#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 6.28 -3.68 0.58 0.00 -1.26 -4.71 120.51 117.71 2ayz n ALA 818 Ca 0.00 -2.05 -0.27 0.00 0.00 0.00 0.00 53.44 51.12 2ayz n ALA 818 Cb 0.00 -2.20 -0.16 0.00 0.00 0.00 0.00 19.45 17.08 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 0.10 0.33 0.00 0.00 1.01 -1.26 -5.02 120.40 115.56 2ayz s VAL 819 Ca 0.62 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.07 2ayz s VAL 819 Cb 0.32 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.75 2ayz s VAL 819 CO -0.06 -0.31 0.00 -1.54 0.00 0.00 0.00 175.10 173.20 2ayz n SER 820 N 5.12 0.00 -4.55 3.32 3.41 -1.26 -5.15 113.62 114.50 2ayz n SER 820 Ca -0.08 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.24 2ayz n SER 820 Cb 0.47 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.56 2ayz n SER 820 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2ayz s ASP 821 N 1.09 3.46 0.00 4.04 -1.08 -1.26 -5.01 116.67 117.91 2ayz s ASP 821 Ca 0.00 0.69 0.00 0.00 -0.52 0.00 0.00 52.55 52.72 2ayz s ASP 821 Cb 0.00 -1.07 0.00 0.00 -1.46 0.00 0.00 42.92 40.39 2ayz s ASP 821 CO 0.00 -2.55 0.00 -3.20 0.52 0.00 0.00 175.17 169.94 2ayz n ASN 822 N -3.73 0.00 -3.50 -0.34 2.85 -1.26 -5.05 115.26 104.23 2ayz n ASN 822 Ca 0.10 0.00 -0.25 0.00 -0.11 0.00 0.00 54.58 54.32 2ayz n ASN 822 Cb 0.60 0.00 0.06 0.00 1.24 0.00 0.00 39.78 41.67 2ayz n ASN 822 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2ayz n ASP 823 N -0.10 -5.91 -3.33 1.20 2.03 -1.26 -4.83 116.55 104.35 2ayz n ASP 823 Ca 0.00 -0.89 -0.37 0.00 0.52 0.00 0.00 54.79 54.05 2ayz n ASP 823 Cb 0.00 -4.15 -0.03 0.00 -0.72 0.00 0.00 41.12 36.22 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 -2.90 7.77 -4.57 1.67 2.03 -1.26 -4.89 116.55 114.41 2ayz n ASP 824 Ca -0.08 -2.56 -0.42 0.00 0.52 0.00 0.00 54.79 52.25 2ayz n ASP 824 Cb 0.60 -1.50 -0.03 0.00 -0.72 0.00 0.00 41.12 39.48 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 2.46 3.37 -0.22 -0.67 1.75 -1.26 -4.99 119.30 119.75 2ayz s MET 825 Ca 0.64 0.08 -0.16 0.00 -1.25 0.00 0.00 55.69 55.00 2ayz s MET 825 Cb 0.17 -4.09 -0.04 0.00 2.84 0.00 0.00 34.83 33.71 2ayz s MET 825 CO -0.06 -1.88 0.40 -1.64 -0.65 0.00 0.00 175.02 171.19 2ayz s MET 826 N 5.30 4.14 -0.06 4.11 -1.94 -1.26 -2.36 119.30 127.23 2ayz s MET 826 Ca 0.41 0.19 0.04 0.00 -1.71 0.00 0.00 55.69 54.62 2ayz s MET 826 Cb -0.08 -3.56 -0.02 0.00 2.01 0.00 0.00 34.83 33.18 2ayz s MET 826 CO 0.21 -0.10 -0.19 0.42 -0.01 0.00 0.00 175.02 175.35 2ayz s ILE 827 N 1.51 2.63 -0.39 2.53 -1.09 -0.02 -2.21 121.20 124.17 2ayz s ILE 827 Ca 0.19 -0.87 -0.09 0.00 -2.23 0.00 0.00 60.65 57.65 2ayz s ILE 827 Cb -0.15 -2.01 0.05 0.00 -1.58 0.00 0.00 42.46 38.78 2ayz s ILE 827 CO 0.08 0.57 0.21 -0.22 -1.23 0.00 0.00 174.94 174.36 2ayz s LEU 828 N -0.39 4.85 -0.69 2.97 2.96 0.16 -0.85 118.68 127.69 2ayz s LEU 828 Ca 0.04 -1.28 -0.16 0.00 -0.22 0.00 0.00 54.13 52.51 2ayz s LEU 828 Cb -0.12 -1.97 0.15 0.00 0.50 0.00 0.00 46.19 44.75 2ayz s LEU 828 CO 0.02 -0.45 0.71 0.68 -1.32 0.00 0.00 176.35 175.99 2ayz s VAL 829 N 1.46 5.19 -0.07 1.68 -7.23 0.32 -1.24 120.40 120.51 2ayz s VAL 829 Ca 0.02 -1.70 -0.02 0.00 -1.81 0.00 0.00 61.98 58.47 2ayz s VAL 829 Cb -0.21 -4.47 -0.03 0.00 0.56 0.00 0.00 36.38 32.22 2ayz s VAL 829 CO 0.04 -1.06 0.03 -0.69 -0.31 0.00 0.00 175.10 173.11 2ayz s VAL 830 N 1.53 4.51 -0.06 1.32 1.01 -0.06 -2.22 120.40 126.41 2ayz s VAL 830 Ca 0.13 -0.23 -0.28 0.00 0.00 0.00 0.00 61.98 61.60 2ayz s VAL 830 Cb -0.19 -2.93 0.06 0.00 0.00 0.00 0.00 36.38 33.32 2ayz s VAL 830 CO -0.01 0.56 0.63 -0.62 0.00 0.00 0.00 175.10 175.65 2ayz s ASP 831 N -1.05 -0.60 0.18 3.32 2.15 -0.96 -0.43 116.67 119.28 2ayz s ASP 831 Ca 0.15 0.69 0.24 0.00 0.43 0.00 0.00 52.55 54.06 2ayz s ASP 831 Cb -0.11 0.59 0.30 0.00 -0.30 0.00 0.00 42.92 43.40 2ayz s ASP 831 CO 0.04 -0.55 1.33 -2.24 -0.17 0.00 0.00 175.17 173.58 2ayz h ASP 832 N 3.33 0.00 -4.32 -0.34 2.03 -1.61 -3.28 116.42 112.22 2ayz h ASP 832 Ca -0.28 -0.12 -0.65 0.00 -0.73 0.00 0.00 57.03 55.25 2ayz h ASP 832 Cb 1.15 0.00 -0.40 0.00 -0.83 0.00 0.00 39.33 39.25 2ayz h ASP 832 CO 0.36 0.06 -0.57 -1.00 -1.03 0.00 0.00 179.24 177.06 2ayz s HIS 833 N -3.21 3.24 0.33 4.15 3.76 -1.26 -4.91 115.29 117.38 2ayz s HIS 833 Ca 0.05 -3.08 0.26 0.00 -0.15 0.00 0.00 55.06 52.14 2ayz s HIS 833 Cb 0.11 -2.91 1.11 0.00 1.11 0.00 0.00 32.58 32.00 2ayz s HIS 833 CO 0.72 -0.76 1.13 -2.30 -0.85 0.00 0.00 174.74 172.67 2ayz n PRO 