#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 4.57 0.04 7.82 0.00 -1.26 -4.65 120.51 127.02 2ayz n ALA 818 Ca 0.00 -4.78 0.02 0.00 0.00 0.00 0.00 53.44 48.68 2ayz n ALA 818 Cb 0.00 -1.63 0.04 0.00 0.00 0.00 0.00 19.45 17.86 2ayz n ALA 818 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2ayz n VAL 819 N 1.17 0.55 -2.63 0.00 0.31 -1.26 -4.92 118.33 111.54 2ayz n VAL 819 Ca 0.28 -0.77 -0.42 0.00 -0.01 0.00 0.00 64.34 63.42 2ayz n VAL 819 Cb 0.37 0.76 -0.03 0.00 -0.91 0.00 0.00 33.84 34.03 2ayz n VAL 819 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2ayz s SER 820 N -0.69 6.44 -0.29 4.52 1.04 -1.26 -4.89 113.70 118.57 2ayz s SER 820 Ca 0.06 -1.33 -0.15 0.00 0.48 0.00 0.00 55.95 55.01 2ayz s SER 820 Cb 0.04 -2.53 0.15 0.00 0.10 0.00 0.00 66.02 63.77 2ayz s SER 820 CO 0.05 -1.50 0.93 -0.62 0.98 0.00 0.00 173.24 173.07 2ayz s ASP 821 N 4.48 -0.63 -0.34 7.02 2.15 -1.26 -5.05 116.67 123.03 2ayz s ASP 821 Ca 0.41 0.94 0.04 0.00 0.43 0.00 0.00 52.55 54.36 2ayz s ASP 821 Cb -0.03 1.51 0.26 0.00 -0.30 0.00 0.00 42.92 44.36 2ayz s ASP 821 CO -0.04 -0.14 1.28 -3.20 -0.17 0.00 0.00 175.17 172.90 2ayz n ASN 822 N 4.43 -1.32 -1.64 -0.34 2.85 -1.26 -4.99 115.26 112.98 2ayz n ASN 822 Ca -0.14 -1.97 -0.05 0.00 -0.11 0.00 0.00 54.58 52.31 2ayz n ASN 822 Cb 0.55 1.17 -0.02 0.00 1.24 0.00 0.00 39.78 42.72 2ayz n ASN 822 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 2ayz n ASP 823 N 0.16 5.52 -2.12 1.20 5.68 -1.26 -4.64 116.55 121.10 2ayz n ASP 823 Ca -0.11 -2.53 -0.17 0.00 -0.50 0.00 0.00 54.79 51.48 2ayz n ASP 823 Cb 0.73 -1.16 -0.09 0.00 -1.14 0.00 0.00 41.12 39.46 2ayz n ASP 823 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2ayz n ASP 824 N 1.45 5.85 -4.45 -1.12 2.03 -1.26 -4.81 116.55 114.23 2ayz n ASP 824 Ca 0.11 -2.81 -0.44 0.00 0.52 0.00 0.00 54.79 52.17 2ayz n ASP 824 Cb 0.57 -1.28 -0.03 0.00 -0.72 0.00 0.00 41.12 39.66 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 -0.44 3.51 -0.25 -0.67 1.75 -1.26 -4.88 119.30 117.06 2ayz s MET 825 Ca 0.53 -1.58 -0.10 0.00 -1.25 0.00 0.00 55.69 53.29 2ayz s MET 825 Cb 0.30 -4.81 -0.04 0.00 2.84 0.00 0.00 34.83 33.11 2ayz s MET 825 CO -0.08 -1.79 0.14 0.00 -0.65 0.00 0.00 175.02 172.63 2ayz s MET 826 N 2.98 3.92 -0.04 4.11 0.23 -1.26 -1.69 119.30 127.55 2ayz s MET 826 Ca 0.31 -0.35 0.01 0.00 -1.03 0.00 0.00 55.69 54.64 2ayz s MET 826 Cb -0.07 -3.49 -0.03 0.00 -1.53 0.00 0.00 34.83 29.71 2ayz s MET 826 CO -0.06 -0.06 -0.05 0.42 -2.03 0.00 0.00 175.02 173.23 2ayz s ILE 827 N 1.36 3.79 -0.40 3.16 -1.09 0.21 -0.96 121.20 127.27 2ayz s ILE 827 Ca 0.06 -0.57 -0.18 0.00 -2.23 0.00 0.00 60.65 57.73 2ayz s ILE 827 Cb -0.15 -2.60 0.01 0.00 -1.58 0.00 0.00 42.46 38.15 2ayz s ILE 827 CO 0.06 0.51 0.50 -0.76 -1.23 0.00 0.00 174.94 174.02 2ayz s LEU 828 N -1.10 4.60 -0.50 2.97 1.43 0.01 -0.89 118.68 125.20 2ayz s LEU 828 Ca 0.15 -0.39 -0.17 0.00 -1.03 0.00 0.00 54.13 52.69 2ayz s LEU 828 Cb -0.11 -2.52 0.08 0.00 0.03 0.00 0.00 46.19 43.67 2ayz s LEU 828 CO 0.04 -0.58 0.50 0.54 0.23 0.00 0.00 176.35 177.08 2ayz s VAL 829 N 2.37 5.10 -0.53 -1.59 0.11 0.13 -0.75 120.40 125.23 2ayz s VAL 829 Ca 0.16 -0.95 0.04 0.00 -2.93 0.00 0.00 61.98 58.30 2ayz s VAL 829 Cb -0.16 -4.23 0.13 0.00 -1.53 0.00 0.00 36.38 30.59 2ayz s VAL 829 CO 0.15 -0.72 0.27 -0.69 -3.33 0.00 0.00 175.10 170.77 2ayz s VAL 830 N 1.99 2.62 -0.11 2.04 1.01 -0.83 -0.98 120.40 126.15 2ayz s VAL 830 Ca 0.08 -3.35 -0.00 0.00 0.00 0.00 0.00 61.98 58.71 2ayz s VAL 830 Cb -0.24 -2.82 -0.02 0.00 0.00 0.00 0.00 36.38 33.30 2ayz s VAL 830 CO 0.08 -0.81 -0.09 -0.62 0.00 0.00 0.00 175.10 173.66 2ayz s ASP 831 N -0.31 4.38 0.35 3.32 -1.08 -0.90 -0.27 116.67 122.16 2ayz s ASP 831 Ca 0.17 -0.17 0.12 0.00 -0.52 0.00 0.00 52.55 52.15 2ayz s ASP 831 Cb -0.25 -1.40 0.63 0.00 -1.46 0.00 0.00 42.92 40.44 2ayz s ASP 831 CO -0.00 0.25 1.77 -0.78 0.52 0.00 0.00 175.17 176.93 2ayz h ASP 832 N 6.07 0.00 -3.53 -0.34 3.58 -1.76 -3.39 116.42 117.05 2ayz h ASP 832 Ca -0.37 0.00 -0.64 0.00 0.42 0.00 0.00 57.03 56.44 2ayz h ASP 832 Cb 1.19 0.00 -0.22 0.00 1.72 0.00 0.00 39.33 42.02 2ayz h ASP 832 CO 0.56 0.43 -0.63 -1.00 -2.88 0.00 0.00 179.24 175.72 2ayz s HIS 833 N -4.02 3.09 0.31 0.28 3.76 -1.26 -4.99 115.29 112.46 2ayz s HIS 833 Ca -0.02 -0.37 0.08 0.00 -0.15 0.00 0.00 55.06 54.60 2ayz s HIS 833 Cb 0.14 -2.17 0.87 0.00 1.11 0.00 0.00 32.58 32.53 2ayz s HIS 833 CO 0.73 -0.26 1.71 -1.35 -0.85 