#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 1.66 -0.05 1.64 0.41 -0.11 -4.96 118.70 117.28 2dyy s GLU 3 Ca 0.00 -0.49 -0.17 0.00 -0.41 0.00 0.00 54.97 53.90 2dyy s GLU 3 Cb 0.00 -1.41 -0.05 0.00 -1.78 0.00 0.00 34.13 30.89 2dyy s GLU 3 CO 0.00 0.13 0.47 0.54 -0.49 0.00 0.00 175.26 175.92 2dyy s VAL 4 N 0.32 5.07 0.00 2.63 0.11 -1.26 0.80 120.40 128.07 2dyy s VAL 4 Ca -0.09 0.97 0.00 0.00 -2.93 0.00 0.00 61.98 59.94 2dyy s VAL 4 Cb -0.13 -3.80 -0.04 0.00 -1.53 0.00 0.00 36.38 30.88 2dyy s VAL 4 CO 0.03 0.43 0.05 -0.63 -3.33 0.00 0.00 175.10 171.66 2dyy s ILE 5 N -0.14 4.53 -0.03 7.04 1.09 -0.69 -4.95 121.20 128.04 2dyy s ILE 5 Ca 0.26 -0.49 -0.12 0.00 -1.10 0.00 0.00 60.65 59.19 2dyy s ILE 5 Cb -0.16 -3.06 0.02 0.00 -1.06 0.00 0.00 42.46 38.20 2dyy s ILE 5 CO 0.13 0.35 0.27 0.12 -0.10 0.00 0.00 174.94 175.70 2dyy s PHE 6 N -1.17 -0.15 -0.27 3.97 5.36 -1.26 -3.91 117.98 120.55 2dyy s PHE 6 Ca 0.22 0.26 -0.25 0.00 -0.96 0.00 0.00 56.93 56.20 2dyy s PHE 6 Cb -0.12 0.07 0.07 0.00 -0.34 0.00 0.00 43.02 42.70 2dyy s PHE 6 CO 0.13 -0.33 0.74 -0.08 -1.46 0.00 0.00 175.22 174.23 2dyy s THR 7 N -1.08 0.00 -0.67 0.12 -1.32 -1.26 -4.99 115.64 106.44 2dyy s THR 7 Ca -0.11 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.61 2dyy s THR 7 Cb -0.05 -1.00 0.25 0.00 -1.51 0.00 0.00 72.50 70.19 2dyy s THR 7 CO 0.03 0.00 1.73 -1.84 -2.21 0.00 0.00 174.62 172.33 2dyy n GLU 8 N 2.61 0.18 0.00 7.08 0.28 -1.26 -2.69 120.64 126.84 2dyy n GLU 8 Ca -0.14 0.30 0.03 0.00 -0.16 0.00 0.00 57.16 57.19 2dyy n GLU 8 Cb 0.55 -1.78 0.14 0.00 1.43 0.00 0.00 31.44 31.78 2dyy n GLU 8 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2dyy n ASN 9 N -2.11 0.00 -3.88 -1.84 3.02 -1.26 -4.72 115.26 104.47 2dyy n ASN 9 Ca 0.04 0.33 -0.09 0.00 -0.03 0.00 0.00 54.58 54.82 2dyy n ASN 9 Cb 0.30 -0.38 -0.08 0.00 -0.61 0.00 0.00 39.78 39.01 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 -2.75 -0.21 1.16 5.41 0.00 -1.10 -4.81 121.76 119.46 2dyy s ALA 10 Ca 0.04 -0.49 -0.17 0.00 0.00 0.00 0.00 51.96 51.35 2dyy s ALA 10 Cb 0.04 0.34 0.19 0.00 0.00 0.00 0.00 23.12 23.69 2dyy s ALA 10 CO 0.10 -0.40 0.40 -2.30 0.00 0.00 0.00 175.76 173.56 2dyy n PRO 11 N 0.44 -2.11 -3.13 0.00 -0.02 -1.26 -4.82 135.00 124.09 2dyy n PRO 11 Ca -0.17 -0.60 0.04 0.00 -2.02 0.00 0.00 63.50 60.75 2dyy n PRO 11 Cb 0.60 -1.87 -0.00 0.00 -0.02 0.00 0.00 33.50 32.21 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 -3.83 0.45 -0.11 -0.52 2.47 -1.26 -4.89 119.74 112.05 2dyy s LYS 12 Ca 0.61 0.27 -0.32 0.00 -1.56 0.00 0.00 55.97 54.97 2dyy s LYS 12 Cb -0.17 0.16 -0.09 0.00 -1.46 0.00 0.00 37.83 36.26 2dyy s LYS 12 CO 0.66 -0.79 2.02 -0.35 0.16 0.00 0.00 175.35 177.05 2dyy n PRO 13 N 5.06 2.23 -1.62 4.03 -0.04 -1.26 -4.88 135.00 138.51 2dyy n PRO 13 Ca 0.07 0.76 -0.45 0.00 -0.04 0.00 0.00 63.50 63.85 2dyy n PRO 13 Cb 0.56 -2.87 -0.02 0.00 -0.04 0.00 0.00 33.50 31.13 2dyy n PRO 13 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2dyy n ILE 14 N 6.08 1.61 0.00 0.52 3.06 -1.26 -4.43 119.36 124.94 2dyy n ILE 14 Ca 0.25 -0.40 0.00 0.00 -2.50 0.00 0.00 62.75 60.10 2dyy n ILE 14 Cb 0.36 -1.15 0.00 0.00 0.54 0.00 0.00 39.64 39.38 2dyy n ILE 14 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2dyy n GLY 15 N 1.45 0.17 2.50 4.50 0.00 -1.26 -4.83 105.19 107.72 2dyy n GLY 15 Ca 0.10 -1.98 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 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 3.39 -4.22 1.61 -0.04 -1.26 -4.92 135.00 129.56 2dyy n PRO 16 Ca 0.00 -2.88 -0.17 0.00 -0.04 0.00 0.00 63.50 60.40 2dyy n PRO 16 Cb 0.00 -2.35 -0.13 0.00 -0.04 0.00 0.00 33.50 30.98 2dyy n PRO 16 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2dyy s TYR 17 N -1.60 1.00 0.18 0.54 1.51 -1.26 -5.15 117.35 112.57 2dyy s TYR 17 Ca 0.56 -0.39 0.10 0.00 -1.01 0.00 0.00 57.07 56.33 2dyy s TYR 17 Cb 0.30 -0.59 -0.04 0.00 -0.11 0.00 0.00 41.96 41.52 2dyy s TYR 17 CO -0.17 