.05 0.00 2.00 0.00 0.00 58.73 61.01 2dyy h TYR 92 Cb 0.18 -0.20 -0.03 0.00 2.00 0.00 0.00 36.73 38.69 2dyy h TYR 92 CO -0.08 0.61 0.36 0.00 -0.00 0.00 0.00 178.16 179.05 2dyy h ALA 93 N 1.44 1.82 0.00 3.88 0.00 -1.65 1.25 119.26 125.99 2dyy h ALA 93 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2dyy h ALA 93 Cb 0.31 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2dyy h ALA 93 CO 0.00 0.10 0.00 1.05 0.00 0.00 0.00 179.25 180.41 2dyy h GLU 94 N 0.55 0.00 0.00 0.00 4.11 -1.63 -1.14 114.58 116.47 2dyy h GLU 94 Ca 0.23 0.00 -0.39 0.00 0.07 0.00 0.00 59.36 59.27 2dyy h GLU 94 Cb 0.22 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.41 2dyy h GLU 94 CO -0.06 0.00 -2.33 0.66 0.07 0.00 0.00 179.01 177.34 2dyy n TYR 95 N -2.58 0.00 -1.10 2.06 4.01 -0.30 -4.67 117.16 114.57 2dyy n TYR 95 Ca 0.04 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.80 2dyy n TYR 95 Cb 0.39 -0.87 0.26 0.00 -0.31 0.00 0.00 39.34 38.81 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 -3.80 1.32 0.05 -0.72 3.72 0.41 -4.67 117.46 113.78 2dyy n PHE 96 Ca -0.45 -1.09 -0.12 0.00 -0.05 0.00 0.00 57.45 55.73 2dyy n PHE 96 Cb 0.87 -0.44 -0.09 0.00 -0.94 0.00 0.00 39.48 38.88 2dyy n PHE 96 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2dyy h GLY 97 N 1.87 -0.19 -1.10 1.37 0.00 -1.33 0.47 103.07 104.16 2dyy h GLY 97 Ca 0.10 0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2dyy h GLY 97 CO 0.37 -0.07 0.00 -2.21 0.00 0.00 0.00 176.54 174.63 2dyy n GLU 98 N -4.93 1.70 0.01 4.80 2.13 -1.26 -3.99 120.64 119.10 2dyy n GLU 98 Ca -0.08 -0.81 -0.03 0.00 0.66 0.00 0.00 57.16 56.89 2dyy n GLU 98 Cb 0.27 -1.35 -0.01 0.00 0.27 0.00 0.00 31.44 30.62 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 0.14 0.93 -3.63 4.31 2.88 -1.20 -4.60 113.62 112.46 2dyy n SER 99 Ca 0.07 0.13 -0.21 0.00 -1.33 0.00 0.00 58.87 57.54 2dyy n SER 99 Cb 0.29 -0.31 0.05 0.00 -0.75 0.00 0.00 64.21 63.49 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 -3.50 -5.62 -0.87 -1.46 5.02 0.15 -4.97 118.16 106.92 2dyy n LYS 100 Ca -0.05 0.70 -0.30 0.00 -2.02 0.00 0.00 58.31 56.64 2dyy n LYS 100 Cb 0.26 -5.44 0.18 0.00 -0.02 0.00 0.00 35.03 30.01 2dyy n LYS 100 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2dyy s PRO 101 N -5.85 0.53 0.22 1.97 0.04 -1.26 -4.97 135.00 125.68 2dyy s PRO 101 Ca 0.07 1.03 -0.30 0.00 0.04 0.00 0.00 61.00 61.84 2dyy s PRO 101 Cb -0.03 -1.71 -0.09 0.00 0.04 0.00 0.00 34.50 32.71 2dyy s PRO 101 CO 0.78 -2.80 1.10 0.00 0.04 0.00 0.00 177.00 176.12 2dyy s ALA 102 N -2.71 3.39 0.07 8.56 0.00 0.56 -4.87 121.76 126.75 2dyy s ALA 102 Ca 0.66 0.85 0.08 0.00 0.00 0.00 0.00 51.96 53.55 2dyy s ALA 102 Cb -0.21 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 2dyy s ALA 102 CO 0.60 -0.17 -0.23 0.50 0.00 0.00 0.00 175.76 176.46 2dyy s ARG 103 N -0.85 1.42 -0.03 0.00 3.00 -1.26 -1.24 118.95 119.98 2dyy s ARG 103 Ca 0.47 -1.06 0.04 0.00 -1.00 0.00 0.00 55.73 54.18 2dyy s ARG 103 Cb -0.30 -1.62 -0.00 0.00 0.00 0.00 0.00 34.95 33.02 2dyy s ARG 103 CO 0.37 0.40 -0.16 0.08 0.00 0.00 0.00 175.30 176.00 2dyy s VAL 104 