#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ayz s ALA 818 N 0.00 3.19 -1.06 7.82 0.00 -1.26 -5.04 121.76 125.41 2ayz s ALA 818 Ca 0.00 -0.78 -0.18 0.00 0.00 0.00 0.00 51.96 50.99 2ayz s ALA 818 Cb 0.00 -1.70 0.12 0.00 0.00 0.00 0.00 23.12 21.54 2ayz s ALA 818 CO 0.00 0.23 1.34 0.08 0.00 0.00 0.00 175.76 177.41 2ayz s VAL 819 N 0.27 4.57 -0.25 0.00 1.01 -1.26 -4.89 120.40 119.85 2ayz s VAL 819 Ca -0.00 -1.72 -0.06 0.00 0.00 0.00 0.00 61.98 60.20 2ayz s VAL 819 Cb -0.13 -4.92 -0.19 0.00 0.00 0.00 0.00 36.38 31.14 2ayz s VAL 819 CO 0.02 -1.68 3.41 -1.20 0.00 0.00 0.00 175.10 175.64 2ayz n SER 820 N 7.01 5.81 -4.45 3.32 7.64 -1.26 -4.81 113.62 126.88 2ayz n SER 820 Ca 0.32 -2.62 -0.38 0.00 1.01 0.00 0.00 58.87 57.20 2ayz n SER 820 Cb 0.48 -1.40 -0.12 0.00 -1.01 0.00 0.00 64.21 62.16 2ayz n SER 820 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2ayz s ASP 821 N 1.72 5.47 -0.18 6.43 2.15 -1.26 -4.97 116.67 126.02 2ayz s ASP 821 Ca 0.66 -0.39 -0.04 0.00 0.43 0.00 0.00 52.55 53.21 2ayz s ASP 821 Cb 0.32 -1.99 -0.09 0.00 -0.30 0.00 0.00 42.92 40.85 2ayz s ASP 821 CO -0.04 -0.13 -0.20 -3.20 -0.17 0.00 0.00 175.17 171.42 2ayz n ASN 822 N 4.97 1.92 0.02 -0.34 5.15 -1.26 -5.06 115.26 120.66 2ayz n ASN 822 Ca -0.15 0.08 0.00 0.00 -0.60 0.00 0.00 54.58 53.91 2ayz n ASN 822 Cb 0.50 -0.42 0.00 0.00 -0.53 0.00 0.00 39.78 39.33 2ayz n ASN 822 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2ayz n ASP 823 N -3.45 -0.30 0.00 1.20 2.03 -1.26 -5.04 116.55 109.73 2ayz n ASP 823 Ca -0.34 0.07 0.00 0.00 0.52 0.00 0.00 54.79 55.04 2ayz n ASP 823 Cb 0.79 0.68 0.00 0.00 -0.72 0.00 0.00 41.12 41.87 2ayz n ASP 823 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2ayz n ASP 824 N -2.45 0.00 -3.80 1.67 2.03 -1.26 -4.73 116.55 108.01 2ayz n ASP 824 Ca 0.00 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.18 2ayz n ASP 824 Cb 0.00 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.27 2ayz n ASP 824 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 2ayz s MET 825 N 0.00 0.18 -0.16 -0.67 1.75 -1.26 -5.13 119.30 114.01 2ayz s MET 825 Ca 0.00 0.27 0.01 0.00 -1.25 0.00 0.00 55.69 54.72 2ayz s MET 825 Cb 0.00 0.03 0.01 0.00 2.84 0.00 0.00 34.83 37.71 2ayz s MET 825 CO 0.00 -0.05 -0.18 1.41 -0.65 0.00 0.00 175.02 175.54 2ayz s MET 826 N 0.34 3.10 0.07 4.11 1.75 -1.26 -2.50 119.30 124.91 2ayz s MET 826 Ca -0.02 -0.80 0.09 0.00 -1.25 0.00 0.00 55.69 53.71 2ayz s MET 826 Cb -0.03 -2.56 -0.03 0.00 2.84 0.00 0.00 34.83 35.04 2ayz s MET 826 CO -0.01 -0.06 -0.22 0.42 -0.65 0.00 0.00 175.02 174.49 2ayz s ILE 827 N 0.96 2.49 -0.33 10.11 -1.09 -0.02 -1.04 121.20 132.28 2ayz s ILE 827 Ca -0.03 -1.39 -0.13 0.00 -2.23 0.00 0.00 60.65 56.88 2ayz s ILE 827 Cb -0.15 -2.05 -0.02 0.00 -1.58 0.00 0.00 42.46 38.67 2ayz s ILE 827 CO -0.04 0.28 0.23 -0.76 -1.23 0.00 0.00 174.94 173.42 2ayz s LEU 828 N -1.56 4.46 -0.44 2.97 1.43 -0.65 -1.01 118.68 123.89 2ayz s LEU 828 Ca 0.14 -0.40 -0.13 0.00 -1.03 0.00 0.00 54.13 52.70 2ayz s LEU 828 Cb -0.10 -2.13 0.06 0.00 0.03 0.00 0.00 46.19 44.05 2ayz s LEU 828 CO 0.05 -0.22 0.33 0.68 0.23 0.00 0.00 176.35 177.42 2ayz s VAL 829 N 1.72 4.91 -0.07 -1.59 -7.23 0.34 -0.96 120.40 117.52 2ayz s VAL 829 Ca 0.06 -1.09 0.05 0.00 -1.81 0.00 0.00 61.98 59.20 2ayz s VAL 829 Cb -0.17 -3.91 -0.01 0.00 0.56 0.00 0.00 36.38 32.85 2ayz s VAL 829 CO 0.10 -0.50 -0.24 -0.69 -0.31 0.00 0.00 175.10 173.47 2ayz s VAL 830 N 1.58 2.01 -0.17 1.32 1.01 0.08 -2.45 120.40 123.78 2ayz s VAL 830 Ca 0.04 -1.02 -0.10 0.00 0.00 0.00 0.00 61.98 60.89 2ayz s VAL 830 Cb -0.23 -1.71 0.06 0.00 0.00 0.00 0.00 36.38 34.50 2ayz s VAL 830 CO 0.06 0.55 0.42 -0.62 0.00 0.00 0.00 175.10 175.51 2ayz s ASP 831 N 0.02 -0.52 0.36 3.32 2.15 -0.94 -0.56 116.67 120.51 2ayz s ASP 831 Ca -0.09 0.90 0.07 0.00 0.43 0.00 0.00 52.55 53.86 2ayz s ASP 831 Cb -0.15 0.80 0.76 0.00 -0.30 0.00 0.00 42.92 44.03 2ayz s ASP 831 CO 0.05 -0.19 1.94 -0.78 -0.17 0.00 0.00 175.17 176.02 2ayz h ASP 832 N 6.88 0.66 -2.27 -0.34 3.58 -1.71 -3.37 116.42 119.85 2ayz h ASP 832 Ca -0.35 0.01 -0.45 0.00 0.42 0.00 0.00 57.03 56.66 2ayz h ASP 832 Cb 1.18 -0.13 0.01 0.00 1.72 0.00 0.00 39.33 42.12 2ayz h ASP 832 CO 0.28 0.41 -0.27 -1.00 -2.88 0.00 0.00 179.24 175.78 2ayz s HIS 833 N -5.68 3.26 -0.39 0.28 3.76 -1.26 -4.82 115.29 110.45 2ayz s HIS 833 Ca -0.10 0.02 0.22 0.00 -0.15 0.00 0.00 55.06 55.05 2ayz s HIS 833 Cb 0.20 -1.99 0.28 0.00 1.11 0.00 0.00 32.58 