#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 3.56 -0.45 7.82 0.00 -1.26 -5.04 121.76 126.40 2ayz s ALA 818 Ca 0.00 -0.82 -0.21 0.00 0.00 0.00 0.00 51.96 50.93 2ayz s ALA 818 Cb 0.00 -2.75 0.03 0.00 0.00 0.00 0.00 23.12 20.40 2ayz s ALA 818 CO 0.00 -0.71 0.68 0.08 0.00 0.00 0.00 175.76 175.80 2ayz s VAL 819 N 2.11 4.79 -0.13 0.00 1.01 -1.26 -5.03 120.40 121.89 2ayz s VAL 819 Ca 0.16 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.26 2ayz s VAL 819 Cb -0.16 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 32.00 2ayz s VAL 819 CO 0.10 -0.65 -0.12 -0.94 0.00 0.00 0.00 175.10 173.49 2ayz s SER 820 N 2.10 2.44 0.26 3.32 1.04 -1.26 -5.11 113.70 116.50 2ayz s SER 820 Ca 0.23 -0.41 -0.05 0.00 0.48 0.00 0.00 55.95 56.20 2ayz s SER 820 Cb -0.14 -1.04 0.02 0.00 0.10 0.00 0.00 66.02 64.96 2ayz s SER 820 CO 0.19 -0.06 0.44 -0.67 0.98 0.00 0.00 173.24 174.12 2ayz n ASP 821 N 4.72 -1.26 0.00 7.02 -0.08 -1.26 -5.11 116.55 120.58 2ayz n ASP 821 Ca -0.16 -2.25 0.00 0.00 -1.51 0.00 0.00 54.79 50.87 2ayz n ASP 821 Cb 0.50 2.21 0.00 0.00 2.34 0.00 0.00 41.12 46.17 2ayz n ASP 821 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 2ayz n ASN 822 N -1.59 0.00 0.00 1.67 5.15 -1.26 -5.02 115.26 114.21 2ayz n ASN 822 Ca -0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.95 2ayz n ASN 822 Cb 0.42 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.67 2ayz n ASN 822 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2ayz n ASP 823 N -0.20 0.00 0.00 1.20 9.92 -1.26 -5.04 116.55 121.17 2ayz n ASP 823 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2ayz n ASP 823 Cb 0.00 0.17 0.00 0.00 -0.64 0.00 0.00 41.12 40.65 2ayz n ASP 823 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 2ayz n ASP 824 N -1.93 0.00 -3.87 -2.24 2.03 -1.26 -4.53 116.55 104.75 2ayz n ASP 824 Ca 0.00 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 55.05 2ayz n ASP 824 Cb 0.00 0.00 -0.17 0.00 -0.72 0.00 0.00 41.12 40.23 2ayz n ASP 824 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2ayz s MET 825 N 0.00 1.26 -0.20 -0.67 -1.94 -1.26 -5.10 119.30 111.38 2ayz s MET 825 Ca 0.00 -0.18 -0.03 0.00 -1.71 0.00 0.00 55.69 53.77 2ayz s MET 825 Cb 0.00 -1.47 -0.01 0.00 2.01 0.00 0.00 34.83 35.36 2ayz s MET 825 CO 0.00 -0.30 -0.05 0.00 -0.01 0.00 0.00 175.02 174.66 2ayz s MET 826 N 1.78 3.41 -0.09 2.03 0.23 -1.26 -2.04 119.30 123.35 2ayz s MET 826 Ca 0.05 -0.62 -0.02 0.00 -1.03 0.00 0.00 55.69 54.07 2ayz s MET 826 Cb -0.13 -2.96 -0.03 0.00 -1.53 0.00 0.00 34.83 30.18 2ayz s MET 826 CO -0.07 -0.11 -0.02 0.42 -2.03 0.00 0.00 175.02 173.21 2ayz s ILE 827 N 1.25 4.14 -0.45 3.16 -1.09 0.24 -1.96 121.20 126.49 2ayz s ILE 827 Ca 0.03 -0.31 -0.18 0.00 -2.23 0.00 0.00 60.65 57.96 2ayz s ILE 827 Cb -0.14 -2.74 0.03 0.00 -1.58 0.00 0.00 42.46 38.03 2ayz s ILE 827 CO -0.02 0.59 0.53 -0.22 -1.23 0.00 0.00 174.94 174.59 2ayz s LEU 828 N -0.71 4.84 -0.67 2.97 2.96 -0.40 -1.00 118.68 126.66 2ayz s LEU 828 Ca 0.11 -0.68 -0.16 0.00 -0.22 0.00 0.00 54.13 53.18 2ayz s LEU 828 Cb -0.12 -2.47 0.16 0.00 0.50 0.00 0.00 46.19 44.26 2ayz s LEU 828 CO 0.02 -0.70 0.66 0.68 -1.32 0.00 0.00 176.35 175.69 2ayz s VAL 829 N 2.39 5.27 -0.06 1.68 -7.23 0.06 -2.53 120.40 119.98 2ayz s VAL 829 Ca 0.15 -1.78 -0.03 0.00 -1.81 0.00 0.00 61.98 58.51 2ayz s VAL 829 Cb -0.17 -4.43 -0.04 0.00 0.56 0.00 0.00 36.38 32.30 2ayz s VAL 829 CO 0.14 -1.00 0.07 -0.69 -0.31 0.00 0.00 175.10 173.31 2ayz s VAL 830 N 1.30 4.78 0.01 1.32 1.01 -0.94 -2.44 120.40 125.43 2ayz s VAL 830 Ca 0.11 -0.19 -0.16 0.00 0.00 0.00 0.00 61.98 61.74 2ayz s VAL 830 Cb -0.20 -3.10 0.03 0.00 0.00 0.00 0.00 36.38 33.10 2ayz s VAL 830 CO -0.02 0.51 0.34 -0.62 0.00 0.00 0.00 175.10 175.32 2ayz s ASP 831 N -1.26 -0.21 0.04 3.32 2.15 -1.02 -0.42 116.67 119.27 2ayz s ASP 831 Ca 0.18 0.03 0.22 0.00 0.43 0.00 0.00 52.55 53.41 2ayz s ASP 831 Cb -0.12 0.35 -0.15 0.00 -0.30 0.00 0.00 42.92 42.70 2ayz s ASP 831 CO 0.07 -0.53 0.79 -0.67 -0.17 0.00 0.00 175.17 174.66 2ayz n ASP 832 N 0.95 0.44 -3.91 -0.34 -0.08 -0.27 -3.03 116.55 110.31 2ayz n ASP 832 Ca -0.20 -0.10 -0.30 0.00 -1.51 0.00 0.00 54.79 52.68 2ayz n ASP 832 Cb 0.57 1.26 -0.14 0.00 2.34 0.00 0.00 41.12 45.16 2ayz n ASP 832 CO 0.00 0.00 0.00 -2.28 0.12 0.00 0.00 177.20 175.04 2ayz s HIS 833 N -3.35 3.13 0.08 -0.67 2.46 -1.26 -4.95 115.29 110.74 2ayz s HIS 833 Ca -0.02 -3.14 0.01 0.00 0.47 0.00 0.00 55.06 52.39 2ayz s HIS 833 Cb 0.13 -2.70 0.23 0.00 -0.13 0.00 