#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 -2.38 -2.86 7.82 0.00 -1.26 -4.99 120.51 116.84 2ayz n ALA 818 Ca 0.00 0.19 -0.34 0.00 0.00 0.00 0.00 53.44 53.28 2ayz n ALA 818 Cb 0.00 -0.87 -0.10 0.00 0.00 0.00 0.00 19.45 18.48 2ayz n ALA 818 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ayz s VAL 819 N -1.71 4.56 -0.60 0.00 0.11 -1.26 -5.03 120.40 116.47 2ayz s VAL 819 Ca 0.00 -0.11 0.06 0.00 -2.93 0.00 0.00 61.98 59.00 2ayz s VAL 819 Cb 0.00 -3.05 0.24 0.00 -1.53 0.00 0.00 36.38 32.05 2ayz s VAL 819 CO 0.00 0.47 0.68 -1.20 -3.33 0.00 0.00 175.10 171.72 2ayz n SER 820 N 3.57 3.08 -3.95 3.54 7.64 -1.26 -5.05 113.62 121.19 2ayz n SER 820 Ca -0.17 -3.29 -0.26 0.00 1.01 0.00 0.00 58.87 56.16 2ayz n SER 820 Cb 0.52 -0.67 -0.17 0.00 -1.01 0.00 0.00 64.21 62.88 2ayz n SER 820 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2ayz s ASP 821 N -2.15 2.05 -0.06 6.43 2.15 -1.26 -5.00 116.67 118.83 2ayz s ASP 821 Ca 0.38 -0.31 -0.02 0.00 0.43 0.00 0.00 52.55 53.03 2ayz s ASP 821 Cb 0.13 -0.85 -0.03 0.00 -0.30 0.00 0.00 42.92 41.88 2ayz s ASP 821 CO -0.04 -0.06 -0.06 -3.20 -0.17 0.00 0.00 175.17 171.63 2ayz n ASN 822 N 4.53 1.67 0.00 -0.34 2.85 -1.26 -5.04 115.26 117.66 2ayz n ASN 822 Ca -0.17 0.03 0.00 0.00 -0.11 0.00 0.00 54.58 54.33 2ayz n ASN 822 Cb 0.51 -0.14 0.00 0.00 1.24 0.00 0.00 39.78 41.39 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 -3.02 0.00 0.00 1.20 2.03 -1.26 -5.06 116.55 110.45 2ayz n ASP 823 Ca -0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.20 2ayz n ASP 823 Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 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 0.00 0.00 -3.66 1.67 2.03 -1.26 -4.74 116.55 110.59 2ayz n ASP 824 Ca 0.00 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.11 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 -0.32 -1.92 0.00 0.00 177.20 174.96 2ayz s MET 825 N 0.00 -0.04 -0.22 -0.67 1.75 -1.26 -5.09 119.30 113.77 2ayz s MET 825 Ca 0.00 0.40 -0.05 0.00 -1.25 0.00 0.00 55.69 54.79 2ayz s MET 825 Cb 0.00 -0.54 -0.02 0.00 2.84 0.00 0.00 34.83 37.11 2ayz s MET 825 CO 0.00 -0.35 -0.01 0.00 -0.65 0.00 0.00 175.02 174.01 2ayz s MET 826 N 2.20 3.50 -0.03 4.11 0.23 -1.26 -2.50 119.30 125.55 2ayz s MET 826 Ca 0.04 -0.56 0.04 0.00 -1.03 0.00 0.00 55.69 54.18 2ayz s MET 826 Cb -0.12 -3.09 -0.03 0.00 -1.53 0.00 0.00 34.83 30.06 2ayz s MET 826 CO -0.04 -0.13 -0.15 0.42 -2.03 0.00 0.00 175.02 173.09 2ayz s ILE 827 N 1.35 3.01 -0.35 3.16 -1.09 -0.08 -0.85 121.20 126.37 2ayz s ILE 827 Ca 0.04 -0.82 -0.10 0.00 -2.23 0.00 0.00 60.65 57.54 2ayz s ILE 827 Cb -0.15 -2.20 0.01 0.00 -1.58 0.00 0.00 42.46 38.55 2ayz s ILE 827 CO -0.00 