834 N 3.19 -0.02 -0.28 8.40 -0.02 -1.26 0.34 135.00 145.35 2ayz n PRO 834 Ca 0.06 0.89 0.03 0.00 -2.02 0.00 0.00 63.50 62.46 2ayz n PRO 834 Cb 0.33 -1.79 0.25 0.00 -0.02 0.00 0.00 33.50 32.27 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 1.10 0.00 4.25 -0.00 -1.97 -1.67 117.51 119.21 2ayz h ILE 835 Ca 0.64 -0.35 -0.18 0.00 -0.00 0.00 0.00 64.86 64.97 2ayz h ILE 835 Cb 2.16 -0.01 -0.03 0.00 -0.00 0.00 0.00 36.82 38.94 2ayz h ILE 835 CO -0.29 0.19 -1.01 -1.13 -0.00 0.00 0.00 178.15 175.91 2ayz h ASN 836 N 1.02 0.00 -0.32 2.19 -1.24 -0.54 -2.81 115.58 113.88 2ayz h ASN 836 Ca 0.36 0.00 0.06 0.00 0.71 0.00 0.00 56.30 57.42 2ayz h ASN 836 Cb 0.12 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.12 2ayz h ASN 836 CO -0.12 0.78 0.00 -0.09 -1.29 0.00 0.00 177.43 176.71 2ayz h ARG 837 N 0.00 0.10 -0.38 6.67 2.43 -1.42 0.17 114.38 121.94 2ayz h ARG 837 Ca -0.07 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.00 2ayz h ARG 837 Cb 1.66 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 31.17 2ayz h ARG 837 CO 0.09 0.06 -0.16 0.07 -1.51 0.00 0.00 179.97 178.52 2ayz h ARG 838 N 0.10 0.70 -0.28 0.20 -0.00 -1.32 -1.81 114.38 111.97 2ayz h ARG 838 Ca 0.15 -0.24 -0.11 0.00 -0.00 0.00 0.00 59.98 59.78 2ayz h ARG 838 Cb 0.20 -0.05 -0.00 0.00 -0.00 0.00 0.00 29.97 30.12 2ayz h ARG 838 CO -0.25 0.82 -0.26 1.25 -0.00 0.00 0.00 179.97 181.53 2ayz h LEU 839 N 0.62 0.70 -0.62 0.08 6.46 -1.18 0.02 115.31 121.39 2ayz h LEU 839 Ca 0.10 -0.47 -0.05 0.00 -0.12 0.00 0.00 57.88 57.35 2ayz h LEU 839 Cb 0.63 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.33 2ayz h LEU 839 CO 0.04 1.02 0.19 0.25 -0.62 0.00 0.00 178.44 179.33 2ayz h LEU 840 N 0.39 0.90 -1.04 2.25 5.85 -0.59 -1.64 115.31 121.43 2ayz h LEU 840 Ca 0.05 -0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.50 2ayz h LEU 840 Cb 0.82 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 2ayz h LEU 840 CO 0.06 0.87 -0.27 0.00 -0.34 0.00 0.00 178.44 178.76 2ayz h ALA 841 N 1.07 1.01 -0.10 1.25 0.00 -1.29 -2.19 119.26 119.01 2ayz h ALA 841 Ca 0.20 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2ayz h ALA 841 Cb 0.29 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2ayz h ALA 841 CO -0.01 0.34 0.00 -0.44 0.00 0.00 0.00 179.25 179.15 2ayz h ASP 842 N 0.00 0.17 0.14 0.00 3.32 -0.10 0.02 116.42 119.98 2ayz h ASP 842 Ca -0.00 -0.30 -0.09 0.00 0.02 0.00 0.00 57.03 56.66 2ayz h ASP 842 Cb 0.80 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 2ayz h ASP 842 CO 0.04 0.43 -0.32 1.56 -1.72 0.00 0.00 179.24 179.22 2ayz h GLN 843 N -0.09 0.27 -0.12 3.56 7.50 -1.28 -1.77 115.11 123.18 2ayz h GLN 843 Ca 0.03 -0.11 -0.07 0.00 0.50 0.00 0.00 58.65 59.01 2ayz h GLN 843 Cb 0.34 -0.01 -0.01 0.00 0.05 0.00 0.00 27.48 27.84 2ayz h GLN 843 CO 0.00 0.57 -0.22 1.25 -1.50 0.00 0.00 178.83 178.93 2ayz h LEU 844 N 0.24 0.21 -0.97 1.46 5.85 -1.21 -2.24 115.31 118.64 2ayz h LEU 844 Ca 0.03 -0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 2ayz h LEU 844 Cb 0.69 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 2ayz h LEU 844 CO 0.05 0.44 -0.11 1.23 -0.34 0.00 0.00 178.44 179.71 2ayz h GLY 845 N 0.88 0.67 1.48 3.75 0.00 -0.11 0.17 103.07 109.91 2ayz h GLY 845 Ca 0.03 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 2ayz h GLY 845 CO 0.03 0.44 0.31 1.76 0.00 0.00 0.00 176.54 179.09 2ayz h SER 846 N 0.57 0.61 0.01 0.19 0.02 -1.01 -2.63 113.55 111.31 2ayz h SER 846 Ca 0.10 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2ayz h SER 846 Cb 0.53 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.91 2ayz h SER 846 CO 0.03 0.47 -0.00 -0.07 -1.14 0.00 0.00 176.83 176.12 2ayz h LEU 847 N 0.71 -0.01 0.00 5.07 4.07 -1.00 -3.48 115.31 120.67 2ayz h LEU 847 Ca 0.19 -0.49 0.00 0.00 0.08 0.00 0.00 57.88 57.66 2ayz h LEU 847 Cb -0.03 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.71 2ayz h LEU 847 CO -0.04 0.49 0.00 0.61 -1.08 0.00 0.00 178.44 178.42 2ayz n GLY 848 N 0.25 1.06 4.01 0.83 0.00 0.50 -5.10 105.19 106.75 2ayz n GLY 848 Ca -0.08 -0.24 -0.20 0.00 0.00 0.00 0.00 46.02 45.49 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 1.86 -0.11 1.61 2.02 -1.24 -5.03 117.35 114.46 2ayz s TYR 849 Ca 0.00 -0.49 -0.29 0.00 -0.37 0.00 0.00 57.07 55.91 2ayz s TYR 849 Cb 0.00 -2.47 -0.04 0.00 -0.40 0.00 0.00 41.96 39.05 2ayz s TYR 849 CO 0.00 -1.11 1.54 -0.65 -1.57 0.00 0.00 175.55 173.76 2ayz s GLN 850 N -4.72 4.13 -0.46 -0.62 1.11 -1.00 -4.84 119.66 