0.00 32.58 30.11 2ayz s HIS 833 CO 0.85 -0.71 0.41 -2.30 -2.47 0.00 0.00 174.74 170.53 2ayz n PRO 834 N 2.92 -0.02 0.17 2.88 -0.02 -1.26 -0.00 135.00 139.67 2ayz n PRO 834 Ca 0.08 0.39 0.11 0.00 -2.02 0.00 0.00 63.50 62.06 2ayz n PRO 834 Cb 0.33 -0.63 0.63 0.00 -0.02 0.00 0.00 33.50 33.81 2ayz n PRO 834 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2ayz h ILE 835 N 0.00 0.94 0.08 4.25 -0.00 -1.98 -1.40 117.51 119.39 2ayz h ILE 835 Ca 0.17 -0.02 -0.25 0.00 -0.00 0.00 0.00 64.86 64.76 2ayz h ILE 835 Cb 0.37 0.88 -0.01 0.00 -0.00 0.00 0.00 36.82 38.07 2ayz h ILE 835 CO -0.24 0.01 -1.12 -1.13 -0.00 0.00 0.00 178.15 175.67 2ayz h ASN 836 N 0.06 0.30 -0.95 2.19 -1.24 -0.86 -2.78 115.58 112.30 2ayz h ASN 836 Ca 0.08 -0.31 0.06 0.00 0.71 0.00 0.00 56.30 56.84 2ayz h ASN 836 Cb 0.25 -0.10 -0.06 0.00 0.73 0.00 0.00 38.32 39.13 2ayz h ASN 836 CO -0.01 1.22 0.61 -0.09 -1.29 0.00 0.00 177.43 177.87 2ayz h ARG 837 N 0.07 1.08 -0.38 6.67 2.43 -1.40 0.21 114.38 123.05 2ayz h ARG 837 Ca -0.09 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.04 2ayz h ARG 837 Cb 1.85 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 31.13 2ayz h ARG 837 CO 0.18 0.71 0.22 -0.09 -1.51 0.00 0.00 179.97 179.47 2ayz h ARG 838 N 1.11 0.43 -0.14 0.20 1.12 -1.17 0.10 114.38 116.03 2ayz h ARG 838 Ca 0.41 -0.03 -0.19 0.00 -1.11 0.00 0.00 59.98 59.06 2ayz h ARG 838 Cb 0.15 -0.10 0.00 0.00 -0.01 0.00 0.00 29.97 30.01 2ayz h ARG 838 CO -0.17 0.28 -0.70 -0.07 -3.11 0.00 0.00 179.97 176.20 2ayz h LEU 839 N 0.44 0.71 -0.52 3.80 3.38 -1.17 -2.17 115.31 119.77 2ayz h LEU 839 Ca 0.15 -0.44 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 2ayz h LEU 839 Cb 0.02 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2ayz h LEU 839 CO -0.08 1.20 0.03 0.25 0.09 0.00 0.00 178.44 179.94 2ayz h LEU 840 N 0.43 0.88 -1.09 1.67 5.85 -0.40 -0.00 115.31 122.65 2ayz h LEU 840 Ca -0.03 -0.29 -0.07 0.00 0.84 0.00 0.00 57.88 58.33 2ayz h LEU 840 Cb 1.29 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 2ayz h LEU 840 CO 0.13 0.95 -0.33 0.00 -0.34 0.00 0.00 178.44 178.86 2ayz h ALA 841 N 0.96 1.06 -0.16 1.25 0.00 -0.98 -0.07 119.26 121.32 2ayz h ALA 841 Ca 0.15 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2ayz h ALA 841 Cb 0.48 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2ayz h ALA 841 CO 0.02 0.41 -0.07 0.22 0.00 0.00 0.00 179.25 179.83 2ayz h ASP 842 N 0.00 0.34 -0.56 0.00 3.58 -0.76 0.10 116.42 119.12 2ayz h ASP 842 Ca -0.00 -0.41 0.01 0.00 0.42 0.00 0.00 57.03 57.05 2ayz h ASP 842 Cb 0.80 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.73 2ayz h ASP 842 CO 0.04 0.67 0.37 1.56 -2.88 0.00 0.00 179.24 179.01 2ayz h GLN 843 N 0.01 0.74 -0.68 0.28 4.20 -0.73 -0.01 115.11 118.91 2ayz h GLN 843 Ca 0.04 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 2ayz h GLN 843 Cb 0.54 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 2ayz h GLN 843 CO 0.02 0.49 0.31 1.25 -0.67 0.00 0.00 178.83 180.23 2ayz h LEU 844 N 0.76 0.92 -1.58 1.46 7.12 -0.98 -1.86 115.31 121.15 2ayz h LEU 844 Ca 0.21 -0.15 -0.04 0.00 0.13 0.00 0.00 57.88 58.02 2ayz h LEU 844 Cb -0.09 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 39.80 2ayz h LEU 844 CO -0.04 0.81 -0.21 1.23 -0.13 0.00 0.00 178.44 180.09 2ayz h GLY 845 N 0.96 0.00 2.00 3.75 0.00 -0.33 -1.50 103.07 107.95 2ayz h GLY 845 Ca 0.23 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.46 2ayz h GLY 845 CO -0.03 0.00 -0.49 1.76 0.00 0.00 0.00 176.54 177.79 2ayz h SER 846 N 0.00 0.00 0.50 0.19 0.02 -0.23 -2.20 113.55 111.84 2ayz h SER 846 Ca -0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 2ayz h SER 846 Cb 0.38 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 2ayz h SER 846 CO 0.03 0.49 -0.41 -0.07 -1.14 0.00 0.00 176.83 175.72 2ayz h LEU 847 N 0.00 0.00 0.00 5.07 3.38 -0.63 -3.47 115.31 119.67 2ayz h LEU 847 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ayz h LEU 847 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 2ayz h LEU 847 CO 0.06 0.41 0.00 0.61 0.09 0.00 0.00 178.44 179.62 2ayz n GLY 848 N -0.20 0.62 3.96 0.83 0.00 -0.83 -5.07 105.19 104.50 2ayz n GLY 848 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.37 3.17 -0.07 1.61 2.02 -1.23 -5.02 117.35 115.46 2ayz s TYR 849 Ca 0.00 0.17 -0.30 0.00 -0.37 0.00 0.00 57.07 56.57 2ayz s TYR 849 Cb 0.00 -2.34 -0.05 0.00 -0.40 0.00 0.00 41.96 39.17 2ayz s TYR 849 CO 0.00 -0.39 1.59 -1.14 -1.57 0.00 0.00 175.55 174.04 