0.54 0.18 -0.22 -1.23 0.00 0.00 174.94 174.20 2ayz s LEU 828 N -0.89 4.43 -0.45 2.97 2.96 -0.95 -0.78 118.68 125.97 2ayz s LEU 828 Ca 0.12 -0.81 -0.16 0.00 -0.22 0.00 0.00 54.13 53.06 2ayz s LEU 828 Cb -0.11 -2.00 0.05 0.00 0.50 0.00 0.00 46.19 44.63 2ayz s LEU 828 CO 0.02 -0.30 0.42 0.68 -1.32 0.00 0.00 176.35 175.84 2ayz s VAL 829 N 1.57 5.15 -0.05 1.68 -7.23 0.60 -1.60 120.40 120.52 2ayz s VAL 829 Ca 0.03 -0.74 -0.01 0.00 -1.81 0.00 0.00 61.98 59.44 2ayz s VAL 829 Cb -0.18 -4.09 -0.04 0.00 0.56 0.00 0.00 36.38 32.63 2ayz s VAL 829 CO 0.06 -0.52 0.05 -0.69 -0.31 0.00 0.00 175.10 173.69 2ayz s VAL 830 N 1.91 4.60 -0.25 1.32 1.01 0.06 -2.19 120.40 126.85 2ayz s VAL 830 Ca 0.08 -0.30 -0.23 0.00 0.00 0.00 0.00 61.98 61.53 2ayz s VAL 830 Cb -0.21 -3.03 0.07 0.00 0.00 0.00 0.00 36.38 33.21 2ayz s VAL 830 CO 0.10 0.48 0.67 -0.62 0.00 0.00 0.00 175.10 175.72 2ayz s ASP 831 N -1.32 -0.70 0.00 3.32 2.15 -0.59 -0.42 116.67 119.11 2ayz s ASP 831 Ca 0.18 1.35 0.26 0.00 0.43 0.00 0.00 52.55 54.77 2ayz s ASP 831 Cb -0.12 1.36 0.73 0.00 -0.30 0.00 0.00 42.92 44.59 2ayz s ASP 831 CO 0.08 -0.23 1.55 -0.67 -0.17 0.00 0.00 175.17 175.73 2ayz n ASP 832 N 2.74 0.76 -4.06 -0.34 2.03 -1.01 -4.24 116.55 112.41 2ayz n ASP 832 Ca -0.14 -0.59 -0.35 0.00 0.52 0.00 0.00 54.79 54.23 2ayz n ASP 832 Cb 0.55 0.14 -0.12 0.00 -0.72 0.00 0.00 41.12 40.98 2ayz n ASP 832 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 2ayz s HIS 833 N -2.69 3.45 0.17 -0.67 2.46 -1.26 -5.01 115.29 111.73 2ayz s HIS 833 Ca 0.20 -2.76 -0.06 0.00 0.47 0.00 0.00 55.06 52.90 2ayz s HIS 833 Cb 0.19 -3.10 0.27 0.00 -0.13 0.00 0.00 32.58 29.80 2ayz s HIS 833 CO 0.58 -0.87 0.98 -2.30 -2.47 0.00 0.00 174.74 170.67 2ayz n PRO 834 N 3.76 -0.07 -0.37 2.88 -0.02 -1.26 0.65 135.00 140.57 2ayz n PRO 834 Ca 0.04 0.98 0.01 0.00 -2.02 0.00 0.00 63.50 62.52 2ayz n PRO 834 Cb 0.38 -1.46 0.16 0.00 -0.02 0.00 0.00 33.50 32.55 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 1.13 -0.02 4.25 2.10 -1.98 -1.81 117.51 121.19 2ayz h ILE 835 Ca 0.29 -0.42 -0.15 0.00 1.08 0.00 0.00 64.86 65.66 2ayz h ILE 835 Cb 0.45 -0.21 -0.02 0.00 -1.09 0.00 0.00 36.82 35.95 2ayz h ILE 835 CO -0.65 0.22 -0.67 0.78 -1.08 0.00 0.00 178.15 176.76 2ayz h ASN 836 N 1.23 0.12 -0.05 2.19 4.21 -0.21 -2.89 115.58 120.17 2ayz h ASN 836 Ca 0.42 -0.08 0.02 0.00 1.21 0.00 0.00 56.30 57.87 2ayz h ASN 836 Cb 0.08 -0.03 -0.02 0.00 -1.12 0.00 0.00 38.32 37.22 2ayz h ASN 836 CO -0.15 0.75 -0.08 -0.09 -1.29 0.00 0.00 177.43 176.57 2ayz h ARG 837 N 0.07 -0.12 -0.36 0.81 2.43 -1.11 0.22 114.38 116.32 2ayz h ARG 837 Ca -0.01 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 2ayz h ARG 837 Cb 