113.27 2ayz s GLN 850 Ca 0.61 1.96 -0.11 0.00 0.01 0.00 0.00 55.36 57.83 2ayz s GLN 850 Cb -0.07 -3.93 0.09 0.00 -1.01 0.00 0.00 33.01 28.09 2ayz s GLN 850 CO 0.39 -0.88 0.34 0.00 0.01 0.00 0.00 175.29 175.15 2ayz s LYS 852 N 1.48 3.11 0.14 0.00 2.47 -0.03 -4.95 119.74 121.96 2ayz s LYS 852 Ca 0.04 -0.87 -0.13 0.00 -1.56 0.00 0.00 55.97 53.44 2ayz s LYS 852 Cb -0.25 -3.59 -0.07 0.00 -1.46 0.00 0.00 37.83 32.46 2ayz s LYS 852 CO 0.02 -0.52 0.53 0.95 0.16 0.00 0.00 175.35 176.49 2ayz s THR 853 N 1.57 4.90 0.23 3.43 -4.23 -1.26 -0.52 115.64 119.76 2ayz s THR 853 Ca 0.03 0.74 -0.08 0.00 -1.18 0.00 0.00 61.69 61.20 2ayz s THR 853 Cb -0.18 -3.71 -0.02 0.00 1.34 0.00 0.00 72.50 69.93 2ayz s THR 853 CO 0.06 0.22 0.33 0.00 -0.54 0.00 0.00 174.62 174.69 2ayz s ALA 854 N -1.49 0.36 -0.42 3.99 0.00 -0.94 -4.94 121.76 118.32 2ayz s ALA 854 Ca 0.38 -1.23 0.07 0.00 0.00 0.00 0.00 51.96 51.18 2ayz s ALA 854 Cb -0.14 1.21 0.23 0.00 0.00 0.00 0.00 23.12 24.41 2ayz s ALA 854 CO 0.19 -0.74 0.57 0.27 0.00 0.00 0.00 175.76 176.05 2ayz n ASN 855 N -0.34 -0.75 0.00 0.00 6.94 -1.26 -2.25 115.26 117.60 2ayz n ASN 855 Ca -0.00 -2.77 0.00 0.00 -0.02 0.00 0.00 54.58 51.79 2ayz n ASN 855 Cb 0.64 -0.01 0.00 0.00 -2.36 0.00 0.00 39.78 38.05 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 1.80 0.00 -0.01 0.53 -0.08 -1.24 -4.71 116.55 112.84 2ayz n ASP 856 Ca 0.20 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.35 2ayz n ASP 856 Cb 0.54 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.91 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 0.02 2.00 0.27 0.00 -1.91 -2.84 103.07 100.61 2ayz h GLY 857 Ca 0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 47.33 47.21 2ayz h GLY 857 CO 0.00 0.01 -0.53 -0.39 0.00 0.00 0.00 176.54 175.64 2ayz h VAL 858 N -0.39 1.23 -0.37 4.60 -1.51 -1.92 -2.55 116.25 115.34 2ayz h VAL 858 Ca 0.00 -1.90 0.05 0.00 -1.23 0.00 0.00 66.70 63.62 2ayz h VAL 858 Cb 0.41 2.07 -0.02 0.00 -2.13 0.00 0.00 31.29 31.62 2ayz h VAL 858 CO 0.00 0.52 0.25 -0.78 -1.23 0.00 0.00 177.57 176.33 2ayz h ASP 859 N 0.00 0.27 -0.31 4.19 3.58 -1.88 -0.48 116.42 121.80 2ayz h ASP 859 Ca -0.01 -0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.39 2ayz h ASP 859 Cb 1.03 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.99 2ayz h ASP 859 CO 0.07 0.18 0.05 0.00 -2.88 0.00 0.00 179.24 176.66 2ayz h ALA 860 N 1.79 1.33 -0.69 -0.78 0.00 -1.20 -0.80 119.26 118.91 2ayz h ALA 860 Ca 0.16 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2ayz h ALA 860 Cb 0.24 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2ayz h ALA 860 CO -0.03 0.47 0.16 -0.07 0.00 0.00 0.00 179.25 179.77 2ayz h LEU 861 N 0.60 1.04 0.14 0.00 -0.00 -1.15 -0.04 115.31 115.89 2ayz h LEU 861 Ca 0.13 -0.22 -0.01 0.00 -0.00 0.00 0.00 57.88 57.78 2ayz h LEU 861 Cb 0.31 -0.27 0.00 0.00 -0.00 0.00 0.00 40.66 40.70 2ayz h LEU 861 CO 0.01 1.00 -0.07 -1.13 -0.00 0.00 0.00 178.44 178.25 2ayz h ASN 862 N 1.04 -0.16 0.16 -0.43 -1.24 -0.96 -1.92 115.58 112.08 2ayz h ASN 862 Ca 0.22 -0.20 -0.08 0.00 0.71 0.00 0.00 56.30 56.94 2ayz h ASN 862 Cb 0.37 0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.45 2ayz h ASN 862 CO 0.00 0.11 -0.30 1.62 -1.29 0.00 0.00 177.43 177.58 2ayz h VAL 863 N -0.44 1.26 -0.09 2.57 3.04 -1.12 -1.98 116.25 119.50 2ayz h VAL 863 Ca -0.02 -1.23 -0.10 0.00 -1.01 0.00 0.00 66.70 64.34 2ayz h VAL 863 Cb 0.35 1.50 -0.01 0.00 -2.01 0.00 0.00 31.29 31.12 2ayz h VAL 863 CO 0.03 0.37 -0.40 -0.07 -1.01 0.00 0.00 177.57 176.49 2ayz h LEU 864 N 0.20 0.19 -0.13 3.16 3.38 -0.94 0.82 115.31 122.00 2ayz h LEU 864 Ca 0.03 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2ayz h LEU 864 Cb 0.64 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 2ayz h LEU 864 CO 0.05 0.58 -0.10 0.28 0.09 0.00 0.00 178.44 179.34 2ayz h SER 865 N 0.16 0.00 0.12 -0.43 0.02 -0.79 -3.30 113.55 109.33 2ayz h SER 865 Ca 0.02 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.68 2ayz h SER 865 Cb 0.78 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.32 2ayz h SER 865 CO 0.06 0.10 -1.46 0.50 -1.14 0.00 0.00 176.83 174.89 2ayz h LYS 866 N 0.00 0.26 -3.87 3.45 1.63 -0.92 -3.48 116.57 113.64 2ayz h LYS 866 Ca -0.00 -0.45 -0.16 0.00 -0.85 0.00 0.00 60.65 59.18 2ayz h LYS 866 Cb 1.03 0.17 -0.21 0.00 -0.60 0.00 0.00 32.23 32.62 2ayz h LYS 866 CO 0.01 1.22 -0.65 1.21 -3.45 0.00 0.00 179.45 177.79 2ayz s ASN 867 N -7.06 0.19 -0.74 4.20 2.47 0.24 -5.10 