2ayz s GLN 850 N -4.55 4.19 -0.38 -0.62 2.00 -0.87 -4.57 119.66 114.87 2ayz s GLN 850 Ca 0.49 2.11 -0.11 0.00 -2.00 0.00 0.00 55.36 55.85 2ayz s GLN 850 Cb -0.10 -3.93 0.03 0.00 0.80 0.00 0.00 33.01 29.81 2ayz s GLN 850 CO 0.37 -0.82 0.21 0.00 -0.50 0.00 0.00 175.29 174.56 2ayz s LYS 852 N 1.54 3.10 -0.09 0.00 3.01 -0.17 -4.93 119.74 122.21 2ayz s LYS 852 Ca 0.02 -0.82 -0.15 0.00 -1.01 0.00 0.00 55.97 54.00 2ayz s LYS 852 Cb -0.19 -3.95 -0.05 0.00 -1.01 0.00 0.00 37.83 32.63 2ayz s LYS 852 CO 0.06 -0.77 0.39 0.95 0.51 0.00 0.00 175.35 176.49 2ayz s THR 853 N 1.94 5.19 0.34 2.17 -4.23 -1.26 -0.76 115.64 119.02 2ayz s THR 853 Ca 0.09 0.77 0.07 0.00 -1.18 0.00 0.00 61.69 61.44 2ayz s THR 853 Cb -0.18 -3.71 -0.03 0.00 1.34 0.00 0.00 72.50 69.92 2ayz s THR 853 CO 0.12 0.43 0.26 0.00 -0.54 0.00 0.00 174.62 174.90 2ayz s ALA 854 N -0.00 1.96 -0.40 3.99 0.00 -1.02 -4.98 121.76 121.30 2ayz s ALA 854 Ca 0.22 -1.99 0.06 0.00 0.00 0.00 0.00 51.96 50.25 2ayz s ALA 854 Cb -0.15 1.42 0.21 0.00 0.00 0.00 0.00 23.12 24.59 2ayz s ALA 854 CO 0.09 -0.63 0.43 -1.71 0.00 0.00 0.00 175.76 173.94 2ayz n ASN 855 N -1.52 -0.28 0.00 0.00 5.15 -1.26 -2.45 115.26 114.91 2ayz n ASN 855 Ca 0.06 -2.53 0.00 0.00 -0.60 0.00 0.00 54.58 51.51 2ayz n ASN 855 Cb 0.63 -0.53 0.00 0.00 -0.53 0.00 0.00 39.78 39.35 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 2.20 0.00 -0.10 1.20 2.03 -1.17 -4.86 116.55 115.86 2ayz n ASP 856 Ca 0.26 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.36 2ayz n ASP 856 Cb 0.50 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.78 2ayz n ASP 856 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ayz n GLY 857 N -0.54 -0.43 0.13 0.27 0.00 -1.26 -4.13 105.19 99.23 2ayz n GLY 857 Ca 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 46.02 45.80 2ayz n GLY 857 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ayz h VAL 858 N -0.12 1.47 -0.23 1.61 2.07 -1.95 -3.02 116.25 116.08 2ayz h VAL 858 Ca -0.55 -2.32 -0.00 0.00 0.82 0.00 0.00 66.70 64.65 2ayz h VAL 858 Cb 1.88 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 33.88 2ayz h VAL 858 CO -0.09 0.67 0.13 -0.78 0.02 0.00 0.00 177.57 177.52 2ayz h ASP 859 N 0.05 0.27 -0.94 0.57 3.58 -1.90 -0.12 116.42 117.94 2ayz h ASP 859 Ca -0.01 -0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.45 2ayz h ASP 859 Cb 1.24 -0.07 -0.05 0.00 1.72 0.00 0.00 39.33 42.17 2ayz h ASP 859 CO 0.10 0.22 0.61 0.00 -2.88 0.00 0.00 179.24 177.29 2ayz h ALA 860 N 1.83 1.23 -0.04 -0.78 0.00 -1.68 0.36 119.26 120.17 2ayz h ALA 860 Ca 0.08 -0.05 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 2ayz h ALA 860 Cb 0.01 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 17.46 2ayz h ALA 860 CO -0.01 0.51 -0.89 1.25 0.00 0.00 0.00 179.25 180.10 2ayz h LEU 861 N 1.20 0.66 -0.13 0.00 5.85 -1.18 -2.03 115.31 119.68 2ayz h LEU 861 Ca 0.37 -0.49 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 2ayz h LEU 861 Cb -0.03 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 2ayz h LEU 861 CO -0.11 1.28 0.03 -1.13 -0.34 0.00 0.00 178.44 178.17 2ayz h ASN 862 N 0.32 0.20 0.15 1.25 -1.24 -0.78 -0.38 115.58 115.10 2ayz h ASN 862 Ca -0.08 -0.22 -0.04 0.00 0.71 0.00 0.00 56.30 56.67 2ayz h ASN 862 Cb 1.52 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 40.51 2ayz h ASN 862 CO 0.16 0.37 -0.18 1.62 -1.29 0.00 0.00 177.43 178.11 2ayz h VAL 863 N 0.02 1.15 -0.18 2.57 3.04 -0.99 -0.14 116.25 121.71 2ayz h VAL 863 Ca 0.04 -0.68 -0.07 0.00 -1.01 0.00 0.00 66.70 64.98 2ayz h VAL 863 Cb 0.24 1.32 -0.01 0.00 -2.01 0.00 0.00 31.29 30.83 2ayz h VAL 863 CO -0.00 0.20 -0.19 0.25 -1.01 0.00 0.00 177.57 176.82 2ayz h LEU 864 N 0.05 0.30 -0.39 3.16 7.12 -0.85 0.15 115.31 124.86 2ayz h LEU 864 Ca 0.01 -0.08 0.00 0.00 0.13 0.00 0.00 57.88 57.94 2ayz h LEU 864 Cb 0.34 -0.08 0.00 0.00 -0.53 0.00 0.00 40.66 40.39 2ayz h LEU 864 CO 0.02 0.51 0.00 0.28 -0.13 0.00 0.00 178.44 179.12 2ayz h SER 865 N 0.29 0.00 0.03 1.25 0.02 0.67 -3.31 113.55 112.50 2ayz h SER 865 Ca 0.05 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.66 2ayz h SER 865 Cb 0.50 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.00 2ayz h SER 865 CO 0.03 0.00 -1.91 1.17 -1.14 0.00 0.00 176.83 174.98 2ayz n LYS 866 N -2.41 0.63 -3.83 3.45 0.00 -0.59 -5.05 118.16 110.35 2ayz n LYS 866 Ca 0.04 0.37 -0.21 0.00 0.00 0.00 0.00 58.31 58.50 2ayz n LYS 866 Cb 0.36 -1.65 -0.05 0.00 0.00 0.00 0.00 35.03 33.69 2ayz n LYS 866 