#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ayz n ALA 818 N 0.00 -0.77 -3.66 7.82 0.00 -1.26 -5.16 120.51 117.48 2ayz n ALA 818 Ca 0.00 -1.29 -0.19 0.00 0.00 0.00 0.00 53.44 51.96 2ayz n ALA 818 Cb 0.00 1.04 -0.17 0.00 0.00 0.00 0.00 19.45 20.32 2ayz n ALA 818 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2ayz s VAL 819 N -2.56 -0.17 -0.29 0.00 1.01 -1.26 -5.12 120.40 112.02 2ayz s VAL 819 Ca 0.21 0.36 0.03 0.00 0.00 0.00 0.00 61.98 62.58 2ayz s VAL 819 Cb -0.02 -0.23 0.08 0.00 0.00 0.00 0.00 36.38 36.20 2ayz s VAL 819 CO 0.15 0.14 -0.03 -0.44 0.00 0.00 0.00 175.10 174.91 2ayz s SER 820 N 2.21 4.54 -0.21 3.32 0.01 -1.26 -5.09 113.70 117.22 2ayz s SER 820 Ca 0.04 -1.71 -0.21 0.00 1.31 0.00 0.00 55.95 55.38 2ayz s SER 820 Cb -0.12 -1.54 -0.02 0.00 0.21 0.00 0.00 66.02 64.54 2ayz s SER 820 CO -0.04 -0.28 0.65 -0.62 0.41 0.00 0.00 173.24 173.36 2ayz s ASP 821 N 1.05 6.69 0.00 2.44 2.15 -1.26 -5.00 116.67 122.74 2ayz s ASP 821 Ca 0.00 0.84 0.00 0.00 0.43 0.00 0.00 52.55 53.82 2ayz s ASP 821 Cb -0.19 -2.36 0.00 0.00 -0.30 0.00 0.00 42.92 40.07 2ayz s ASP 821 CO -0.07 -0.31 0.14 0.59 -0.17 0.00 0.00 175.17 175.34 2ayz n ASN 822 N 5.24 0.00 -3.15 -0.34 3.02 -1.26 -4.99 115.26 113.78 2ayz n ASN 822 Ca -0.00 0.14 0.05 0.00 -0.03 0.00 0.00 54.58 54.73 2ayz n ASN 822 Cb 0.49 0.00 -0.00 0.00 -0.61 0.00 0.00 39.78 39.66 2ayz n ASN 822 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 2ayz s ASP 823 N -1.49 -0.50 0.00 6.41 -4.77 -1.26 -5.02 116.67 110.04 2ayz s ASP 823 Ca 0.00 0.07 0.15 0.00 -3.30 0.00 0.00 52.55 49.47 2ayz s ASP 823 Cb 0.00 1.32 0.77 0.00 -1.09 0.00 0.00 42.92 43.92 2ayz s ASP 823 CO 0.00 -0.09 1.41 -0.67 0.70 0.00 0.00 175.17 176.52 2ayz n ASP 824 N 5.14 0.00 -3.67 2.11 2.03 -1.26 -4.59 116.55 116.31 2ayz n ASP 824 Ca 0.09 0.03 -0.17 0.00 0.52 0.00 0.00 54.79 55.25 2ayz n ASP 824 Cb 0.57 -0.26 -0.16 0.00 -0.72 0.00 0.00 41.12 40.55 2ayz n ASP 824 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2ayz s MET 825 N -2.52 0.01 -0.19 -0.67 -1.94 -1.26 -5.12 119.30 107.61 2ayz s MET 825 Ca 0.15 0.52 -0.02 0.00 -1.71 0.00 0.00 55.69 54.63 2ayz s MET 825 Cb 0.10 -0.33 -0.00 0.00 2.01 0.00 0.00 34.83 36.60 2ayz s MET 825 CO 0.22 -0.32 -0.09 0.00 -0.01 0.00 0.00 175.02 174.82 2ayz s MET 826 N 2.27 3.31 -0.01 2.03 0.23 -1.26 -2.40 119.30 123.47 2ayz s MET 826 Ca 0.03 -0.68 0.08 0.00 -1.03 0.00 0.00 55.69 54.09 2ayz s MET 826 Cb -0.12 -2.83 -0.02 0.00 -1.53 0.00 0.00 34.83 30.32 2ayz s MET 826 CO -0.05 -0.09 -0.24 0.42 -2.03 0.00 0.00 175.02 173.02 2ayz s ILE 827 N 1.15 2.23 -0.43 3.16 -1.09 -0.37 -2.34 121.20 123.51 2ayz s ILE 827 Ca 0.01 -1.11 -0.15 0.00 -2.23 0.00 0.00 60.65 57.17 2ayz s ILE 827 Cb -0.14 -1.80 0.03 0.00 -1.58 0.00 0.00 42.46 38.97 2ayz s ILE 827 CO -0.03 0.54 0.35 -0.22 -1.23 0.00 0.00 174.94 174.35 2ayz s LEU 828 N -0.76 5.21 -0.62 2.97 2.96 -0.53 -0.90 118.68 127.01 2ayz s LEU 828 Ca 0.11 -0.98 -0.18 0.00 -0.22 0.00 0.00 54.13 52.85 2ayz s LEU 828 Cb -0.10 -2.20 0.11 0.00 0.50 0.00 0.00 46.19 44.51 2ayz s LEU 828 CO -0.00 -0.53 0.72 0.68 -1.32 0.00 0.00 176.35 175.90 2ayz s VAL 829 N 1.74 4.89 -0.01 1.68 -7.23 0.19 -1.03 120.40 120.63 2ayz s VAL 829 Ca 0.06 -1.16 0.02 0.00 -1.81 0.00 0.00 61.98 59.09 2ayz s VAL 829 Cb -0.20 -4.49 -0.03 0.00 0.56 0.00 0.00 36.38 32.21 2ayz s VAL 829 CO 0.10 -1.12 -0.04 -0.69 -0.31 0.00 0.00 175.10 173.03 2ayz s VAL 830 N 2.45 3.86 -0.13 1.32 1.01 -0.06 -2.29 120.40 126.56 2ayz s VAL 830 Ca 0.12 -0.64 -0.26 0.00 0.00 0.00 0.00 61.98 61.20 2ayz s VAL 830 Cb -0.23 -2.67 0.06 0.00 0.00 0.00 0.00 36.38 33.54 2ayz s VAL 830 CO 0.04 0.43 0.64 -0.62 0.00 0.00 0.00 175.10 175.60 2ayz s ASP 831 N -1.33 -0.63 0.14 3.32 2.15 -0.83 -0.39 116.67 119.09 2ayz s ASP 831 Ca 0.17 0.91 0.27 0.00 0.43 0.00 0.00 52.55 54.33 2ayz s ASP 831 Cb -0.11 0.84 0.87 0.00 -0.30 0.00 0.00 42.92 44.23 2ayz s ASP 831 CO 0.07 -0.45 1.76 -0.90 -0.17 0.00 0.00 175.17 175.49 2ayz n ASP 832 N 1.66 0.57 -3.70 -0.34 5.68 -0.74 -4.05 116.55 115.62 2ayz n ASP 832 Ca -0.17 0.48 -0.30 0.00 -0.50 0.00 0.00 54.79 54.30 2ayz n ASP 832 Cb 0.56 -0.59 -0.14 0.00 -1.14 0.00 0.00 41.12 39.82 2ayz n ASP 832 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 2ayz s HIS 833 N -3.07 1.84 0.05 2.11 3.76 -1.26 -4.94 115.29 113.77 2ayz s HIS 833 Ca 0.11 -2.18 0.01 0.00 -0.15 0.00 0.00 55.06 52.86 2ayz s HIS 833 Cb 0.14 -1.78 0.14 0.00 1.11 0.00 0.00 32.58 32.19 2ayz s HIS 833 CO 0.59 -0.82 0.22 -2.30 -0.85 0.00 0.00 174.74 