1.20 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.73 2ayz h ARG 837 CO 0.09 -0.08 0.08 -0.09 -1.51 0.00 0.00 179.97 178.47 2ayz h ARG 838 N -0.12 0.21 -0.01 0.20 1.12 -1.38 -0.37 114.38 114.03 2ayz h ARG 838 Ca 0.05 -0.01 -0.16 0.00 -1.11 0.00 0.00 59.98 58.75 2ayz h ARG 838 Cb 0.19 -0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 30.09 2ayz h ARG 838 CO -0.12 0.14 -0.75 1.25 -3.11 0.00 0.00 179.97 177.38 2ayz h LEU 839 N 0.21 0.08 -0.19 3.80 6.46 -1.29 0.51 115.31 124.89 2ayz h LEU 839 Ca 0.17 -0.06 -0.10 0.00 -0.12 0.00 0.00 57.88 57.77 2ayz h LEU 839 Cb 0.18 -0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 40.08 2ayz h LEU 839 CO -0.21 0.79 -0.27 0.25 -0.62 0.00 0.00 178.44 178.38 2ayz h LEU 840 N 0.04 0.57 -1.34 2.25 5.85 -0.30 -0.34 115.31 122.05 2ayz h LEU 840 Ca -0.01 -0.51 -0.07 0.00 0.84 0.00 0.00 57.88 58.12 2ayz h LEU 840 Cb 1.31 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 2ayz h LEU 840 CO 0.10 0.98 -0.33 0.00 -0.34 0.00 0.00 178.44 178.85 2ayz h ALA 841 N 0.61 1.35 0.29 1.25 0.00 -1.00 -0.68 119.26 121.09 2ayz h ALA 841 Ca 0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2ayz h ALA 841 Cb 0.85 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2ayz h ALA 841 CO 0.06 0.41 -0.14 0.22 0.00 0.00 0.00 179.25 179.80 2ayz h ASP 842 N 0.00 -0.33 -0.82 0.00 1.82 -0.60 0.17 116.42 116.65 2ayz h ASP 842 Ca -0.00 -0.10 0.03 0.00 -0.39 0.00 0.00 57.03 56.57 2ayz h ASP 842 Cb 0.62 0.09 -0.05 0.00 0.68 0.00 0.00 39.33 40.67 2ayz h ASP 842 CO 0.04 -0.10 0.53 1.56 -1.61 0.00 0.00 179.24 179.66 2ayz h GLN 843 N -0.56 1.01 -0.76 0.28 4.20 -0.87 -0.69 115.11 117.72 2ayz h GLN 843 Ca -0.04 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.62 2ayz h GLN 843 Cb 0.41 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 27.92 2ayz h GLN 843 CO 0.07 0.67 0.50 1.25 -0.67 0.00 0.00 178.83 180.64 2ayz h LEU 844 N 1.04 0.85 -0.86 1.46 7.12 -1.02 -2.02 115.31 121.88 2ayz h LEU 844 Ca 0.33 -0.02 -0.10 0.00 0.13 0.00 0.00 57.88 58.22 2ayz h LEU 844 Cb -0.00 -0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 39.91 2ayz h LEU 844 CO -0.11 0.61 -0.21 1.23 -0.13 0.00 0.00 178.44 179.83 2ayz h GLY 845 N 1.01 0.67 2.00 3.75 0.00 -0.12 -2.60 103.07 107.77 2ayz h GLY 845 Ca 0.29 -0.53 -0.07 0.00 0.00 0.00 0.00 47.33 47.02 2ayz h GLY 845 CO -0.08 0.49 -0.32 1.76 0.00 0.00 0.00 176.54 178.39 2ayz h SER 846 N 0.55 0.00 -0.29 0.19 0.02 -0.67 -2.18 113.55 111.17 2ayz h SER 846 Ca 0.08 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.95 2ayz h SER 846 Cb 0.66 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.18 2ayz h SER 846 CO 0.05 0.32 -0.09 -0.07 -1.14 0.00 