0.01 -0.14 -1.12 -1.11 0.00 0.00 175.55 173.01 2dyy s SER 18 N -1.28 3.99 0.30 2.29 0.01 -1.26 -4.88 113.70 112.86 2dyy s SER 18 Ca -0.02 -0.67 0.10 0.00 1.31 0.00 0.00 55.95 56.67 2dyy s SER 18 Cb -0.08 -0.57 0.44 0.00 0.21 0.00 0.00 66.02 66.02 2dyy s SER 18 CO 0.01 0.11 1.66 1.56 0.41 0.00 0.00 173.24 176.99 2dyy h GLN 19 N 3.01 0.02 -1.79 12.44 4.20 -1.91 -3.41 115.11 127.67 2dyy h GLN 19 Ca -0.47 -0.01 0.16 0.00 0.06 0.00 0.00 58.65 58.39 2dyy h GLN 19 Cb 1.21 0.00 -0.19 0.00 0.30 0.00 0.00 27.48 28.80 2dyy h GLN 19 CO 0.52 0.57 0.63 0.00 -0.67 0.00 0.00 178.83 179.88 2dyy s ALA 20 N -3.78 -1.94 0.01 3.87 0.00 -1.25 -0.98 121.76 117.68 2dyy s ALA 20 Ca -0.02 1.38 0.05 0.00 0.00 0.00 0.00 51.96 53.37 2dyy s ALA 20 Cb 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.12 2dyy s ALA 20 CO 0.76 -0.55 -0.16 0.42 0.00 0.00 0.00 175.76 176.22 2dyy s ILE 21 N -2.34 1.28 -0.26 0.00 -1.09 -0.14 -1.71 121.20 116.94 2dyy s ILE 21 Ca 0.05 -0.81 -0.08 0.00 -2.23 0.00 0.00 60.65 57.58 2dyy s ILE 21 Cb -0.01 -1.09 -0.02 0.00 -1.58 0.00 0.00 42.46 39.76 2dyy s ILE 21 CO -0.05 0.26 0.09 -0.75 -1.23 0.00 0.00 174.94 173.26 2dyy s LYS 22 N -0.64 3.57 -0.37 2.79 2.36 0.24 -1.20 119.74 126.49 2dyy s LYS 22 Ca 0.05 -0.54 0.01 0.00 -2.55 0.00 0.00 55.97 52.95 2dyy s LYS 22 Cb -0.07 -3.39 0.11 0.00 -1.05 0.00 0.00 37.83 33.44 2dyy s LYS 22 CO 0.00 -0.25 0.14 0.00 1.55 0.00 0.00 175.35 176.79 2dyy s ALA 23 N 1.61 2.11 0.00 3.13 0.00 -0.27 -0.94 121.76 127.40 2dyy s ALA 23 Ca 0.06 -2.22 0.00 0.00 0.00 0.00 0.00 51.96 49.80 2dyy s ALA 23 Cb -0.16 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 21.16 2dyy s ALA 23 CO 0.04 -1.81 0.00 0.41 0.00 0.00 0.00 175.76 174.41 2dyy n GLY 24 N 4.24 0.87 0.38 0.00 0.00 -1.26 -2.62 105.19 106.80 2dyy n GLY 24 Ca 0.03 -0.60 0.12 0.00 0.00 0.00 0.00 46.02 45.57 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 6.77 1.48 -4.84 1.61 5.03 -1.26 -4.91 115.26 119.14 2dyy n ASN 25 Ca 0.00 -1.20 -0.37 0.00 0.87 0.00 0.00 54.58 53.88 2dyy n ASN 25 Cb 0.00 0.22 -0.06 0.00 -1.02 0.00 0.00 39.78 38.92 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 -2.42 3.70 -0.20 3.10 0.08 -1.08 -1.70 117.98 119.46 2dyy s PHE 26 Ca 0.24 0.96 0.01 0.00 0.12 0.00 0.00 56.93 58.26 2dyy s PHE 26 Cb 0.19 -2.27 0.03 0.00 -0.57 0.00 0.00 43.02 40.41 2dyy s PHE 26 CO 0.51 0.62 -0.17 -1.17 -0.10 0.00 0.00 175.22 174.91 2dyy s LEU 27 N -1.23 2.54 -0.34 -0.37 2.96 0.78 -1.12 118.68 121.89 2dyy s LEU 27 Ca 0.25 -0.87 -0.13 0.00 -0.22 0.00 0.00 54.13 53.17 2dyy s LEU 27 Cb -0.16 -1.51 -0.02 0.00 0.50 0.00 0.00 46.19 45.00 2dyy s LEU 27 CO 0.14 -0.06 0.26 -0.36 -1.32 0.00 0.00 176.35 175.01 2dyy s PHE 28 N 1.24 3.23 -0.19 5.38 0.08 -0.34 -1.35 117.98 126.02 2dyy s PHE 28 Ca 0.01 -0.16 -0.12 0.00 0.12 0.00 0.00 56.93 56.78 2dyy s PHE 28 Cb -0.15 -2.50 -0.05 0.00 -0.57 0.00 0.00 43.02 39.75 2dyy s PHE 28 CO -0.10 -0.36 0.22 0.42 -0.10 0.00 0.00 175.22 175.30 2dyy s ILE 29 N 1.77 5.35 1.08 0.64 1.01 -0.78 -0.96 121.20 129.30 2dyy s ILE 29 Ca 0.07 0.38 -0.13 0.00 0.00 0.00 0.00 60.65 60.96 2dyy s ILE 29 Cb -0.17 -3.56 0.19 0.00 0.01 0.00 0.00 42.46 38.93 2dyy s ILE 29 CO 0.11 0.39 0.76 0.00 0.00 0.00 0.00 174.94 176.20 2dyy n ALA 30 N 3.70 -2.67 -2.13 9.38 0.00 -0.16 -3.63 120.51 125.00 2dyy n ALA 30 Ca -0.14 -1.00 -0.42 0.00 0.00 0.00 0.00 53.44 51.89 2dyy n ALA 30 Cb 0.52 -1.