171.59 2ayz n PRO 834 N 3.97 -0.01 -0.25 8.40 -0.02 -1.26 -1.31 135.00 144.52 2ayz n PRO 834 Ca 0.06 0.21 0.10 0.00 -2.02 0.00 0.00 63.50 61.84 2ayz n PRO 834 Cb 0.37 -0.35 0.36 0.00 -0.02 0.00 0.00 33.50 33.86 2ayz n PRO 834 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2ayz h ILE 835 N 0.00 0.91 -0.05 4.25 2.10 -1.96 -1.26 117.51 121.50 2ayz h ILE 835 Ca 0.10 -0.25 -0.25 0.00 1.08 0.00 0.00 64.86 65.54 2ayz h ILE 835 Cb 0.23 0.10 0.02 0.00 -1.09 0.00 0.00 36.82 36.08 2ayz h ILE 835 CO -0.13 0.13 -0.94 0.78 -1.08 0.00 0.00 178.15 176.91 2ayz h ASN 836 N 0.74 0.88 -0.31 2.19 2.35 -1.60 -2.78 115.58 117.05 2ayz h ASN 836 Ca 0.41 -0.66 0.03 0.00 -0.55 0.00 0.00 56.30 55.52 2ayz h ASN 836 Cb 0.55 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.62 2ayz h ASN 836 CO -0.17 1.46 0.14 -0.09 -1.65 0.00 0.00 177.43 177.12 2ayz h ARG 837 N 0.43 0.28 -0.27 0.81 2.43 -1.44 0.11 114.38 116.72 2ayz h ARG 837 Ca -0.10 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 58.95 2ayz h ARG 837 Cb 1.59 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 31.06 2ayz h ARG 837 CO 0.19 0.19 -0.29 0.07 -1.51 0.00 0.00 179.97 178.62 2ayz h ARG 838 N 0.29 0.54 -0.33 0.20 0.11 -1.31 0.26 114.38 114.14 2ayz h ARG 838 Ca 0.13 -0.22 -0.14 0.00 0.10 0.00 0.00 59.98 59.85 2ayz h ARG 838 Cb 0.07 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.12 2ayz h ARG 838 CO -0.11 0.77 -0.34 -0.07 0.10 0.00 0.00 179.97 180.33 2ayz h LEU 839 N 0.47 0.88 -0.75 0.08 3.38 -1.18 -1.84 115.31 116.34 2ayz h LEU 839 Ca 0.06 -0.47 -0.04 0.00 0.09 0.00 0.00 57.88 57.52 2ayz h LEU 839 Cb 0.74 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2ayz h LEU 839 CO 0.06 1.17 0.30 0.25 0.09 0.00 0.00 178.44 180.30 2ayz h LEU 840 N 0.60 1.04 -1.33 1.67 5.85 -0.57 -2.46 115.31 120.12 2ayz h LEU 840 Ca 0.05 -0.17 -0.05 0.00 0.84 0.00 0.00 57.88 58.54 2ayz h LEU 840 Cb 0.92 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 2ayz h LEU 840 CO 0.08 0.93 -0.25 0.00 -0.34 0.00 0.00 178.44 178.87 2ayz h ALA 841 N 1.15 1.13 -0.27 1.25 0.00 -0.84 -1.21 119.26 120.47 2ayz h ALA 841 Ca 0.25 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2ayz h ALA 841 Cb 0.22 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2ayz h ALA 841 CO -0.02 0.31 -0.15 0.22 0.00 0.00 0.00 179.25 179.62 2ayz h ASP 842 N 0.00 0.60 -0.03 0.00 3.58 -0.88 -0.04 116.42 119.65 2ayz h ASP 842 Ca -0.00 -0.42 -0.00 0.00 0.42 0.00 0.00 57.03 57.03 2ayz h ASP 842 Cb 0.65 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.54 2ayz h ASP 842 CO 0.03 0.88 0.02 -0.61 -2.88 0.00 0.00 179.24 176.68 2ayz h GLN 843 N 0.31 0.05 -0.84 0.28 5.75 -1.15 -1.34 115.11 118.17 2ayz h GLN 843 Ca 0.06 -0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.56 2ayz h GLN 843 Cb 0.67 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.17 2ayz h GLN 843 CO 0.04 0.12 0.54 1.25 -2.65 0.00 0.00 178.83 178.14 2ayz h LEU 844 N -0.04 0.97 -1.30 -2.39 5.85 -1.22 -1.63 115.31 115.55 2ayz h LEU 844 Ca 0.01 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 2ayz h LEU 844 Cb 0.09 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2ayz h LEU 844 CO -0.00 0.72 -0.02 1.23 -0.34 0.00 0.00 178.44 180.02 2ayz h GLY 845 N 1.14 0.48 2.00 3.75 0.00 -0.84 -1.93 103.07 107.67 2ayz h GLY 845 Ca 0.31 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 2ayz h GLY 845 CO -0.06 0.26 -0.30 1.76 0.00 0.00 0.00 176.54 178.19 2ayz h SER 846 N 0.43 0.00 -0.02 0.19 0.02 -0.31 -2.69 113.55 111.17 2ayz h SER 846 Ca 0.09 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.88 2ayz h SER 846 Cb 0.32 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 2ayz h SER 846 CO 0.01 0.30 -0.55 -0.07 -1.14 0.00 0.00 176.83 175.38 2ayz h LEU 847 N 0.00 0.67 0.00 5.07 3.38 -0.78 -3.48 115.31 120.18 2ayz h LEU 847 Ca -0.00 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2ayz h LEU 847 Cb 0.66 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2ayz h LEU 847 CO 0.04 1.09 0.00 0.61 0.09 0.00 0.00 178.44 180.27 2ayz n GLY 848 N 0.28 1.66 3.49 0.83 0.00 -1.01 -5.13 105.19 105.31 2ayz n GLY 848 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 2ayz n GLY 848 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ayz s TYR 849 N -2.00 2.33 -0.33 1.61 2.02 -1.18 -4.96 117.35 114.85 2ayz s TYR 849 Ca 0.00 -0.33 -0.25 0.00 -0.37 0.00 0.00 57.07 56.13 2ayz s TYR 849 Cb 0.00 -1.03 0.01 0.00 -0.40 0.00 0.00 41.96 40.54 2ayz s TYR 849 CO 0.00 0.70 0.85 -1.14 -1.57 0.00 0.00 