32.17 2ayz s HIS 833 CO 0.78 -0.01 1.54 -1.00 -0.85 0.00 0.00 174.74 175.20 2ayz h PRO 834 N 0.79 0.00 -0.03 8.40 0.13 -2.00 -3.27 132.00 136.02 2ayz h PRO 834 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 2ayz h PRO 834 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 2ayz h PRO 834 CO 0.57 0.07 -0.04 0.97 -0.23 0.00 0.00 178.00 179.34 2ayz h ILE 835 N 0.00 1.40 0.00 -3.56 2.10 -1.95 -1.36 117.51 114.14 2ayz h ILE 835 Ca -0.00 -1.24 -0.04 0.00 1.08 0.00 0.00 64.86 64.65 2ayz h ILE 835 Cb 1.06 2.16 -0.01 0.00 -1.09 0.00 0.00 36.82 38.94 2ayz h ILE 835 CO 0.01 0.33 -0.51 -1.13 -1.08 0.00 0.00 178.15 175.77 2ayz h ASN 836 N -0.40 0.00 0.08 2.19 -1.24 -1.96 -2.72 115.58 111.54 2ayz h ASN 836 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.01 2ayz h ASN 836 Cb 0.56 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.61 2ayz h ASN 836 CO 0.01 0.19 -0.04 -0.09 -1.29 0.00 0.00 177.43 176.21 2ayz h ARG 837 N 0.00 -0.11 -0.25 6.67 2.43 -1.60 0.11 114.38 121.63 2ayz h ARG 837 Ca -0.02 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 2ayz h ARG 837 Cb 1.16 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 2ayz h ARG 837 CO 0.02 0.10 -0.15 0.07 -1.51 0.00 0.00 179.97 178.50 2ayz h ARG 838 N -0.30 0.43 0.07 0.20 -0.00 -1.25 0.07 114.38 113.60 2ayz h ARG 838 Ca -0.01 -0.12 -0.00 0.00 -0.00 0.00 0.00 59.98 59.84 2ayz h ARG 838 Cb 0.25 -0.05 0.00 0.00 -0.00 0.00 0.00 29.97 30.18 2ayz h ARG 838 CO 0.02 0.57 -0.03 1.25 -0.00 0.00 0.00 179.97 181.78 2ayz h LEU 839 N 0.40 -0.08 -1.05 0.08 5.85 -1.39 -2.17 115.31 116.96 2ayz h LEU 839 Ca 0.07 -0.46 -0.10 0.00 0.84 0.00 0.00 57.88 58.23 2ayz h LEU 839 Cb 0.50 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 2ayz h LEU 839 CO 0.03 0.45 -0.43 0.25 -0.34 0.00 0.00 178.44 178.40 2ayz h LEU 840 N -0.64 0.09 -0.90 2.25 6.46 -0.72 -0.02 115.31 121.83 2ayz h LEU 840 Ca -0.01 -0.04 -0.11 0.00 -0.12 0.00 0.00 57.88 57.61 2ayz h LEU 840 Cb 0.54 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.43 2ayz h LEU 840 CO 0.02 0.52 -0.34 0.00 -0.62 0.00 0.00 178.44 178.01 2ayz h ALA 841 N 1.49 1.06 -0.24 1.25 0.00 -1.03 -0.47 119.26 121.33 2ayz h ALA 841 Ca 0.00 -0.39 -0.16 0.00 0.00 0.00 0.00 54.91 54.37 2ayz h ALA 841 Cb 0.80 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2ayz h ALA 841 CO 0.06 0.58 -0.49 0.22 0.00 0.00 0.00 179.25 179.62 2ayz h ASP 842 N 0.34 0.71 -0.37 0.00 3.58 -0.66 0.60 116.42 120.62 2ayz h ASP 842 Ca 0.04 -0.36 0.01 0.00 0.42 0.00 0.00 57.03 57.14 2ayz h ASP 842 Cb 0.77 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.59 2ayz h ASP 842 CO 0.06 1.08 0.23 1.56 -2.88 0.00 0.00 179.24 179.29 2ayz h GLN 843 N 0.51 0.45 -0.13 0.28 4.20 -0.67 -0.06 115.11 119.70 2ayz h GLN 843 Ca 0.02 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 2ayz h GLN 843 Cb 1.04 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 2ayz h GLN 843 CO 0.10 0.30 -0.28 1.25 -0.67 0.00 0.00 178.83 179.53 2ayz h LEU 844 N 0.47 0.23 -1.42 1.46 5.85 -0.96 -1.82 115.31 119.13 2ayz h LEU 844 Ca 0.14 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 2ayz h LEU 844 Cb -0.03 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2ayz h LEU 844 CO -0.05 0.51 0.02 1.23 -0.34 0.00 0.00 178.44 179.82 2ayz h GLY 845 N 1.00 0.44 1.94 3.75 0.00 -0.09 -0.64 103.07 109.46 2ayz h GLY 845 Ca 0.03 -0.23 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 2ayz h GLY 845 CO 0.04 0.22 -0.50 1.76 0.00 0.00 0.00 176.54 178.06 2ayz h SER 846 N 0.40 0.07 -0.13 0.19 0.02 -0.21 -2.32 113.55 111.57 2ayz h SER 846 Ca 0.09 -0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 60.92 2ayz h SER 846 Cb 0.23 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2ayz h SER 846 CO 0.00 0.56 -0.20 -0.07 -1.14 0.00 0.00 176.83 175.99 2ayz h LEU 847 N 0.06 0.54 0.00 5.07 4.07 -0.69 -3.47 115.31 120.89 2ayz h LEU 847 Ca -0.00 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.79 2ayz h LEU 847 Cb 0.90 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.50 2ayz h LEU 847 CO 0.07 0.75 0.00 0.61 -1.08 0.00 0.00 178.44 178.79 2ayz n GLY 848 N -0.44 0.70 3.85 0.83 0.00 -0.37 -5.07 105.19 104.69 2ayz n GLY 848 Ca 0.00 -0.71 -0.22 0.00 0.00 0.00 0.00 46.02 45.10 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 2.63 0.01 1.61 2.02 -1.20 -5.05 117.35 115.37 2ayz s TYR 849 Ca 0.00 -0.53 -0.30 0.00 -0.37 0.00 0.00 57.07 55.87 2ayz s TYR 849 Cb 0.00 -2.12 -0.07 0.00 -0.40 