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2ayz n ASN 867 N -3.98 2.07 -3.86 3.14 5.15 0.43 -5.09 115.26 113.12 2ayz n ASN 867 Ca -0.39 -2.59 -0.37 0.00 -0.60 0.00 0.00 54.58 50.64 2ayz n ASN 867 Cb 0.87 0.50 -0.03 0.00 -0.53 0.00 0.00 39.78 40.59 2ayz n ASN 867 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 2ayz n HIS 868 N -0.79 3.27 -2.77 1.20 -0.00 -1.26 -4.61 115.22 110.26 2ayz n HIS 868 Ca -0.10 -3.47 -0.34 0.00 0.46 0.00 0.00 57.72 54.28 2ayz n HIS 868 Cb 0.45 -1.04 -0.06 0.00 -0.12 0.00 0.00 29.99 29.22 2ayz n HIS 868 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 2ayz s ILE 869 N -2.33 4.27 -0.26 3.57 1.09 -1.26 -4.85 121.20 121.43 2ayz s ILE 869 Ca 0.33 1.47 -0.06 0.00 -1.10 0.00 0.00 60.65 61.28 2ayz s ILE 869 Cb 0.05 -3.62 -0.14 0.00 -1.06 0.00 0.00 42.46 37.69 2ayz s ILE 869 CO 0.01 -0.25 -0.29 -0.67 -0.10 0.00 0.00 174.94 173.64 2ayz n ASP 870 N -0.55 1.97 -4.21 3.58 2.03 -0.83 -4.90 116.55 113.63 2ayz n ASP 870 Ca 0.07 0.11 -0.29 0.00 0.52 0.00 0.00 54.79 55.20 2ayz n ASP 870 Cb 0.53 -0.60 -0.16 0.00 -0.72 0.00 0.00 41.12 40.17 2ayz n ASP 870 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2ayz s ILE 871 N -2.49 1.80 -0.16 5.18 -1.09 -1.25 -4.38 121.20 118.82 2ayz s ILE 871 Ca -0.36 -0.93 0.01 0.00 -2.23 0.00 0.00 60.65 57.14 2ayz s ILE 871 Cb 0.12 -1.53 0.02 0.00 -1.58 0.00 0.00 42.46 39.48 2ayz s ILE 871 CO 0.52 0.51 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.88 2ayz s VAL 872 N -0.09 1.78 -0.15 2.92 1.01 -1.10 -1.28 120.40 123.49 2ayz s VAL 872 Ca -0.04 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 2ayz s VAL 872 Cb -0.13 -1.63 0.04 0.00 0.00 0.00 0.00 36.38 34.66 2ayz s VAL 872 CO 0.03 0.49 -0.05 -1.48 0.00 0.00 0.00 175.10 174.10 2ayz s LEU 873 N 1.34 1.45 -0.13 3.92 0.05 -1.05 -0.62 118.68 123.64 2ayz s LEU 873 Ca 0.03 -0.58 -0.01 0.00 0.05 0.00 0.00 54.13 53.62 2ayz s LEU 873 Cb -0.13 -0.85 -0.02 0.00 -2.05 0.00 0.00 46.19 43.14 2ayz s LEU 873 CO -0.10 -0.18 -0.08 -0.94 -0.55 0.00 0.00 176.35 174.50 2ayz s SER 874 N 1.68 4.49 -0.22 1.48 1.04 -0.97 -2.22 113.70 118.98 2ayz s SER 874 Ca 0.02 -0.17 -0.09 0.00 0.48 0.00 0.00 55.95 56.18 2ayz s SER 874 Cb -0.15 -1.58 -0.05 0.00 0.10 0.00 0.00 66.02 64.35 2ayz s SER 874 CO -0.08 0.21 0.12 -0.62 0.98 0.00 0.00 173.24 173.86 2ayz s ASP 875 N 0.09 5.93 -0.13 7.02 -1.08 0.44 -1.25 116.67 127.69 2ayz s ASP 875 Ca -0.03 0.10 0.00 0.00 -0.52 0.00 0.00 52.55 52.11 2ayz s ASP 875 Cb -0.14 -2.05 0.02 0.00 -1.46 0.00 0.00 42.92 39.29 2ayz s ASP 875 CO 0.03 0.11 -0.12 -0.69 0.52 0.00 0.00 175.17 175.02 2ayz s VAL 876 N 0.79 1.34 -0.24 1.11 1.01 -0.55 -1.11 120.40 122.75 2ayz s VAL 876 Ca 0.06 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.58 2ayz s VAL 876 Cb -0.13 -1.28 -0.17 0.00 0.00 0.00 0.00 36.38 34.80 2ayz s VAL 876 CO 0.02 0.42 -0.19 -3.20 0.00 0.00 0.00 175.10 172.15 2ayz n ASN 877 N 4.71 1.91 -4.61 3.32 4.05 -1.26 -1.86 115.26 121.52 2ayz n ASN 877 Ca -0.16 -0.12 -0.43 0.00 0.45 0.00 0.00 54.58 54.32 2ayz n ASN 877 Cb 0.50 -0.25 -0.02 0.00 1.23 0.00 0.00 39.78 41.24 2ayz n ASN 877 CO 0.00 0.00 0.00 -0.32 -3.05 0.00 0.00 177.26 173.89 2ayz s MET 878 N -2.49 3.55 0.11 1.20 1.75 -1.26 -4.75 119.30 117.41 2ayz s MET 878 Ca -0.31 1.31 -0.27 0.00 -1.25 0.00 0.00 55.69 55.17 2ayz s MET 878 Cb 0.08 -4.09 -0.09 0.00 2.84 0.00 0.00 34.83 33.57 2ayz s MET 878 CO 0.59 -1.59 1.64 -1.00 -0.65 0.00 0.00 175.02 174.01 2ayz h PRO 879 N 11.47 -0.45 -0.59 4.11 0.13 -1.79 -3.04 132.00 141.84 2ayz h PRO 879 Ca -0.31 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2ayz h PRO 879 Cb 1.14 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2ayz h PRO 879 CO 1.04 -0.30 0.00 0.09 -0.23 0.00 0.00 178.00 178.60 2ayz n ASN 880 N -5.37 4.86 -4.32 1.44 4.13 -1.26 -4.21 115.26 110.52 2ayz n ASN 880 Ca -0.07 -2.58 -0.45 0.00 1.68 0.00 0.00 54.58 53.16 2ayz n ASN 880 Cb 0.28 -0.59 -0.01 0.00 -1.54 0.00 0.00 39.78 37.92 2ayz n ASN 880 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 2ayz s MET 881 N -2.09 4.01 -1.35 3.52 1.75 -1.15 -4.63 119.30 119.35 2ayz s MET 881 Ca 0.50 -3.06 0.00 0.00 -1.25 0.00 0.00 55.69 51.89 2ayz s MET 881 Cb 0.34 -4.49 0.00 0.00 2.84 0.00 0.00 34.83 33.53 2ayz s MET 881 CO 0.21 -1.25 0.00 -3.47 -0.65 0.00 0.00 175.02 169.86 2ayz n ASP 882 N 2.96 -5.05 -3.13 1.11 2.03 -1.26 -4.85 116.55 108.35 2ayz n ASP 882 Ca 0.21 0.32 -0.22 0.00 0.52 0.00 0.00 54.79 55.61 2ayz n ASP 882 Cb 0.41 -3.67 -0.02 