0.00 0.00 174.74 174.72 2ayz h PRO 834 N 7.80 0.47 -0.27 8.40 0.11 -1.99 -0.88 132.00 145.64 2ayz h PRO 834 Ca -0.37 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.70 2ayz h PRO 834 Cb 1.18 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2ayz h PRO 834 CO 0.60 0.31 0.15 0.97 -0.21 0.00 0.00 178.00 179.82 2ayz h ILE 835 N 0.48 1.12 0.00 4.15 6.09 -1.96 -2.13 117.51 125.26 2ayz h ILE 835 Ca 0.63 -0.30 -0.05 0.00 -1.37 0.00 0.00 64.86 63.77 2ayz h ILE 835 Cb 1.24 0.83 -0.01 0.00 0.47 0.00 0.00 36.82 39.35 2ayz h ILE 835 CO -0.51 0.12 -0.46 0.78 -3.07 0.00 0.00 178.15 175.00 2ayz h ASN 836 N 0.33 0.00 0.17 2.19 2.35 -1.81 -2.84 115.58 115.96 2ayz h ASN 836 Ca 0.10 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2ayz h ASN 836 Cb 0.05 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2ayz h ASN 836 CO -0.02 0.22 -0.12 -0.09 -1.65 0.00 0.00 177.43 175.78 2ayz h ARG 837 N 0.00 -0.27 -0.11 0.81 2.43 -0.79 0.24 114.38 116.68 2ayz h ARG 837 Ca -0.02 0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.05 2ayz h ARG 837 Cb 1.18 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 2ayz h ARG 837 CO 0.03 -0.18 -0.46 0.07 -1.51 0.00 0.00 179.97 177.91 2ayz h ARG 838 N -0.28 0.28 -0.33 0.20 -0.00 -1.44 -1.20 114.38 111.60 2ayz h ARG 838 Ca -0.01 -0.15 -0.16 0.00 -0.00 0.00 0.00 59.98 59.66 2ayz h ARG 838 Cb 0.25 0.01 -0.01 0.00 -0.00 0.00 0.00 29.97 30.22 2ayz h ARG 838 CO 0.00 0.69 -0.43 -0.07 -0.00 0.00 0.00 179.97 180.16 2ayz h LEU 839 N 0.23 0.89 -0.46 0.08 4.07 -1.28 0.22 115.31 119.06 2ayz h LEU 839 Ca 0.01 -0.42 -0.17 0.00 0.08 0.00 0.00 57.88 57.39 2ayz h LEU 839 Cb 0.91 -0.25 -0.00 0.00 1.08 0.00 0.00 40.66 42.39 2ayz h LEU 839 CO 0.07 1.19 -0.52 0.25 -1.08 0.00 0.00 178.44 178.35 2ayz h LEU 840 N 0.67 0.76 -1.12 1.67 5.85 -0.41 0.00 115.31 122.72 2ayz h LEU 840 Ca 0.05 -0.39 -0.09 0.00 0.84 0.00 0.00 57.88 58.29 2ayz h LEU 840 Cb 1.00 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 2ayz h LEU 840 CO 0.10 1.14 -0.34 0.00 -0.34 0.00 0.00 178.44 178.99 2ayz h ALA 841 N 0.88 1.27 -0.26 1.25 0.00 -1.13 -0.52 119.26 120.74 2ayz h ALA 841 Ca 0.02 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 2ayz h ALA 841 Cb 1.08 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2ayz h ALA 841 CO 0.11 0.51 -0.03 0.22 0.00 0.00 0.00 179.25 180.06 2ayz h ASP 842 N 0.15 0.48 -0.38 0.00 1.82 -0.55 0.35 116.42 118.29 2ayz h ASP 842 Ca 0.02 -0.34 0.04 0.00 -0.39 0.00 0.00 57.03 56.36 2ayz h ASP 842 Cb 0.68 -0.13 -0.04 0.00 0.68 0.00 0.00 39.33 40.52 2ayz h ASP 842 CO 0.05 0.70 0.17 -0.61 -1.61 0.00 0.00 179.24 177.94 2ayz h GLN 843 N 0.25 0.33 -0.77 0.28 4.15 -0.71 0.28 115.11 118.93 2ayz h GLN 843 Ca 0.07 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.45 2ayz h GLN 843 Cb 0.47 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 28.05 2ayz h GLN 843 CO 0.02 0.22 0.38 1.25 -1.93 0.00 0.00 178.83 178.77 2ayz h LEU 844 N 0.35 0.99 -1.43 -2.39 5.85 -0.99 -1.69 115.31 115.99 2ayz h LEU 844 Ca 0.17 -0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 2ayz h LEU 844 Cb 0.11 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 2ayz h LEU 844 CO -0.14 0.83 -0.24 1.23 -0.34 0.00 0.00 178.44 179.78 2ayz h GLY 845 N 1.07 0.07 2.00 3.75 0.00 -0.44 -1.45 103.07 108.06 2ayz h GLY 845 Ca 0.26 -0.04 -0.06 0.00 0.00 0.00 0.00 47.33 47.49 2ayz h GLY 845 CO -0.04 0.04 -0.30 1.76 0.00 0.00 0.00 176.54 178.00 2ayz h SER 846 N 0.06 0.00 -0.12 0.19 0.02 -0.08 -2.83 113.55 110.78 2ayz h SER 846 Ca 0.01 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.74 2ayz h SER 846 Cb 0.47 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.02 2ayz h SER 846 CO 0.03 0.30 -0.77 -0.07 -1.14 0.00 0.00 176.83 175.18 2ayz h LEU 847 N 0.00 0.89 0.00 5.07 3.38 -0.55 -3.48 115.31 120.62 2ayz h LEU 847 Ca -0.00 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.32 2ayz h LEU 847 Cb 0.81 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2ayz h LEU 847 CO 0.04 1.40 0.00 0.61 0.09 0.00 0.00 178.44 180.58 2ayz n GLY 848 N 0.77 1.24 3.81 0.83 0.00 -0.77 -5.11 105.19 105.96 2ayz n GLY 848 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 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 3.17 0.21 1.61 2.02 -1.17 -5.05 117.35 116.14 2ayz s TYR 849 Ca 0.00 -0.03 -0.31 0.00 -0.37 0.00 0.00 57.07 56.36 2ayz s TYR 849 Cb 0.00 -1.50 -0.10 0.00 -0.40 0.00 0.00 41.96 39.96 2ayz s TYR 849 CO 