0.00 176.83 175.91 2ayz h LEU 847 N 0.00 0.67 0.00 5.07 -0.00 -0.99 -3.47 115.31 116.58 2ayz h LEU 847 Ca -0.00 -0.18 0.00 0.00 -0.00 0.00 0.00 57.88 57.70 2ayz h LEU 847 Cb 0.62 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 41.10 2ayz h LEU 847 CO 0.04 0.79 0.00 0.61 -0.00 0.00 0.00 178.44 179.88 2ayz n GLY 848 N -0.56 1.91 3.37 0.83 0.00 -0.82 -5.13 105.19 104.79 2ayz n GLY 848 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 2ayz n GLY 848 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ayz s TYR 849 N -2.00 2.00 0.17 1.61 2.02 -1.20 -5.02 117.35 114.94 2ayz s TYR 849 Ca 0.00 -0.42 -0.31 0.00 -0.37 0.00 0.00 57.07 55.97 2ayz s TYR 849 Cb 0.00 -0.99 -0.09 0.00 -0.40 0.00 0.00 41.96 40.48 2ayz s TYR 849 CO 0.00 0.40 1.41 -1.14 -1.57 0.00 0.00 175.55 174.65 2ayz s GLN 850 N -2.77 4.31 -0.44 -0.62 2.00 -1.04 -4.28 119.66 116.81 2ayz s GLN 850 Ca 0.18 2.16 -0.06 0.00 -2.00 0.00 0.00 55.36 55.64 2ayz s GLN 850 Cb -0.06 -3.19 0.11 0.00 0.80 0.00 0.00 33.01 30.67 2ayz s GLN 850 CO 0.08 -0.41 0.27 0.00 -0.50 0.00 0.00 175.29 174.73 2ayz s LYS 852 N 1.25 4.14 0.12 0.00 -0.14 0.04 -4.89 119.74 120.27 2ayz s LYS 852 Ca 0.07 0.59 -0.14 0.00 -1.36 0.00 0.00 55.97 55.12 2ayz s LYS 852 Cb -0.24 -3.63 -0.07 0.00 -1.68 0.00 0.00 37.83 32.21 2ayz s LYS 852 CO -0.02 -0.37 0.53 0.95 -0.76 0.00 0.00 175.35 175.67 2ayz s THR 853 N 2.37 4.87 0.16 2.17 -4.23 -1.26 -0.30 115.64 119.43 2ayz s THR 853 Ca 0.27 0.84 -0.15 0.00 -1.18 0.00 0.00 61.69 61.47 2ayz s THR 853 Cb -0.16 -3.74 0.02 0.00 1.34 0.00 0.00 72.50 69.96 2ayz s THR 853 CO 0.09 0.30 0.43 0.00 -0.54 0.00 0.00 174.62 174.90 2ayz s ALA 854 N -1.40 -0.76 -0.41 3.99 0.00 -0.93 -4.94 121.76 117.31 2ayz s ALA 854 Ca 0.36 -0.29 0.07 0.00 0.00 0.00 0.00 51.96 52.10 2ayz s ALA 854 Cb -0.15 0.79 0.23 0.00 0.00 0.00 0.00 23.12 23.98 2ayz s ALA 854 CO 0.19 -0.72 0.51 0.27 0.00 0.00 0.00 175.76 176.02 2ayz n ASN 855 N -0.27 -0.40 0.00 0.00 0.23 -1.26 -1.54 115.26 112.02 2ayz n ASN 855 Ca -0.12 -2.67 0.00 0.00 -0.53 0.00 0.00 54.58 51.26 2ayz n ASN 855 Cb 0.63 -0.32 0.00 0.00 -2.08 0.00 0.00 39.78 38.01 2ayz n ASN 855 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2ayz n ASP 856 N 1.85 0.00 -0.06 0.53 -0.08 -1.26 -4.81 116.55 112.71 2ayz n ASP 856 Ca 0.22 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.39 2ayz n ASP 856 Cb 0.53 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.93 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 0.37 1.93 0.27 0.00 -1.90 -2.29 103.07 101.45 2ayz h GLY 857 Ca 0.00 -0.28 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 2ayz h GLY 857 CO 0.00 0.26 -0.34 -0.39 0.00 0.00 0.00 176.54 176.06 2ayz