0.00 -0.72 0.00 0.00 41.12 37.11 2ayz n ASP 882 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ayz n GLY 883 N -0.73 3.16 0.00 0.27 0.00 -1.26 -3.09 105.19 103.54 2ayz n GLY 883 Ca -0.13 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.00 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 4.06 0.00 0.29 1.61 4.11 -1.26 -4.90 117.16 121.08 2ayz n TYR 884 Ca 0.46 0.00 0.14 0.00 -0.00 0.00 0.00 57.90 58.50 2ayz n TYR 884 Cb 0.16 0.00 0.88 0.00 -0.00 0.00 0.00 39.34 40.38 2ayz n TYR 884 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.86 176.77 2ayz h ARG 885 N 0.00 0.00 0.00 -3.48 1.12 -1.89 0.21 114.38 110.34 2ayz h ARG 885 Ca 0.00 0.00 -0.05 0.00 -1.11 0.00 0.00 59.98 58.82 2ayz h ARG 885 Cb 0.00 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 -0.24 1.37 -3.11 0.00 0.00 179.97 177.99 2ayz h LEU 886 N 0.00 0.00 -0.33 3.80 8.10 -1.93 0.88 115.31 125.83 2ayz h LEU 886 Ca -0.00 0.00 -0.20 0.00 0.11 0.00 0.00 57.88 57.79 2ayz h LEU 886 Cb 0.01 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.23 2ayz h LEU 886 CO 0.00 0.24 -0.77 0.74 -4.11 0.00 0.00 178.44 174.55 2ayz h THR 887 N 0.00 1.36 -0.13 0.15 2.02 -0.87 -2.30 112.91 113.15 2ayz h THR 887 Ca -0.00 -2.14 -0.01 0.00 0.77 0.00 0.00 66.41 65.03 2ayz h THR 887 Cb 0.47 2.12 -0.01 0.00 -1.74 0.00 0.00 68.15 69.00 2ayz h THR 887 CO 0.03 0.65 0.06 -0.61 0.37 0.00 0.00 175.52 176.02 2ayz h GLN 888 N 0.32 0.19 -0.41 6.66 -0.00 -0.84 -2.51 115.11 118.51 2ayz h GLN 888 Ca -0.04 -0.03 0.01 0.00 -0.00 0.00 0.00 58.65 58.59 2ayz h GLN 888 Cb 1.36 -0.03 -0.02 0.00 0.00 0.00 0.00 27.48 28.79 2ayz h GLN 888 CO 0.14 0.27 0.27 -0.09 0.00 0.00 0.00 178.83 179.42 2ayz h ARG 889 N 0.06 0.53 0.06 1.69 9.65 -0.89 0.62 114.38 126.09 2ayz h ARG 889 Ca 0.04 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.89 2ayz h ARG 889 Cb 0.15 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.61 2ayz h ARG 889 CO -0.00 0.35 -0.03 0.82 2.80 0.00 0.00 179.97 183.91 2ayz h ILE 890 N 0.54 0.99 0.00 1.20 2.04 -1.10 -0.60 117.51 120.58 2ayz h ILE 890 Ca 0.15 -0.14 -0.05 0.00 1.00 0.00 0.00 64.86 65.83 2ayz h ILE 890 Cb -0.04 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 2ayz h ILE 890 CO -0.03 0.03 -0.23 0.08 0.00 0.00 0.00 178.15 178.00 2ayz h ARG 891 N -0.13 0.00 -0.03 2.37 0.11 -0.99 -1.94 114.38 113.77 2ayz h ARG 891 Ca -0.01 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.04 2ayz h ARG 891 Cb 0.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.19 2ayz h ARG 891 CO 0.01 0.23 -0.10 1.96 0.10 0.00 0.00 179.97 182.17 2ayz h GLN 892 N 0.00 0.12 0.12 0.08 1.08 -0.62 -3.39 115.11 112.51 2ayz h GLN 892 Ca -0.00 -0.09 -0.01 0.00 -1.45 0.00 0.00 58.65 57.10 2ayz h GLN 892 Cb 0.84 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.29 2ayz h GLN 892 CO 0.03 0.72 -0.06 1.25 -0.95 0.00 0.00 178.83 179.82 2ayz h LEU 893 N -0.45 -0.14 0.00 1.46 5.85 -1.08 -3.49 115.31 117.46 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 0.73 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.80 2ayz h LEU 893 CO 0.02 0.02 0.00 0.61 -0.34 0.00 0.00 178.44 178.75 2ayz n GLY 894 N 0.86 -0.06 3.96 3.75 0.00 -0.74 -5.11 105.19 107.86 2ayz n GLY 894 Ca -0.02 0.67 -0.22 0.00 0.00 0.00 0.00 46.02 46.44 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 3.31 0.00 0.99 2.34 -1.16 -4.96 118.68 119.20 2ayz s LEU 895 Ca 0.00 0.15 0.00 0.00 0.06 0.00 0.00 54.13 54.34 2ayz s LEU 895 Cb 0.00 -3.00 0.00 0.00 -0.56 0.00 0.00 46.19 42.63 2ayz s LEU 895 CO 0.00 -1.08 0.00 0.41 -1.06 0.00 0.00 176.35 174.62 2ayz n THR 896 N -2.35 0.00 -3.94 5.48 -1.04 -1.26 -5.09 114.28 106.07 2ayz n THR 896 Ca 0.06 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.86 2ayz n THR 896 Cb 0.59 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 69.08 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 -0.67 4.22 -0.14 -4.42 2.01 -1.26 -5.05 118.68 113.36 2ayz s LEU 897 Ca 0.00 0.00 -0.29 0.00 0.01 0.00 0.00 54.13 53.85 2ayz s LEU 897 Cb 0.00 -2.78 -0.03 0.00 0.01 0.00 0.00 46.19 43.39 2ayz s LEU 897 CO 0.00 -0.10 1.54 -2.84 1.01 0.00 0.00 176.35 175.96 2ayz s PRO 898 N -3.98 4.05 -0.48 1.29 0.02 -1.26 -4.93 135.00 129.70 2ayz s PRO 898 Ca 0.35 1.86 -0.17 0.00 0.02 0.00 0.00 61.00 63.05 2ayz s PRO 898 Cb -0.09 -3.95 0.06 0.00 0.02 0.00 0.00 34.50 30.54 2ayz s PRO 898 CO 0.29 -0.98 0.50 0.08 -0.33 0.00 0.00 177.00 176.56 2ayz s VAL 899 N 4.35 5.05 -0.46 3.83 1.01 -1.08 -2.72 120.40 130.38 