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.02 2dyy n ALA 30 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2dyy s GLY 31 N -2.29 1.87 -0.15 0.00 0.00 -1.26 -4.62 107.32 100.87 2dyy s GLY 31 Ca 0.64 1.11 -0.06 0.00 0.00 0.00 0.00 44.72 46.41 2dyy s GLY 31 CO 0.64 2.45 0.07 1.20 0.00 0.00 0.00 173.10 177.46 2dyy s GLN 32 N 1.47 3.71 0.26 2.90 -1.52 0.53 -4.88 119.66 122.12 2dyy s GLN 32 Ca 0.66 -0.31 0.09 0.00 -1.95 0.00 0.00 55.36 53.85 2dyy s GLN 32 Cb -0.37 -3.14 -0.04 0.00 -0.22 0.00 0.00 33.01 29.24 2dyy s GLN 32 CO 0.30 0.45 0.04 0.96 -0.25 0.00 0.00 175.29 176.78 2dyy s ILE 33 N -0.12 3.67 -0.68 1.08 -4.36 -1.26 -1.92 121.20 117.60 2dyy s ILE 33 Ca 0.07 -1.77 -0.05 0.00 -0.26 0.00 0.00 60.65 58.64 2dyy s ILE 33 Cb -0.12 -2.96 -0.04 0.00 1.25 0.00 0.00 42.46 40.59 2dyy s ILE 33 CO 0.01 -0.35 1.83 -0.81 0.24 0.00 0.00 174.94 175.86 2dyy n PRO 34 N -0.89 1.55 -4.50 0.37 -0.04 -1.26 -4.55 135.00 125.67 2dyy n PRO 34 Ca -0.07 -1.23 -0.34 0.00 -0.04 0.00 0.00 63.50 61.82 2dyy n PRO 34 Cb 0.58 -2.35 -0.11 0.00 -0.04 0.00 0.00 33.50 31.58 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 3.86 3.86 -0.42 0.52 1.01 -1.26 -1.55 121.20 127.22 2dyy s ILE 35 Ca 0.30 -0.40 -0.26 0.00 0.00 0.00 0.00 60.65 60.30 2dyy s ILE 35 Cb 0.08 -2.63 0.02 0.00 0.01 0.00 0.00 42.46 39.94 2dyy s ILE 35 CO -0.02 0.56 0.93 -0.62 0.00 0.00 0.00 174.94 175.79 2dyy s ASP 36 N -0.35 6.59 0.59 3.58 3.68 -0.56 -4.68 116.67 125.52 2dyy s ASP 36 Ca 0.06 0.36 0.29 0.00 2.13 0.00 0.00 52.55 55.38 2dyy s ASP 36 Cb -0.12 -2.46 1.35 0.00 -1.45 0.00 0.00 42.92 40.24 2dyy s ASP 36 CO 0.02 -0.96 1.74 1.55 0.13 0.00 0.00 175.17 177.65 2dyy h PRO 37 N 8.79 0.00 0.07 4.34 0.13 -1.89 0.25 132.00 143.69 2dyy h PRO 37 Ca -0.24 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2dyy h PRO 37 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2dyy h PRO 37 CO 1.01 0.00 -0.04 0.87 -0.23 0.00 0.00 178.00 179.61 2dyy h LYS 38 N 0.00 -0.10 -0.01 0.86 6.56 -1.92 -3.39 116.57 118.58 2dyy h LYS 38 Ca 0.30 0.01 -0.17 0.00 -1.06 0.00 0.00 60.65 59.73 2dyy h LYS 38 Cb 1.67 0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 33.33 2dyy h LYS 38 CO -0.00 -0.06 -0.76 1.79 -2.06 0.00 0.00 179.45 178.35 2dyy h THR 39 N -0.59 1.50 0.00 -0.16 1.35 -1.95 -3.47 112.91 109.59 2dyy h THR 39 Ca -0.01 -2.49 0.00 0.00 -0.55 0.00 0.00 66.41 63.36 2dyy h THR 39 Cb 0.08 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.84 2dyy h THR 39 CO 0.02 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 176.61 2dyy n GLY 40 N 0.63 1.05 3.89 5.82 0.00 0.85 -5.03 105.19 112.41 2dyy n GLY 40 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.39 3.68 -0.51 1.61 0.41 -1.26 -4.77 118.70 117.49 2dyy s GLU 41 Ca 0.00 0.13 -0.29 0.00 -0.41 0.00 0.00 54.97 54.40 2dyy s GLU 41 Cb 0.00 -2.60 0.03 0.00 -1.78 0.00 0.00 34.13 29.78 2dyy s GLU 41 CO 0.00 0.18 1.18 0.42 -0.49 0.00 0.00 175.26 176.56 2dyy s ILE 42 N -2.09 4.12 -0.82 -1.63 1.01 -1.26 -1.49 121.20 119.02 2dyy s ILE 42 Ca 0.46 1.10 -0.33 0.00 0.00 0.00 0.00 60.65 61.88 2dyy s ILE 42 Cb -0.11 -4.61 -0.19 0.00 0.01 0.00 0.00 42.46 37.56 2dyy s ILE 42 CO 0.29 -1.10 2.55 0.52 0.00 0.00 0.00 174.94 177.20 2dyy n VAL 43 N 6.82 -0.00 -2.26 2.92 0.31 -0.60 -4.82 118.33 120.71 2dyy n VAL 43 Ca 0.11 -0.12 -0.41 0.00 -0.01 0.00 0.00 64.34 63.92 2dyy n VAL 43 Cb 0.49 -0.86 -0.03 0.00 -0.91 0.00 0.00 33.84 32.53 2dyy n VAL 43 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 2dyy s LYS 44 N 8.31 4.42 0.00 5.55 0.00 -1.26 -4.71 119.74 132.05 2dyy s LYS 44 Ca 1.27 2.00 0.00 0.00 0.00 0.00 0.00 55.97 59.25 2dyy s LYS 44 Cb -1.14 -3.20 0.00 0.00 0.00 0.00 0.00 37.83 33.49 2dyy s LYS 44 CO 0.49 -0.19 0.00 0.41 0.00 0.00 0.00 175.35 176.05 2dyy n GLY 45 N 2.21 -0.67 0.17 0.59 0.00 -1.26 -5.01 105.19 101.23 2dyy n GLY 45 Ca 0.05 -0.91 -0.01 0.00 0.00 0.00 0.00 46.02 45.15 2dyy n GLY 45 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dyy n ASP 46 N 0.31 0.05 -0.02 1.61 5.75 -1.26 -4.90 116.55 118.09 2dyy n ASP 46 Ca 0.00 -1.05 0.01 0.00 -0.01 0.00 0.00 54.79 53.75 2dyy n ASP 46 Cb 0.00 -0.03 0.33 0.00 -1.03 0.00 0.00 41.12 40.39 2dyy n ASP 46 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 2dyy h ILE 47 N -0.46 1.17 -0.48 2.12 6.09 -2.00 -2.86 117.51 121.09 2dyy h ILE 47 Ca -0.02 -0.54 -0.05 0.00 -1.37 0.00 0.00 64.86 62.88 2dyy h ILE 47 Cb 0.05 0.71 -0.02 0.00 0.47 0.00 0.00 36.82 38.03 2dyy h ILE 47 CO 0.02 0.20 0.08 0.11 -3.07 