0.00 0.00 41.96 39.37 2ayz s TYR 849 CO 0.00 -0.09 1.63 -1.14 -1.57 0.00 0.00 175.55 174.39 2ayz s GLN 850 N -4.10 4.20 -0.41 -0.62 2.00 -1.04 -4.74 119.66 114.95 2ayz s GLN 850 Ca 0.46 2.24 -0.13 0.00 -2.00 0.00 0.00 55.36 55.93 2ayz s GLN 850 Cb -0.02 -3.78 0.04 0.00 0.80 0.00 0.00 33.01 30.06 2ayz s GLN 850 CO 0.27 -0.77 0.28 0.00 -0.50 0.00 0.00 175.29 174.56 2ayz s LYS 852 N 1.58 3.68 0.01 0.00 3.01 -0.18 -4.93 119.74 122.91 2ayz s LYS 852 Ca 0.03 -0.30 -0.18 0.00 -1.01 0.00 0.00 55.97 54.51 2ayz s LYS 852 Cb -0.21 -3.77 -0.06 0.00 -1.01 0.00 0.00 37.83 32.79 2ayz s LYS 852 CO 0.07 -0.47 0.52 0.99 0.51 0.00 0.00 175.35 176.97 2ayz s THR 853 N 2.04 4.91 0.20 2.17 2.01 -1.26 -0.50 115.64 125.21 2ayz s THR 853 Ca 0.13 1.09 -0.12 0.00 0.31 0.00 0.00 61.69 63.10 2ayz s THR 853 Cb -0.16 -3.85 0.00 0.00 0.01 0.00 0.00 72.50 68.50 2ayz s THR 853 CO 0.11 0.50 0.39 0.00 -0.69 0.00 0.00 174.62 174.94 2ayz s ALA 854 N -0.67 -0.25 -0.42 7.40 0.00 -1.02 -4.97 121.76 121.83 2ayz s ALA 854 Ca 0.28 -0.75 0.07 0.00 0.00 0.00 0.00 51.96 51.55 2ayz s ALA 854 Cb -0.18 0.94 0.23 0.00 0.00 0.00 0.00 23.12 24.10 2ayz s ALA 854 CO 0.16 -0.74 0.54 0.27 0.00 0.00 0.00 175.76 175.98 2ayz n ASN 855 N -0.30 -0.61 0.00 0.00 6.94 -1.26 -2.22 115.26 117.82 2ayz n ASN 855 Ca -0.06 -2.71 0.00 0.00 -0.02 0.00 0.00 54.58 51.79 2ayz n ASN 855 Cb 0.63 -0.15 0.00 0.00 -2.36 0.00 0.00 39.78 37.89 2ayz n ASN 855 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2ayz n ASP 856 N 1.87 0.00 -0.10 0.53 2.03 -1.26 -4.49 116.55 115.13 2ayz n ASP 856 Ca 0.21 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.40 2ayz n ASP 856 Cb 0.53 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.90 2ayz n ASP 856 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2ayz h GLY 857 N 0.00 0.69 2.00 0.27 0.00 -1.94 -2.89 103.07 101.21 2ayz h GLY 857 Ca 0.00 -0.63 -0.13 0.00 0.00 0.00 0.00 47.33 46.57 2ayz h GLY 857 CO 0.00 0.57 -0.61 -2.08 0.00 0.00 0.00 176.54 174.42 2ayz h VAL 858 N 0.39 1.34 -1.00 4.60 2.07 -1.95 -2.91 116.25 118.79 2ayz h VAL 858 Ca 0.07 -2.17 0.14 0.00 0.82 0.00 0.00 66.70 65.55 2ayz h VAL 858 Cb 0.69 2.20 -0.09 0.00 -1.52 0.00 0.00 31.29 32.57 2ayz h VAL 858 CO 0.05 0.60 0.62 -0.78 0.02 0.00 0.00 177.57 178.08 2ayz h ASP 859 N 0.00 0.88 -0.46 0.57 3.58 -1.86 0.48 116.42 119.60 2ayz h ASP 859 Ca -0.01 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2ayz h ASP 859 Cb 1.15 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 42.07 2ayz h ASP 859 CO 0.08 0.43 0.29 0.00 -2.88 0.00 0.00 179.24 177.17 2ayz h ALA 860 N 1.57 1.64 -0.23 -0.78 0.00 -1.30 -0.03 119.26 120.12 2ayz h ALA 860 Ca 0.51 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.33 2ayz h ALA 860 Cb 0.60 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2ayz h ALA 860 CO -0.28 0.33 -0.03 -0.07 0.00 0.00 0.00 179.25 179.19 2ayz h LEU 861 N 0.64 0.42 -0.26 0.00 4.07 -1.00 -0.16 115.31 119.02 2ayz h LEU 861 Ca 0.17 -0.35 -0.02 0.00 0.08 0.00 0.00 57.88 57.76 2ayz h LEU 861 Cb -0.05 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.57 2ayz h LEU 861 CO -0.03 0.67 0.08 -1.13 -1.08 0.00 0.00 178.44 176.95 2ayz h ASN 862 N 0.17 0.38 -0.63 -0.43 -0.73 -0.89 -0.13 115.58 113.33 2ayz h ASN 862 Ca 0.06 -0.21 -0.03 0.00 1.87 0.00 0.00 56.30 57.99 2ayz h ASN 862 Cb 0.47 -0.10 -0.03 0.00 0.27 0.00 0.00 38.32 38.93 2ayz h ASN 862 CO 0.02 0.49 0.29 0.58 -0.37 0.00 0.00 177.43 178.44 2ayz h VAL 863 N 0.26 1.22 -0.30 2.57 2.07 -1.01 -2.26 116.25 118.80 2ayz h VAL 863 Ca 0.08 -0.65 -0.12 0.00 0.82 0.00 0.00 66.70 66.83 2ayz h VAL 863 Cb 0.24 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2ayz h VAL 863 CO -0.00 0.27 -0.30 0.25 0.02 0.00 0.00 177.57 177.80 2ayz h LEU 864 N 0.93 0.65 -1.40 2.57 7.12 -0.62 0.83 115.31 125.39 2ayz h LEU 864 Ca 0.22 -0.25 -0.06 0.00 0.13 0.00 0.00 57.88 57.92 2ayz h LEU 864 Cb 0.14 -0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 40.08 2ayz h LEU 864 CO -0.03 0.92 -0.29 0.28 -0.13 0.00 0.00 178.44 179.19 2ayz h SER 865 N 0.54 0.00 0.00 1.25 0.02 -0.47 -3.25 113.55 111.65 2ayz h SER 865 Ca 0.07 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.89 2ayz h SER 865 Cb 0.79 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.31 2ayz h SER 865 CO 0.06 0.29 -0.83 0.11 -1.14 0.00 0.00 176.83 175.32 2ayz h LYS 866 N 0.00 0.00 -6.22 3.45 1.79 -1.21 -3.48 116.57 110.90 2ayz h LYS 866 Ca -0.00 0.00 -0.63 0.00 -2.18 0.00 0.00 60.65 