h VAL 858 N 0.09 1.26 -0.52 4.60 -1.51 -1.93 -2.68 116.25 115.57 2ayz h VAL 858 Ca 0.05 -1.24 -0.03 0.00 -1.23 0.00 0.00 66.70 64.25 2ayz h VAL 858 Cb 0.41 1.62 -0.03 0.00 -2.13 0.00 0.00 31.29 31.16 2ayz h VAL 858 CO 0.01 0.36 0.21 -0.78 -1.23 0.00 0.00 177.57 176.15 2ayz h ASP 859 N 0.07 0.67 -0.19 4.19 3.58 -1.84 0.05 116.42 122.95 2ayz h ASP 859 Ca 0.01 -0.08 0.01 0.00 0.42 0.00 0.00 57.03 57.39 2ayz h ASP 859 Cb 0.64 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 2ayz h ASP 859 CO 0.05 0.60 0.12 0.00 -2.88 0.00 0.00 179.24 177.13 2ayz h ALA 860 N 1.50 0.24 0.00 -0.78 0.00 -1.06 -0.62 119.26 118.54 2ayz h ALA 860 Ca 0.18 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.93 2ayz h ALA 860 Cb 0.14 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2ayz h ALA 860 CO -0.02 -0.29 -0.71 1.37 0.00 0.00 0.00 179.25 179.61 2ayz h LEU 861 N 0.24 0.00 0.26 0.00 8.10 -1.52 -2.42 115.31 119.98 2ayz h LEU 861 Ca 0.07 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 58.05 2ayz h LEU 861 Cb -0.01 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.21 2ayz h LEU 861 CO -0.03 0.71 -0.13 -1.13 -4.11 0.00 0.00 178.44 173.75 2ayz h ASN 862 N 0.00 -0.30 0.15 0.17 -0.73 -0.59 -0.92 115.58 113.36 2ayz h ASN 862 Ca -0.01 -0.02 -0.05 0.00 1.87 0.00 0.00 56.30 58.09 2ayz h ASN 862 Cb 1.28 0.08 -0.01 0.00 0.27 0.00 0.00 38.32 39.94 2ayz h ASN 862 CO 0.09 -0.18 -0.21 1.62 -0.37 0.00 0.00 177.43 178.39 2ayz h VAL 863 N -0.40 1.18 -0.48 2.57 3.04 -1.16 -1.79 116.25 119.21 2ayz h VAL 863 Ca -0.04 -0.85 -0.02 0.00 -1.01 0.00 0.00 66.70 64.79 2ayz h VAL 863 Cb 0.31 1.36 -0.02 0.00 -2.01 0.00 0.00 31.29 30.93 2ayz h VAL 863 CO 0.06 0.25 0.23 0.25 -1.01 0.00 0.00 177.57 177.35 2ayz h LEU 864 N 0.10 0.60 -0.95 3.16 7.12 -0.93 0.99 115.31 125.40 2ayz h LEU 864 Ca 0.02 -0.05 -0.11 0.00 0.13 0.00 0.00 57.88 57.87 2ayz h LEU 864 Cb 0.43 -0.15 -0.02 0.00 -0.53 0.00 0.00 40.66 40.39 2ayz h LEU 864 CO 0.03 0.51 -0.52 0.28 -0.13 0.00 0.00 178.44 178.61 2ayz h SER 865 N 0.68 0.00 0.14 1.25 0.02 -0.31 -3.25 113.55 112.07 2ayz h SER 865 Ca 0.17 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 2ayz h SER 865 Cb 0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.61 2ayz h SER 865 CO -0.02 0.52 -0.07 0.11 -1.14 0.00 0.00 176.83 176.23 2ayz h LYS 866 N 0.00 -0.19 -3.85 3.45 6.56 -0.79 -3.48 116.57 118.28 2ayz h LYS 866 Ca -0.01 0.01 -0.11 0.00 -1.06 0.00 0.00 60.65 59.48 2ayz h LYS 866 Cb 0.93 0.04 -0.16 0.00 -0.57 0.00 0.00 32.23 32.47 2ayz h LYS 866 CO 0.07 0.27 -0.50 1.21 -2.06 0.00 0.00 179.45 178.44 2ayz s ASN 867 N -5.50 0.20 0.09 0.86 2.47 0.21 -5.11 114.94 108.15 2ayz s ASN 867 Ca -0.13 -0.62 -0.24 