175.55 174.39 2ayz s GLN 850 N -3.53 3.93 -0.46 -0.62 0.74 -1.01 -4.37 119.66 114.33 2ayz s GLN 850 Ca 0.30 0.62 -0.21 0.00 0.05 0.00 0.00 55.36 56.12 2ayz s GLN 850 Cb -0.05 -3.75 0.03 0.00 1.10 0.00 0.00 33.01 30.34 2ayz s GLN 850 CO 0.16 -0.77 0.68 0.00 -0.55 0.00 0.00 175.29 174.81 2ayz s LYS 852 N 2.94 3.39 0.21 0.00 3.01 -0.08 -4.90 119.74 124.31 2ayz s LYS 852 Ca 0.23 -0.62 -0.10 0.00 -1.01 0.00 0.00 55.97 54.46 2ayz s LYS 852 Cb -0.15 -3.86 -0.07 0.00 -1.01 0.00 0.00 37.83 32.75 2ayz s LYS 852 CO 0.18 -0.58 0.55 0.95 0.51 0.00 0.00 175.35 176.95 2ayz s THR 853 N 1.90 4.92 0.29 2.17 -4.23 -1.26 -0.64 115.64 118.79 2ayz s THR 853 Ca 0.09 0.52 -0.13 0.00 -1.18 0.00 0.00 61.69 60.99 2ayz s THR 853 Cb -0.17 -3.63 0.01 0.00 1.34 0.00 0.00 72.50 70.04 2ayz s THR 853 CO 0.11 -0.02 0.56 0.00 -0.54 0.00 0.00 174.62 174.74 2ayz s ALA 854 N -1.75 -0.32 -0.40 3.99 0.00 -0.97 -4.94 121.76 117.37 2ayz s ALA 854 Ca 0.46 -0.86 0.08 0.00 0.00 0.00 0.00 51.96 51.63 2ayz s ALA 854 Cb -0.12 0.99 0.25 0.00 0.00 0.00 0.00 23.12 24.24 2ayz s ALA 854 CO 0.21 -0.89 0.54 0.27 0.00 0.00 0.00 175.76 175.88 2ayz n ASN 855 N -0.69 -0.11 0.00 0.00 2.04 -1.26 -1.97 115.26 113.27 2ayz n ASN 855 Ca -0.02 -2.72 0.00 0.00 -0.44 0.00 0.00 54.58 51.39 2ayz n ASN 855 Cb 0.61 -0.44 0.00 0.00 -2.53 0.00 0.00 39.78 37.42 2ayz n ASN 855 CO 0.00 0.00 0.00 -0.67 -0.44 0.00 0.00 177.26 176.15 2ayz n ASP 856 N 1.51 0.00 0.01 0.53 -0.08 -1.26 -4.76 116.55 112.50 2ayz n ASP 856 Ca 0.21 0.00 -0.18 0.00 -1.51 0.00 0.00 54.79 53.30 2ayz n ASP 856 Cb 0.54 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.89 2ayz n ASP 856 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2ayz h GLY 857 N 0.00 0.60 2.00 0.27 0.00 -1.96 -2.99 103.07 101.00 2ayz h GLY 857 Ca 0.00 -1.01 -0.12 0.00 0.00 0.00 0.00 47.33 46.20 2ayz h GLY 857 CO 0.00 0.90 -0.57 -0.39 0.00 0.00 0.00 176.54 176.47 2ayz h VAL 858 N 0.12 1.28 -0.90 4.60 -1.51 -1.95 -2.56 116.25 115.33 2ayz h VAL 858 Ca -0.09 -2.06 0.10 0.00 -1.23 0.00 0.00 66.70 63.42 2ayz h VAL 858 Cb 1.42 2.15 -0.07 0.00 -2.13 0.00 0.00 31.29 32.66 2ayz h VAL 858 CO 0.15 0.56 0.54 -0.78 -1.23 0.00 0.00 177.57 176.81 2ayz h ASP 859 N 0.00 0.80 -0.37 4.19 3.58 -1.88 -1.29 116.42 121.45 2ayz h ASP 859 Ca -0.01 0.04 -0.10 0.00 0.42 0.00 0.00 57.03 57.39 2ayz h ASP 859 Cb 1.11 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 42.02 2ayz h ASP 859 CO 0.07 0.46 -0.11 0.00 -2.88 0.00 0.00 179.24 176.78 2ayz h ALA 860 N 1.47 0.95 -0.62 -0.78 0.00 -1.31 -2.79 119.26 116.18 2ayz h ALA 860 Ca 0.43 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2ayz h ALA 860 Cb 0.36 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 2ayz h ALA 860 CO -0.24 0.61 0.36 -0.07 0.00 0.00 0.00 179.25 179.92 2ayz h LEU 861 N 0.74 0.57 0.21 0.00 -0.00 -0.95 0.02 115.31 115.90 2ayz h LEU 861 Ca 0.12 0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 58.01 2ayz h LEU 861 Cb 0.61 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 2ayz h LEU 861 CO 0.04 0.38 -0.10 -1.13 -0.00 0.00 0.00 178.44 177.63 2ayz h ASN 862 N 0.70 -0.24 0.03 -0.43 -0.73 -1.16 -1.92 115.58 111.82 2ayz h ASN 862 Ca 0.26 -0.13 -0.07 0.00 1.87 0.00 0.00 56.30 58.24 2ayz h ASN 862 Cb 0.10 0.06 -0.01 0.00 0.27 0.00 0.00 38.32 38.74 2ayz h ASN 862 CO -0.14 -0.01 -0.20 1.62 -0.37 0.00 0.00 177.43 178.33 2ayz h VAL 863 N -0.47 1.23 -0.32 2.57 3.04 -1.39 -2.09 116.25 118.82 2ayz h VAL 863 Ca -0.03 -1.03 -0.06 0.00 -1.01 0.00 0.00 66.70 64.56 2ayz h VAL 863 Cb 0.35 1.31 -0.02 0.00 -2.01 0.00 0.00 31.29 30.93 2ayz h VAL 863 CO 0.05 0.32 -0.08 -0.07 -1.01 0.00 0.00 177.57 176.78 2ayz h LEU 864 N 0.29 0.50 -0.63 3.16 3.38 -0.85 0.31 115.31 121.47 2ayz h LEU 864 Ca 0.05 -0.12 -0.14 0.00 0.09 0.00 0.00 57.88 57.76 2ayz h LEU 864 Cb 0.52 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2ayz h LEU 864 CO 0.03 0.62 -0.50 0.28 0.09 0.00 0.00 178.44 178.97 2ayz h SER 865 N 0.49 0.52 0.95 -0.43 0.02 -0.68 -3.17 113.55 111.25 2ayz h SER 865 Ca 0.10 -0.26 -0.22 0.00 -0.84 0.00 0.00 61.79 60.57 2ayz h SER 865 Cb 0.44 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 2ayz h SER 865 CO 0.02 0.93 -1.03 0.11 -1.14 0.00 0.00 176.83 175.72 2ayz h LYS 866 N 0.38 0.04 -2.46 3.45 1.57 -1.04 -3.46 116.57 115.04 2ayz h LYS 866 Ca 0.02 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 2ayz h LYS 866 Cb 1.01 0.02 -0.24 0.00 0.08 0.00 0.00 32.23 33.11 2ayz h LYS 866 CO 0.09 1.03 -0.14 1.21 -0.57 0.00 0.00 179.45 181.07 2ayz