N -0.90 1.31 -0.08 7.11 1.01 -0.01 -4.98 120.40 123.86 2dyy s VAL 104 Ca 0.09 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.37 2dyy s VAL 104 Cb -0.09 -1.12 0.05 0.00 0.00 0.00 0.00 36.38 35.21 2dyy s VAL 104 CO 0.03 0.38 0.18 0.00 0.00 0.00 0.00 175.10 175.68 2dyy s ALA 105 N -0.03 -0.29 0.05 5.51 0.00 -1.26 -0.19 121.76 125.56 2dyy s ALA 105 Ca -0.02 0.69 -0.06 0.00 0.00 0.00 0.00 51.96 52.58 2dyy s ALA 105 Cb -0.10 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 22.32 2dyy s ALA 105 CO 0.01 -0.38 0.10 0.14 0.00 0.00 0.00 175.76 175.64 2dyy s VAL 106 N 1.78 0.15 -0.02 0.00 -7.23 -0.23 -4.97 120.40 109.88 2dyy s VAL 106 Ca -0.03 -1.25 0.00 0.00 -1.81 0.00 0.00 61.98 58.90 2dyy s VAL 106 Cb -0.12 -1.14 -0.04 0.00 0.56 0.00 0.00 36.38 35.64 2dyy s VAL 106 CO -0.06 -0.69 0.02 -1.61 -0.31 0.00 0.00 175.10 172.45 2dyy s GLU 107 N -3.22 2.91 0.42 4.82 2.02 -1.26 -1.44 118.70 122.94 2dyy s GLU 107 Ca 0.00 -0.53 0.04 0.00 0.02 0.00 0.00 54.97 54.50 2dyy s GLU 107 Cb 0.02 -2.75 -0.02 0.00 0.10 0.00 0.00 34.13 31.48 2dyy s GLU 107 CO -0.07 0.65 0.16 0.14 0.02 0.00 0.00 175.26 176.15 2dyy s VAL 108 N -1.08 0.46 0.02 2.63 -7.23 0.27 -4.90 120.40 110.56 2dyy s VAL 108 Ca 0.19 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.10 2dyy s VAL 108 Cb -0.12 -2.30 -0.16 0.00 0.56 0.00 0.00 36.38 34.36 2dyy s VAL 108 CO 0.10 0.00 1.18 0.28 -0.31 0.00 0.00 175.10 176.34 2dyy h SER 109 N 1.77 -0.67 -5.05 4.85 0.02 -2.00 -3.12 113.55 109.36 2dyy h SER 109 Ca -0.33 -0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 60.51 2dyy h SER 109 Cb 1.27 0.17 -0.16 0.00 0.14 0.00 0.00 62.40 63.82 2dyy h SER 109 CO 0.52 -0.30 -0.16 -0.60 -1.14 0.00 0.00 176.83 175.15 2dyy s ARG 110 N -4.76 0.90 0.36 3.45 3.52 -1.26 -4.72 118.95 116.44 2dyy s ARG 110 Ca -0.14 -0.48 0.08 0.00 -0.13 0.00 0.00 55.73 55.07 2dyy s ARG 110 Cb 0.02 0.40 -0.05 0.00 -1.56 0.00 0.00 34.95 33.75 2dyy s ARG 110 CO 0.47 -0.31 0.05 -0.51 -0.81 0.00 0.00 175.30 174.20 2dyy s LEU 111 N -2.16 3.02 0.17 -0.88 1.43 -1.26 -5.05 118.68 113.96 2dyy s LEU 111 Ca -0.04 -1.02 -0.32 0.00 -1.03 0.00 0.00 54.13 51.72 2dyy s LEU 111 Cb -0.00 -1.36 -0.12 0.00 0.03 0.00 0.00 46.19 44.74 2dyy s LEU 111 CO -0.04 -0.32 1.74 -2.65 0.23 0.00 0.00 176.35 175.31 2dyy n PRO 112 N -1.02 2.70 -2.35 1.29 -0.02 -1.26 -2.13 135.00 132.21 2dyy n PRO 112 Ca -0.04 0.98 -0.11 0.00 -2.02 0.00 0.00 63.50 62.31 2dyy n PRO 112 Cb 0.63 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 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 4.41 -1.39 -4.19 -0.52 5.02 -1.26 -3.67 118.16 116.55 2dyy n LYS 113 Ca 0.17 0.50 -0.34 0.00 -2.02 0.00 0.00 58.31 56.61 2dyy n LYS 113 Cb 0.35 -4.53 -0.03 0.00 -0.02 0.00 0.00 35.03 30.80 2dyy n LYS 113 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2dyy n ASP 114 N -0.15 -2.57 -4.91 4.39 -0.08 -0.90 -4.95 116.55 107.38 2dyy n ASP 114 Ca -0.10 -1.03 -0.27 0.00 -1.51 0.00 0.00 54.79 51.88 2dyy n ASP 114 Cb 0.58 -2.73 -0.00 0.00 2.34 0.00 0.00 41.12 41.31 2dyy n ASP 114 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2dyy s