0.00 0.42 0.00 0.00 52.86 52.28 2ayz s ASN 867 Cb 0.01 0.26 -0.07 0.00 -1.45 0.00 0.00 41.25 40.00 2ayz s ASN 867 CO 0.52 -0.58 0.74 -2.28 -3.72 0.00 0.00 177.10 171.77 2ayz s HIS 868 N -3.12 3.81 0.06 0.43 2.46 -1.26 -4.07 115.29 113.59 2ayz s HIS 868 Ca -0.01 1.50 0.08 0.00 0.47 0.00 0.00 55.06 57.10 2ayz s HIS 868 Cb 0.02 -2.75 -0.03 0.00 -0.13 0.00 0.00 32.58 29.69 2ayz s HIS 868 CO -0.07 0.41 -0.21 0.42 -2.47 0.00 0.00 174.74 172.82 2ayz s ILE 869 N -0.61 1.69 -0.00 0.89 1.09 -1.26 -4.96 121.20 118.03 2ayz s ILE 869 Ca 0.36 -1.30 -0.24 0.00 -1.10 0.00 0.00 60.65 58.37 2ayz s ILE 869 Cb -0.21 -1.49 -0.14 0.00 -1.06 0.00 0.00 42.46 39.56 2ayz s ILE 869 CO 0.23 0.13 1.03 -0.78 -0.10 0.00 0.00 174.94 175.45 2ayz h ASP 870 N 4.63 -0.59 -3.95 3.58 1.82 -1.39 -3.45 116.42 117.06 2ayz h ASP 870 Ca -0.44 -0.04 -0.46 0.00 -0.39 0.00 0.00 57.03 55.70 2ayz h ASP 870 Cb 1.17 0.15 -0.30 0.00 0.68 0.00 0.00 39.33 41.03 2ayz h ASP 870 CO 0.43 -0.20 -0.80 -0.63 -1.61 0.00 0.00 179.24 176.42 2ayz s ILE 871 N -4.34 0.98 -0.20 2.25 1.01 -1.26 -4.49 121.20 115.16 2ayz s ILE 871 Ca -0.13 -0.49 -0.03 0.00 0.00 0.00 0.00 60.65 60.00 2ayz s ILE 871 Cb 0.01 -0.84 -0.01 0.00 0.01 0.00 0.00 42.46 41.63 2ayz s ILE 871 CO 0.42 0.29 -0.06 -0.69 0.00 0.00 0.00 174.94 174.90 2ayz s VAL 872 N -0.01 3.41 -0.26 2.92 1.01 -1.10 -2.24 120.40 124.13 2ayz s VAL 872 Ca -0.00 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.51 2ayz s VAL 872 Cb -0.08 -2.52 0.06 0.00 0.00 0.00 0.00 36.38 33.84 2ayz s VAL 872 CO 0.00 0.45 -0.11 -0.76 0.00 0.00 0.00 175.10 174.69 2ayz s LEU 873 N 1.12 3.46 -0.25 3.92 1.02 -0.63 -0.57 118.68 126.76 2ayz s LEU 873 Ca 0.01 -1.41 -0.04 0.00 0.02 0.00 0.00 54.13 52.72 2ayz s LEU 873 Cb -0.15 -1.55 0.01 0.00 0.02 0.00 0.00 46.19 44.52 2ayz s LEU 873 CO -0.01 -0.19 -0.01 -0.94 0.02 0.00 0.00 176.35 175.22 2ayz s SER 874 N 1.10 4.55 -0.55 2.29 1.04 -0.85 -0.76 113.70 120.52 2ayz s SER 874 Ca -0.09 -0.63 -0.25 0.00 0.48 0.00 0.00 55.95 55.46 2ayz s SER 874 Cb -0.20 -1.76 0.04 0.00 0.10 0.00 0.00 66.02 64.20 2ayz s SER 874 CO -0.05 -0.10 0.96 -0.62 0.98 0.00 0.00 173.24 174.41 2ayz s ASP 875 N 1.44 6.36 -0.85 7.02 -1.08 0.44 -1.01 116.67 128.98 2ayz s ASP 875 Ca 0.03 -0.28 0.00 0.00 -0.52 0.00 0.00 52.55 51.78 2ayz s ASP 875 Cb -0.16 -2.45 0.23 0.00 -1.46 0.00 0.00 42.92 39.09 2ayz s ASP 875 CO -0.02 -1.24 0.83 1.33 0.52 0.00 0.00 175.17 176.59 2ayz n VAL 876 N 6.25 3.02 1.58 1.11 0.24 0.10 -2.41 118.33 128.23 2ayz n VAL 876 Ca 0.03 -5.20 0.03 0.00 -2.04 0.00 0.00 64.34 57.15 2ayz n VAL 876 Cb 0.48 -2.27 0.09 0.00 -1.47 0.00 0.00 33.84 30.67 2ayz n VAL 876 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2ayz