0.00 0.00 178.15 175.49 2dyy h LYS 48 N 0.57 0.74 0.00 2.19 6.56 -1.94 -2.00 116.57 122.69 2dyy h LYS 48 Ca 0.14 -0.15 -0.17 0.00 -1.06 0.00 0.00 60.65 59.41 2dyy h LYS 48 Cb 0.15 -0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 31.68 2dyy h LYS 48 CO -0.01 0.69 -0.88 -0.44 -2.06 0.00 0.00 179.45 176.75 2dyy h ASP 49 N 0.71 0.00 0.86 0.86 5.19 -1.88 -3.01 116.42 119.15 2dyy h ASP 49 Ca 0.15 0.00 -0.23 0.00 -0.62 0.00 0.00 57.03 56.34 2dyy h ASP 49 Cb 0.31 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.80 2dyy h ASP 49 CO 0.00 0.74 -1.07 1.56 -3.12 0.00 0.00 179.24 177.35 2dyy h GLN 50 N 0.00 0.10 -0.42 3.56 4.20 -1.43 -2.89 115.11 118.23 2dyy h GLN 50 Ca -0.04 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.48 2dyy h GLN 50 Cb 1.60 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 29.42 2dyy h GLN 50 CO 0.09 1.06 0.18 1.15 -0.67 0.00 0.00 178.83 180.64 2dyy h THR 51 N 0.03 1.19 -0.75 -0.54 2.02 -1.41 -1.89 112.91 111.56 2dyy h THR 51 Ca -0.05 -0.58 -0.04 0.00 0.77 0.00 0.00 66.41 66.51 2dyy h THR 51 Cb 1.81 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 68.97 2dyy h THR 51 CO 0.15 0.21 0.29 -0.09 0.37 0.00 0.00 175.52 176.46 2dyy h ARG 52 N 0.54 1.11 -0.28 6.66 2.43 -1.56 -0.69 114.38 122.59 2dyy h ARG 52 Ca 0.14 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 2dyy h ARG 52 Cb 0.16 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 2dyy h ARG 52 CO -0.01 0.90 -0.22 0.37 -1.51 0.00 0.00 179.97 179.50 2dyy h GLN 53 N 1.08 0.64 -0.15 0.20 5.75 -1.32 -1.31 115.11 120.00 2dyy h GLN 53 Ca 0.25 -0.32 0.00 0.00 -0.15 0.00 0.00 58.65 58.43 2dyy h GLN 53 Cb 0.21 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.75 2dyy h GLN 53 CO -0.02 0.92 0.10 0.28 -2.65 0.00 0.00 178.83 177.45 2dyy h VAL 54 N 0.38 1.05 -0.59 2.39 2.07 -1.16 -0.91 116.25 119.48 2dyy h VAL 54 Ca 0.05 -0.11 0.05 0.00 0.82 0.00 0.00 66.70 67.51 2dyy h VAL 54 Cb 0.77 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 2dyy h VAL 54 CO 0.06 0.05 0.39 -0.07 0.02 0.00 0.00 177.57 178.02 2dyy h LEU 55 N 0.19 0.54 -0.25 2.57 3.38 -1.05 -0.57 115.31 120.12 2dyy h LEU 55 Ca 0.05 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 2dyy h LEU 55 Cb -0.00 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2dyy h LEU 55 CO -0.01 0.36 -0.27 -0.33 0.09 0.00 0.00 178.44 178.28 2dyy h GLU 56 N 0.62 0.62 -0.52 1.13 4.39 -0.69 -1.55 114.58 118.58 2dyy h GLU 56 Ca 0.25 -0.34 -0.04 0.00 0.34 0.00 0.00 59.36 59.57 2dyy h GLU 56 Cb 0.19 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2dyy h GLU 56 CO -0.07 0.94 0.14 -0.91 -1.16 0.00 0.00 179.01 177.95 2dyy h ASN 57 N 0.33 0.72 -0.34 1.42 2.35 -0.57 0.80 115.58 120.29 2dyy h ASN 57 Ca 0.04 -0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.64 2dyy h ASN 57 Cb 0.84 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 39.01 2dyy h ASN 57 CO 0.07 0.69 0.08 0.40 -1.65 0.00 0.00 177.43 177.02 2dyy h ILE 58 N 0.75 1.22 -0.75 2.81 2.04 -0.98 -1.95 117.51 120.65 2dyy h ILE 58 Ca 0.17 -0.76 -0.01 0.00 1.00 0.00 0.00 64.86 65.26 2dyy h ILE 58 Cb 0.25 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.37 2dyy h ILE 58 CO -0.01 0.26 0.41 0.50 0.00 0.00 0.00 178.15 179.31 2dyy h LYS 59 N 0.39 1.04 -0.74 2.37 3.64 -0.75 -1.24 116.57 121.28 2dyy h LYS 59 Ca 0.11 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 2dyy h LYS 59 Cb 0.31 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.89 2dyy h LYS 59 CO 0.00 0.77 0.35 0.00 -2.27 0.00 0.00 179.45 178.31 2dyy h ALA 60 N 1.21 1.23 -0.18 5.00 0.00 -0.64 -1.57 119.26 124.31 2dyy h ALA 60 Ca 0.26 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 2dyy h ALA 60 Cb 0.03 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2dyy h ALA 60 CO -0.04 0.59 -0.30 0.82 0.00 0.00 0.00 179.25 180.32 2dyy h ILE 61 N 1.05 1.34 -0.37 0.00 2.04 -0.93 -1.17 117.51 119.48 2dyy h ILE 61 Ca 0.26 -1.53 0.05 0.00 1.00 0.00 0.00 