2ayz s VAL 899 Ca 0.68 -0.68 -0.18 0.00 0.00 0.00 0.00 61.98 61.80 2ayz s VAL 899 Cb -0.27 -4.19 0.04 0.00 0.00 0.00 0.00 36.38 31.96 2ayz s VAL 899 CO 0.26 -0.65 0.50 -0.63 0.00 0.00 0.00 175.10 174.57 2ayz s ILE 900 N 2.17 5.04 -0.76 2.22 1.01 0.21 -1.47 121.20 129.61 2ayz s ILE 900 Ca 0.10 -0.51 -0.22 0.00 0.00 0.00 0.00 60.65 60.02 2ayz s ILE 900 Cb -0.21 -4.15 0.08 0.00 0.01 0.00 0.00 42.46 38.19 2ayz s ILE 900 CO 0.10 -0.58 1.08 -0.83 0.00 0.00 0.00 174.94 174.71 2ayz s GLY 901 N 2.25 1.43 -0.25 6.18 0.00 0.01 -2.28 107.32 114.65 2ayz s GLY 901 Ca 0.12 -2.04 -0.28 0.00 0.00 0.00 0.00 44.72 42.52 2ayz s GLY 901 CO 0.12 2.17 0.99 0.54 0.00 0.00 0.00 173.10 176.92 2ayz s VAL 902 N 4.02 4.69 0.12 1.40 0.11 -0.38 -0.83 120.40 129.53 2ayz s VAL 902 Ca 0.28 1.83 -0.04 0.00 -2.93 0.00 0.00 61.98 61.12 2ayz s VAL 902 Cb -0.12 -4.28 -0.03 0.00 -1.53 0.00 0.00 36.38 30.43 2ayz s VAL 902 CO 0.04 -0.22 0.12 0.42 -3.33 0.00 0.00 175.10 172.14 2ayz s THR 903 N 3.20 0.12 -0.07 5.04 -4.23 -0.05 -1.49 115.64 118.17 2ayz s THR 903 Ca 0.42 -1.64 -0.06 0.00 -1.18 0.00 0.00 61.69 59.23 2ayz s THR 903 Cb -0.14 -1.78 0.02 0.00 1.34 0.00 0.00 72.50 71.94 2ayz s THR 903 CO 0.08 -0.56 0.19 0.00 -0.54 0.00 0.00 174.62 173.79 2ayz s ALA 904 N -3.97 -0.46 -1.17 3.99 0.00 -0.78 -1.69 121.76 117.68 2ayz s ALA 904 Ca 0.16 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.65 2ayz s ALA 904 Cb 0.06 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.87 2ayz s ALA 904 CO -0.03 -0.09 0.00 -1.71 0.00 0.00 0.00 175.76 173.93 2ayz n ASN 905 N 3.03 -4.20 -0.05 0.00 5.15 -1.26 -4.50 115.26 113.44 2ayz n ASN 905 Ca -0.13 0.02 0.11 0.00 -0.60 0.00 0.00 54.58 53.98 2ayz n ASN 905 Cb 0.58 -3.33 0.13 0.00 -0.53 0.00 0.00 39.78 36.63 2ayz n ASN 905 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ayz n ALA 906 N -1.38 3.92 0.00 5.20 0.00 -1.26 -4.50 120.51 122.49 2ayz n ALA 906 Ca -0.16 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.83 2ayz n ALA 906 Cb 0.60 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.07 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 -1.35 0.00 -3.01 0.00 4.32 -1.26 -4.31 117.00 111.39 2ayz n LEU 907 Ca 0.06 0.00 -0.15 0.00 -0.02 0.00 0.00 56.01 55.90 2ayz n LEU 907 Cb 0.34 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 42.13 2ayz n LEU 907 CO 0.37 0.00 -0.17 0.00 -1.22 0.00 0.00 177.39 176.36 2ayz n ALA 908 N 0.00 2.36 -0.08 -1.18 0.00 -1.26 -4.97 120.51 115.38 2ayz n ALA 908 Ca 0.00 -3.24 -0.07 0.00 0.00 0.00 0.00 53.44 50.13 2ayz n ALA 908 Cb 0.00 -0.94 -0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 2.99 0.09 -0.41 0.00 3.07 -1.94 -0.64 114.58 117.74 2ayz h GLU 909 Ca 0.03 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.91 2ayz h GLU 909 Cb 1.04 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.91 2ayz h GLU 909 CO 0.48 0.06 0.27 0.93 -1.40 0.00 0.00 179.01 179.36 2ayz h GLU 910 N 0.09 0.43 -0.25 2.33 5.08 -1.97 -0.17 114.58 120.11 2ayz h GLU 910 Ca 0.14 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.31 2ayz h GLU 910 Cb 0.19 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2ayz h GLU 910 CO -0.24 0.28 -0.52 -0.22 -1.00 0.00 0.00 179.01 177.31 2ayz h LYS 911 N 0.44 0.73 0.00 2.33 3.64 -1.57 -2.22 116.57 119.92 2ayz h LYS 911 Ca 0.16 -0.45 -0.14 0.00 -1.27 0.00 0.00 60.65 58.95 2ayz h LYS 911 Cb 0.11 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 2ayz h LYS 911 CO -0.04 1.07 -0.69 1.96 -2.27 0.00 0.00 179.45 179.48 2ayz h GLN 912 N 0.57 0.00 -0.86 1.90 7.50 -0.34 -1.13 115.11 122.75 2ayz h GLN 912 Ca 0.02 0.00 0.02 0.00 0.50 0.00 0.00 58.65 59.18 2ayz h GLN 912 Cb 1.10 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 28.58 2ayz h GLN 912 CO 0.11 0.69 0.56 -0.09 -1.50 0.00 0.00 178.83 178.60 2ayz h ARG 913 N 0.00 1.10 -0.17 1.46 2.43 -0.92 -0.98 114.38 117.29 2ayz h ARG 913 Ca -0.01 -0.07 -0.21 0.00 -0.81 0.00 0.00 59.98 58.88 2ayz h ARG 913 Cb 1.25 -0.25 0.01 0.00 -0.42 0.00 0.00 29.97 30.56 2ayz h ARG 913 CO 0.09 0.73 -0.73 0.00 -1.51 0.00 0.00 179.97 178.55 2ayz h LEU 915 N 0.54 -0.08 -0.34 0.00 -0.00 -1.07 -3.22 115.31 111.14 2ayz h LEU 915 Ca -0.04 -0.46 -0.07 0.00 -0.00 0.00 0.00 57.88 57.30 2ayz h LEU 915 Cb 1.35 0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 42.02 2ayz h LEU 915 CO 0.15 0.45 -0.35 -0.33 -0.00 0.00 0.00 178.44 178.36 2ayz h GLU 916 N -0.64 0.00 -6.24 1.13 4.39 -1.31 -3.48 114.58 108.43 2ayz h GLU 916 Ca -0.01 