57.83 2ayz h LYS 866 Cb 0.59 0.00 -0.29 0.00 -1.58 0.00 0.00 32.23 30.94 2ayz h LYS 866 CO 0.04 0.60 -0.87 1.21 -1.08 0.00 0.00 179.45 179.35 2ayz s ASN 867 N -6.35 2.63 -0.09 0.86 2.47 0.27 -5.12 114.94 109.61 2ayz s ASN 867 Ca -0.22 -0.42 -0.21 0.00 0.42 0.00 0.00 52.86 52.44 2ayz s ASN 867 Cb 0.04 -0.29 -0.04 0.00 -1.45 0.00 0.00 41.25 39.51 2ayz s ASN 867 CO 0.44 0.27 0.61 -1.00 -3.72 0.00 0.00 177.10 173.69 2ayz s HIS 868 N -0.55 3.54 0.05 0.43 3.76 -1.26 -3.85 115.29 117.42 2ayz s HIS 868 Ca 0.09 1.09 0.09 0.00 -0.15 0.00 0.00 55.06 56.17 2ayz s HIS 868 Cb -0.09 -2.70 -0.03 0.00 1.11 0.00 0.00 32.58 30.87 2ayz s HIS 868 CO -0.01 0.11 -0.24 0.42 -0.85 0.00 0.00 174.74 174.17 2ayz s ILE 869 N 0.77 1.98 0.03 0.60 1.09 -1.26 -4.98 121.20 119.42 2ayz s ILE 869 Ca 0.32 -1.34 -0.31 0.00 -1.10 0.00 0.00 60.65 58.23 2ayz s ILE 869 Cb -0.17 -1.70 -0.17 0.00 -1.06 0.00 0.00 42.46 39.36 2ayz s ILE 869 CO 0.15 0.30 1.28 0.44 -0.10 0.00 0.00 174.94 177.00 2ayz h ASP 870 N 4.79 -0.94 -4.04 3.58 3.32 -1.48 -3.45 116.42 118.20 2ayz h ASP 870 Ca -0.45 0.03 -0.38 0.00 0.02 0.00 0.00 57.03 56.25 2ayz h ASP 870 Cb 1.15 0.24 -0.28 0.00 0.22 0.00 0.00 39.33 40.66 2ayz h ASP 870 CO 0.43 -0.58 -0.77 -0.63 -1.72 0.00 0.00 179.24 175.97 2ayz s ILE 871 N -5.16 0.68 -0.17 0.35 1.01 -1.24 -4.70 121.20 111.97 2ayz s ILE 871 Ca -0.16 -0.39 -0.01 0.00 0.00 0.00 0.00 60.65 60.09 2ayz s ILE 871 Cb 0.02 -0.57 -0.01 0.00 0.01 0.00 0.00 42.46 41.91 2ayz s ILE 871 CO 0.49 0.17 -0.12 -0.69 0.00 0.00 0.00 174.94 174.79 2ayz s VAL 872 N -0.24 2.93 -0.33 2.92 1.01 -1.11 -1.63 120.40 123.95 2ayz s VAL 872 Ca 0.03 -0.67 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 2ayz s VAL 872 Cb -0.04 -2.26 0.05 0.00 0.00 0.00 0.00 36.38 34.13 2ayz s VAL 872 CO -0.00 0.49 0.07 -0.76 0.00 0.00 0.00 175.10 174.90 2ayz s LEU 873 N 0.92 4.21 -0.20 3.92 1.02 -0.13 -0.28 118.68 128.14 2ayz s LEU 873 Ca -0.03 -1.23 0.01 0.00 0.02 0.00 0.00 54.13 52.90 2ayz s LEU 873 Cb -0.15 -1.81 0.02 0.00 0.02 0.00 0.00 46.19 44.27 2ayz s LEU 873 CO -0.01 -0.31 -0.17 -0.94 0.02 0.00 0.00 176.35 174.94 2ayz s SER 874 N 1.38 3.46 -0.29 2.29 1.04 -0.90 -0.74 113.70 119.93 2ayz s SER 874 Ca -0.03 -0.73 -0.18 0.00 0.48 0.00 0.00 55.95 55.50 2ayz s SER 874 Cb -0.20 -1.52 -0.02 0.00 0.10 0.00 0.00 66.02 64.38 2ayz s SER 874 CO 0.01 -0.03 0.50 -0.62 0.98 0.00 0.00 173.24 174.08 2ayz s ASP 875 N 1.29 6.38 -0.48 7.02 -1.08 0.28 -0.87 116.67 129.20 2ayz s ASP 875 Ca 0.03 0.35 -0.18 0.00 -0.52 0.00 0.00 52.55 52.23 2ayz s ASP 875 Cb -0.14 -2.27 0.05 0.00 -1.46 0.00 0.00 42.92 39.10 2ayz s ASP 875 CO -0.11 -0.33 0.56 -0.69 0.52 0.00 0.00 175.17 175.12 2ayz s VAL 876 N 2.31 4.97 -1.27 1.11 1.01 0.17 -2.48 120.40 126.23 2ayz s VAL 876 Ca 0.20 -0.54 0.22 0.00 0.00 0.00 0.00 61.98 61.86 2ayz s VAL 876 Cb -0.16 -4.23 -0.13 0.00 0.00 0.00 0.00 36.38 31.87 2ayz s VAL 876 CO 0.10 -0.70 1.03 -3.20 0.00 0.00 0.00 175.10 172.34 2ayz n ASN 877 N 5.92 1.17 -3.74 3.32 5.15 -1.26 -1.95 115.26 123.87 2ayz n ASN 877 Ca -0.07 -1.02 -0.30 0.00 -0.60 0.00 0.00 54.58 52.59 2ayz n ASN 877 Cb 0.45 0.76 -0.15 0.00 -0.53 0.00 0.00 39.78 40.31 2ayz n ASN 877 CO 0.00 0.00 0.00 -0.32 1.40 0.00 0.00 177.26 178.34 2ayz s MET 878 N -2.86 0.73 -0.83 1.20 1.75 -1.26 -4.92 119.30 113.10 2ayz s MET 878 Ca 0.11 -1.02 -0.25 0.00 -1.25 0.00 0.00 55.69 53.29 2ayz s MET 878 Cb 0.17 -2.01 -0.05 0.00 2.84 0.00 0.00 34.83 35.78 2ayz s MET 878 CO 0.77 -0.95 1.95 -2.14 -0.65 0.00 0.00 175.02 174.00 2ayz s PRO 879 N 1.63 2.52 0.00 4.11 0.02 -1.26 -4.83 135.00 137.20 2ayz s PRO 879 Ca 0.08 -0.06 0.00 0.00 0.02 0.00 0.00 61.00 61.05 2ayz s PRO 879 Cb -0.17 -4.91 0.00 0.00 0.02 0.00 0.00 34.50 29.44 2ayz s PRO 879 CO -0.23 -3.29 1.40 0.27 -0.33 0.00 0.00 177.00 174.81 2ayz n ASN 880 N 13.95 3.90 0.00 2.53 0.23 -1.26 -4.32 115.26 130.28 2ayz n ASN 880 Ca 0.36 -2.10 0.00 0.00 -0.53 0.00 0.00 54.58 52.31 2ayz n ASN 880 Cb 0.48 -0.76 0.00 0.00 -2.08 0.00 0.00 39.78 37.42 2ayz n ASN 880 CO 0.00 0.00 0.00 0.80 -0.93 0.00 0.00 177.26 177.13 2ayz n MET 881 N 1.00 0.00 -3.82 -3.83 0.00 -1.26 -5.03 117.12 104.17 2ayz n MET 881 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 57.70 57.68 2ayz n MET 881 Cb 0.47 0.00 0.01 0.00 0.00 0.00 0.00 33.22 33.70 2ayz n MET 881 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2ayz s ASP 882 N 0.00 -0.05 -0.90 6.12 -1.08 -1.26 -5.04 116.67 114.46 2ayz s ASP 882 Ca 0.00 -0.52 -0.08 0.00 -0.52 0.00 0.00 52.55 51.43 2ayz s ASP 882 Cb 0.00 0.44 -0.15 0.00 -1.46 0.00 0.00 42.92 41.75 2ayz s ASP 882 CO 0.00 -0.86 3.04 0.61 0.52 0.00 0.00 175.17 178.48 2ayz n GLY 883 N -0.62 3.57 0.47 2.66 0.00 -1.26 -3.30 105.19 106.70 2ayz n GLY 883 Ca -0.04 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.70 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 3.23 -0.59 0.05 1.61 4.11 -1.26 -4.58 117.16 119.73 2ayz n TYR 884 Ca 0.60 0.00 0.18 0.00 -0.00 0.00 0.00 57.90 58.68 2ayz n TYR 884 Cb 0.47 0.12 0.69 0.00 -0.00 0.00 0.00 39.34 40.62 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 -0.12 -3.48 1.12 -1.88 -0.02 114.38 109.99 2ayz h ARG 885 Ca 0.00 0.00 -0.13 0.00 -1.11 0.00 0.00 59.98 58.74 2ayz h ARG 885 Cb 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 29.95 2ayz h ARG 885 CO 0.00 0.00 -0.49 1.37 -3.11 0.00 0.00 179.97 177.74 2ayz h LEU 886 N 0.00 0.33 -0.49 3.80 -0.00 -1.95 0.25 115.31 117.25 2ayz h LEU 886 Ca 0.20 -0.16 -0.11 0.00 -0.00 0.00 0.00 57.88 57.81 2ayz h LEU 886 Cb 0.84 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 41.39 2ayz h LEU 886 CO -0.00 0.77 -0.53 0.74 -0.00 0.00 0.00 178.44 179.42 2ayz h THR 887 N 0.25 1.05 -0.45 0.15 2.02 -1.35 -2.72 112.91 111.85 2ayz h THR 887 Ca 0.01 -2.07 -0.04 0.00 0.77 0.00 0.00 66.41 65.08 2ayz h THR 887 Cb 0.96 2.24 -0.02 0.00 -1.74 0.00 0.00 68.15 69.58 2ayz h THR 887 CO 0.08 0.52 0.12 -0.61 0.37 0.00 0.00 175.52 175.99 2ayz h GLN 888 N 0.00 0.67 -0.67 6.66 4.15 -0.79 0.58 115.11 125.71 2ayz h GLN 888 Ca -0.01 -0.12 -0.02 0.00 0.77 0.00 0.00 58.65 59.28 2ayz h GLN 888 Cb 1.20 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.75 2ayz h GLN 888 CO 0.07 0.60 0.36 -0.09 -1.93 0.00 0.00 178.83 177.84 2ayz h ARG 889 N 0.65 0.95 -0.42 1.69 1.12 -1.10 -0.32 114.38 116.94 2ayz h ARG 889 Ca 0.15 -0.12 0.06 0.00 -1.11 0.00 0.00 59.98 58.96 2ayz h ARG 889 Cb 0.23 -0.18 -0.05 0.00 -0.01 0.00 0.00 29.97 29.96 2ayz h ARG 889 CO -0.00 0.72 0.13 0.82 -3.11 0.00 0.00 179.97 178.53 2ayz h ILE 890 N 0.92 0.84 -0.68 1.20 2.04 -1.04 -1.75 117.51 119.04 2ayz h ILE 890 Ca 0.23 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 66.01 2ayz h ILE 890 Cb 0.06 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 36.64 2ayz h ILE 890 CO -0.04 0.05 0.44 -0.09 0.00 0.00 0.00 178.15 178.52 2ayz h ARG 891 N 0.28 0.87 -0.14 2.37 2.43 -0.35 0.79 114.38 120.63 2ayz h ARG 891 Ca 0.20 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.24 2ayz h ARG 891 Cb 0.21 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2ayz h ARG 891 CO -0.22 0.57 -0.27 1.96 -1.51 0.00 0.00 179.97 180.50 2ayz h GLN 892 N 0.89 0.25 -0.11 0.20 1.08 -0.78 -2.40 115.11 114.26 2ayz h GLN 892 Ca 0.26 -0.09 -0.20 0.00 -1.45 0.00 0.00 58.65 57.17 2ayz h GLN 892 Cb -0.06 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.35 2ayz h GLN 892 CO -0.07 0.51 -0.76 -0.07 -0.95 0.00 0.00 178.83 177.49 2ayz h LEU 893 N 0.23 0.68 0.00 1.46 -0.00 -0.64 -3.48 115.31 113.55 2ayz h LEU 893 Ca 0.03 -0.45 0.00 0.00 -0.00 0.00 0.00 57.88 57.47 2ayz h LEU 893 Cb 0.61 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 41.07 2ayz h LEU 893 CO 0.04 1.21 0.00 0.61 -0.00 0.00 0.00 178.44 180.31 2ayz n GLY 894 N 0.63 1.22 3.62 0.83 0.00 0.21 -5.04 105.19 106.66 2ayz n GLY 894 Ca -0.06 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 2ayz n GLY 894 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ayz s LEU 895 N 0.00 4.00 -0.29 0.99 1.43 -1.17 -4.92 118.68 118.72 2ayz s LEU 895 Ca 0.00 0.74 -0.06 0.00 -1.03 0.00 0.00 54.13 53.78 2ayz s LEU 895 Cb 0.00 -3.30 -0.20 0.00 0.03 0.00 0.00 46.19 42.73 2ayz s LEU 895 CO 0.00 -0.80 3.41 1.07 0.23 0.00 0.00 176.35 180.26 2ayz n THR 896 N 5.83 3.26 -3.58 5.49 5.66 -1.26 -4.86 114.28 124.81 2ayz n THR 896 Ca 0.08 -1.89 -0.36 0.00 -3.05 0.00 0.00 64.05 58.82 2ayz n THR 896 Cb 0.48 -2.02 -0.07 0.00 -1.55 0.00 0.00 70.33 67.16 2ayz n THR 896 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2ayz s LEU 897 N -0.32 4.24 -0.45 1.09 2.96 -1.26 -5.03 118.68 119.91 2ayz s LEU 897 Ca 0.66 0.46 -0.28 0.00 -0.22 0.00 0.00 54.13 54.75 2ayz s LEU 897 Cb 0.31 -2.31 -0.01 0.00 0.50 0.00 0.00 46.19 44.68 2ayz s LEU 897 CO -0.04 0.13 1.66 -2.16 -1.32 0.00 0.00 176.35 174.62 2ayz s PRO 898 N 0.38 3.22 -0.29 0.98 0.04 -1.26 -4.76 135.00 133.32 2ayz s PRO 898 Ca 0.15 0.97 -0.08 0.00 0.04 0.00 0.00 61.00 62.08 2ayz s PRO 898 Cb -0.13 -4.19 -0.01 0.00 