64.86 64.64 2dyy h ILE 61 Cb 0.11 1.90 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 2dyy h ILE 61 CO -0.03 0.46 0.08 -0.07 0.00 0.00 0.00 178.15 178.59 2dyy h LEU 62 N 0.16 0.03 -0.19 1.44 3.38 -1.08 -1.16 115.31 117.88 2dyy h LEU 62 Ca 0.01 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.07 2dyy h LEU 62 Cb 0.88 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 2dyy h LEU 62 CO 0.07 0.05 0.04 -0.33 0.09 0.00 0.00 178.44 178.36 2dyy h GLU 63 N 0.21 0.12 -0.66 1.13 5.08 -1.23 0.31 114.58 119.54 2dyy h GLU 63 Ca 0.18 -0.01 0.14 0.00 -1.00 0.00 0.00 59.36 58.67 2dyy h GLU 63 Cb 0.20 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 2dyy h GLU 63 CO -0.23 0.08 0.45 0.00 -1.00 0.00 0.00 179.01 178.31 2dyy h ALA 64 N 1.14 2.22 -0.01 3.43 0.00 -0.50 0.11 119.26 125.65 2dyy h ALA 64 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2dyy h ALA 64 Cb 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2dyy h ALA 64 CO -0.11 -0.39 -0.23 0.00 0.00 0.00 0.00 179.25 178.52 2dyy n ALA 65 N -2.56 3.01 -0.49 0.00 0.00 -0.51 -4.93 120.51 115.03 2dyy n ALA 65 Ca 0.12 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2dyy n ALA 65 Cb 0.53 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 1.33 0.73 3.93 0.00 0.00 0.03 -5.07 105.19 106.15 2dyy n GLY 66 Ca 0.12 -0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 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 1.95 0.30 1.61 4.12 0.96 -4.97 117.35 119.32 2dyy s TYR 67 Ca 0.00 -0.69 0.02 0.00 0.02 0.00 0.00 57.07 56.43 2dyy s TYR 67 Cb 0.00 -2.09 -0.04 0.00 -1.52 0.00 0.00 41.96 38.31 2dyy s TYR 67 CO 0.00 -0.53 0.13 -1.54 0.02 0.00 0.00 175.55 173.62 2dyy s SER 68 N -4.33 1.54 0.40 2.29 1.04 -1.26 -3.38 113.70 110.00 2dyy s SER 68 Ca 0.46 -1.49 0.11 0.00 0.48 0.00 0.00 55.95 55.51 2dyy s SER 68 Cb -0.04 0.28 0.92 0.00 0.10 0.00 0.00 66.02 67.28 2dyy s SER 68 CO 0.28 -0.81 1.96 -0.07 0.98 0.00 0.00 173.24 175.58 2dyy h LEU 69 N 2.24 0.49 -0.86 2.42 3.38 -1.93 -1.79 115.31 119.26 2dyy h LEU 69 Ca -0.36 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2dyy h LEU 69 Cb 1.25 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2dyy h LEU 69 CO 0.57 0.30 0.00 -0.46 0.09 0.00 0.00 178.44 178.94 2dyy n ASN 70 N -4.48 1.26 0.00 -0.43 2.04 -1.26 -2.91 115.26 109.48 2dyy n ASN 70 Ca 0.11 -1.93 0.12 0.00 -0.44 0.00 0.00 54.58 52.44 2dyy n ASN 70 Cb 0.34 -0.14 0.20 0.00 -2.53 0.00 0.00 39.78 37.64 2dyy n ASN 70 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 2dyy n ASP 71 N 0.16 0.56 -4.69 0.53 10.43 -0.67 -4.87 116.55 118.00 2dyy n ASP 71 Ca 0.09 -0.32 -0.42 0.00 2.57 0.00 0.00 54.79 56.71 2dyy n ASP 71 Cb 0.21 0.35 -0.03 0.00 1.84 0.00 0.00 41.12 43.49 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 -3.01 3.67 -0.04 2.53 1.01 -1.15 -0.78 120.40 122.64 2dyy s VAL 72 Ca 0.10 1.09 0.08 0.00 0.00 0.00 0.00 61.98 63.26 2dyy s VAL 72 Cb 0.17 -3.70 -0.13 0.00 0.00 0.00 0.00 36.38 32.72 2dyy s VAL 72 CO 0.72 0.01 0.13 2.30 0.00 0.00 0.00 175.10 178.27 2dyy n ILE 73 N 4.52 0.22 -3.79 2.22 -5.35 -0.11 -4.50 119.36 112.58 2dyy n ILE 73 Ca 0.13 -0.26 -0.13 0.00 -0.27 0.00 0.00 62.75 62.22 2dyy n ILE 73 Cb 0.44 -0.12 -0.13 0.00 -1.74 0.00 0.00 39.64 38.09 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 -2.46 0.21 0.01 6.28 2.20 -1.11 -1.39 119.74 123.47 2dyy s LYS 74 Ca -0.04 0.32 0.02 0.00 -0.36 0.00 0.00 55.97 55.91 2dyy s LYS 74 Cb 0.05 0.04 -0.01 0.00 -1.51 0.00 0.00 37.83 36.40 2dyy s LYS 74 CO 0.36 -0.06 -0.07 0.08 -0.36 0.00 0.00 175.35 175.30 2dyy s VAL 75 N 0.39 0.53 -0.13 4.02 1.01 -0.36 -0.87 120.40 124.99 2dyy s VAL 75 Ca -0.02 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2dyy s VAL 75 Cb -0.04 -0.48 0.02 0.00 0.00 0.00 0.00 36.38 35.89 2dyy s VAL 75 CO -0.02 0.05 -0.12 -0.89 0.00 0.00 0.00 175.10 174.12 2dyy s THR 76 N -0.39 1.38 -0.20 3.92 2.01 -0.34 -2.06 115.64 119.96 2dyy s THR 76 Ca 0.00 -0.52 -0.07 