0.00 0.52 1.54 -1.14 -1.57 0.00 0.00 175.55 174.90 2ayz s GLN 850 N -3.27 4.21 -0.39 -0.62 2.00 -0.68 -4.40 119.66 116.52 2ayz s GLN 850 Ca 0.32 2.38 -0.03 0.00 -2.00 0.00 0.00 55.36 56.03 2ayz s GLN 850 Cb -0.10 -3.12 0.10 0.00 0.80 0.00 0.00 33.01 30.69 2ayz s GLN 850 CO 0.24 -0.56 0.17 0.00 -0.50 0.00 0.00 175.29 174.64 2ayz s LYS 852 N 1.17 3.42 -0.15 0.00 3.01 -0.07 -4.90 119.74 122.23 2ayz s LYS 852 Ca 0.06 -0.15 -0.20 0.00 -1.01 0.00 0.00 55.97 54.67 2ayz s LYS 852 Cb -0.22 -3.92 -0.03 0.00 -1.01 0.00 0.00 37.83 32.65 2ayz s LYS 852 CO -0.03 -1.01 0.58 0.95 0.51 0.00 0.00 175.35 176.34 2ayz s THR 853 N 3.04 5.09 0.32 2.17 -4.23 -1.26 -0.70 115.64 120.07 2ayz s THR 853 Ca 0.27 1.12 0.03 0.00 -1.18 0.00 0.00 61.69 61.93 2ayz s THR 853 Cb -0.13 -3.91 -0.02 0.00 1.34 0.00 0.00 72.50 69.78 2ayz s THR 853 CO 0.20 0.21 0.32 0.00 -0.54 0.00 0.00 174.62 174.82 2ayz s ALA 854 N 1.26 1.40 -0.47 3.99 0.00 -0.15 -4.98 121.76 122.81 2ayz s ALA 854 Ca 0.29 -1.84 0.06 0.00 0.00 0.00 0.00 51.96 50.47 2ayz s ALA 854 Cb -0.16 1.36 0.22 0.00 0.00 0.00 0.00 23.12 24.54 2ayz s ALA 854 CO 0.12 -0.70 0.70 -1.71 0.00 0.00 0.00 175.76 174.17 2ayz n ASN 855 N -1.32 -2.19 0.00 0.00 5.15 -1.26 -2.11 115.26 113.53 2ayz n ASN 855 Ca 0.05 -2.96 0.00 0.00 -0.60 0.00 0.00 54.58 51.07 2ayz n ASN 855 Cb 0.63 1.05 0.00 0.00 -0.53 0.00 0.00 39.78 40.92 2ayz n ASN 855 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2ayz n ASP 856 N 2.13 0.00 -0.21 1.20 2.03 -1.26 -4.88 116.55 115.55 2ayz n ASP 856 Ca 0.17 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.39 2ayz n ASP 856 Cb 0.57 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 41.00 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 1.11 1.87 0.27 0.00 -1.93 -1.23 103.07 103.16 2ayz h GLY 857 Ca 0.00 -0.77 -0.15 0.00 0.00 0.00 0.00 47.33 46.41 2ayz h GLY 857 CO 0.00 0.71 -0.69 -2.08 0.00 0.00 0.00 176.54 174.48 2ayz h VAL 858 N 0.93 1.45 -0.89 4.60 2.07 -1.96 -2.82 116.25 119.63 2ayz h VAL 858 Ca 0.18 -2.25 -0.00 0.00 0.82 0.00 0.00 66.70 65.45 2ayz h VAL 858 Cb 0.48 2.20 -0.04 0.00 -1.52 0.00 0.00 31.29 32.41 2ayz h VAL 858 CO 0.02 0.65 0.55 -0.78 0.02 0.00 0.00 177.57 178.04 2ayz h ASP 859 N 0.09 1.06 -0.55 0.57 3.58 -1.82 0.44 116.42 119.79 2ayz h ASP 859 Ca -0.01 -0.06 -0.03 0.00 0.42 0.00 0.00 57.03 57.35 2ayz h ASP 859 Cb 1.22 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.98 2ayz h ASP 859 CO 0.10 0.80 0.21 0.00 -2.88 0.00 0.00 179.24 177.47 2ayz h ALA 860 N 1.30 0.72 -0.14 -0.78 0.00 -1.07 0.59 119.26 119.88 2ayz h ALA 860 Ca 0.32 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 2ayz h ALA 860 Cb -0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2ayz h ALA 860 CO -0.06 0.34 -0.57 1.25 0.00 0.00 0.00 179.25 180.21 2ayz h LEU 861 N 0.76 0.48 -0.38 0.00 5.85 -1.22 -0.19 115.31 120.62 2ayz h LEU 861 Ca 0.18 -0.26 -0.10 0.00 0.84 0.00 0.00 57.88 58.54 2ayz h LEU 861 Cb 0.21 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2ayz h LEU 861 CO -0.01 0.95 -0.17 -1.13 -0.34 0.00 0.00 178.44 177.73 2ayz h ASN 862 N 0.33 0.81 -0.19 1.25 -1.24 -0.75 -1.81 115.58 113.98 2ayz h ASN 862 Ca 0.00 -0.40 -0.02 0.00 0.71 0.00 0.00 56.30 56.59 2ayz h ASN 862 Cb 1.09 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 39.90 2ayz h ASN 862 CO 0.10 1.03 0.08 0.58 -1.29 0.00 0.00 177.43 177.93 2ayz h VAL 863 N 0.59 1.12 -0.30 2.57 2.07 -0.70 -1.84 116.25 119.74 2ayz h VAL 863 Ca 0.09 -0.39 -0.11 0.00 0.82 0.00 0.00 66.70 67.10 2ayz h VAL 863 Cb 0.72 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2ayz h VAL 863 CO 0.05 0.14 -0.29 0.25 0.02 0.00 0.00 177.57 177.75 2ayz h LEU 864 N 0.36 0.63 -0.43 2.57 7.12 -0.60 0.13 115.31 125.08 2ayz h LEU 864 Ca 0.09 -0.24 -0.10 0.00 0.13 0.00 0.00 57.88 57.76 2ayz h LEU 864 Cb 0.12 -0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 40.06 2ayz h LEU 864 CO -0.01 0.89 -0.11 0.28 -0.13 0.00 0.00 178.44 179.37 2ayz h SER 865 N 0.53 0.85 0.71 1.25 0.02 -0.49 -3.16 113.55 113.25 2ayz h SER 865 Ca 0.07 -0.36 -0.26 0.00 -0.84 0.00 0.00 61.79 60.40 2ayz h SER 865 Cb 0.76 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.05 2ayz h SER 865 CO 0.06 1.01 -1.33 0.11 -1.14 0.00 0.00 176.83 175.54 2ayz h LYS 866 N 0.67 0.08 -4.35 3.45 1.79 -1.49 -3.45 116.57 113.27 2ayz h LYS 866 Ca 0.11 -0.13 -0.54 0.00 -2.18 0.00 0.00 60.65 57.91 2ayz h LYS 866 Cb 0.64 0.05 -0.36 0.00 -1.58 0.00 0.00 32.23 30.98 