114.94 109.14 2ayz s ASN 867 Ca -0.19 -0.43 -0.15 0.00 0.42 0.00 0.00 52.86 52.50 2ayz s ASN 867 Cb 0.04 0.12 0.18 0.00 -1.45 0.00 0.00 41.25 40.15 2ayz s ASN 867 CO 0.78 -0.32 0.72 -1.00 -3.72 0.00 0.00 177.10 173.56 2ayz s HIS 868 N -1.45 3.50 0.52 0.43 3.76 -1.26 -4.09 115.29 116.70 2ayz s HIS 868 Ca -0.16 -1.66 -0.14 0.00 -0.15 0.00 0.00 55.06 52.95 2ayz s HIS 868 Cb -0.09 -3.87 -0.07 0.00 1.11 0.00 0.00 32.58 29.65 2ayz s HIS 868 CO -0.00 -1.07 0.96 0.42 -0.85 0.00 0.00 174.74 174.19 2ayz s ILE 869 N 1.00 4.61 -0.04 0.60 1.09 -1.26 -5.04 121.20 122.17 2ayz s ILE 869 Ca 0.15 1.04 -0.01 0.00 -1.10 0.00 0.00 60.65 60.72 2ayz s ILE 869 Cb -0.16 -3.76 -0.00 0.00 -1.06 0.00 0.00 42.46 37.48 2ayz s ILE 869 CO -0.04 -0.77 -0.03 -0.78 -0.10 0.00 0.00 174.94 173.22 2ayz h ASP 870 N 0.69 0.00 -3.63 3.58 3.58 -1.84 -3.45 116.42 115.34 2ayz h ASP 870 Ca -0.46 0.00 -0.64 0.00 0.42 0.00 0.00 57.03 56.35 2ayz h ASP 870 Cb 1.19 0.00 -0.15 0.00 1.72 0.00 0.00 39.33 42.09 2ayz h ASP 870 CO 0.62 0.19 -0.12 -0.63 -2.88 0.00 0.00 179.24 176.42 2ayz s ILE 871 N -1.27 5.08 -0.22 2.25 -1.09 -1.08 -4.09 121.20 120.77 2ayz s ILE 871 Ca -0.02 0.41 -0.07 0.00 -2.23 0.00 0.00 60.65 58.74 2ayz s ILE 871 Cb 0.00 -3.87 -0.03 0.00 -1.58 0.00 0.00 42.46 36.98 2ayz s ILE 871 CO 0.03 -0.09 0.05 -0.69 -1.23 0.00 0.00 174.94 173.02 2ayz s VAL 872 N 2.26 4.30 -0.22 2.92 1.01 -1.08 -0.66 120.40 128.93 2ayz s VAL 872 Ca 0.17 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.98 2ayz s VAL 872 Cb -0.16 -2.98 0.04 0.00 0.00 0.00 0.00 36.38 33.29 2ayz s VAL 872 CO 0.12 0.39 -0.14 -0.76 0.00 0.00 0.00 175.10 174.71 2ayz s LEU 873 N 1.21 2.69 -0.35 3.92 1.43 -0.37 -0.71 118.68 126.50 2ayz s LEU 873 Ca 0.04 -1.01 -0.05 0.00 -1.03 0.00 0.00 54.13 52.08 2ayz s LEU 873 Cb -0.14 -1.44 0.06 0.00 0.03 0.00 0.00 46.19 44.70 2ayz s LEU 873 CO 0.03 -0.12 0.12 -0.94 0.23 0.00 0.00 176.35 175.67 2ayz s SER 874 N 1.25 5.25 -0.24 2.29 1.04 -1.02 -0.89 113.70 121.38 2ayz s SER 874 Ca -0.02 -1.40 -0.18 0.00 0.48 0.00 0.00 55.95 54.83 2ayz s SER 874 Cb -0.17 -1.84 -0.03 0.00 0.10 0.00 0.00 66.02 64.08 2ayz s SER 874 CO -0.09 -0.38 0.51 -0.62 0.98 0.00 0.00 173.24 173.64 2ayz s ASP 875 N 1.56 6.47 -0.16 7.02 2.15 0.42 -1.14 116.67 132.99 2ayz s ASP 875 Ca 0.00 0.56 0.02 0.00 0.43 0.00 0.00 52.55 53.56 2ayz s ASP 875 Cb -0.21 -2.28 0.01 0.00 -0.30 0.00 0.00 42.92 40.14 2ayz s ASP 875 CO 0.00 -0.25 -0.21 -0.69 -0.17 0.00 0.00 175.17 173.86 2ayz s VAL 876 N 2.10 2.10 -0.28 1.11 1.01 0.23 -1.69 120.40 124.98 2ayz s VAL 876 Ca 0.22 -0.95 0.20 0.00 0.00 0.00 0.00 61.98 61.46 2ayz s VAL 876 Cb -0.16 -1.86 0.12 0.00 0.00 0.00 0.00 36.38 34.48 2ayz s VAL 876 CO 0.09 0.54 1.31 -1.13 0.00 0.00 0.00 175.10 175.92 2ayz h ASN 877 N 7.63 0.00 -3.26 3.32 -1.24 -1.87 -0.12 115.58 120.04 2ayz h ASN 877 Ca -0.39 0.00 -0.55 0.00 0.71 0.00 0.00 56.30 56.07 2ayz h ASN 877 Cb 1.17 0.00 -0.37 0.00 0.73 0.00 0.00 38.32 39.84 2ayz h ASN 877 CO 0.60 0.19 -0.80 -0.32 -1.29 0.00 0.00 177.43 175.81 2ayz s MET 878 N -3.16 1.58 0.00 6.67 1.75 -1.26 -4.58 119.30 120.31 2ayz s MET 878 Ca 0.03 -0.44 0.04 0.00 -1.25 0.00 0.00 55.69 54.06 2ayz s MET 878 Cb 0.07 -1.89 0.23 0.00 2.84 0.00 0.00 34.83 36.08 2ayz s MET 878 CO 0.74 -0.35 0.84 -0.35 -0.65 0.00 0.00 175.02 175.24 2ayz n PRO 879 N 4.88 0.66 0.00 4.11 -0.04 -1.26 -3.04 135.00 140.30 2ayz n PRO 879 Ca -0.13 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.47 2ayz n PRO 879 Cb 0.49 -1.09 0.55 0.00 -0.04 0.00 0.00 33.50 33.41 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 -0.59 1.20 -1.11 3.54 5.15 -1.26 -4.90 115.26 117.28 2ayz n ASN 880 Ca 0.03 -1.29 0.00 0.00 -0.60 0.00 0.00 54.58 52.72 2ayz n ASN 880 Cb 0.01 0.02 0.00 0.00 -0.53 0.00 0.00 39.78 39.28 2ayz n ASN 880 CO 0.00 0.00 0.00 1.15 1.40 0.00 0.00 177.26 179.81 2ayz n MET 881 N -0.15 1.10 -1.95 1.20 0.00 -1.17 -5.04 117.12 111.11 2ayz n MET 881 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 57.70 57.52 2ayz n MET 881 Cb 0.32 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.50 2ayz n MET 881 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 2ayz n ASP 882 N -1.62 3.47 0.00 3.17 8.00 -1.26 -4.61 116.55 123.69 2ayz n ASP 882 Ca 0.00 -2.76 0.00 0.00 0.71 0.00 0.00 54.79 52.74 2ayz n ASP 882 Cb 0.00 -1.59 0.00 0.00 -0.02 0.00 0.00 41.12 39.51 2ayz n ASP 882 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ayz n GLY 883 N 5.24 -0.25 0.29 0.44 0.00 -1.26 -3.78 105.19 105.87 2ayz n GLY 883 Ca 0.48 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.48 2ayz n GLY 883 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2ayz h TYR 884 N 0.00 -0.57 -0.11 1.61 -0.00 -1.93 -0.66 116.97 115.32 2ayz h TYR 884 Ca 0.00 0.06 0.03 0.00 -0.00 0.00 0.00 58.73 58.83 2ayz h TYR 884 Cb 0.00 0.35 -0.00 0.00 -0.00 0.00 0.00 36.73 37.07 2ayz h TYR 884 CO 0.00 -0.33 0.10 -0.09 -0.00 0.00 0.00 178.16 177.85 2ayz h ARG 885 N -0.07 0.00 0.00 0.10 1.12 -1.85 0.31 114.38 114.00 2ayz h ARG 885 Ca 0.29 0.00 -0.06 0.00 -1.11 0.00 0.00 59.98 59.10 2ayz h ARG 885 Cb 0.52 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.47 2ayz h ARG 885 CO -0.69 0.00 -0.28 1.37 -3.11 0.00 0.00 179.97 177.26 2ayz h LEU 886 N 0.00 0.00 0.00 3.80 8.10 -1.26 0.13 115.31 126.08 2ayz h LEU 886 Ca 0.05 0.00 -0.13 0.00 0.11 0.00 0.00 57.88 57.91 2ayz h LEU 886 Cb 0.26 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.46 2ayz h LEU 886 CO -0.00 0.28 -0.62 0.74 -4.11 0.00 0.00 178.44 174.72 2ayz h THR 887 N 0.00 1.03 -0.82 0.15 2.02 -0.93 -1.51 112.91 112.84 2ayz h THR 887 Ca -0.00 -2.46 -0.04 0.00 0.77 0.00 0.00 66.41 64.68 2ayz h THR 887 Cb 0.61 2.50 -0.04 0.00 -1.74 0.00 0.00 68.15 69.48 2ayz h THR 887 CO 0.04 0.59 0.36 -0.61 0.37 0.00 0.00 175.52 176.26 2ayz h GLN 888 N 0.00 1.21 -0.39 6.66 5.75 -0.84 -0.43 115.11 127.07 2ayz h GLN 888 Ca -0.01 -0.20 -0.10 0.00 -0.15 0.00 0.00 58.65 58.19 2ayz h GLN 888 Cb 1.47 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 29.80 2ayz h GLN 888 CO 0.08 0.95 -0.17 -0.09 -2.65 0.00 0.00 178.83 176.95 2ayz h ARG 889 N 1.18 0.73 -0.49 1.69 1.12 -0.96 -2.23 114.38 115.42 2ayz h ARG 889 Ca 0.28 -0.26 -0.03 0.00 -1.11 0.00 0.00 59.98 58.86 2ayz h ARG 889 Cb 0.17 -0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 30.06 2ayz h ARG 889 CO -0.03 0.85 0.20 0.82 -3.11 0.00 0.00 179.97 178.71 2ayz h ILE 890 N 0.65 1.18 -0.44 1.20 2.04 -0.77 -0.09 117.51 121.28 2ayz h ILE 890 Ca 0.10 -0.56 -0.07 0.00 1.00 0.00 0.00 64.86 65.33 2ayz h ILE 890 Cb 0.65 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 2ayz h ILE 890 CO 0.05 0.22 -0.02 -0.09 0.00 0.00 0.00 178.15 178.31 2ayz h ARG 891 N 0.70 0.73 0.00 2.37 2.43 -0.53 0.10 114.38 120.19 2ayz h ARG 891 Ca 0.17 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2ayz h ARG 891 Cb 0.13 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 2ayz h ARG 891 CO -0.02 0.75 0.00 1.96 -1.51 0.00 0.00 179.97 181.16 2ayz h GLN 892 N 0.68 0.00 0.00 0.20 4.20 -0.79 -3.02 115.11 116.38 2ayz h GLN 892 Ca 0.13 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.69 2ayz h GLN 892 Cb 0.45 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 2ayz h GLN 892 CO 0.02 0.00 -1.22 1.25 -0.67 0.00 0.00 178.83 178.21 2ayz h LEU 893 N 0.00 0.00 -2.53 1.46 5.85 -0.28 -3.50 115.31 116.32 2ayz h LEU 893 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2ayz h LEU 893 Cb 0.79 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.82 2ayz h LEU 893 CO 0.00 0.55 0.00 0.61 -0.34 0.00 0.00 178.44 179.26 2ayz n GLY 894 N 1.36 -0.54 3.77 3.75 0.00 0.29 -5.03 105.19 108.78 2ayz n GLY 894 Ca -0.07 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.81 4.37 -0.08 0.99 2.34 -1.17 -4.94 118.68 119.38 2ayz s LEU 895 Ca 0.00 2.24 0.12 0.00 0.06 0.00 0.00 54.13 56.56 2ayz s LEU 895 Cb 0.00 -3.86 0.20 0.00 -0.56 0.00 0.00 46.19 41.97 2ayz s LEU 895 CO 0.00 -0.36 1.10 0.41 -1.06 0.00 0.00 176.35 176.44 2ayz n THR 896 N 0.61 1.18 -4.05 5.48 -1.04 -1.26 -5.07 114.28 110.13 2ayz n THR 896 Ca 0.02 -1.47 -0.08 0.00 -2.04 0.00 0.00 64.05 60.48 2ayz n THR 896 Cb 0.46 0.06 -0.09 0.00 -1.82 0.00 0.00 70.33 68.94 2ayz n THR 896 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 2ayz s LEU 897 N -1.79 2.16 -0.32 -4.42 0.05 -1.26 -5.12 118.68 107.99 2ayz s LEU 897 Ca 0.21 -0.95 -0.29 0.00 0.05 0.00 0.00 54.13 53.15 2ayz s LEU 897 Cb 0.19 0.40 -0.00 0.00 -2.05 0.00 0.00 46.19 44.73 2ayz s LEU 897 CO 0.01 -0.65 1.44 -2.84 -0.55 0.00 0.00 176.35 173.76 2ayz s PRO 898 N -3.92 3.75 -0.41 1.48 0.02 -1.26 -4.96 135.00 129.70 2ayz s PRO 898 Ca 0.09 1.27 -0.16 0.00 0.02 0.00 0.00 61.00 62.21 2ayz s PRO 898 Cb 0.07 -3.98 0.02 0.00 0.02 0.00 0.00 34.50 30.63 2ayz s PRO 898 CO -0.09 -1.34 0.34 0.08 -0.33 0.00 0.00 177.00 175.66 2ayz s VAL 899 N 5.05 5.21 -0.43 3.83 1.01 -1.06 -2.65 120.40 131.37 2ayz s VAL 899 Ca 0.63 -0.57 -0.14 0.00 0.00 0.00 0.00 61.98 61.90 