0.00 0.31 0.00 0.00 61.69 61.41 2dyy s THR 76 Cb -0.04 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 2dyy s THR 76 CO -0.00 0.43 0.06 -0.69 -0.69 0.00 0.00 174.62 173.72 2dyy s VAL 77 N 1.47 4.59 -0.24 3.82 1.01 0.47 -1.79 120.40 129.72 2dyy s VAL 77 Ca 0.03 -0.10 -0.04 0.00 0.00 0.00 0.00 61.98 61.87 2dyy s VAL 77 Cb -0.13 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.17 2dyy s VAL 77 CO -0.08 0.43 -0.02 -0.31 0.00 0.00 0.00 175.10 175.12 2dyy s TYR 78 N 0.69 3.03 0.26 5.22 1.51 0.78 -2.54 117.35 126.30 2dyy s TYR 78 Ca 0.03 -1.07 0.08 0.00 -1.01 0.00 0.00 57.07 55.10 2dyy s TYR 78 Cb -0.13 -2.13 -0.04 0.00 -0.11 0.00 0.00 41.96 39.54 2dyy s TYR 78 CO 0.02 -0.59 0.08 -0.51 -1.11 0.00 0.00 175.55 173.44 2dyy s LEU 79 N 1.45 3.47 0.00 -1.29 1.43 -0.99 -0.92 118.68 121.84 2dyy s LEU 79 Ca 0.04 -0.47 0.12 0.00 -1.03 0.00 0.00 54.13 52.79 2dyy s LEU 79 Cb -0.15 -2.00 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 2dyy s LEU 79 CO -0.02 -0.02 0.66 1.17 0.23 0.00 0.00 176.35 178.38 2dyy n LYS 80 N -1.01 2.17 0.00 1.70 4.81 -0.89 -0.83 118.16 124.11 2dyy n LYS 80 Ca -0.07 -0.56 0.00 0.00 -0.87 0.00 0.00 58.31 56.81 2dyy n LYS 80 Cb 0.58 -1.12 0.00 0.00 0.02 0.00 0.00 35.03 34.51 2dyy n LYS 80 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 2dyy n MET 88 N -0.38 0.00 -1.04 1.64 0.00 -1.26 -4.67 117.12 111.41 2dyy n MET 88 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 57.70 57.88 2dyy n MET 88 Cb 0.24 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.42 2dyy n MET 88 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2dyy n ASN 89 N -0.03 -6.02 0.00 7.83 3.02 -1.26 -4.49 115.26 114.31 2dyy n ASN 89 Ca 0.00 0.46 0.00 0.00 -0.03 0.00 0.00 54.58 55.01 2dyy n ASN 89 Cb 0.00 -3.31 0.00 0.00 -0.61 0.00 0.00 39.78 35.86 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 -3.21 0.00 -0.24 3.52 2.13 -1.26 -0.77 120.64 120.82 2dyy n GLU 90 Ca 0.00 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.81 2dyy n GLU 90 Cb 0.62 0.00 0.11 0.00 0.27 0.00 0.00 31.44 32.44 2dyy n GLU 90 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2dyy h VAL 91 N 0.00 0.95 -0.52 6.31 2.07 -1.95 -0.86 116.25 122.25 2dyy h VAL 91 Ca 0.00 -0.23 0.08 0.00 0.82 0.00 0.00 66.70 67.37 2dyy h VAL 91 Cb 0.00 0.21 -0.07 0.00 -1.52 0.00 0.00 31.29 29.91 2dyy h VAL 91 CO 0.00 0.12 0.14 0.22 0.02 0.00 0.00 177.57 178.08 2dyy h TYR 92 N 0.68 0.24 -0.08 1.57 3.20 -1.21 -0.27 116.97 121.10 2dyy h TYR 92 Ca 0.31 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.23 2dyy h TYR 92 Cb 0.21 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 2dyy h TYR 92 CO -0.08 0.04 0.09 0.00 -1.64 0.00 0.00 178.16 176.56 2dyy h ALA 93 N 1.39 1.71 -0.22 1.82 0.00 -1.36 -2.26 119.26 120.34 2dyy h ALA 93 Ca 0.26 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 2dyy h ALA 93 Cb 0.33 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2dyy h ALA 93 CO -0.31 -0.13 -0.05 0.93 0.00 0.00 0.00 179.25 179.69 2dyy h GLU 94 N 0.00 0.43 0.07 0.00 5.08 -0.73 -3.27 114.58 116.16 2dyy h GLU 94 Ca 0.04 -0.16 -0.26 0.00 -1.00 0.00 0.00 59.36 57.98 2dyy h GLU 94 Cb 0.21 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2dyy h GLU 94 CO -0.00 0.66 -1.22 1.88 -1.00 0.00 0.00 179.01 179.34 2dyy h TYR 95 N 0.16 0.28 -2.96 4.33 -1.99 -1.48 -3.38 116.97 111.93 2dyy h TYR 95 Ca 0.06 -0.21 -0.73 0.00 2.00 0.00 0.00 58.73 59.85 2dyy h TYR 95 Cb 0.51 -0.01 -0.33 0.00 2.00 0.00 0.00 36.73 38.89 2dyy h TYR 95 CO 0.05 1.18 0.17 1.19 -0.00 0.00 0.00 178.16 180.75 2dyy n PHE 96 N -3.43 3.56 -0.05 4.88 3.72 -0.88 -4.74 117.46 120.52 2dyy n PHE 96 Ca -0.07 -3.58 -0.06 0.00 -0.05 0.00 0.00 57.45 53.69 2dyy n PHE 96 Cb 1.00 -1.12 -0.02 0.00 -0.94 0.00 0.00 39.48 38.40 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 1.69 -0.39 0.24 1.37 0.00 -1.23 -4.53 105.19 102.33 2dyy n GLY 97 Ca 0.25 -0.21 0.16 0.00 0.00 0.00 0.00 46.02 46.22 2dyy