2ayz h LYS 866 CO 0.04 0.91 -0.81 1.21 -1.08 0.00 0.00 179.45 179.72 2ayz s ASN 867 N -6.64 2.22 -1.29 0.86 2.47 0.43 -5.06 114.94 107.93 2ayz s ASN 867 Ca -0.03 -0.33 -0.18 0.00 0.42 0.00 0.00 52.86 52.73 2ayz s ASN 867 Cb 0.09 -0.90 0.04 0.00 -1.45 0.00 0.00 41.25 39.02 2ayz s ASN 867 CO 0.83 -0.09 1.83 1.41 -3.72 0.00 0.00 177.10 177.36 2ayz n HIS 868 N 4.77 4.20 -2.37 0.43 8.25 -1.25 -3.85 115.22 125.39 2ayz n HIS 868 Ca -0.15 -2.64 -0.36 0.00 -0.26 0.00 0.00 57.72 54.31 2ayz n HIS 868 Cb 0.50 -2.61 -0.02 0.00 1.12 0.00 0.00 29.99 28.99 2ayz n HIS 868 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2ayz s ILE 869 N 5.08 3.37 -0.11 1.59 1.09 -1.26 -4.93 121.20 126.02 2ayz s ILE 869 Ca 0.55 0.98 -0.04 0.00 -1.10 0.00 0.00 60.65 61.04 2ayz s ILE 869 Cb 0.05 -3.47 -0.01 0.00 -1.06 0.00 0.00 42.46 37.96 2ayz s ILE 869 CO 0.07 -0.06 -0.08 0.44 -0.10 0.00 0.00 174.94 175.21 2ayz h ASP 870 N 1.95 0.00 -3.96 3.58 5.19 -1.39 -3.47 116.42 118.32 2ayz h ASP 870 Ca -0.49 0.00 -0.69 0.00 -0.62 0.00 0.00 57.03 55.23 2ayz h ASP 870 Cb 1.24 0.00 -0.22 0.00 0.18 0.00 0.00 39.33 40.53 2ayz h ASP 870 CO 0.60 0.60 -0.79 -0.63 -3.12 0.00 0.00 179.24 175.90 2ayz s ILE 871 N -1.84 2.95 -0.10 0.35 -1.09 -1.18 -4.41 121.20 115.87 2ayz s ILE 871 Ca -0.07 -1.01 0.02 0.00 -2.23 0.00 0.00 60.65 57.37 2ayz s ILE 871 Cb 0.01 -2.22 0.01 0.00 -1.58 0.00 0.00 42.46 38.68 2ayz s ILE 871 CO 0.10 0.42 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.36 2ayz s VAL 872 N -0.88 1.61 -0.35 2.92 1.01 -1.11 -0.81 120.40 122.80 2ayz s VAL 872 Ca 0.14 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.42 2ayz s VAL 872 Cb -0.11 -1.45 0.10 0.00 0.00 0.00 0.00 36.38 34.93 2ayz s VAL 872 CO 0.04 0.46 0.07 -0.76 0.00 0.00 0.00 175.10 174.91 2ayz s LEU 873 N 0.75 4.60 -0.51 3.92 1.02 0.07 -0.56 118.68 127.97 2ayz s LEU 873 Ca -0.11 -2.19 -0.17 0.00 0.02 0.00 0.00 54.13 51.68 2ayz s LEU 873 Cb -0.16 -1.59 0.08 0.00 0.02 0.00 0.00 46.19 44.54 2ayz s LEU 873 CO 0.02 -0.37 0.51 -0.94 0.02 0.00 0.00 176.35 175.59 2ayz s SER 874 N 0.86 6.18 -0.36 2.29 1.04 -0.71 -1.97 113.70 121.02 2ayz s SER 874 Ca 0.11 -1.29 -0.21 0.00 0.48 0.00 0.00 55.95 55.05 2ayz s SER 874 Cb -0.19 -2.23 0.00 0.00 0.10 0.00 0.00 66.02 63.70 2ayz s SER 874 CO -0.08 -0.80 0.64 -0.62 0.98 0.00 0.00 173.24 173.36 2ayz s ASP 875 N 2.89 6.42 -0.42 7.02 -1.08 0.63 -1.39 116.67 130.74 2ayz s ASP 875 Ca 0.08 0.11 -0.11 0.00 -0.52 0.00 0.00 52.55 52.11 2ayz s ASP 875 Cb -0.24 -2.33 0.07 0.00 -1.46 0.00 0.00 42.92 38.96 2ayz s ASP 875 CO 0.08 -0.62 0.28 -0.69 0.52 0.00 0.00 175.17 174.74 2ayz s VAL 876 N 2.74 4.55 -0.65 1.11 1.01 0.09 -2.37 120.40 126.88 2ayz s VAL 876 Ca 0.25 -1.20 0.25 0.00 0.00 0.00 0.00 61.98 61.28 2ayz s VAL 876 Cb -0.14 -3.72 0.30 0.00 0.00 0.00 0.00 36.38 32.82 2ayz s VAL 876 CO 0.15 -0.47 1.74 -1.13 0.00 0.00 0.00 175.10 175.40 2ayz h ASN 877 N 8.50 0.00 -2.98 3.32 -1.24 -1.89 -2.40 115.58 118.88 2ayz h ASN 877 Ca -0.25 0.00 -0.55 0.00 0.71 0.00 0.00 56.30 56.21 2ayz h ASN 877 Cb 1.09 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 40.08 2ayz h ASN 877 CO 0.77 0.00 1.08 -0.32 -1.29 0.00 0.00 177.43 177.67 2ayz s MET 878 N -3.14 3.39 0.00 6.67 1.75 -1.26 -4.73 119.30 121.98 2ayz s MET 878 Ca 0.10 0.55 0.00 0.00 -1.25 0.00 0.00 55.69 55.09 2ayz s MET 878 Cb 0.11 -4.09 0.00 0.00 2.84 0.00 0.00 34.83 33.69 2ayz s MET 878 CO 0.60 -1.82 0.00 -0.35 -0.65 0.00 0.00 175.02 172.80 2ayz n PRO 879 N 8.49 0.00 -1.29 4.11 -0.04 -1.26 -4.28 135.00 140.73 2ayz n PRO 879 Ca 0.13 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.21 2ayz n PRO 879 Cb 0.49 -0.12 -0.03 0.00 -0.04 0.00 0.00 33.50 33.80 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 -0.16 8.62 -2.73 3.54 5.15 -1.26 -3.98 115.26 124.44 2ayz n ASN 880 Ca 0.00 -2.56 -0.07 0.00 -0.60 0.00 0.00 54.58 51.35 2ayz n ASN 880 Cb 0.00 -1.54 0.07 0.00 -0.53 0.00 0.00 39.78 37.77 2ayz n ASN 880 CO 0.00 0.00 0.00 0.80 1.40 0.00 0.00 177.26 179.46 2ayz n MET 881 N 3.57 0.68 -3.59 1.20 1.56 -1.26 -5.00 117.12 114.28 2ayz n MET 881 Ca 0.77 -1.54 -0.24 0.00 -0.27 0.00 0.00 57.70 56.43 2ayz n MET 881 Cb 0.24 -1.11 0.08 0.00 2.15 0.00 0.00 33.22 34.58 2ayz n MET 881 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 2ayz n ASP 882 N 1.32 -6.40 0.00 6.12 8.00 -1.26 -4.85 116.55 119.48 2ayz n ASP 882 Ca 0.06 -0.54 0.09 0.00 0.71 0.00 0.00 54.79 55.11 2ayz n ASP 882 Cb 0.66 -5.04 