2ayz s VAL 899 Cb -0.18 -3.96 0.05 0.00 0.00 0.00 0.00 36.38 32.29 2ayz s VAL 899 CO 0.28 -0.34 0.32 -0.63 0.00 0.00 0.00 175.10 174.73 2ayz s ILE 900 N 1.81 4.97 -0.64 2.22 1.01 0.12 -1.84 121.20 128.85 2ayz s ILE 900 Ca 0.07 -0.97 -0.24 0.00 0.00 0.00 0.00 60.65 59.52 2ayz s ILE 900 Cb -0.18 -3.89 0.06 0.00 0.01 0.00 0.00 42.46 38.45 2ayz s ILE 900 CO 0.11 -0.43 0.99 -0.83 0.00 0.00 0.00 174.94 174.78 2ayz s GLY 901 N 2.08 1.32 -0.15 6.18 0.00 0.12 -2.43 107.32 114.45 2ayz s GLY 901 Ca 0.04 -1.62 -0.29 0.00 0.00 0.00 0.00 44.72 42.85 2ayz s GLY 901 CO 0.07 2.13 1.22 0.14 0.00 0.00 0.00 173.10 176.66 2ayz s VAL 902 N 4.23 4.32 -0.01 1.40 1.01 -0.29 -0.86 120.40 130.20 2ayz s VAL 902 Ca 0.26 1.61 0.02 0.00 0.00 0.00 0.00 61.98 63.87 2ayz s VAL 902 Cb -0.15 -4.04 -0.00 0.00 0.00 0.00 0.00 36.38 32.19 2ayz s VAL 902 CO 0.13 -0.11 -0.07 0.42 0.00 0.00 0.00 175.10 175.47 2ayz s THR 903 N 3.20 0.58 -0.44 3.92 -4.23 0.22 -0.60 115.64 118.30 2ayz s THR 903 Ca 0.54 -0.31 -0.10 0.00 -1.18 0.00 0.00 61.69 60.63 2ayz s THR 903 Cb -0.21 -0.50 0.08 0.00 1.34 0.00 0.00 72.50 73.21 2ayz s THR 903 CO 0.15 0.17 0.30 0.00 -0.54 0.00 0.00 174.62 174.70 2ayz s ALA 904 N -0.14 3.36 -0.86 3.99 0.00 -0.06 -1.78 121.76 126.28 2ayz s ALA 904 Ca 0.02 -2.21 -0.04 0.00 0.00 0.00 0.00 51.96 49.73 2ayz s ALA 904 Cb -0.03 -2.76 -0.00 0.00 0.00 0.00 0.00 23.12 20.32 2ayz s ALA 904 CO -0.00 -1.71 0.68 -1.71 0.00 0.00 0.00 175.76 173.02 2ayz n ASN 905 N 4.97 -6.11 -0.56 0.00 2.85 -1.26 -4.46 115.26 110.69 2ayz n ASN 905 Ca -0.10 -0.63 0.09 0.00 -0.11 0.00 0.00 54.58 53.83 2ayz n ASN 905 Cb 0.43 -3.45 0.33 0.00 1.24 0.00 0.00 39.78 38.33 2ayz n ASN 905 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ayz n ALA 906 N -2.61 2.50 -2.81 5.20 0.00 -1.26 -4.54 120.51 116.99 2ayz n ALA 906 Ca -0.15 -0.53 -0.05 0.00 0.00 0.00 0.00 53.44 52.70 2ayz n ALA 906 Cb 0.60 -1.07 0.01 0.00 0.00 0.00 0.00 19.45 18.99 2ayz n ALA 906 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ayz n LEU 907 N 0.34 -7.94 -2.80 0.00 4.77 -1.26 -4.25 117.00 105.86 2ayz n LEU 907 Ca 0.15 0.85 -0.12 0.00 -0.03 0.00 0.00 56.01 56.86 2ayz n LEU 907 Cb 0.32 -3.37 0.06 0.00 -2.33 0.00 0.00 43.42 38.10 2ayz n LEU 907 CO 0.12 -2.65 0.07 0.00 -1.33 0.00 0.00 177.39 173.60 2ayz n ALA 908 N 0.05 -1.61 0.28 -1.18 0.00 -1.26 -4.87 120.51 111.93 2ayz n ALA 908 Ca 0.08 -0.01 0.18 0.00 0.00 0.00 0.00 53.44 53.69 2ayz n ALA 908 Cb 0.30 -2.50 0.95 0.00 0.00 0.00 0.00 19.45 18.21 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 -1.27 0.00 -0.23 0.00 9.09 -1.98 -0.05 114.58 120.14 2ayz h GLU 909 Ca -0.44 0.00 0.02 0.00 0.05 0.00 0.00 59.36 58.99 2ayz h GLU 909 Cb 1.25 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.33 2ayz h GLU 909 CO 0.36 0.00 0.11 0.93 0.05 0.00 0.00 179.01 180.46 2ayz h GLU 910 N 0.00 0.22 -0.28 1.06 4.39 -1.95 -0.07 114.58 117.95 2ayz h GLU 910 Ca 0.04 -0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.59 2ayz h GLU 910 Cb 0.33 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 2ayz h GLU 910 CO -0.00 0.15 -0.37 -0.22 -1.16 0.00 0.00 179.01 177.40 2ayz h LYS 911 N 0.23 0.65 -0.70 2.33 3.64 -1.37 -2.60 116.57 118.74 2ayz h LYS 911 Ca 0.10 -0.32 -0.06 0.00 -1.27 0.00 0.00 60.65 59.09 2ayz h LYS 911 Cb 0.04 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 2ayz h LYS 911 CO -0.07 0.92 0.20 1.96 -2.27 0.00 0.00 179.45 180.19 2ayz h GLN 912 N 0.54 1.10 -0.99 1.90 7.50 -1.21 0.58 115.11 124.53 2ayz h GLN 912 Ca 0.05 -0.25 0.01 0.00 0.50 0.00 0.00 58.65 58.96 2ayz h GLN 912 Cb 0.89 -0.15 -0.05 0.00 0.05 0.00 0.00 27.48 28.21 2ayz h GLN 912 CO 0.08 0.96 0.66 -0.09 -1.50 0.00 0.00 178.83 178.94 2ayz h ARG 913 N 1.04 1.30 -0.04 1.46 2.43 -0.83 0.17 114.38 119.92 2ayz h ARG 913 Ca 0.22 -0.08 -0.16 0.00 -0.81 0.00 0.00 59.98 59.16 2ayz h ARG 913 Cb 0.33 -0.29 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2ayz h ARG 913 CO -0.00 0.86 -0.67 0.00 -1.51 0.00 0.00 179.97 178.65 2ayz h LEU 915 N 0.14 0.24 -0.25 0.00 3.38 -0.27 -3.19 115.31 115.36 2ayz h LEU 915 Ca -0.01 -0.52 -0.08 0.00 0.09 0.00 0.00 57.88 57.35 2ayz h LEU 915 Cb 1.21 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 2ayz h LEU 915 CO 0.10 0.72 -0.38 -0.33 0.09 0.00 0.00 178.44 178.64 2ayz h GLU 916 N -0.23 0.00 -6.27 1.13 4.39 -1.03 -3.48 114.58 109.09 2ayz h GLU 916 Ca 0.01 0.00 -0.45 0.00 0.34 0.00 0.00 59.36 59.26 2ayz h GLU 916 Cb 0.66 