s ASN 867 N -6.77 -0.59 -0.79 0.86 2.47 0.06 -5.10 114.94 105.09 2ayz s ASN 867 Ca 0.00 1.07 -0.26 0.00 0.42 0.00 0.00 52.86 54.09 2ayz s ASN 867 Cb 0.10 1.03 0.02 0.00 -1.45 0.00 0.00 41.25 40.95 2ayz s ASN 867 CO 0.83 -0.19 1.43 -2.28 -3.72 0.00 0.00 177.10 173.17 2ayz s HIS 868 N 0.74 2.22 0.10 0.43 5.65 -1.26 -3.92 115.29 119.25 2ayz s HIS 868 Ca -0.04 -0.07 -0.30 0.00 0.25 0.00 0.00 55.06 54.90 2ayz s HIS 868 Cb -0.05 -4.54 -0.06 0.00 -1.18 0.00 0.00 32.58 26.75 2ayz s HIS 868 CO -0.05 -2.07 1.11 0.42 -0.65 0.00 0.00 174.74 173.50 2ayz s ILE 869 N 6.26 4.12 0.10 0.89 1.09 -1.26 -4.97 121.20 127.44 2ayz s ILE 869 Ca 0.44 1.64 -0.12 0.00 -1.10 0.00 0.00 60.65 61.51 2ayz s ILE 869 Cb -0.07 -4.05 -0.15 0.00 -1.06 0.00 0.00 42.46 37.12 2ayz s ILE 869 CO 0.10 0.20 1.31 -0.78 -0.10 0.00 0.00 174.94 175.66 2ayz h ASP 870 N 6.06 0.95 -3.55 3.58 3.58 -1.85 -3.43 116.42 121.76 2ayz h ASP 870 Ca -0.43 -0.62 -0.46 0.00 0.42 0.00 0.00 57.03 55.94 2ayz h ASP 870 Cb 1.21 -0.28 -0.33 0.00 1.72 0.00 0.00 39.33 41.66 2ayz h ASP 870 CO 0.76 1.42 -0.79 -0.63 -2.88 0.00 0.00 179.24 177.12 2ayz s ILE 871 N -3.76 0.86 -0.17 2.25 1.01 -1.25 -4.02 121.20 116.12 2ayz s ILE 871 Ca -0.10 -0.34 -0.01 0.00 0.00 0.00 0.00 60.65 60.19 2ayz s ILE 871 Cb 0.09 -0.81 -0.00 0.00 0.01 0.00 0.00 42.46 41.75 2ayz s ILE 871 CO 0.91 0.29 -0.12 -0.69 0.00 0.00 0.00 174.94 175.32 2ayz s VAL 872 N 0.59 2.87 -0.28 2.92 1.01 -1.10 -1.45 120.40 124.96 2ayz s VAL 872 Ca -0.10 -0.69 -0.02 0.00 0.00 0.00 0.00 61.98 61.17 2ayz s VAL 872 Cb -0.13 -2.24 0.04 0.00 0.00 0.00 0.00 36.38 34.05 2ayz s VAL 872 CO 0.02 0.49 -0.02 -0.76 0.00 0.00 0.00 175.10 174.83 2ayz s LEU 873 N 0.96 3.69 -0.36 3.92 1.43 -0.20 -0.71 118.68 127.42 2ayz s LEU 873 Ca -0.02 -1.17 -0.09 0.00 -1.03 0.00 0.00 54.13 51.82 2ayz s LEU 873 Cb -0.15 -1.69 0.03 0.00 0.03 0.00 0.00 46.19 44.41 2ayz s LEU 873 CO -0.01 -0.22 0.17 -0.94 0.23 0.00 0.00 176.35 175.57 2ayz s SER 874 N 1.27 5.58 -0.20 2.29 1.04 -0.81 -0.88 113.70 122.00 2ayz s SER 874 Ca -0.04 -1.00 -0.15 0.00 0.48 0.00 0.00 55.95 55.24 2ayz s SER 874 Cb -0.19 -1.97 -0.04 0.00 0.10 0.00 0.00 66.02 63.92 2ayz s SER 874 CO -0.02 -0.35 0.37 -0.62 0.98 0.00 0.00 173.24 173.60 2ayz s ASP 875 N 1.51 6.41 -0.14 7.02 2.15 0.48 -1.02 116.67 133.09 2ayz s ASP 875 Ca 0.01 0.49 0.01 0.00 0.43 0.00 0.00 52.55 53.49 2ayz s ASP 875 Cb -0.19 -2.22 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 2ayz s ASP 875 CO 0.05 -0.05 -0.18 -0.69 -0.17 0.00 0.00 175.17 174.14 2ayz s VAL 876 N 1.20 2.45 -0.72 1.11 1.01 0.02 -1.79 120.40 123.69 2ayz s VAL 876 Ca 0.18 -0.85 0.24 0.00 0.00 0.00 0.00 61.98 61.55 2ayz s VAL 876 Cb -0.14 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.21 2ayz s VAL 876 CO 0.07 0.53 1.24 -0.46 0.00 0.00 0.00 175.10 176.49 2ayz n ASN 877 N 3.97 0.63 -4.10 3.32 0.23 -1.26 -3.13 115.26 114.91 2ayz n ASN 877 Ca -0.19 -0.08 -0.36 0.00 -0.53 0.00 0.00 54.58 53.41 2ayz n ASN 877 Cb 0.52 0.40 -0.11 0.00 -2.08 0.00 0.00 39.78 38.51 2ayz n ASN 877 CO 0.00 0.00 0.00 -0.32 -0.93 0.00 0.00 177.26 176.01 2ayz s MET 878 N -3.14 2.25 0.00 -3.83 1.75 -1.26 -4.86 119.30 110.22 2ayz s MET 878 Ca 0.06 -2.16 0.18 0.00 -1.25 0.00 0.00 55.69 52.52 2ayz s MET 878 Cb 0.15 -3.64 0.82 0.00 2.84 0.00 0.00 34.83 34.99 2ayz s MET 878 CO 0.74 -1.12 1.57 -0.35 -0.65 0.00 0.00 175.02 175.22 2ayz n PRO 879 N 4.06 0.08 -0.02 4.11 -0.04 -1.26 -2.10 135.00 139.83 2ayz n PRO 879 Ca 0.02 0.17 0.13 0.00 -0.04 0.00 0.00 63.50 63.78 2ayz n PRO 879 Cb 0.39 -1.50 0.62 0.00 -0.04 0.00 0.00 33.50 32.97 2ayz n PRO 879 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2ayz n ASN 880 N -1.43 0.81 0.00 3.54 5.15 -1.26 -4.86 115.26 117.21 2ayz n ASN 880 Ca 0.06 -1.39 0.00 0.00 -0.60 0.00 0.00 54.58 52.65 2ayz n ASN 880 Cb 0.19 -0.02 0.00 0.00 -0.53 0.00 0.00 39.78 39.42 2ayz n ASN 880 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 2ayz n MET 881 N -0.32 1.41 -3.68 1.20 2.81 -0.89 -5.12 117.12 112.53 2ayz n MET 881 Ca 0.19 0.00 -0.37 0.00 -1.81 0.00 0.00 57.70 55.71 2ayz n MET 881 Cb 0.22 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 32.62 2ayz n MET 881 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2ayz s ASP 882 N 1.00 5.68 0.00 7.83 2.15 -1.26 -4.84 116.67 127.23 2ayz s ASP 882 Ca 0.00 -0.07 0.00 0.00 0.43 0.00 0.00 52.55 52.91 2ayz s ASP 882 Cb 0.00 -2.04 0.00 0.00 -0.30 0.00 0.00 42.92 40.58 2ayz s ASP 882 CO 0.00 -0.02 0.48 0.61 -0.17 0.00 0.00 175.17 176.07 2ayz n GLY 