0.04 0.00 0.00 34.50 30.22 2ayz s PRO 898 CO 0.03 -2.00 0.10 0.08 0.04 0.00 0.00 177.00 175.24 2ayz s VAL 899 N 6.92 4.23 -0.70 -0.36 1.01 -1.10 -2.74 120.40 127.67 2ayz s VAL 899 Ca 0.68 -0.47 -0.22 0.00 0.00 0.00 0.00 61.98 61.98 2ayz s VAL 899 Cb -0.16 -3.11 0.08 0.00 0.00 0.00 0.00 36.38 33.19 2ayz s VAL 899 CO 0.29 0.15 0.97 -0.63 0.00 0.00 0.00 175.10 175.88 2ayz s ILE 900 N 1.56 4.43 -0.21 2.22 1.01 0.61 -2.03 121.20 128.80 2ayz s ILE 900 Ca 0.04 -0.63 -0.19 0.00 0.00 0.00 0.00 60.65 59.87 2ayz s ILE 900 Cb -0.16 -4.68 -0.03 0.00 0.01 0.00 0.00 42.46 37.59 2ayz s ILE 900 CO 0.04 -1.44 0.56 -0.83 0.00 0.00 0.00 174.94 173.27 2ayz s GLY 901 N 3.68 2.03 0.00 6.18 0.00 -0.39 -2.13 107.32 116.70 2ayz s GLY 901 Ca 0.23 -0.37 -0.01 0.00 0.00 0.00 0.00 44.72 44.56 2ayz s GLY 901 CO 0.06 1.19 0.14 0.14 0.00 0.00 0.00 173.10 174.63 2ayz s VAL 902 N 1.82 5.11 -0.04 1.40 1.01 -0.05 -0.71 120.40 128.95 2ayz s VAL 902 Ca 0.26 -0.31 -0.06 0.00 0.00 0.00 0.00 61.98 61.87 2ayz s VAL 902 Cb -0.16 -3.38 0.01 0.00 0.00 0.00 0.00 36.38 32.85 2ayz s VAL 902 CO 0.10 0.31 0.15 0.42 0.00 0.00 0.00 175.10 176.07 2ayz s THR 903 N -1.29 0.03 -0.47 3.92 -4.23 -0.12 -0.65 115.64 112.83 2ayz s THR 903 Ca 0.26 -0.27 -0.16 0.00 -1.18 0.00 0.00 61.69 60.35 2ayz s THR 903 Cb -0.12 -0.30 0.07 0.00 1.34 0.00 0.00 72.50 73.48 2ayz s THR 903 CO 0.18 -0.15 0.41 0.00 -0.54 0.00 0.00 174.62 174.52 2ayz s ALA 904 N -0.48 3.54 -1.32 3.99 0.00 -0.82 -0.57 121.76 126.11 2ayz s ALA 904 Ca -0.06 -2.07 -0.02 0.00 0.00 0.00 0.00 51.96 49.82 2ayz s ALA 904 Cb -0.04 -3.08 -0.00 0.00 0.00 0.00 0.00 23.12 20.00 2ayz s ALA 904 CO 0.01 -1.73 0.62 0.09 0.00 0.00 0.00 175.76 174.74 2ayz n ASN 905 N 5.27 -1.39 -4.34 0.00 4.13 -1.26 -4.93 115.26 112.73 2ayz n ASN 905 Ca -0.12 -0.90 -0.46 0.00 1.68 0.00 0.00 54.58 54.78 2ayz n ASN 905 Cb 0.44 -3.67 -0.04 0.00 -1.54 0.00 0.00 39.78 34.96 2ayz n ASN 905 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ayz s ALA 906 N -3.74 3.64 0.38 5.41 0.00 -1.26 -5.05 121.76 121.13 2ayz s ALA 906 Ca 0.06 -2.60 -0.25 0.00 0.00 0.00 0.00 51.96 49.17 2ayz s ALA 906 Cb -0.02 -3.45 -0.09 0.00 0.00 0.00 0.00 23.12 19.56 2ayz s ALA 906 CO 0.84 -2.24 1.07 -1.17 0.00 0.00 0.00 175.76 174.27 2ayz s LEU 907 N 1.75 4.20 -1.48 0.00 2.96 -1.26 -3.65 118.68 121.21 2ayz s LEU 907 Ca 0.10 2.11 -0.02 0.00 -0.22 0.00 0.00 54.13 56.11 2ayz s LEU 907 Cb -0.23 -4.09 0.00 0.00 0.50 0.00 0.00 46.19 42.38 2ayz s LEU 907 CO 0.01 -0.48 0.23 0.00 -1.32 0.00 0.00 176.35 174.79 2ayz n ALA 908 N 0.12 -0.67 0.33 5.97 0.00 -1.26 -4.88 120.51 120.12 2ayz n ALA 908 Ca 0.04 0.19 0.15 0.00 0.00 0.00 0.00 53.44 53.82 2ayz n ALA 908 Cb 0.48 -2.63 0.54 0.00 0.00 0.00 0.00 19.45 17.84 2ayz n ALA 908 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2ayz h GLU 909 N -0.53 0.00 0.26 0.00 -0.00 -1.88 -2.82 114.58 109.63 2ayz h GLU 909 Ca -0.45 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 58.90 2ayz h GLU 909 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.07 2ayz h GLU 909 CO 0.51 0.00 -0.13 0.93 -0.00 0.00 0.00 179.01 180.32 2ayz h GLU 910 N 0.00 -0.34 -0.42 1.06 4.39 -1.90 0.11 114.58 117.48 2ayz h GLU 910 Ca 0.00 0.02 -0.10 0.00 0.34 0.00 0.00 59.36 59.62 2ayz h GLU 910 Cb 0.56 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.27 2ayz h GLU 910 CO 0.00 -0.20 -0.15 -0.22 -1.16 0.00 0.00 179.01 177.28 2ayz h LYS 911 N -0.39 0.79 0.00 2.33 3.64 -1.94 -2.34 116.57 118.67 2ayz h LYS 911 Ca -0.04 -0.29 -0.08 0.00 -1.27 0.00 0.00 60.65 58.98 2ayz h LYS 911 Cb 0.30 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 2ayz h LYS 911 CO 0.06 0.90 -0.37 1.96 -2.27 0.00 0.00 179.45 179.73 2ayz h GLN 912 N 0.71 0.00 -0.53 1.90 7.50 -1.38 -2.32 115.11 120.98 2ayz h GLN 912 Ca 0.11 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 59.18 2ayz h GLN 912 Cb 0.65 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.16 2ayz h GLN 912 CO 0.05 0.37 0.01 -0.09 -1.50 0.00 0.00 178.83 177.67 2ayz h ARG 913 N 0.00 0.90 -0.25 1.46 9.65 -0.24 0.56 114.38 126.46 2ayz h ARG 913 Ca -0.00 -0.25 -0.03 0.00 -1.10 0.00 0.00 59.98 58.60 2ayz h ARG 913 Cb 0.67 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.14 2ayz h ARG 913 CO 0.05 0.88 0.03 0.00 2.80 0.00 0.00 179.97 183.73 2ayz h LEU 915 N 0.36 0.17 -0.01 0.00 6.46 -0.70 -3.32 115.31 118.27 2ayz h LEU 915 Ca 0.09 -0.55 -0.12 0.00 -0.12 0.00 0.00 57.88 57.18 2ayz h LEU 915 Cb 0.19 -0.05 0.01 0.00 -0.73 0.00 0.00 40.66 40.08 2ayz h LEU 915 CO 0.00 0.69 -0.46 1.05 -0.62 0.00 0.00 178.44 179.10 2ayz h GLU 916 N -0.33 0.32 -6.12 1.25 -0.00 -0.91 -3.45 114.58 105.34 2ayz h GLU 916 Ca 0.00 -0.34 -0.42 0.00 -0.00 0.00 0.00 59.36 58.60 2ayz h GLU 916 Cb 0.65 0.09 0.05 0.00 -0.00 0.00 0.00 28.75 29.55 2ayz h GLU 916 CO 0.02 1.03 -0.85 0.43 -0.00 0.00 0.00 179.01 179.64 2ayz n SER 917 N -4.33 -1.58 0.00 3.06 7.64 0.47 -3.84 113.62 115.04 2ayz n SER 917 Ca -0.10 -0.85 0.00 0.00 1.01 0.00 0.00 58.87 58.93 2ayz n SER 917 Cb 0.60 -3.93 0.00 0.00 -1.01 0.00 0.00 64.21 59.87 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 -1.62 0.77 0.00 0.23 0.00 -1.26 -4.60 105.19 98.71 2ayz n GLY 918 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.20 0.00 0.00 1.61 2.81 -1.26 -4.23 117.12 115.85 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 -4.84 7.83 -0.08 -0.86 -2.69 116.55 115.91 2ayz n ASP 920 Ca 0.00 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.96 2ayz n ASP 920 Cb 0.00 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.40 2ayz n ASP 920 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2ayz s SER 921 N 0.00 5.95 -0.15 1.67 0.01 -1.07 -5.00 113.70 115.11 2ayz s SER 921 Ca 0.00 0.18 -0.00 0.00 1.31 0.00 0.00 55.95 57.44 2ayz s SER 921 Cb 0.00 -1.75 0.03 0.00 0.21 0.00 0.00 66.02 64.51 2ayz s SER 921 CO 0.00 0.22 -0.09 0.00 0.41 0.00 0.00 173.24 173.78 2ayz s LEU 923 N 1.60 1.66 0.19 0.00 1.43 0.11 -5.00 118.68 118.67 2ayz s LEU 923 Ca 0.03 -1.50 0.08 0.00 -1.03 0.00 0.00 54.13 51.71 2ayz s LEU 923 Cb -0.14 0.13 -0.04 0.00 0.03 0.00 0.00 46.19 46.17 2ayz s LEU 923 CO -0.09 -0.83 -0.02 -0.44 0.23 0.00 0.00 176.35 175.20 2ayz s SER 924 N -3.36 4.64 0.25 2.29 0.01 -1.26 -0.94 113.70 115.33 2ayz s SER 924 Ca 0.36 -0.48 -0.09 0.00 1.31 0.00 0.00 55.95 57.06 2ayz s SER 924 Cb 0.06 -0.93 0.40 0.00 0.21 0.00 0.00 66.02 65.75 2ayz s SER 924 CO 0.16 0.07 1.61 0.50 0.41 0.00 0.00 173.24 175.99 2ayz h LYS 925 N 2.56 0.03 -4.43 12.44 3.64 -1.17 -3.14 116.57 126.50 2ayz h LYS 925 Ca -0.46 -0.00 -0.49 0.00 -1.27 0.00 0.00 60.65 58.42 2ayz h LYS 925 Cb 1.21 -0.01 0.07 0.00 -0.41 0.00 0.00 32.23 33.10 2ayz h LYS 925 CO 0.58 0.02 1.83 -0.35 -2.27 0.00 0.00 179.45 179.26 2ayz n PRO 926 N -5.45 0.84 -2.49 1.90 -0.04 -1.26 -4.89 135.00 123.61 2ayz n PRO 926 Ca 0.13 -1.29 -0.26 0.00 -0.04 0.00 0.00 63.50 62.03 2ayz n PRO 926 Cb 0.45 -2.57 0.03 0.00 -0.04 0.00 0.00 33.50 31.37 2ayz n PRO 926 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2ayz s VAL 927 N 5.46 3.77 0.24 0.52 0.11 -1.19 -5.12 120.40 124.20 2ayz s VAL 927 Ca 0.50 -0.05 0.01 0.00 -2.93 0.00 0.00 61.98 59.51 2ayz s VAL 927 Cb 0.12 -3.48 -0.05 0.00 -1.53 0.00 0.00 36.38 31.44 2ayz s VAL 927 CO 0.16 -0.47 0.10 0.42 -3.33 0.00 0.00 175.10 171.97 2ayz s THR 928 N -2.92 0.44 0.12 5.04 -4.23 -1.26 -5.04 115.64 107.79 2ayz s THR 928 Ca 0.53 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.85 2ayz s THR 928 Cb -0.10 -2.55 -0.05 0.00 1.34 0.00 0.00 72.50 71.13 2ayz s THR 928 CO 0.44 -0.05 1.73 0.25 -0.54 0.00 0.00 174.62 176.45 2ayz h LEU 929 N 2.47 0.32 -0.49 4.79 6.46 -1.98 -0.05 115.31 126.83 2ayz h LEU 929 Ca -0.38 -0.07 -0.07 0.00 -0.12 0.00 0.00 57.88 57.24 2ayz h LEU 929 Cb 1.24 -0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 41.07 2ayz h LEU 929 CO 0.59 0.30 0.02 -0.78 -0.62 0.00 0.00 178.44 177.96 2ayz h ASP 930 N 0.31 0.83 -0.23 1.25 1.82 -1.98 0.05 116.42 118.48 2ayz h ASP 930 Ca 0.09 -0.29 -0.01 0.00 -0.39 0.00 0.00 57.03 56.43 2ayz h ASP 930 Cb 0.05 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 39.82 2ayz h ASP 930 CO -0.02 0.92 0.12 0.58 -1.61 0.00 0.00 179.24 179.23 2ayz h VAL 931 N 0.72 1.12 -0.09 2.25 2.07 -1.93 -0.47 116.25 119.92 2ayz h VAL 931 Ca 0.14 -0.34 -0.09 0.00 0.82 0.00 0.00 66.70 67.23 2ayz h VAL 931 Cb 0.48 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2ayz h VAL 931 CO 0.02 0.12 -0.37 -0.29 0.02 0.00 0.00 177.57 177.07 2ayz h ILE 932 N 0.25 1.29 -0.32 4.57 2.10 -0.83 -2.21 117.51 122.36 2ayz h ILE 932 Ca 0.08 -1.39 -0.11 0.00 1.08 0.00 0.00 64.86 64.51 2ayz h ILE 932 Cb 0.09 1.63 -0.01 0.00 -1.09 0.00 0.00 36.82 37.44 2ayz h ILE 932 CO -0.01 0.41 -0.27 0.50 -1.08 0.00 0.00 178.15 177.70 2ayz h LYS 933 N 0.16 0.64 0.50 2.19 3.11 -0.65 0.37 116.57 122.88 2ayz h LYS 933 Ca 0.02 -0.27 -0.02 0.00 -2.81 0.00 0.00 60.65 57.57 2ayz h LYS 933 Cb 0.73 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.94 