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.33 2ayz h GLU 916 CO 0.03 0.38 -0.87 0.43 -1.16 0.00 0.00 179.01 177.82 2ayz n SER 917 N -3.25 -1.19 -0.98 1.42 7.64 0.19 -3.52 113.62 113.93 2ayz n SER 917 Ca 0.02 -0.92 -0.00 0.00 1.01 0.00 0.00 58.87 58.98 2ayz n SER 917 Cb 0.64 -3.58 -0.01 0.00 -1.01 0.00 0.00 64.21 60.25 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 -1.76 0.76 0.00 0.23 0.00 -1.17 -4.48 105.19 98.78 2ayz n GLY 918 Ca -0.29 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2ayz n GLY 918 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2ayz n MET 919 N 0.17 0.00 0.00 1.61 1.56 -1.26 -4.58 117.12 114.62 2ayz n MET 919 Ca -0.05 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.38 2ayz n MET 919 Cb 0.82 0.00 0.00 0.00 2.15 0.00 0.00 33.22 36.19 2ayz n MET 919 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 2ayz n ASP 920 N 0.00 0.00 -3.91 6.12 -0.08 -0.77 -2.56 116.55 115.36 2ayz n ASP 920 Ca 0.00 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.19 2ayz n ASP 920 Cb 0.00 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.39 2ayz n ASP 920 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2ayz s SER 921 N 0.00 0.03 -0.01 1.67 1.04 -1.09 -5.02 113.70 110.33 2ayz s SER 921 Ca 0.00 -0.77 0.04 0.00 0.48 0.00 0.00 55.95 55.70 2ayz s SER 921 Cb 0.00 0.42 -0.01 0.00 0.10 0.00 0.00 66.02 66.53 2ayz s SER 921 CO 0.00 -0.86 -0.15 0.00 0.98 0.00 0.00 173.24 173.21 2ayz n LEU 923 N 2.72 0.00 -4.63 0.00 4.77 -0.04 -4.92 117.00 114.90 2ayz n LEU 923 Ca -0.14 -1.70 -0.29 0.00 -0.03 0.00 0.00 56.01 53.85 2ayz n LEU 923 Cb 0.55 0.28 -0.09 0.00 -2.33 0.00 0.00 43.42 41.83 2ayz n LEU 923 CO 0.24 -0.25 -0.37 -0.44 -1.33 0.00 0.00 177.39 175.24 2ayz s SER 924 N -2.46 4.66 0.29 -1.43 0.01 -1.26 -0.61 113.70 112.91 2ayz s SER 924 Ca 0.03 -0.33 0.04 0.00 1.31 0.00 0.00 55.95 56.99 2ayz s SER 924 Cb 0.00 -0.98 0.74 0.00 0.21 0.00 0.00 66.02 65.99 2ayz s SER 924 CO 0.02 0.15 1.70 0.50 0.41 0.00 0.00 173.24 176.02 2ayz h LYS 925 N 3.32 0.40 -3.89 12.44 3.64 -1.65 -3.14 116.57 127.69 2ayz h LYS 925 Ca -0.48 -0.02 -0.24 0.00 -1.27 0.00 0.00 60.65 58.64 2ayz h LYS 925 Cb 1.18 -0.09 0.02 0.00 -0.41 0.00 0.00 32.23 32.93 2ayz h LYS 925 CO 0.56 0.26 1.75 -0.35 -2.27 0.00 0.00 179.45 179.40 2ayz n PRO 926 N -5.04 0.92 -2.46 1.90 -0.04 -1.26 -4.80 135.00 124.22 2ayz n PRO 926 Ca 0.22 -1.00 -0.39 0.00 -0.04 0.00 0.00 63.50 62.29 2ayz n PRO 926 Cb 0.66 -2.28 -0.02 0.00 -0.04 0.00 0.00 33.50 31.83 2ayz n PRO 926 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2ayz s VAL 927 N 4.53 3.96 0.76 0.52 1.01 -1.19 -4.82 120.40 125.18 2ayz s VAL 927 Ca 0.25 -1.55 -0.13 0.00 0.00 0.00 0.00 61.98 60.54 2ayz s VAL 927 Cb 0.06 -5.02 0.18 0.00 0.00 0.00 0.00 36.38 31.60 2ayz s VAL 927 CO 0.02 -1.78 0.85 0.35 0.00 0.00 0.00 175.10 174.54 2ayz n THR 928 N 6.78 0.00 0.25 3.92 -2.24 -1.26 -4.61 114.28 117.11 2ayz n THR 928 Ca 0.46 -0.52 0.07 0.00 -2.27 0.00 0.00 64.05 61.80 2ayz n THR 928 Cb 0.47 -1.42 0.60 0.00 -2.10 0.00 0.00 70.33 67.87 2ayz n THR 928 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2ayz h LEU 929 N 0.00 0.00 0.52 3.22 7.12 -1.98 0.10 115.31 124.29 2ayz h LEU 929 Ca -0.29 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.69 2ayz h LEU 929 Cb 0.85 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.98 2ayz h LEU 929 CO 0.20 0.06 -0.25 -0.78 -0.13 0.00 0.00 178.44 177.54 2ayz h ASP 930 N 0.00 -0.59 -0.71 1.25 3.58 -1.96 -2.41 116.42 115.57 2ayz h ASP 930 Ca -0.00 0.02 0.03 0.00 0.42 0.00 0.00 57.03 57.50 2ayz h ASP 930 Cb 0.11 0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.27 2ayz h ASP 930 CO 0.01 -0.25 0.45 0.58 -2.88 0.00 0.00 179.24 177.15 2ayz h VAL 931 N -1.05 1.10 -0.12 2.25 2.07 -1.83 -2.54 116.25 116.13 2ayz h VAL 931 Ca -0.07 -0.30 -0.10 0.00 0.82 0.00 0.00 66.70 67.05 2ayz h VAL 931 Cb 0.54 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 2ayz h VAL 931 CO 0.12 0.16 -0.37 -0.29 0.02 0.00 0.00 177.57 177.20 2ayz h ILE 932 N 0.88 1.29 0.00 4.57 2.10 -0.89 -2.70 117.51 122.76 2ayz h ILE 932 Ca 0.29 -1.44 -0.14 0.00 1.08 0.00 0.00 64.86 64.65 2ayz h ILE 932 Cb 0.01 1.62 0.01 0.00 -1.09 0.00 0.00 36.82 37.37 2ayz h ILE 932 CO -0.11 0.43 -0.55 0.11 -1.08 0.00 0.00 178.15 176.96 2ayz h LYS 933 N 0.22 0.36 -0.68 2.19 1.79 -1.02 0.58 116.57 120.01 2ayz h LYS 933 Ca 0.02 -0.40 -0.00 0.00 -2.18 0.00 0.00 60.65 58.09 2ayz h LYS 933 Cb 0.77 0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 31.50 2ayz h LYS 933 CO 0.06 1.08 0.41 -0.56 -1.08 0.00 0.00 179.45 179.36 2ayz h GLN 934 N -0.19 0.92 0.01 3.15 3.07 -1.51 -0.63 115.11 119.94 2ayz h GLN 934 Ca -0.07 -0.08 -0.00 0.00 0.09 0.00 0.00 58.65 58.59 2ayz h GLN 934 Cb 1.27 -0.19 0.00 0.00 0.08 0.00 0.00 27.48 28.64 2ayz h GLN 934 CO 0.11 0.65 -0.01 1.15 0.09 0.00 0.00 178.83 180.83 2ayz h THR 935 N 0.92 1.28 0.03 1.86 2.02 -1.50 -2.74 112.91 114.78 2ayz h THR 935 Ca 0.24 -0.89 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 2ayz h THR 935 Cb -0.03 1.