883 N 4.87 -1.02 1.41 2.66 0.00 -1.26 -4.89 105.19 106.96 2ayz n GLY 883 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2ayz n GLY 883 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2ayz n TYR 884 N -0.09 -0.33 0.18 1.61 4.11 -1.26 -4.85 117.16 116.54 2ayz n TYR 884 Ca 0.00 0.06 0.16 0.00 -0.00 0.00 0.00 57.90 58.12 2ayz n TYR 884 Cb 0.37 0.21 0.77 0.00 -0.00 0.00 0.00 39.34 40.69 2ayz n TYR 884 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.86 176.77 2ayz h ARG 885 N 0.00 0.00 0.00 -3.48 1.12 -1.90 0.12 114.38 110.24 2ayz h ARG 885 Ca 0.00 0.00 -0.05 0.00 -1.11 0.00 0.00 59.98 58.82 2ayz h ARG 885 Cb 0.41 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.37 2ayz h ARG 885 CO 0.00 0.00 -0.24 1.37 -3.11 0.00 0.00 179.97 177.99 2ayz h LEU 886 N 0.00 0.00 0.00 3.80 -0.00 -1.92 0.13 115.31 117.33 2ayz h LEU 886 Ca 0.10 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.85 2ayz h LEU 886 Cb 0.45 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.09 2ayz h LEU 886 CO -0.00 0.24 -0.94 0.74 -0.00 0.00 0.00 178.44 178.47 2ayz h THR 887 N 0.00 0.62 -0.54 0.15 2.02 -1.32 -2.17 112.91 111.67 2ayz h THR 887 Ca -0.00 -2.00 0.01 0.00 0.77 0.00 0.00 66.41 65.19 2ayz h THR 887 Cb 0.44 2.17 -0.03 0.00 -1.74 0.00 0.00 68.15 68.99 2ayz h THR 887 CO 0.03 0.35 0.36 -0.61 0.37 0.00 0.00 175.52 176.02 2ayz h GLN 888 N 0.00 0.70 -0.01 6.66 4.15 -0.62 0.86 115.11 126.84 2ayz h GLN 888 Ca -0.08 -0.04 -0.14 0.00 0.77 0.00 0.00 58.65 59.16 2ayz h GLN 888 Cb 1.44 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.95 2ayz h GLN 888 CO 0.05 0.46 -0.66 -0.09 -1.93 0.00 0.00 178.83 176.66 2ayz h ARG 889 N 0.72 0.06 -0.30 1.69 1.12 -0.99 -2.51 114.38 114.18 2ayz h ARG 889 Ca 0.20 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 59.02 2ayz h ARG 889 Cb -0.07 0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 29.89 2ayz h ARG 889 CO -0.04 0.70 0.18 0.82 -3.11 0.00 0.00 179.97 178.52 2ayz h ILE 890 N 0.04 1.09 -0.03 1.20 2.04 -0.26 -0.41 117.51 121.20 2ayz h ILE 890 Ca -0.01 -0.21 -0.11 0.00 1.00 0.00 0.00 64.86 65.54 2ayz h ILE 890 Cb 1.18 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 2ayz h ILE 890 CO 0.09 0.09 -0.48 0.08 0.00 0.00 0.00 178.15 177.94 2ayz h ARG 891 N 0.39 0.06 -0.96 2.37 -0.00 -1.04 0.14 114.38 115.34 2ayz h ARG 891 Ca 0.11 -0.03 0.01 0.00 -0.00 0.00 0.00 59.98 60.06 2ayz h ARG 891 Cb -0.01 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 29.91 2ayz h ARG 891 CO -0.02 0.53 0.62 0.37 -0.00 0.00 0.00 179.97 181.47 2ayz h GLN 892 N 0.05 1.27 -0.02 0.08 5.75 -1.02 -2.96 115.11 118.27 2ayz h GLN 892 Ca -0.00 -0.09 -0.08 0.00 -0.15 0.00 0.00 58.65 58.33 2ayz h GLN 892 Cb 0.86 -0.28 0.01 0.00 1.07 0.00 0.00 27.48 29.14 2ayz h GLN 892 CO 0.06 0.85 -0.30 1.25 -2.65 0.00 0.00 178.83 178.05 2ayz h LEU 893 N 1.31 0.30 0.00 -2.39 5.85 -0.51 -3.49 115.31 116.37 2ayz h LEU 893 Ca 0.35 -0.73 0.00 0.00 0.84 0.00 0.00 57.88 58.34 2ayz h LEU 893 Cb -0.13 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.81 2ayz h LEU 893 CO -0.07 0.99 0.00 0.61 -0.34 0.00 0.00 178.44 179.63 2ayz n GLY 894 N 0.93 0.87 3.76 3.75 0.00 0.45 -5.11 105.19 109.84 2ayz n GLY 894 Ca -0.09 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 2ayz n GLY 894 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2ayz s LEU 895 N 0.00 4.42 -0.10 0.99 2.34 -1.13 -4.92 118.68 120.27 2ayz s LEU 895 Ca 0.00 2.66 0.21 0.00 0.06 0.00 0.00 54.13 57.06 2ayz s LEU 895 Cb 0.00 -3.64 0.39 0.00 -0.56 0.00 0.00 46.19 42.38 2ayz s LEU 895 CO 0.00 -0.57 1.16 0.35 -1.06 0.00 0.00 176.35 176.23 2ayz n THR 896 N 1.25 0.38 -3.51 5.48 -2.24 -1.26 -5.06 114.28 109.32 2ayz n THR 896 Ca 0.02 -1.43 -0.12 0.00 -2.27 0.00 0.00 64.05 60.25 2ayz n THR 896 Cb 0.42 1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 69.63 2ayz n THR 896 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 2ayz s LEU 897 N -1.46 -0.47 0.08 3.22 2.34 -1.26 -5.08 118.68 116.05 2ayz s LEU 897 Ca 0.25 0.24 -0.30 0.00 0.06 0.00 0.00 54.13 54.38 2ayz s LEU 897 Cb 0.32 2.22 -0.06 0.00 -0.56 0.00 0.00 46.19 48.11 2ayz s LEU 897 CO -0.11 -0.63 1.12 -2.84 -1.06 0.00 0.00 176.35 172.83 2ayz s PRO 898 N -2.39 4.51 -0.17 1.48 0.02 -1.26 -4.99 135.00 132.20 2ayz s PRO 898 Ca -0.01 1.67 -0.04 0.00 0.02 0.00 0.00 61.00 62.64 2ayz s PRO 898 Cb -0.01 -3.36 -0.03 0.00 0.02 0.00 0.00 34.50 31.13 2ayz s PRO 898 CO -0.03 -0.11 -0.02 0.08 -0.33 0.00 0.00 177.00 176.58 2ayz s VAL 899 N 0.69 3.95 -0.26 3.83 1.01 -1.08 -2.72 120.40 125.82 2ayz s VAL 899 Ca 0.54 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.20 2ayz s VAL 899 Cb -0.27 -2.75 0.04 0.00 0.00 0.00 0.00 36.38 33.40 2ayz s VAL 899 CO 0.30 0.48 -0.08 -0.63 0.00 0.00 0.00 175.10 175.17 2ayz s ILE 900 N 0.52 2.55 -0.34 2.22 1.01 0.12 -2.21 121.20 125.06 2ayz s ILE 900 Ca -0.02 -1.34 -0.18 0.00 0.00 0.00 0.00 60.65 59.11 2ayz s ILE 900 Cb -0.14 -2.39 -0.01 0.00 0.01 0.00 0.00 42.46 39.93 2ayz s ILE 900 CO 0.02 0.07 0.52 -0.83 0.00 0.00 0.00 174.94 174.73 2ayz s GLY 901 N 1.22 1.82 -0.15 6.18 0.00 0.06 -1.92 107.32 114.53 2ayz s GLY 901 Ca -0.04 -0.94 -0.24 0.00 0.00 0.00 0.00 44.72 43.49 2ayz s GLY 901 CO -0.05 1.28 0.77 0.14 0.00 0.00 0.00 173.10 175.24 2ayz s VAL 902 N 2.40 4.94 0.03 1.40 1.01 -0.19 -0.74 120.40 129.25 2ayz s VAL 902 Ca 0.19 1.53 0.01 0.00 0.00 0.00 0.00 61.98 63.71 2ayz s VAL 902 Cb -0.15 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.12 2ayz s VAL 902 CO 0.13 0.09 -0.05 0.42 0.00 0.00 0.00 175.10 175.69 2ayz s THR 903 N 1.79 0.32 -0.33 3.92 -4.23 -0.01 -0.80 115.64 116.29 2ayz s THR 903 Ca 0.37 -0.88 0.02 0.00 -1.18 0.00 0.00 61.69 60.02 2ayz s THR 903 Cb -0.17 -0.41 0.09 0.00 1.34 0.00 0.00 72.50 73.36 2ayz s THR 903 CO 0.14 -0.37 0.05 0.00 -0.54 0.00 0.00 174.62 173.89 2ayz s ALA 904 N -1.23 2.88 -1.29 3.99 0.00 -1.18 -1.68 121.76 123.25 2ayz s ALA 904 Ca -0.11 -2.31 -0.12 0.00 0.00 0.00 0.00 51.96 49.42 2ayz s ALA 904 Cb -0.09 -1.99 0.00 0.00 0.00 0.00 0.00 23.12 21.05 2ayz s ALA 904 CO -0.00 -1.58 0.58 -1.71 0.00 0.00 0.00 175.76 173.05 2ayz n ASN 905 N 4.40 -2.62 -2.61 0.00 4.05 -1.26 -4.43 115.26 112.79 2ayz n ASN 905 Ca -0.03 -1.06 -0.28 0.00 0.45 0.00 0.00 54.58 53.67 2ayz n ASN 905 Cb 0.42 -2.96 -0.06 0.00 1.23 0.00 0.00 39.78 38.41 2ayz n ASN 905 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2ayz n ALA 906 N -4.41 6.52 -0.99 5.20 0.00 -1.26 -4.78 120.51 120.80 2ayz n ALA 906 Ca -0.21 -3.11 0.00 0.00 0.00 0.00 0.00 53.44 50.13 2ayz n ALA 906 Cb 0.64 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.81 2ayz n ALA 906 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2ayz n LEU 907 N 1.18 0.00 -3.95 0.00 0.00 -1.26 -3.48 117.00 109.49 2ayz n LEU 907 Ca 0.51 0.00 -0.30 0.00 0.00 0.00 0.00 56.01 56.22 2ayz n LEU 907 Cb 0.53 0.00 -0.14 0.00 0.00 0.00 0.00 43.42 43.81 2ayz n LEU 907 CO 0.37 0.00 -0.22 0.00 0.00 0.00 0.00 177.39 177.54 2ayz s ALA 908 N -1.00 3.14 0.36 1.96 0.00 -1.26 -4.96 121.76 119.99 2ayz s ALA 908 Ca 0.00 -3.07 0.03 0.00 0.00 0.00 0.00 51.96 48.93 2ayz s ALA 908 Cb 0.00 -2.10 0.67 0.00 0.00 0.00 0.00 23.12 21.69 2ayz s ALA 908 CO 0.00 -1.95 2.00 0.93 0.00 0.00 0.00 175.76 176.74 2ayz h GLU 909 N 6.76 0.75 0.00 0.00 3.07 -1.98 0.69 114.58 123.86 2ayz h GLU 909 Ca -0.07 -0.06 -0.04 0.00 -0.50 0.00 0.00 59.36 58.69 2ayz h GLU 909 Cb 0.92 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.66 2ayz h GLU 909 CO 0.64 0.52 -0.21 1.05 -1.40 0.00 0.00 179.01 179.61 2ayz h GLU 910 N 0.77 0.00 0.03 2.33 9.09 -1.93 -0.05 114.58 124.81 2ayz h GLU 910 Ca 0.20 0.00 -0.24 0.00 0.05 0.00 0.00 59.36 59.37 2ayz h GLU 910 Cb -0.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.06 2ayz h GLU 910 CO -0.04 0.21 -1.01 -0.22 0.05 0.00 0.00 179.01 178.00 2ayz h LYS 911 N 0.00 0.41 0.00 1.06 3.64 -1.29 -1.86 116.57 118.53 2ayz h LYS 911 Ca -0.00 -0.48 -0.15 0.00 -1.27 0.00 0.00 60.65 58.74 2ayz h LYS 911 Cb 0.43 0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 2ayz h LYS 911 CO 0.03 1.15 -0.74 1.96 -2.27 0.00 0.00 179.45 179.58 2ayz h GLN 912 N 0.21 0.00 -0.53 1.90 7.50 -0.96 -0.68 115.11 122.55 2ayz h GLN 912 Ca -0.10 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.02 2ayz h GLN 912 Cb 1.66 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 29.16 2ayz h GLN 912 CO 0.17 0.74 0.20 -0.09 -1.50 0.00 0.00 178.83 178.35 2ayz h ARG 913 N 0.00 0.77 -0.01 1.46 2.43 -0.93 0.14 114.38 118.25 2ayz h ARG 913 Ca -0.01 -0.12 -0.15 0.00 -0.81 0.00 0.00 59.98 58.89 2ayz h ARG 913 Cb 1.32 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 2ayz h ARG 913 CO 0.10 0.64 -0.72 0.00 -1.51 0.00 0.00 179.97 178.48 2ayz h LEU 915 N 0.03 -0.14 -0.07 0.00 4.07 -0.01 -3.28 115.31 115.91 2ayz h LEU 915 Ca -0.01 -0.39 -0.13 0.00 0.08 0.00 0.00 57.88 57.42 2ayz h LEU 915 Cb 1.27 0.04 -0.02 0.00 1.08 0.00 0.00 40.66 43.03 2ayz h LEU 915 CO 0.10 0.37 -0.62 1.05 -1.08 0.00 0.00 178.44 178.26 2ayz h GLU 916 N -0.70 0.00 -6.11 1.13 9.09 -0.88 -3.48 114.58 