2ayz h LYS 933 CO 0.06 0.84 -0.24 1.96 -2.81 0.00 0.00 179.45 179.26 2ayz h GLN 934 N 0.56 -0.64 -0.52 1.90 1.08 -0.50 -0.25 115.11 116.73 2ayz h GLN 934 Ca 0.07 0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.27 2ayz h GLN 934 Cb 0.75 0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 28.30 2ayz h GLN 934 CO 0.06 -0.39 0.16 1.15 -0.95 0.00 0.00 178.83 178.86 2ayz h THR 935 N -0.74 1.23 0.25 -0.54 2.02 -1.41 -0.09 112.91 113.63 2ayz h THR 935 Ca -0.07 -0.78 0.01 0.00 0.77 0.00 0.00 66.41 66.34 2ayz h THR 935 Cb 0.55 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 2ayz h THR 935 CO 0.11 0.29 -0.36 0.25 0.37 0.00 0.00 175.52 176.19 2ayz h LEU 936 N 0.72 -1.00 -0.45 2.58 7.12 -0.87 -0.59 115.31 122.83 2ayz h LEU 936 Ca 0.17 0.10 -0.16 0.00 0.13 0.00 0.00 57.88 58.12 2ayz h LEU 936 Cb 0.28 0.35 -0.01 0.00 -0.53 0.00 0.00 40.66 40.76 2ayz h LEU 936 CO -0.01 -0.47 -0.43 0.74 -0.13 0.00 0.00 178.44 178.15 2ayz h THR 937 N -0.67 1.28 -0.57 1.05 2.02 -0.98 -0.16 112.91 114.89 2ayz h THR 937 Ca -0.00 -1.61 -0.10 0.00 0.77 0.00 0.00 66.41 65.47 2ayz h THR 937 Cb 0.64 1.48 -0.02 0.00 -1.74 0.00 0.00 68.15 68.51 2ayz h THR 937 CO -0.13 0.53 -0.03 -0.07 0.37 0.00 0.00 175.52 176.19 2ayz h LEU 938 N 0.66 1.01 -0.42 2.58 3.38 -0.94 -0.89 115.31 120.71 2ayz h LEU 938 Ca 0.05 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.60 2ayz h LEU 938 Cb 1.00 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2ayz h LEU 938 CO 0.10 1.09 -0.48 1.88 0.09 0.00 0.00 178.44 181.11 2ayz h TYR 939 N 0.91 0.00 -0.46 1.13 -1.99 -1.04 -2.18 116.97 113.35 2ayz h TYR 939 Ca 0.16 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.83 2ayz h TYR 939 Cb 0.59 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.30 2ayz h TYR 939 CO 0.04 0.48 0.06 0.00 -0.00 0.00 0.00 178.16 178.74 2ayz h ALA 940 N 1.52 0.62 -0.16 3.88 0.00 -0.62 0.08 119.26 124.57 2ayz h ALA 940 Ca -0.00 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 2ayz h ALA 940 Cb 1.20 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2ayz h ALA 940 CO 0.06 0.36 -0.21 1.05 0.00 0.00 0.00 179.25 180.51 2ayz h GLU 941 N 0.64 0.28 -0.11 0.00 4.11 -1.05 -0.35 114.58 118.10 2ayz h GLU 941 Ca 0.14 -0.09 -0.04 0.00 0.07 0.00 0.00 59.36 59.45 2ayz h GLU 941 Cb 0.41 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 2ayz h GLU 941 CO 0.01 0.49 -0.07 -0.09 0.07 0.00 0.00 179.01 179.42 2ayz h ARG 942 N 0.26 0.24 -0.00 1.06 2.43 -0.94 -0.32 114.38 117.10 2ayz h ARG 942 Ca 0.04 -0.11 -0.11 0.00 -0.81 0.00 0.00 59.98 58.99 2ayz h ARG 942 Cb 0.52 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 2ayz h ARG 942 CO 0.04 0.61 -0.51 -0.39 -1.51 0.00 0.00 179.97 178.21 2ayz h VAL 943 N -0.14 1.37 -0.24 0.20 -1.51 -0.92 -1.03 116.25 113.98 2ayz h VAL 943 Ca 0.02 -1.76 -0.01 0.00 -1.23 0.00 0.00 66.70 63.72 2ayz h VAL 943 Cb 0.56 1.95 -0.01 0.00 -2.13 0.00 0.00 31.29 31.65 2ayz h VAL 943 CO 0.02 0.50 0.12 -0.09 -1.23 0.00 0.00 177.57 176.89 2ayz h ARG 944 N 0.01 0.35 -0.32 5.19 2.43 -0.90 -0.19 114.38 120.94 2ayz h ARG 944 Ca -0.00 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 2ayz h ARG 944 Cb 0.91 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.38 2ayz h ARG 944 CO 0.07 0.35 0.07 0.87 -1.51 0.00 0.00 179.97 179.82 2ayz h LYS 945 N 0.27 0.46 -0.20 0.20 1.57 -0.76 0.29 116.57 118.38 2ayz h LYS 945 Ca 0.08 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 2ayz h LYS 945 Cb 0.11 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2ayz h LYS 945 CO -0.01 0.43 -0.33 0.77 -0.57 0.00 0.00 179.45 179.73 2ayz h SER 946 N 0.45 0.43 0.10 0.86 0.02 -0.66 -3.27 113.55 111.49 2ayz h SER 946 Ca 0.11 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 2ayz h SER 946 Cb 0.18 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.60 2ayz h SER 946 CO -0.00 0.74 -0.05 0.03 -1.14 0.00 0.00 176.83 176.41 2ayz h ARG 947 N 0.36 -0.14 -4.68 3.45 3.08 -0.38 -3.46 114.38 112.62 2ayz h ARG 947 Ca 0.04 0.01 -0.47 0.00 0.07 0.00 0.00 59.98 59.64 2ayz h ARG 947 Cb 0.76 0.03 -0.32 0.00 0.08 0.00 0.00 29.97 30.53 2ayz h ARG 947 CO 0.06 0.22 -0.80 0.16 -1.07 0.00 0.00 179.97 178.54 2ayz s ASP 948 N -5.58 1.46 0.00 7.04 -4.77 0.03 -5.11 116.67 109.75 2ayz s ASP 948 Ca -0.09 -0.23 0.22 0.00 -3.30 0.00 0.00 52.55 49.15 2ayz s ASP 948 Cb -0.00 -0.47 0.17 0.00 -1.09 0.00 0.00 42.92 41.53 2ayz s ASP 948 CO 0.32 0.07 1.19 -1.20 0.70 0.00 0.00 175.17 176.25