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.26 2ayz h THR 935 CO -0.05 0.23 -0.01 -0.07 0.37 0.00 0.00 175.52 175.99 2ayz h LEU 936 N -0.40 -0.03 -0.52 2.58 -0.00 -0.74 -1.34 115.31 114.85 2ayz h LEU 936 Ca -0.00 -0.08 -0.01 0.00 -0.00 0.00 0.00 57.88 57.79 2ayz h LEU 936 Cb 0.39 0.01 -0.02 0.00 -0.00 0.00 0.00 40.66 41.03 2ayz h LEU 936 CO 0.00 0.06 0.28 0.74 -0.00 0.00 0.00 178.44 179.52 2ayz h THR 937 N -0.12 1.18 -0.25 0.22 2.02 -1.21 0.10 112.91 114.85 2ayz h THR 937 Ca -0.00 -0.47 -0.13 0.00 0.77 0.00 0.00 66.41 66.58 2ayz h THR 937 Cb 0.11 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2ayz h THR 937 CO 0.01 0.19 -0.40 0.25 0.37 0.00 0.00 175.52 175.94 2ayz h LEU 938 N 0.70 0.62 0.05 2.58 5.85 -1.38 -2.71 115.31 121.01 2ayz h LEU 938 Ca 0.18 -0.27 -0.25 0.00 0.84 0.00 0.00 57.88 58.39 2ayz h LEU 938 Cb 0.06 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2ayz h LEU 938 CO -0.03 0.95 -1.18 1.88 -0.34 0.00 0.00 178.44 179.71 2ayz h TYR 939 N 0.48 0.21 -0.51 1.25 0.05 -1.02 -2.26 116.97 115.17 2ayz h TYR 939 Ca 0.04 -0.15 -0.03 0.00 0.05 0.00 0.00 58.73 58.64 2ayz h TYR 939 Cb 0.90 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.61 2ayz h TYR 939 CO 0.04 1.13 0.19 0.00 -1.05 0.00 0.00 178.16 178.46 2ayz h ALA 940 N 0.81 0.66 -0.11 3.88 0.00 -0.76 -0.19 119.26 123.56 2ayz h ALA 940 Ca -0.09 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.50 2ayz h ALA 940 Cb 1.88 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 2ayz h ALA 940 CO 0.15 0.29 -0.59 1.05 0.00 0.00 0.00 179.25 180.15 2ayz h GLU 941 N 0.68 0.35 -0.46 0.00 -0.00 -1.55 -2.49 114.58 111.11 2ayz h GLU 941 Ca 0.17 -0.24 -0.06 0.00 -0.00 0.00 0.00 59.36 59.23 2ayz h GLU 941 Cb 0.23 0.03 -0.02 0.00 -0.00 0.00 0.00 28.75 28.99 2ayz h GLU 941 CO -0.01 0.84 0.05 0.07 -0.00 0.00 0.00 179.01 179.96 2ayz h ARG 942 N 0.27 0.79 -0.01 1.06 0.11 -0.97 0.23 114.38 115.84 2ayz h ARG 942 Ca -0.00 -0.23 -0.14 0.00 0.10 0.00 0.00 59.98 59.71 2ayz h ARG 942 Cb 1.11 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 32.09 2ayz h ARG 942 CO 0.10 0.82 -0.64 -0.39 0.10 0.00 0.00 179.97 179.96 2ayz h VAL 943 N 0.65 1.45 -0.23 0.08 -1.51 -1.06 -1.17 116.25 114.46 2ayz h VAL 943 Ca 0.14 -2.16 -0.11 0.00 -1.23 0.00 0.00 66.70 63.34 2ayz h VAL 943 Cb 0.43 2.15 -0.00 0.00 -2.13 0.00 0.00 31.29 31.74 2ayz h VAL 943 CO 0.01 0.62 -0.27 0.03 -1.23 0.00 0.00 177.57 176.74 2ayz h ARG 944 N 0.04 0.58 -0.06 5.19 3.08 -1.15 -1.31 114.38 120.75 2ayz h ARG 944 Ca -0.01 -0.32 -0.17 0.00 0.07 0.00 0.00 59.98 59.55 2ayz h ARG 944 Cb 1.14 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.20 2ayz h ARG 944 CO 0.09 0.92 -0.71 1.57 -1.07 0.00 0.00 179.97 180.78 2ayz h LYS 945 N 0.28 0.31 0.00 0.04 2.10 -0.91 -0.10 116.57 118.30 2ayz h LYS 945 Ca 0.03 -0.25 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 2ayz h LYS 945 Cb 0.84 0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.22 2ayz h LYS 945 CO 0.06 0.90 0.00 0.77 -2.00 0.00 0.00 179.45 179.18 2ayz h SER 946 N 0.22 0.00 0.00 7.07 0.02 -1.22 -3.26 113.55 116.37 2ayz h SER 946 Ca -0.02 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 2ayz h SER 946 Cb 1.26 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.80 2ayz h SER 946 CO 0.11 0.00 -0.29 -0.09 -1.14 0.00 0.00 176.83 175.42 2ayz h ARG 947 N 0.00 0.00 -5.34 3.45 9.65 -0.90 -3.50 114.38 117.73 2ayz h ARG 947 Ca 0.00 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 2ayz h ARG 947 Cb 0.65 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.23 2ayz h ARG 947 CO 0.00 0.33 -0.81 -3.47 2.80 0.00 0.00 179.97 178.83 2ayz n ASP 948 N -4.66 -7.81 0.00 -3.80 -0.08 -0.08 -5.09 116.55 95.03 2ayz n ASP 948 Ca -0.08 0.93 0.00 0.00 -1.51 0.00 0.00 54.79 54.13 2ayz n ASP 948 Cb 0.25 -4.97 0.00 0.00 2.34 0.00 0.00 41.12 38.75 2ayz n ASP 948 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12