n GLY 97 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2dyy h GLU 98 N -0.65 0.00 -5.82 1.61 4.11 -1.92 -3.41 114.58 108.51 2dyy h GLU 98 Ca 0.00 0.00 -0.68 0.00 0.07 0.00 0.00 59.36 58.75 2dyy h GLU 98 Cb 0.65 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 29.63 2dyy h GLU 98 CO 0.00 0.00 -0.79 0.45 0.07 0.00 0.00 179.01 178.74 2dyy s SER 99 N -5.26 3.83 -0.53 3.06 0.15 -1.26 -5.00 113.70 108.69 2dyy s SER 99 Ca 0.02 -0.32 0.04 0.00 0.70 0.00 0.00 55.95 56.39 2dyy s SER 99 Cb 0.09 -1.18 0.15 0.00 -1.71 0.00 0.00 66.02 63.37 2dyy s SER 99 CO 0.49 0.25 0.34 -0.54 1.20 0.00 0.00 173.24 174.98 2dyy s LYS 100 N -0.15 1.66 0.74 5.44 -0.14 -1.26 -4.58 119.74 121.45 2dyy s LYS 100 Ca -0.01 -2.52 -0.11 0.00 -1.36 0.00 0.00 55.97 51.97 2dyy s LYS 100 Cb -0.14 -2.61 0.03 0.00 -1.68 0.00 0.00 37.83 33.43 2dyy s LYS 100 CO 0.03 -1.24 1.07 -2.14 -0.76 0.00 0.00 175.35 172.32 2dyy s PRO 101 N -0.35 2.60 0.36 -1.68 0.02 -1.26 -4.99 135.00 129.70 2dyy s PRO 101 Ca 0.23 0.95 -0.28 0.00 0.02 0.00 0.00 61.00 61.92 2dyy s PRO 101 Cb -0.13 -1.95 -0.10 0.00 0.02 0.00 0.00 34.50 32.34 2dyy s PRO 101 CO -0.09 -1.34 1.33 0.00 -0.33 0.00 0.00 177.00 176.57 2dyy s ALA 102 N -3.03 3.44 0.04 -1.55 0.00 -0.48 -4.86 121.76 115.33 2dyy s ALA 102 Ca 0.59 1.30 0.07 0.00 0.00 0.00 0.00 51.96 53.92 2dyy s ALA 102 Cb -0.15 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 2dyy s ALA 102 CO 0.55 -0.75 -0.19 0.50 0.00 0.00 0.00 175.76 175.87 2dyy s ARG 103 N -1.96 1.26 -0.04 0.00 6.06 -1.26 -1.22 118.95 121.79 2dyy s ARG 103 Ca 0.52 -0.89 -0.00 0.00 -2.50 0.00 0.00 55.73 52.85 2dyy s ARG 103 Cb -0.40 -1.35 0.03 0.00 0.06 0.00 0.00 34.95 33.28 2dyy s ARG 103 CO 0.53 0.34 0.00 0.08 -2.50 0.00 0.00 175.30 173.76 2dyy s VAL 104 N -0.81 0.25 -0.08 7.11 1.01 -0.88 -5.00 120.40 122.01 2dyy s VAL 104 Ca 0.06 0.10 -0.01 0.00 0.00 0.00 0.00 61.98 62.13 2dyy s VAL 104 Cb -0.09 -0.37 0.03 0.00 0.00 0.00 0.00 36.38 35.95 2dyy s VAL 104 CO 0.02 0.19 -0.03 0.00 0.00 0.00 0.00 175.10 175.28 2dyy s ALA 105 N 1.38 0.86 0.05 5.51 0.00 -1.26 -0.40 121.76 127.90 2dyy s ALA 105 Ca -0.05 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 51.70 2dyy s ALA 105 Cb -0.13 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 2dyy s ALA 105 CO -0.02 -0.35 -0.05 0.14 0.00 0.00 0.00 175.76 175.47 2dyy s VAL 106 N 1.69 0.40 -0.18 0.00 -7.23 -1.05 -5.01 120.40 109.01 2dyy s VAL 106 Ca 0.02 -1.33 -0.10 0.00 -1.81 0.00 0.00 61.98 58.75 2dyy s VAL 106 Cb -0.13 -0.89 -0.05 0.00 0.56 0.00 0.00 36.38 35.87 2dyy s VAL 106 CO -0.05 -0.62 0.17 -1.61 -0.31 0.00 0.00 175.10 172.68 2dyy s GLU 107 N -2.41 4.11 0.48 4.82 0.41 -1.26 -2.34 118.70 122.51 2dyy s GLU 107 Ca -0.04 -0.14 0.05 0.00 -0.41 0.00 0.00 54.97 54.42 2dyy s GLU 107 Cb -0.04 -3.39 -0.02 0.00 -1.78 0.00 0.00 34.13 28.91 2dyy s GLU 107 CO -0.03 0.35 0.16 0.14 -0.49 0.00 0.00 175.26 175.39 2dyy s VAL 108 N 0.19 1.68 0.09 2.63 -7.23 -0.01 -4.94 120.40 112.81 2dyy s VAL 108 Ca 0.11 -1.78 -0.09 0.00 -1.81 0.00 0.00 61.98 58.40 2dyy s VAL 108 Cb -0.12 -2.47 -0.23 0.00 0.56 0.00 0.00 36.38 34.13 2dyy s VAL 108 CO 0.00 0.00 1.21 0.28 -0.31 0.00 0.00 175.10 176.28 2dyy h SER 109 N 1.25 0.71 -4.41 4.85 0.02 -1.90 -3.41 113.55 110.67 2dyy h SER 109 Ca -0.42 -0.61 0.05 0.00 -0.84 0.00 0.00 61.79 59.97 2dyy h SER 109 Cb 1.29 -0.22 -0.21 0.00 0.14 0.00 0.00 62.40 63.40 2dyy h SER 109 CO 0.69 1.42 0.44 -0.60 -1.14 0.00 0.00 176.83 177.64 2dyy s ARG 110 N -3.16 0.75 0.32 3.45 3.52 -1.26 -5.00 118.95 117.57 2dyy s ARG 110 Ca -0.08 0.12 0.10 0.00 -0.13 0.00 0.00 55.73 55.75 2dyy s ARG 110 Cb 0.07 0.35 -0.06 0.00 -1.56 0.00 0.00 34.95 33.76 2dyy s ARG 110 CO 0.90 -0.24 -0.11 -0.51 -0.81 0.00 0.00 175.30 174.52 2dyy s LEU 111 N -1.29 2.74 0.35 -0.88 1.43 -1.26 -5.02 118.68 114.75 2dyy s LEU 111 Ca -0.03 -1.08 -0.26 0.00 -1.03 0.00 0.00 54.13 51.73 2dyy s LEU 111 Cb -0.00 -1.13 -0.13 0.00 0.03 0.00 0.00 46.19 