0.48 0.00 -0.02 0.00 0.00 41.12 37.21 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 -2.01 -0.72 0.05 0.44 0.00 -1.26 -1.86 105.19 99.83 2ayz n GLY 883 Ca 0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.15 0.00 0.30 1.61 4.11 -1.26 -4.69 117.16 116.08 2ayz n TYR 884 Ca 0.11 0.00 0.15 0.00 -0.00 0.00 0.00 57.90 58.16 2ayz n TYR 884 Cb 0.10 -0.55 0.92 0.00 -0.00 0.00 0.00 39.34 39.81 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 -0.24 -3.48 1.12 -1.71 -0.71 114.38 109.37 2ayz h ARG 885 Ca -0.26 0.00 -0.11 0.00 -1.11 0.00 0.00 59.98 58.50 2ayz h ARG 885 Cb 1.50 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 31.45 2ayz h ARG 885 CO 0.01 0.01 -0.33 1.37 -3.11 0.00 0.00 179.97 177.92 2ayz h LEU 886 N 0.00 0.51 -0.71 3.80 -0.00 -1.84 -0.34 115.31 116.72 2ayz h LEU 886 Ca -0.00 -0.20 -0.10 0.00 -0.00 0.00 0.00 57.88 57.58 2ayz h LEU 886 Cb 0.03 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 40.53 2ayz h LEU 886 CO 0.00 0.81 -0.48 0.74 -0.00 0.00 0.00 178.44 179.51 2ayz h THR 887 N 0.42 1.04 -0.37 0.15 2.02 -1.47 -2.64 112.91 112.07 2ayz h THR 887 Ca 0.05 -1.85 0.01 0.00 0.77 0.00 0.00 66.41 65.39 2ayz h THR 887 Cb 0.78 2.10 -0.02 0.00 -1.74 0.00 0.00 68.15 69.27 2ayz h THR 887 CO 0.06 0.47 0.23 -0.61 0.37 0.00 0.00 175.52 176.04 2ayz h GLN 888 N 0.00 0.45 -0.45 6.66 -0.00 -0.97 0.21 115.11 121.01 2ayz h GLN 888 Ca -0.00 -0.03 -0.03 0.00 -0.00 0.00 0.00 58.65 58.59 2ayz h GLN 888 Cb 1.06 -0.10 -0.02 0.00 0.00 0.00 0.00 27.48 28.41 2ayz h GLN 888 CO 0.06 0.30 0.17 -0.09 0.00 0.00 0.00 178.83 179.27 2ayz h ARG 889 N 0.46 0.65 -0.41 1.69 1.12 -1.24 0.21 114.38 116.87 2ayz h ARG 889 Ca 0.14 -0.09 -0.02 0.00 -1.11 0.00 0.00 59.98 58.90 2ayz h ARG 889 Cb -0.02 -0.12 -0.02 0.00 -0.01 0.00 0.00 29.97 29.80 2ayz h ARG 889 CO -0.05 0.55 0.19 0.82 -3.11 0.00 0.00 179.97 178.37 2ayz h ILE 890 N 0.64 1.18 -0.46 1.20 2.04 -1.00 -1.30 117.51 119.81 2ayz h ILE 890 Ca 0.16 -0.50 -0.12 0.00 1.00 0.00 0.00 64.86 65.39 2ayz h ILE 890 Cb 0.15 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2ayz h ILE 890 CO -0.01 0.19 -0.19 0.08 0.00 0.00 0.00 178.15 178.21 2ayz h ARG 891 N 0.52 0.92 -0.41 2.37 0.11 -0.52 -2.66 114.38 114.71 2ayz h ARG 891 Ca 0.14 -0.37 0.01 0.00 0.10 0.00 0.00 59.98 59.86 2ayz h ARG 891 Cb 0.12 -0.04 -0.02 0.00 1.11 0.00 0.00 29.97 31.14 2ayz h ARG 891 CO -0.02 1.03 0.25 0.37 0.10 0.00 0.00 179.97 181.71 2ayz h GLN 892 N 0.80 0.50 -0.04 0.08 5.75 -0.78 -2.50 115.11 118.93 2ayz h GLN 892 Ca 0.11 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.51 2ayz h GLN 892 Cb 0.74 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 29.17 2ayz h GLN 892 CO 0.06 0.33 -0.29 1.25 -2.65 0.00 0.00 178.83 177.53 2ayz h LEU 893 N 0.52 0.07 0.00 -2.39 6.46 -1.14 -3.48 115.31 115.35 2ayz h LEU 893 Ca 0.16 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.90 2ayz h LEU 893 Cb -0.02 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 39.89 2ayz h LEU 893 CO -0.06 0.36 0.00 0.61 -0.62 0.00 0.00 178.44 178.74 2ayz n GLY 894 N -0.63 0.62 3.88 3.75 0.00 -0.94 -5.11 105.19 106.77 2ayz n GLY 894 Ca -0.02 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 45.05 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 3.29 0.00 0.99 2.34 -1.16 -4.97 118.68 119.18 2ayz s LEU 895 Ca 0.00 1.22 0.00 0.00 0.06 0.00 0.00 54.13 55.41 2ayz s LEU 895 Cb 0.00 -4.20 0.00 0.00 -0.56 0.00 0.00 46.19 41.43 2ayz s LEU 895 CO 0.00 -0.86 0.15 0.41 -1.06 0.00 0.00 176.35 174.99 2ayz n THR 896 N -2.64 0.00 -2.81 5.48 -1.04 -1.26 -5.08 114.28 106.92 2ayz n THR 896 Ca 0.05 -0.28 -0.34 0.00 -2.04 0.00 0.00 64.05 61.43 2ayz n THR 896 Cb 0.55 1.23 -0.07 0.00 -1.82 0.00 0.00 70.33 70.22 2ayz n THR 896 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2ayz s LEU 897 N -0.54 4.09 -0.71 -4.42 1.02 -1.26 -5.01 118.68 111.85 2ayz s LEU 897 Ca 0.00 1.74 -0.22 0.00 0.02 0.00 0.00 54.13 55.67 2ayz s LEU 897 Cb 0.00 -4.34 0.08 0.00 0.02 0.00 0.00 46.19 41.95 2ayz s LEU 897 CO 0.00 -0.25 1.00 -2.16 0.02 0.00 0.00 176.35 174.96 2ayz s PRO 898 N -2.76 3.19 -0.34 1.29 0.05 -1.26 -4.90 135.00 130.27 2ayz s PRO 898 Ca 0.58 -0.97 -0.13 0.00 0.05 0.00 0.00 61.00 60.53 2ayz s PRO 898 Cb -0.13 -4.36 -0.02 0.00 0.05 0.00 0.00 34.50 30.05 2ayz s PRO 898 CO 0.17 -1.83 0.27 0.08 0.05 0.00 0.00 177.00 175.74 2ayz s VAL 899 N 3.91 5.26 -0.47 -0.36 1.01 -1.09 -2.73 120.40 125.93 2ayz s VAL 899 Ca 0.24 -0.13 -0.14 0.00 0.00 0.00 0.00 61.98 61.95 2ayz s VAL 899 Cb -0.15 -3.73 0.08 0.00 0.00 0.00 0.00 36.38 32.58 2ayz s VAL 899 CO 0.07 -0.02 0.38 -0.63 0.00 0.00 0.00 175.10 174.90 2ayz s ILE 900 N 1.79 5.03 -0.31 2.22 1.01 0.27 -1.34 121.20 129.88 2ayz s ILE 900 Ca 0.07 -1.18 -0.15 0.00 0.00 0.00 0.00 60.65 59.40 2ayz s ILE 900 Cb -0.17 -4.04 -0.02 0.00 0.01 0.00 0.00 42.46 38.23 2ayz s ILE 900 CO 0.11 -0.60 0.37 -0.83 0.00 0.00 0.00 174.94 173.99 2ayz s GLY 901 N 2.61 1.89 0.06 6.18 0.00 -0.18 -1.74 107.32 116.13 2ayz s GLY 901 Ca 0.04 -1.02 -0.22 0.00 0.00 0.00 0.00 44.72 43.52 2ayz s GLY 901 CO 0.05 0.99 0.65 0.14 0.00 0.00 0.00 173.10 174.94 2ayz s VAL 902 N 2.06 4.72 -0.08 1.40 1.01 -0.49 -0.87 120.40 128.16 2ayz s VAL 902 Ca 0.13 1.40 0.05 0.00 0.00 0.00 0.00 61.98 63.56 2ayz s VAL 902 Cb -0.16 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.22 2ayz s VAL 902 CO 0.11 0.47 -0.24 0.42 0.00 0.00 0.00 175.10 175.86 2ayz s THR 903 N -0.60 2.03 -0.43 3.92 -4.23 -0.15 -0.73 115.64 115.44 2ayz s THR 903 Ca 0.33 -1.03 -0.07 0.00 -1.18 0.00 0.00 61.69 59.74 2ayz s THR 903 Cb -0.20 -1.73 0.10 0.00 1.34 0.00 0.00 72.50 72.00 2ayz s THR 903 CO 0.20 0.56 0.26 0.00 -0.54 0.00 0.00 174.62 175.11 2ayz s ALA 904 N 0.09 3.27 -1.47 3.99 0.00 -0.90 -2.61 121.76 124.12 2ayz s ALA 904 Ca -0.11 -2.34 -0.03 0.00 0.00 0.00 0.00 51.96 49.48 2ayz s ALA 904 Cb -0.16 -2.62 0.03 0.00 0.00 0.00 0.00 23.12 20.37 2ayz s ALA 904 CO 0.06 -1.75 0.43 -1.71 0.00 0.00 0.00 175.76 172.80 2ayz n ASN 905 N 4.83 -0.68 0.19 0.00 5.15 -1.26 -4.23 115.26 119.26 2ayz n ASN 905 Ca -0.08 -1.04 0.10 0.00 -0.60 0.00 0.00 54.58 52.97 2ayz n ASN 905 Cb 0.42 -2.84 0.12 0.00 -0.53 0.00 0.00 39.78 36.95 2ayz n ASN 905 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ayz h ALA 906 N 0.85 0.88 -3.56 5.20 0.00 -1.87 -3.42 119.26 117.33 2ayz h ALA 906 Ca -0.63 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2ayz h ALA 906 Cb 1.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2ayz h ALA 906 CO 0.66 0.11 -0.62 1.28 0.00 0.00 0.00 179.25 180.68 2ayz n LEU 907 N -3.06 -4.87 -3.65 0.00 4.32 -1.26 -4.67 117.00 103.81 2ayz n LEU 907 Ca 0.03 1.90 -0.21 0.00 -0.02 0.00 0.00 56.01 57.71 2ayz n LEU 907 Cb 0.57 -2.42 0.05 0.00 -1.62 0.00 0.00 43.42 40.00 2ayz n LEU 907 CO 0.36 -1.66 -0.00 0.00 -1.22 0.00 0.00 177.39 174.87 2ayz n ALA 908 N 1.18 -1.94 0.29 -1.18 0.00 -1.26 -4.85 120.51 112.76 2ayz n ALA 908 Ca 0.00 -0.09 0.16 0.00 0.00 0.00 0.00 53.44 53.50 2ayz n ALA 908 Cb 0.00 -2.37 0.76 0.00 0.00 0.00 0.00 19.45 17.84 2ayz n ALA 908 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2ayz h GLU 909 N -1.92 0.00 -0.65 0.00 3.07 -1.99 -0.47 114.58 112.61 2ayz h GLU 909 Ca -0.60 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.22 2ayz h GLU 909 Cb 1.36 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.24 2ayz h GLU 909 CO 0.56 0.00 0.25 0.93 -1.40 0.00 0.00 179.01 179.35 2ayz h GLU 910 N 0.00 0.96 -0.08 2.33 5.08 -1.99 0.13 114.58 121.02 2ayz h GLU 910 Ca 0.00 -0.16 -0.21 0.00 -1.00 0.00 0.00 59.36 57.99 2ayz h GLU 910 Cb 0.21 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.31 2ayz h GLU 910 CO 0.00 0.79 -0.78 -0.22 -1.00 0.00 0.00 179.01 177.81 2ayz h LYS 911 N 0.94 0.67 0.00 2.33 3.11 -1.45 -2.62 116.57 119.55 2ayz h LYS 911 Ca 0.22 -0.61 -0.03 0.00 -2.81 0.00 0.00 60.65 57.42 2ayz h LYS 911 Cb 0.20 0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 31.57 2ayz h LYS 911 CO -0.02 1.22 -0.13 1.96 -2.81 0.00 0.00 179.45 179.67 2ayz h GLN 912 N 0.33 0.00 -0.07 1.90 7.50 -1.35 -2.38 115.11 121.03 2ayz h GLN 912 Ca -0.07 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.07 2ayz h GLN 912 Cb 1.43 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.95 2ayz h GLN 912 CO 0.16 0.13 0.02 -0.09 -1.50 0.00 0.00 178.83 177.55 2ayz h ARG 913 N 0.00 0.12 -0.05 1.46 9.65 -0.46 -0.45 114.38 124.65 2ayz h ARG 913 Ca -0.00 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.86 2ayz h ARG 913 Cb 0.28 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 28.84 2ayz h ARG 913 CO 0.02 0.31 0.04 0.00 2.80 0.00 0.00 179.97 183.14 2ayz h LEU 915 N 0.00 -0.11 0.12 0.00 4.07 -0.85 -3.35 115.31 115.20 2ayz h LEU 915 Ca 0.02 -0.35 -0.17 0.00 0.08 0.00 0.00 57.88 57.46 2ayz h LEU 915 Cb 0.10 0.03 0.02 0.00 1.08 0.00 0.00 40.66 41.89 2ayz h LEU 915 CO -0.00 0.31 -0.74 1.05 -1.08 0.00 0.00 178.44 177.98 2ayz h GLU 916 N -0.55 0.29 -6.44 1.13 -0.00 -0.66 -3.46 114.58 104.89 2ayz h GLU 916 Ca -0.01 -0.47 -0.49 0.00 -0.00 0.00 0.00 59.36 58.38 2ayz h GLU 916 Cb 0.45 0.17 -0.04 0.00 -0.00 0.00 0.00 28.75 29.33 2ayz h GLU 916 CO 0.02 1.22 -0.87 0.43 -0.00 0.00 0.00 179.01 179.80 2ayz n SER 917 N -4.16 -0.61 -0.91 3.06 7.64 0.12 -4.03 113.62 114.73 2ayz n SER 917 Ca -0.13 -0.97 0.00 0.00 1.01 0.00 0.00 58.87 58.77 2ayz n SER 917 Cb 0.79 -3.21 -0.01 0.00 -1.01 0.00 0.00 64.21 60.77 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 -1.90 0.75 0.00 0.23 0.00 -1.26 -4.74 105.19 98.28 2ayz n GLY 918 Ca -0.29 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 0.16 0.00 0.00 1.61 0.00 -1.26 -4.67 117.12 112.96 2ayz n MET 919 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.67 2ayz n MET 919 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 33.22 34.03 2ayz n MET 919 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2ayz n ASP 920 N 0.00 0.00 -3.51 6.12 -0.08 -0.45 -2.68 116.55 115.95 2ayz n ASP 920 Ca 0.00 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.14 2ayz n ASP 920 Cb 0.00 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.41 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 -0.55 0.11 1.67 0.01 -1.05 -5.01 113.70 108.88 2ayz s SER 921 Ca 0.00 0.44 0.05 0.00 1.31 0.00 0.00 55.95 57.75 2ayz s SER 921 Cb 0.00 0.49 -0.04 0.00 0.21 0.00 0.00 66.02 66.68 2ayz s SER 921 CO 0.00 -0.62 0.01 0.00 0.41 0.00 0.00 173.24 173.04 2ayz s LEU 923 N -2.51 2.43 0.07 0.00 1.43 -0.05 -4.90 118.68 115.15 2ayz s LEU 923 Ca 0.27 -1.29 -0.07 0.00 -1.03 0.00 0.00 54.13 52.01 2ayz s LEU 923 Cb -0.11 -0.59 -0.05 0.00 0.03 0.00 0.00 46.19 45.47 2ayz s LEU 923 CO 0.19 -0.46 0.34 -0.44 0.23 0.00 0.00 176.35 176.21 2ayz s SER 924 N -3.50 6.54 0.27 2.29 0.01 -1.26 -0.98 113.70 117.06 2ayz s SER 924 Ca 0.33 0.64 -0.01 0.00 1.31 0.00 0.00 55.95 58.22 2ayz s SER 924 Cb 0.07 -2.11 0.60 0.00 0.21 0.00 0.00 66.02 64.78 2ayz s SER 924 CO 0.14 0.17 1.68 0.50 0.41 0.00 0.00 173.24 176.14 2ayz h LYS 925 N 3.54 0.28 -3.39 12.44 1.63 -1.87 -3.04 116.57 126.16 2ayz h LYS 925 Ca -0.48 -0.02 -0.32 0.00 -0.85 0.00 0.00 60.65 58.98 2ayz h LYS 925 Cb 1.19 -0.06 0.01 0.00 -0.60 0.00 0.00 32.23 32.76 2ayz h LYS 925 CO 0.68 0.19 2.24 -2.30 -3.45 0.00 0.00 179.45 176.81 2ayz n PRO 926 N -5.15 1.82 -2.01 1.90 -0.02 -1.26 -4.89 135.00 125.40 2ayz n PRO 926 Ca 0.18 -1.29 -0.43 0.00 -2.02 0.00 0.00 63.50 59.94 2ayz n PRO 926 Cb 0.57 -2.35 -0.03 0.00 -0.02 0.00 0.00 33.50 31.67 2ayz n PRO 926 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ayz s VAL 927 N 3.39 3.52 0.43 -1.45 1.01 -1.15 -5.00 120.40 121.16 2ayz s VAL 927 Ca 0.36 0.56 -0.02 0.00 0.00 0.00 0.00 61.98 62.87 2ayz s VAL 927 Cb 0.10 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 2ayz s VAL 927 CO -0.03 -0.33 0.68 0.42 0.00 0.00 0.00 175.10 175.85 2ayz s THR 928 N 6.17 4.83 0.22 3.92 -4.23 -1.26 -4.91 115.64 120.37 2ayz s THR 928 Ca 0.78 -0.16 -0.08 0.00 -1.18 0.00 0.00 61.69 61.05 2ayz s THR 928 Cb -0.25 -3.80 0.16 0.00 1.34 0.00 0.00 72.50 69.95 2ayz s THR 928 CO 0.32 -0.66 1.74 0.25 -0.54 0.00 0.00 174.62 175.73 2ayz h LEU 929 N 0.44 0.22 -0.28 4.79 7.12 -1.97 0.35 115.31 125.97 2ayz h LEU 929 Ca -0.48 0.09 -0.19 0.00 0.13 0.00 0.00 57.88 57.43 2ayz h LEU 929 Cb 1.22 0.07 0.00 0.00 -0.53 0.00 0.00 40.66 41.42 2ayz h LEU 929 CO 0.61 0.12 -0.56 -0.78 -0.13 0.00 0.00 178.44 177.70 2ayz h ASP 930 N 0.41 0.98 -0.07 1.25 1.82 -1.98 -1.73 116.42 117.09 2ayz h ASP 930 Ca 0.33 -0.54 -0.11 0.00 -0.39 0.00 0.00 57.03 56.33 2ayz h ASP 930 Cb 0.44 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 40.15 2ayz h ASP 930 CO -0.34 1.34 -0.28 1.62 -1.61 0.00 0.00 179.24 179.97 2ayz h VAL 931 N 0.67 1.27 -0.02 2.25 3.04 -1.80 -0.11 116.25 121.55 2ayz h VAL 931 Ca 0.01 -1.34 -0.12 0.00 -1.01 0.00 0.00 66.70 64.23 2ayz h VAL 931 Cb 1.17 1.38 -0.02 0.00 -2.01 0.00 0.00 31.29 31.82 2ayz h VAL 931 CO 0.12 0.43 -0.56 -0.29 -1.01 0.00 0.00 177.57 176.26 2ayz h ILE 932 N 0.46 1.40 -0.44 3.17 2.10 -0.92 -2.72 117.51 120.55 2ayz h ILE 932 Ca 0.06 -1.92 -0.10 0.00 1.08 0.00 0.00 64.86 63.98 2ayz h ILE 932 Cb 0.73 2.02 -0.01 0.00 -1.09 0.00 0.00 36.82 38.46 2ayz h ILE 932 CO 0.06 0.55 -0.11 0.50 -1.08 0.00 0.00 178.15 178.06 2ayz h LYS 933 N 0.04 0.86 -0.11 2.19 3.11 -0.36 0.14 116.57 122.44 2ayz h LYS 933 Ca -0.00 -0.33 0.00 0.00 -2.81 0.00 0.00 60.65 57.51 2ayz h LYS 933 Cb 1.01 