0.00 -0.44 0.00 0.34 0.00 0.00 59.36 59.25 2ayz h GLU 916 Cb 0.54 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.21 2ayz h GLU 916 CO 0.02 0.35 -0.87 0.43 -1.16 0.00 0.00 179.01 177.78 2ayz n SER 917 N -3.26 -1.67 -1.05 1.42 7.64 -0.01 -3.44 113.62 113.25 2ayz n SER 917 Ca 0.02 -0.92 0.02 0.00 1.01 0.00 0.00 58.87 59.00 2ayz n SER 917 Cb 0.62 -3.62 0.01 0.00 -1.01 0.00 0.00 64.21 60.20 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 -1.73 0.78 0.00 0.23 0.00 -1.22 -4.65 105.19 98.60 2ayz n GLY 918 Ca -0.27 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.30 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 0.27 0.00 0.00 1.61 1.56 -1.26 -4.69 117.12 114.61 2ayz n MET 919 Ca 0.02 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.45 2ayz n MET 919 Cb 0.93 0.00 0.00 0.00 2.15 0.00 0.00 33.22 36.30 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 -4.03 6.12 2.03 -0.54 -2.63 116.55 117.50 2ayz n ASP 920 Ca 0.00 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.22 2ayz n ASP 920 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 2ayz n ASP 920 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2ayz s SER 921 N 0.00 0.21 0.05 1.67 0.01 -1.08 -5.01 113.70 109.55 2ayz s SER 921 Ca 0.00 -0.97 0.08 0.00 1.31 0.00 0.00 55.95 56.37 2ayz s SER 921 Cb 0.00 0.34 -0.03 0.00 0.21 0.00 0.00 66.02 66.54 2ayz s SER 921 CO 0.00 -0.77 -0.22 0.00 0.41 0.00 0.00 173.24 172.66 2ayz n LEU 923 N 1.70 0.00 -4.51 0.00 4.77 -0.01 -4.90 117.00 114.05 2ayz n LEU 923 Ca -0.17 -2.03 -0.33 0.00 -0.03 0.00 0.00 56.01 53.45 2ayz n LEU 923 Cb 0.53 0.97 -0.12 0.00 -2.33 0.00 0.00 43.42 42.47 2ayz n LEU 923 CO 0.23 -0.33 -0.42 -0.94 -1.33 0.00 0.00 177.39 174.60 2ayz s SER 924 N -2.52 4.33 0.27 -1.43 1.04 -1.26 -0.87 113.70 113.26 2ayz s SER 924 Ca 0.23 -0.14 -0.08 0.00 0.48 0.00 0.00 55.95 56.44 2ayz s SER 924 Cb 0.01 -1.14 0.44 0.00 0.10 0.00 0.00 66.02 65.43 2ayz s SER 924 CO 0.16 0.32 1.54 1.17 0.98 0.00 0.00 173.24 177.41 2ayz n LYS 925 N 2.52 -0.10 -1.03 4.02 4.81 -0.68 -2.99 118.16 124.71 2ayz n LYS 925 Ca -0.18 1.54 -0.37 0.00 -0.87 0.00 0.00 58.31 58.43 2ayz n LYS 925 Cb 0.53 -2.30 -0.04 0.00 0.02 0.00 0.00 35.03 33.24 2ayz n LYS 925 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2ayz n PRO 926 N -5.60 1.68 -3.08 1.64 -0.02 -1.26 -4.91 135.00 123.44 2ayz n PRO 926 Ca 0.16 -1.73 -0.40 0.00 -2.02 0.00 0.00 63.50 59.50 2ayz n PRO 926 Cb 0.49 -2.78 -0.05 0.00 -0.02 0.00 0.00 33.50 31.14 2ayz n PRO 926 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2ayz s VAL 927 N 4.51 5.03 0.74 -1.45 -7.23 -1.16 -5.07 120.40 115.77 2ayz s VAL 927 Ca 0.51 1.31 -0.04 0.00 -1.81 0.00 0.00 61.98 61.95 2ayz s VAL 927 Cb 0.13 -3.99 0.12 0.00 0.56 0.00 0.00 36.38 33.20 2ayz s VAL 927 CO 0.07 0.17 1.03 0.42 -0.31 0.00 0.00 175.10 176.48 2ayz s THR 928 N 1.42 2.19 0.17 5.32 -4.23 -1.26 -4.86 115.64 114.38 2ayz s THR 928 Ca 0.33 -0.45 -0.15 0.00 -1.18 0.00 0.00 61.69 60.24 2ayz s THR 928 Cb -0.16 -2.73 0.04 0.00 1.34 0.00 0.00 72.50 70.99 2ayz s THR 928 CO 0.13 0.00 1.80 0.25 -0.54 0.00 0.00 174.62 176.27 2ayz h LEU 929 N -0.67 0.43 -0.36 4.79 7.12 -1.97 -0.35 115.31 124.29 2ayz h LEU 929 Ca -0.39 0.01 -0.04 0.00 0.13 0.00 0.00 57.88 57.58 2ayz h LEU 929 Cb 1.27 -0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 41.30 2ayz h LEU 929 CO 0.44 0.30 0.06 -0.78 -0.13 0.00 0.00 178.44 178.33 2ayz h ASP 930 N 0.53 0.58 -0.29 1.25 3.58 -1.98 -1.02 116.42 119.06 2ayz h ASP 930 Ca 0.18 -0.26 -0.01 0.00 0.42 0.00 0.00 57.03 57.36 2ayz h ASP 930 Cb 0.02 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 2ayz h ASP 930 CO -0.09 0.69 0.13 0.58 -2.88 0.00 0.00 179.24 177.68 2ayz h VAL 931 N 0.44 1.16 -0.34 2.25 2.07 -1.89 -1.06 116.25 118.88 2ayz h VAL 931 Ca 0.11 -0.46 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 2ayz h VAL 931 Cb 0.36 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 2ayz h VAL 931 CO 0.01 0.16 0.04 -0.29 0.02 0.00 0.00 177.57 177.51 2ayz h ILE 932 N 0.33 1.18 -0.08 4.57 2.10 -0.97 -1.99 117.51 122.66 2ayz h ILE 932 Ca 0.10 -0.67 -0.11 0.00 1.08 0.00 0.00 64.86 65.26 2ayz h ILE 932 Cb 0.13 0.88 -0.01 0.00 -1.09 0.00 0.00 36.82 36.74 2ayz h ILE 932 CO -0.01 0.24 -0.43 0.50 -1.08 0.00 0.00 178.15 177.36 2ayz h LYS 933 N 0.49 0.18 0.85 2.19 3.64 -0.65 -0.06 116.57 123.21 2ayz h LYS 933 Ca 0.11 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 2ayz h LYS 933 Cb 0.26 