113.62 2ayz h GLU 916 Ca -0.02 0.00 -0.42 0.00 0.05 0.00 0.00 59.36 58.97 2ayz h GLU 916 Cb 0.52 0.00 0.05 0.00 -1.65 0.00 0.00 28.75 27.67 2ayz h GLU 916 CO 0.03 0.62 -0.84 0.43 0.05 0.00 0.00 179.01 179.30 2ayz n SER 917 N -3.28 -1.19 0.00 3.06 7.64 -0.11 -3.97 113.62 115.77 2ayz n SER 917 Ca 0.01 -0.84 0.00 0.00 1.01 0.00 0.00 58.87 59.06 2ayz n SER 917 Cb 0.77 -3.98 0.00 0.00 -1.01 0.00 0.00 64.21 59.99 2ayz n SER 917 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ayz n GLY 918 N -1.60 0.37 0.00 0.23 0.00 -1.26 -4.89 105.19 98.03 2ayz n GLY 918 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2ayz n GLY 918 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2ayz n MET 919 N 0.00 0.00 0.00 1.61 2.81 -1.26 -4.49 117.12 115.78 2ayz n MET 919 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2ayz n MET 919 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 2ayz n MET 919 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2ayz n ASP 920 N 0.00 0.00 -4.28 7.83 2.03 -0.97 -2.63 116.55 118.52 2ayz n ASP 920 Ca 0.00 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.08 2ayz n ASP 920 Cb 0.00 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.28 2ayz n ASP 920 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2ayz s SER 921 N 0.00 2.46 -0.03 1.67 0.01 -0.94 -5.05 113.70 111.83 2ayz s SER 921 Ca 0.00 -0.69 0.01 0.00 1.31 0.00 0.00 55.95 56.58 2ayz s SER 921 Cb 0.00 -0.13 0.02 0.00 0.21 0.00 0.00 66.02 66.12 2ayz s SER 921 CO 0.00 0.04 -0.03 0.00 0.41 0.00 0.00 173.24 173.66 2ayz s LEU 923 N 0.65 2.04 0.23 0.00 1.43 0.08 -4.95 118.68 118.16 2ayz s LEU 923 Ca -0.07 -1.70 0.05 0.00 -1.03 0.00 0.00 54.13 51.38 2ayz s LEU 923 Cb -0.11 -0.19 -0.03 0.00 0.03 0.00 0.00 46.19 45.89 2ayz s LEU 923 CO -0.01 -0.94 0.34 -0.44 0.23 0.00 0.00 176.35 175.53 2ayz s SER 924 N -3.67 6.27 0.12 2.29 0.01 -1.26 -0.83 113.70 116.63 2ayz s SER 924 Ca 0.20 0.06 -0.20 0.00 1.31 0.00 0.00 55.95 57.32 2ayz s SER 924 Cb 0.02 -1.84 -0.06 0.00 0.21 0.00 0.00 66.02 64.35 2ayz s SER 924 CO 0.13 -0.06 1.76 0.50 0.41 0.00 0.00 173.24 175.98 2ayz h LYS 925 N 1.28 0.20 -4.11 12.44 3.64 -1.66 -3.28 116.57 125.09 2ayz h LYS 925 Ca -0.51 -0.01 -0.65 0.00 -1.27 0.00 0.00 60.65 58.20 2ayz h LYS 925 Cb 1.23 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 33.01 2ayz h LYS 925 CO 0.62 0.13 2.74 -2.30 -2.27 0.00 0.00 179.45 178.37 2ayz n PRO 926 N -5.00 2.19 -3.11 1.90 -0.02 -1.26 -4.91 135.00 124.80 2ayz n PRO 926 Ca -0.03 -2.11 -0.41 0.00 -2.02 0.00 0.00 63.50 58.93 2ayz n PRO 926 Cb 0.05 -3.00 -0.06 0.00 -0.02 0.00 0.00 33.50 30.46 2ayz n PRO 926 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2ayz s VAL 927 N 4.00 4.91 0.94 -1.45 -7.23 -1.24 -5.07 120.40 115.27 2ayz s VAL 927 Ca 0.53 0.75 -0.15 0.00 -1.81 0.00 0.00 61.98 61.29 2ayz s VAL 927 Cb 0.14 -4.04 0.18 0.00 0.56 0.00 0.00 36.38 33.22 2ayz s VAL 927 CO 0.02 -0.22 1.30 0.42 -0.31 0.00 0.00 175.10 176.30 2ayz s THR 928 N 2.66 2.00 0.17 5.32 -4.23 -1.26 -4.77 115.64 115.53 2ayz s THR 928 Ca 0.25 -0.01 -0.14 0.00 -1.18 0.00 0.00 61.69 60.61 2ayz s THR 928 Cb -0.15 -3.00 0.06 0.00 1.34 0.00 0.00 72.50 70.76 2ayz s THR 928 CO 0.13 0.00 1.75 0.25 -0.54 0.00 0.00 174.62 176.22 2ayz h LEU 929 N -1.54 0.18 0.03 4.79 7.12 -1.98 0.22 115.31 124.14 2ayz h LEU 929 Ca -0.45 0.05 -0.27 0.00 0.13 0.00 0.00 57.88 57.34 2ayz h LEU 929 Cb 1.25 0.03 0.02 0.00 -0.53 0.00 0.00 40.66 41.42 2ayz h LEU 929 CO 0.43 0.14 -1.16 -0.78 -0.13 0.00 0.00 178.44 176.94 2ayz h ASP 930 N 0.34 0.71 -0.46 1.25 3.58 -1.97 0.60 116.42 120.46 2ayz h ASP 930 Ca 0.20 -0.64 -0.02 0.00 0.42 0.00 0.00 57.03 56.99 2ayz h ASP 930 Cb 0.19 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 2ayz h ASP 930 CO -0.20 1.46 0.23 0.58 -2.88 0.00 0.00 179.24 178.43 2ayz h VAL 931 N 0.24 1.18 -0.76 2.25 2.07 -1.90 0.27 116.25 119.59 2ayz h VAL 931 Ca -0.15 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 2ayz h VAL 931 Cb 1.83 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 32.22 2ayz h VAL 931 CO 0.21 0.20 0.39 0.40 0.02 0.00 0.00 177.57 178.79 2ayz h ILE 932 N 0.61 1.23 -0.10 4.57 2.04 -0.93 -2.87 117.51 122.05 2ayz h ILE 932 Ca 0.16 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 2ayz h ILE 932 Cb 0.10 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 36.41 2ayz h ILE 932 CO -0.02 0.27 0.04 0.50 0.00 0.00 0.00 178.15 178.94 2ayz h LYS 933 N 1.07 0.15 -0.23 2.37 3.64 0.19 0.11 116.57 123.87 2ayz h LYS 933 Ca 0.27 