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 32.18 2ayz h LYS 933 CO 0.08 0.97 0.06 1.96 -2.81 0.00 0.00 179.45 179.70 2ayz h GLN 934 N 0.69 0.12 -0.44 1.90 4.20 -0.96 0.34 115.11 120.96 2ayz h GLN 934 Ca 0.11 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.71 2ayz h GLN 934 Cb 0.66 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.39 2ayz h GLN 934 CO 0.05 0.08 -0.14 1.15 -0.67 0.00 0.00 178.83 179.30 2ayz h THR 935 N 0.13 1.26 0.44 -0.54 2.02 -1.41 -0.82 112.91 114.00 2ayz h THR 935 Ca 0.04 -1.22 -0.02 0.00 0.77 0.00 0.00 66.41 65.98 2ayz h THR 935 Cb -0.00 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 2ayz h THR 935 CO -0.02 0.42 -0.21 -0.07 0.37 0.00 0.00 175.52 176.00 2ayz h LEU 936 N 0.73 -0.51 -0.76 2.58 -0.00 -0.43 -1.35 115.31 115.57 2ayz h LEU 936 Ca 0.12 -0.01 0.06 0.00 -0.00 0.00 0.00 57.88 58.05 2ayz h LEU 936 Cb 0.64 0.13 -0.06 0.00 -0.00 0.00 0.00 40.66 41.37 2ayz h LEU 936 CO 0.04 -0.33 0.46 0.74 -0.00 0.00 0.00 178.44 179.35 2ayz h THR 937 N -0.64 1.02 -0.02 0.22 2.02 -0.88 0.13 112.91 114.76 2ayz h THR 937 Ca -0.06 -0.29 0.03 0.00 0.77 0.00 0.00 66.41 66.86 2ayz h THR 937 Cb 0.48 0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 2ayz h THR 937 CO 0.10 0.15 -0.16 0.25 0.37 0.00 0.00 175.52 176.24 2ayz h LEU 938 N 0.84 -0.46 -0.49 2.58 6.46 -0.94 -0.02 115.31 123.29 2ayz h LEU 938 Ca 0.33 0.07 -0.17 0.00 -0.12 0.00 0.00 57.88 57.99 2ayz h LEU 938 Cb 0.15 0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 2ayz h LEU 938 CO -0.17 -0.21 -0.74 1.88 -0.62 0.00 0.00 178.44 178.58 2ayz h TYR 939 N -0.25 0.22 -0.63 1.25 -1.99 -0.89 -2.55 116.97 112.13 2ayz h TYR 939 Ca 0.06 -0.10 -0.04 0.00 2.00 0.00 0.00 58.73 60.64 2ayz h TYR 939 Cb 0.32 -0.03 -0.03 0.00 2.00 0.00 0.00 36.73 39.00 2ayz h TYR 939 CO -0.22 0.84 0.22 0.00 -0.00 0.00 0.00 178.16 179.00 2ayz h ALA 940 N 1.13 0.82 -0.46 3.88 0.00 -0.49 -1.23 119.26 122.91 2ayz h ALA 940 Ca -0.02 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2ayz h ALA 940 Cb 1.31 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2ayz h ALA 940 CO 0.11 0.47 0.05 1.05 0.00 0.00 0.00 179.25 180.93 2ayz h GLU 941 N 0.89 0.72 -0.09 0.00 4.11 -0.84 -0.09 114.58 119.28 2ayz h GLU 941 Ca 0.21 -0.16 -0.02 0.00 0.07 0.00 0.00 59.36 59.46 2ayz h GLU 941 Cb 0.26 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2ayz h GLU 941 CO -0.01 0.70 -0.01 0.00 0.07 0.00 0.00 179.01 179.75 2ayz h ARG 942 N 0.69 0.18 -0.03 1.06 3.08 -1.01 -0.29 114.38 118.05 2ayz h ARG 942 Ca 0.15 -0.06 -0.13 0.00 0.07 0.00 0.00 59.98 60.00 2ayz h ARG 942 Cb 0.35 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2ayz h ARG 942 CO 0.01 0.47 -0.60 -0.39 -1.07 0.00 0.00 179.97 178.38 2ayz h VAL 943 N -0.13 1.41 -0.13 2.04 -1.51 -1.14 -2.05 116.25 114.74 2ayz h VAL 943 Ca 0.03 -2.03 -0.07 0.00 -1.23 0.00 0.00 66.70 63.40 2ayz h VAL 943 Cb 0.40 2.07 -0.00 0.00 -2.13 0.00 0.00 31.29 31.63 2ayz h VAL 943 CO 0.01 0.59 -0.18 0.03 -1.23 0.00 0.00 177.57 176.79 2ayz h ARG 944 N 0.07 0.34 0.00 5.19 -0.00 -0.92 -1.01 114.38 118.05 2ayz h ARG 944 Ca -0.01 -0.20 -0.05 0.00 -0.50 0.00 0.00 59.98 59.22 2ayz h ARG 944 Cb 1.09 0.02 -0.01 0.00 0.00 0.00 0.00 29.97 31.06 2ayz h ARG 944 CO 0.08 0.77 -0.24 1.57 0.00 0.00 0.00 179.97 182.16 2ayz h LYS 945 N -0.06 0.00 0.00 0.04 5.09 -1.02 0.39 116.57 121.00 2ayz h LYS 945 Ca 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 60.65 60.71 2ayz h LYS 945 Cb 0.73 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.06 2ayz h LYS 945 CO 0.04 0.24 -0.76 0.77 -2.09 0.00 0.00 179.45 177.65 2ayz h SER 946 N 0.00 0.00 0.00 7.07 0.02 -1.34 -3.33 113.55 115.96 2ayz h SER 946 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ayz h SER 946 Cb 0.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.28 2ayz h SER 946 CO 0.03 0.18 -0.52 -1.14 -1.14 0.00 0.00 176.83 174.24 2ayz n ARG 947 N -2.90 0.36 -2.96 3.45 0.63 -0.39 -4.79 116.66 110.06 2ayz n ARG 947 Ca -0.01 0.35 -0.24 0.00 -0.92 0.00 0.00 57.85 57.04 2ayz n ARG 947 Cb 0.63 -1.37 -0.03 0.00 0.45 0.00 0.00 32.46 32.13 2ayz n ARG 947 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2ayz n ASP 948 N -4.03 3.31 0.00 6.15 2.03 0.08 -5.08 116.55 119.01 2ayz n ASP 948 Ca -0.07 -3.45 0.00 0.00 0.52 0.00 0.00 54.79 51.79 2ayz n ASP 948 Cb 0.27 -0.57 0.00 0.00 -0.72 0.00 0.00 41.12 40.10 2ayz n ASP 948 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08