44.96 2dyy s LEU 111 CO 0.03 -0.11 0.87 -2.65 0.23 0.00 0.00 176.35 174.72 2dyy n PRO 112 N -0.76 1.08 -2.02 1.29 -0.02 -1.26 -0.84 135.00 132.47 2dyy n PRO 112 Ca -0.05 0.38 -0.18 0.00 -2.02 0.00 0.00 63.50 61.63 2dyy n PRO 112 Cb 0.62 -1.76 -0.04 0.00 -0.02 0.00 0.00 33.50 32.30 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 0.56 -1.66 -3.55 -0.52 5.02 -1.26 -3.07 118.16 113.69 2dyy n LYS 113 Ca 0.11 0.96 -0.27 0.00 -2.02 0.00 0.00 58.31 57.09 2dyy n LYS 113 Cb 0.35 -5.47 0.02 0.00 -0.02 0.00 0.00 35.03 29.90 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 -1.55 -5.59 -4.58 4.39 -0.08 -0.02 -4.99 116.55 104.12 2dyy n ASP 114 Ca -0.20 -0.45 -0.26 0.00 -1.51 0.00 0.00 54.79 52.37 2dyy n ASP 114 Cb 0.63 -2.25 -0.09 0.00 2.34 0.00 0.00 41.12 41.75 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 -2.35 3.19 -0.94 5.18 1.01 -1.17 -4.96 120.40 120.36 2dyy s VAL 115 Ca 0.18 -1.78 0.28 0.00 0.00 0.00 0.00 61.98 60.66 2dyy s VAL 115 Cb -0.02 -2.62 0.23 0.00 0.00 0.00 0.00 36.38 33.97 2dyy s VAL 115 CO 0.87 -0.19 1.84 0.18 0.00 0.00 0.00 175.10 177.80 2dyy n LEU 116 N -0.23 0.22 -3.61 3.92 4.77 -1.26 -4.15 117.00 116.66 2dyy n LEU 116 Ca -0.09 0.47 -0.11 0.00 -0.03 0.00 0.00 56.01 56.25 2dyy n LEU 116 Cb 0.57 -0.44 -0.06 0.00 -2.33 0.00 0.00 43.42 41.16 2dyy n LEU 116 CO 0.36 -0.03 0.70 -0.51 -1.33 0.00 0.00 177.39 176.59 2dyy s ILE 117 N -3.02 0.00 -0.00 -0.08 2.07 -1.26 -2.09 121.20 116.81 2dyy s ILE 117 Ca 0.13 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.38 2dyy s ILE 117 Cb 0.17 -1.00 -0.00 0.00 0.13 0.00 0.00 42.46 41.76 2dyy s ILE 117 CO 0.56 0.00 -0.02 -0.70 -1.91 0.00 0.00 174.94 172.87 2dyy s GLU 118 N -0.22 0.19 -0.02 3.50 2.12 -0.09 -4.27 118.70 119.90 2dyy s GLU 118 Ca 0.01 -0.08 0.01 0.00 0.36 0.00 0.00 54.97 55.27 2dyy s GLU 118 Cb -0.03 -0.18 0.01 0.00 0.26 0.00 0.00 34.13 34.18 2dyy s GLU 118 CO -0.02 0.05 -0.05 0.42 -0.54 0.00 0.00 175.26 175.11 2dyy s ILE 119 N -0.03 0.45 0.13 -3.70 1.01 -0.81 -0.16 121.20 118.08 2dyy s ILE 119 Ca 0.01 -0.17 0.10 0.00 0.00 0.00 0.00 60.65 60.58 2dyy s ILE 119 Cb -0.01 -0.42 -0.04 0.00 0.01 0.00 0.00 42.46 41.99 2dyy s ILE 119 CO -0.00 0.16 -0.21 -1.83 0.00 0.00 0.00 174.94 173.06 2dyy s GLU 120 N 0.30 1.66 0.14 2.79 -1.05 -0.74 -0.35 118.70 121.46 2dyy s GLU 120 Ca -0.03 -1.25 -0.04 0.00 -0.15 0.00 0.00 54.97 53.50 2dyy s GLU 120 Cb -0.07 -2.04 -0.03 0.00 -0.44 0.00 0.00 34.13 31.55 2dyy s GLU 120 CO -0.00 0.47 0.14 0.00 0.95 0.00 0.00 175.26 176.81 2dyy s ALA 121 N -1.16 0.56 0.00 -0.84 0.00 -1.24 -1.20 121.76 117.88 2dyy s ALA 121 Ca 0.17 -1.27 0.01 0.00 0.00 0.00 0.00 51.96 50.87 2dyy s ALA 121 Cb -0.10 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.88 2dyy s ALA 121 CO 0.09 -0.55 -0.04 0.42 0.00 0.00 0.00 175.76 175.69 2dyy s ILE 122 N -4.02 0.28 0.05 0.00 1.01 -0.05 -1.86 121.20 116.61 2dyy s ILE 122 Ca 0.22 -0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.62 2dyy s ILE 122 Cb 0.06 -0.26 -0.03 0.00 0.01 0.00 0.00 42.46 42.24 2dyy s ILE 122 CO 0.01 0.01 -0.06 0.00 0.00 0.00 0.00 174.94 174.90 2dyy s ALA 123 N -0.26 0.59 0.02 9.38 0.00 -0.46 -0.93 121.76 130.10 2dyy s ALA 123 Ca -0.01 -0.94 0.06 0.00 0.00 0.00 0.00 51.96 51.07 2dyy s ALA 123 Cb -0.02 0.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 2dyy s ALA 123 CO -0.00 -0.14 -0.17 -0.47 0.00 0.00 0.00 175.76 174.98 2dyy s TYR 124 N -2.27 1.51 -0.07 0.00 5.04 0.04 -0.16 117.35 121.44 2dyy s TYR 124 Ca -0.03 -0.32 -0.03 0.00 -2.44 0.00 0.00 57.07 54.24 2dyy s TYR 124 Cb -0.04 -0.93 0.04 0.00 0.35 0.00 0.00 41.96 41.38 2dyy s TYR 124 CO -0.02 0.02 0.14 0.21 -1.34 0.00 0.00 175.55 174.56 2dyy s LYS 125 N -0.79 0.04 0.00 4.97 2.20 -0.69 -4.70 119.74 120.78 2dyy s LYS 125 Ca 0.06 0.48 0.00 0.00 -0.36 0.00 0.00 55.97 56.15 2dyy s LYS 125 Cb -0.07 -0.26 0.00 0.00 -1.51 0.00 0.00 37.83 35.99 2dyy s LYS 125 CO 0.00 -0.26 0.29 0.39 -0.36 0.00 0.00 175.35 175.41