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.09 2ayz h LYS 933 CO 0.00 0.58 -0.41 1.96 -2.27 0.00 0.00 179.45 179.32 2ayz h GLN 934 N 0.15 -1.10 -0.68 1.90 4.20 -0.44 -2.06 115.11 117.08 2ayz h GLN 934 Ca 0.01 0.08 -0.07 0.00 0.06 0.00 0.00 58.65 58.73 2ayz h GLN 934 Cb 0.83 0.25 -0.03 0.00 0.30 0.00 0.00 27.48 28.83 2ayz h GLN 934 CO 0.06 -0.73 0.14 1.15 -0.67 0.00 0.00 178.83 178.78 2ayz h THR 935 N -1.21 1.26 0.40 -0.54 2.02 -1.49 -2.28 112.91 111.08 2ayz h THR 935 Ca -0.12 -0.98 -0.02 0.00 0.77 0.00 0.00 66.41 66.06 2ayz h THR 935 Cb 0.88 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 2ayz h THR 935 CO 0.19 0.37 -0.23 -0.07 0.37 0.00 0.00 175.52 176.15 2ayz h LEU 936 N 1.03 -0.58 -1.26 2.58 -0.00 -1.03 -1.90 115.31 114.14 2ayz h LEU 936 Ca 0.21 0.03 -0.05 0.00 -0.00 0.00 0.00 57.88 58.07 2ayz h LEU 936 Cb 0.39 0.17 -0.02 0.00 -0.00 0.00 0.00 40.66 41.20 2ayz h LEU 936 CO 0.01 -0.37 -0.03 0.74 -0.00 0.00 0.00 178.44 178.79 2ayz h THR 937 N -0.59 1.19 -0.01 0.22 2.02 -1.42 0.48 112.91 114.80 2ayz h THR 937 Ca -0.05 -0.78 -0.00 0.00 0.77 0.00 0.00 66.41 66.34 2ayz h THR 937 Cb 0.47 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 2ayz h THR 937 CO 0.06 0.26 -0.00 0.25 0.37 0.00 0.00 175.52 176.47 2ayz h LEU 938 N 0.45 0.01 -0.56 2.58 5.85 -1.42 -2.44 115.31 119.78 2ayz h LEU 938 Ca 0.10 -0.32 -0.15 0.00 0.84 0.00 0.00 57.88 58.35 2ayz h LEU 938 Cb 0.34 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2ayz h LEU 938 CO 0.01 0.33 -0.71 1.88 -0.34 0.00 0.00 178.44 179.61 2ayz h TYR 939 N -0.30 0.07 -0.36 1.25 0.05 -1.13 -2.39 116.97 114.15 2ayz h TYR 939 Ca 0.00 -0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.76 2ayz h TYR 939 Cb 0.32 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.03 2ayz h TYR 939 CO 0.03 0.74 0.22 0.00 -1.05 0.00 0.00 178.16 178.10 2ayz h ALA 940 N 1.25 0.45 -0.04 3.88 0.00 -0.87 -0.00 119.26 123.93 2ayz h ALA 940 Ca -0.01 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 2ayz h ALA 940 Cb 1.26 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2ayz h ALA 940 CO 0.10 -0.13 -0.47 1.05 0.00 0.00 0.00 179.25 179.80 2ayz h GLU 941 N 0.44 0.10 -0.12 0.00 4.11 -1.36 -1.18 114.58 116.56 2ayz h GLU 941 Ca 0.14 -0.05 -0.02 0.00 0.07 0.00 0.00 59.36 59.50 2ayz h GLU 941 Cb -0.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2ayz h GLU 941 CO -0.06 0.55 -0.00 0.00 0.07 0.00 0.00 179.01 179.57 2ayz h ARG 942 N 0.08 0.22 -0.01 1.06 3.08 -0.85 -1.38 114.38 116.58 2ayz h ARG 942 Ca 0.00 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 59.86 2ayz h ARG 942 Cb 0.87 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 2ayz h ARG 942 CO 0.07 0.47 -0.58 -0.39 -1.07 0.00 0.00 179.97 178.47 2ayz h VAL 943 N -0.06 1.41 0.04 2.04 -1.51 -0.99 -2.00 116.25 115.18 2ayz h VAL 943 Ca 0.03 -1.97 -0.00 0.00 -1.23 0.00 0.00 66.70 63.53 2ayz h VAL 943 Cb 0.37 2.05 0.00 0.00 -2.13 0.00 0.00 31.29 31.58 2ayz h VAL 943 CO 0.01 0.56 -0.02 -0.09 -1.23 0.00 0.00 177.57 176.80 2ayz h ARG 944 N 0.02 -0.05 -0.20 5.19 9.65 -0.98 -0.22 114.38 127.78 2ayz h ARG 944 Ca -0.01 0.00 -0.14 0.00 -1.10 0.00 0.00 59.98 58.74 2ayz h ARG 944 Cb 1.02 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.61 2ayz h ARG 944 CO 0.08 0.08 -0.47 1.57 2.80 0.00 0.00 179.97 184.03 2ayz h LYS 945 N -0.17 0.50 0.00 0.20 2.10 -1.24 0.15 116.57 118.11 2ayz h LYS 945 Ca -0.01 -0.28 -0.01 0.00 -2.00 0.00 0.00 60.65 58.35 2ayz h LYS 945 Cb 0.15 0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 31.50 2ayz h LYS 945 CO 0.01 0.87 -0.04 0.77 -2.00 0.00 0.00 179.45 179.05 2ayz h SER 946 N 0.40 0.00 0.47 7.07 0.02 -1.21 -2.08 113.55 118.23 2ayz h SER 946 Ca 0.02 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2ayz h SER 946 Cb 0.98 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.51 2ayz h SER 946 CO 0.09 0.04 -1.53 -1.14 -1.14 0.00 0.00 176.83 173.15 2ayz n ARG 947 N -3.17 0.63 0.03 3.45 0.00 -0.11 -4.47 116.66 113.03 2ayz n ARG 947 Ca 0.00 -0.04 -0.12 0.00 -0.00 0.00 0.00 57.85 57.69 2ayz n ARG 947 Cb 0.31 -1.67 -0.08 0.00 0.00 0.00 0.00 32.46 31.02 2ayz n ARG 947 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 2ayz h ASP 948 N 0.00 -0.02 -0.01 6.15 3.58 -0.24 -3.51 116.42 122.38 2ayz h ASP 948 Ca -0.01 -0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.25 2ayz h ASP 948 Cb 1.02 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.08 2ayz h ASP 948 CO 0.00 0.18 0.00 -1.20 -2.88 0.00 0.00 179.24 175.34