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 2ayz h LYS 933 Cb 0.06 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 2ayz h LYS 933 CO -0.04 0.26 0.11 -0.56 -2.27 0.00 0.00 179.45 176.95 2ayz h GLN 934 N 0.01 0.33 -0.39 1.90 3.07 -0.93 0.31 115.11 119.41 2ayz h GLN 934 Ca 0.03 -0.05 -0.05 0.00 0.09 0.00 0.00 58.65 58.68 2ayz h GLN 934 Cb 0.17 -0.06 -0.02 0.00 0.08 0.00 0.00 27.48 27.65 2ayz h GLN 934 CO -0.00 0.35 0.07 1.15 0.09 0.00 0.00 178.83 180.49 2ayz h THR 935 N 0.24 1.24 0.60 1.86 2.02 -1.44 -2.39 112.91 115.03 2ayz h THR 935 Ca 0.08 -0.85 -0.03 0.00 0.77 0.00 0.00 66.41 66.38 2ayz h THR 935 Cb 0.13 1.04 0.01 0.00 -1.74 0.00 0.00 68.15 67.59 2ayz h THR 935 CO -0.01 0.29 -0.29 -0.07 0.37 0.00 0.00 175.52 175.81 2ayz h LEU 936 N 0.49 -0.68 -0.50 2.58 -0.00 -0.65 -2.73 115.31 113.83 2ayz h LEU 936 Ca 0.12 -0.03 0.05 0.00 -0.00 0.00 0.00 57.88 58.02 2ayz h LEU 936 Cb 0.36 0.18 -0.05 0.00 -0.00 0.00 0.00 40.66 41.15 2ayz h LEU 936 CO 0.01 -0.36 0.24 0.74 -0.00 0.00 0.00 178.44 179.07 2ayz h THR 937 N -1.01 0.93 0.23 0.22 2.02 -1.00 0.85 112.91 115.15 2ayz h THR 937 Ca -0.08 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 2ayz h THR 937 Cb 0.67 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 2ayz h THR 937 CO 0.13 0.08 -0.16 0.25 0.37 0.00 0.00 175.52 176.20 2ayz h LEU 938 N 0.46 -0.41 -0.02 2.58 5.85 -1.47 -1.47 115.31 120.84 2ayz h LEU 938 Ca 0.22 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.90 2ayz h LEU 938 Cb 0.16 0.13 0.01 0.00 0.37 0.00 0.00 40.66 41.32 2ayz h LEU 938 CO -0.17 -0.25 -0.29 1.88 -0.34 0.00 0.00 178.44 179.26 2ayz h TYR 939 N -0.39 0.32 -0.67 1.25 0.05 -1.27 -2.08 116.97 114.18 2ayz h TYR 939 Ca -0.02 -0.17 -0.03 0.00 0.05 0.00 0.00 58.73 58.57 2ayz h TYR 939 Cb 0.33 -0.04 -0.03 0.00 1.01 0.00 0.00 36.73 38.00 2ayz h TYR 939 CO -0.10 0.95 0.31 0.00 -1.05 0.00 0.00 178.16 178.27 2ayz h ALA 940 N 0.31 0.87 0.00 3.88 0.00 -0.88 -1.59 119.26 121.84 2ayz h ALA 940 Ca -0.03 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 2ayz h ALA 940 Cb 1.01 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2ayz h ALA 940 CO 0.06 0.44 -0.73 1.05 0.00 0.00 0.00 179.25 180.07 2ayz h GLU 941 N 0.93 0.00 -0.19 0.00 -0.00 -1.36 -2.47 114.58 111.50 2ayz h GLU 941 Ca 0.23 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.58 2ayz h GLU 941 Cb 0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.88 2ayz h GLU 941 CO -0.03 0.73 0.06 -0.09 -0.00 0.00 0.00 179.01 179.69 2ayz h ARG 942 N 0.00 0.29 -0.37 1.06 9.65 -0.73 0.50 114.38 124.77 2ayz h ARG 942 Ca -0.01 -0.06 -0.15 0.00 -1.10 0.00 0.00 59.98 58.66 2ayz h ARG 942 Cb 1.29 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.82 2ayz h ARG 942 CO 0.09 0.38 -0.37 -0.39 2.80 0.00 0.00 179.97 182.49 2ayz h VAL 943 N 0.14 1.28 -0.13 0.20 -1.51 -1.33 -1.19 116.25 113.70 2ayz h VAL 943 Ca 0.06 -1.54 -0.00 0.00 -1.23 0.00 0.00 66.70 63.99 2ayz h VAL 943 Cb 0.21 1.38 -0.01 0.00 -2.13 0.00 0.00 31.29 30.74 2ayz h VAL 943 CO -0.00 0.51 0.07 -0.09 -1.23 0.00 0.00 177.57 176.83 2ayz h ARG 944 N 0.72 0.18 0.00 5.19 2.43 -1.29 -2.52 114.38 119.08 2ayz h ARG 944 Ca 0.06 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2ayz h ARG 944 Cb 0.94 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 2ayz h ARG 944 CO 0.09 0.20 0.00 1.57 -1.51 0.00 0.00 179.97 180.32 2ayz h LYS 945 N 0.11 0.00 -0.39 0.20 2.10 -0.84 0.59 116.57 118.35 2ayz h LYS 945 Ca 0.05 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.54 2ayz h LYS 945 Cb 0.07 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.40 2ayz h LYS 945 CO -0.01 0.00 -0.36 0.77 -2.00 0.00 0.00 179.45 177.85 2ayz h SER 946 N 0.00 0.99 1.12 7.07 0.02 -0.80 -3.12 113.55 118.82 2ayz h SER 946 Ca 0.00 -0.46 -0.16 0.00 -0.84 0.00 0.00 61.79 60.33 2ayz h SER 946 Cb 0.62 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 2ayz h SER 946 CO 0.00 1.24 -0.92 0.03 -1.14 0.00 0.00 176.83 176.04 2ayz h ARG 947 N 0.75 0.00 -1.41 3.45 -0.00 -1.16 -3.51 114.38 112.50 2ayz h ARG 947 Ca 0.07 0.00 0.15 0.00 -0.50 0.00 0.00 59.98 59.70 2ayz h ARG 947 Cb 0.95 0.00 -0.06 0.00 0.00 0.00 0.00 29.97 30.86 2ayz h ARG 947 CO 0.09 0.61 -0.40 -3.47 0.00 0.00 0.00 179.97 176.80 2ayz n ASP 948 N -3.18 -3.58 -0.04 7.04 2.03 0.17 -5.12 116.55 113.87 2ayz n ASP 948 Ca -0.02 0.46 0.00 0.00 0.52 0.00 0.00 54.79 55.75 2ayz n ASP 948 Cb 0.84 -1.97 0.00 0.00 -0.72 0.00 0.00 41.12 39.28 2ayz n ASP 948 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08