VAL 115 N -3.45 4.92 0.11 5.18 1.01 -1.24 -4.95 120.40 121.97 2dyy s VAL 115 Ca 0.58 0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.71 2dyy s VAL 115 Cb -0.32 -3.87 -0.23 0.00 0.00 0.00 0.00 36.38 31.96 2dyy s VAL 115 CO 0.93 -0.84 1.23 -0.07 0.00 0.00 0.00 175.10 176.35 2dyy h LEU 116 N 0.25 0.40 -7.56 3.92 4.07 -1.94 -3.39 115.31 111.06 2dyy h LEU 116 Ca -0.47 -0.38 -0.19 0.00 0.08 0.00 0.00 57.88 56.92 2dyy h LEU 116 Cb 1.21 -0.13 -0.26 0.00 1.08 0.00 0.00 40.66 42.55 2dyy h LEU 116 CO 0.62 1.25 -0.52 -0.51 -1.08 0.00 0.00 178.44 178.19 2dyy s ILE 117 N -2.90 -0.00 -0.02 1.22 2.07 -1.26 -1.48 121.20 118.83 2dyy s ILE 117 Ca -0.04 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.24 2dyy s ILE 117 Cb 0.08 -0.24 -0.00 0.00 0.13 0.00 0.00 42.46 42.42 2dyy s ILE 117 CO 0.87 0.00 -0.12 -0.70 -1.91 0.00 0.00 174.94 173.08 2dyy s GLU 118 N 0.10 1.17 -0.04 3.50 2.12 0.09 -4.26 118.70 121.38 2dyy s GLU 118 Ca -0.00 -0.43 0.01 0.00 0.36 0.00 0.00 54.97 54.91 2dyy s GLU 118 Cb -0.01 -1.08 0.02 0.00 0.26 0.00 0.00 34.13 33.32 2dyy s GLU 118 CO 0.00 0.20 -0.04 0.42 -0.54 0.00 0.00 175.26 175.30 2dyy s ILE 119 N -0.01 0.50 -0.03 -3.70 1.01 -0.40 -0.77 121.20 117.80 2dyy s ILE 119 Ca -0.00 -0.11 0.04 0.00 0.00 0.00 0.00 60.65 60.58 2dyy s ILE 119 Cb -0.08 -0.53 -0.03 0.00 0.01 0.00 0.00 42.46 41.84 2dyy s ILE 119 CO 0.00 0.21 -0.14 -1.83 0.00 0.00 0.00 174.94 173.19 2dyy s GLU 120 N 0.89 2.44 0.11 2.79 -1.05 -1.05 0.53 118.70 123.35 2dyy s GLU 120 Ca -0.12 -0.74 0.02 0.00 -0.15 0.00 0.00 54.97 53.98 2dyy s GLU 120 Cb -0.14 -2.36 -0.04 0.00 -0.44 0.00 0.00 34.13 31.15 2dyy s GLU 120 CO 0.00 0.61 -0.05 0.00 0.95 0.00 0.00 175.26 176.77 2dyy s ALA 121 N -0.78 1.06 -0.02 -0.84 0.00 -1.24 -1.94 121.76 118.00 2dyy s ALA 121 Ca 0.12 -1.40 0.02 0.00 0.00 0.00 0.00 51.96 50.71 2dyy s ALA 121 Cb -0.11 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.25 2dyy s ALA 121 CO 0.02 -0.25 -0.08 0.42 0.00 0.00 0.00 175.76 175.87 2dyy s ILE 122 N -3.63 0.68 0.17 0.00 1.01 -0.79 -1.29 121.20 117.36 2dyy s ILE 122 Ca 0.14 -0.32 0.06 0.00 0.00 0.00 0.00 60.65 60.54 2dyy s ILE 122 Cb 0.05 -0.61 -0.05 0.00 0.01 0.00 0.00 42.46 41.87 2dyy s ILE 122 CO -0.03 0.21 -0.12 0.00 0.00 0.00 0.00 174.94 175.00 2dyy s ALA 123 N 0.14 1.72 0.06 9.38 0.00 -0.71 -0.90 121.76 131.45 2dyy s ALA 123 Ca -0.02 -1.56 0.04 0.00 0.00 0.00 0.00 51.96 50.42 2dyy s ALA 123 Cb -0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.00 2dyy s ALA 123 CO 0.00 -0.01 -0.12 -0.47 0.00 0.00 0.00 175.76 175.17 2dyy s TYR 124 N -3.10 0.99 -0.23 0.00 5.04 0.62 -1.16 117.35 119.50 2dyy s TYR 124 Ca 0.19 -0.46 -0.08 0.00 -2.44 0.00 0.00 57.07 54.27 2dyy s TYR 124 Cb 0.01 -0.57 0.10 0.00 0.35 0.00 0.00 41.96 41.85 2dyy s TYR 124 CO 0.04 -0.00 0.51 0.21 -1.34 0.00 0.00 175.55 174.96 2dyy s LYS 125 N -1.62 0.43 0.00 4.97 2.20 -1.00 -4.63 119.74 120.09 2dyy s LYS 125 Ca -0.05 1.17 0.29 0.00 -0.36 0.00 0.00 55.97 57.02 2dyy s LYS 125 Cb -0.10 0.48 1.33 0.00 -1.51 0.00 0.00 37.83 38.03 2dyy s LYS 125 CO 0.01 -0.22 1.90 -1.91 -0.36 0.00 0.00 175.35 174.77