n ASN 877 N 1.88 0.72 -4.33 -1.34 6.94 -1.26 -4.29 115.26 113.58 2ayz n ASN 877 Ca 0.24 -1.96 -0.46 0.00 -0.02 0.00 0.00 54.58 52.38 2ayz n ASN 877 Cb 0.37 -0.09 -0.06 0.00 -2.36 0.00 0.00 39.78 37.65 2ayz n ASN 877 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 2ayz s MET 878 N -1.83 2.99 0.00 -3.83 1.75 -1.26 -4.72 119.30 112.40 2ayz s MET 878 Ca 0.11 -1.61 0.25 0.00 -1.25 0.00 0.00 55.69 53.19 2ayz s MET 878 Cb 0.06 -4.25 1.31 0.00 2.84 0.00 0.00 34.83 34.78 2ayz s MET 878 CO 0.08 -1.25 1.85 -0.35 -0.65 0.00 0.00 175.02 174.70 2ayz n PRO 879 N 5.25 0.43 -2.58 4.11 -0.04 -1.26 -3.88 135.00 137.03 2ayz n PRO 879 Ca -0.14 0.04 -0.43 0.00 -0.04 0.00 0.00 63.50 62.94 2ayz n PRO 879 Cb 0.41 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.35 2ayz n PRO 879 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2ayz s ASN 880 N -2.49 6.66 0.01 3.54 3.84 -1.26 -4.72 114.94 120.52 2ayz s ASN 880 Ca 0.26 0.61 0.00 0.00 0.21 0.00 0.00 52.86 53.94 2ayz s ASN 880 Cb 0.17 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.32 2ayz s ASN 880 CO 0.37 -1.20 0.00 0.23 -2.79 0.00 0.00 177.10 173.71 2ayz n MET 881 N 7.70 0.00 -3.04 0.43 2.81 -1.26 -4.49 117.12 119.26 2ayz n MET 881 Ca 0.12 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.61 2ayz n MET 881 Cb 0.49 0.00 -0.00 0.00 -0.71 0.00 0.00 33.22 32.99 2ayz n MET 881 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2ayz n ASP 882 N 5.22 6.11 -0.05 7.83 9.92 -1.26 -4.57 116.55 139.75 2ayz n ASP 882 Ca 0.00 -3.44 -0.02 0.00 -0.53 0.00 0.00 54.79 50.80 2ayz n ASP 882 Cb 0.00 -1.18 -0.15 0.00 -0.64 0.00 0.00 41.12 39.15 2ayz n ASP 882 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ayz n GLY 883 N 1.17 -1.02 0.08 0.44 0.00 -1.25 -4.53 105.19 100.07 2ayz n GLY 883 Ca 0.27 -0.37 -0.05 0.00 0.00 0.00 0.00 46.02 45.87 2ayz n GLY 883 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2ayz n TYR 884 N -2.60 0.00 0.13 1.61 4.11 -1.26 -4.70 117.16 114.44 2ayz n TYR 884 Ca -0.20 0.00 0.19 0.00 -0.00 0.00 0.00 57.90 57.88 2ayz n TYR 884 Cb 0.92 -0.26 0.77 0.00 -0.00 0.00 0.00 39.34 40.77 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 -0.02 0.00 -0.07 -3.48 1.12 -1.83 0.31 114.38 110.41 2ayz h ARG 885 Ca -0.15 0.00 -0.08 0.00 -1.11 0.00 0.00 59.98 58.64 2ayz h ARG 885 Cb 1.23 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 31.18 2ayz h ARG 885 CO -0.03 0.00 -0.30 1.37 -3.11 0.00 0.00 179.97 177.90 2ayz h LEU 886 N 0.00 0.13 -0.26 3.80 -0.00 -1.84 0.51 115.31 117.65 2ayz h LEU 886 Ca 0.15 -0.04 -0.14 0.00 -0.00 0.00 0.00 57.88 57.85 2ayz h LEU 886 Cb 0.79 -0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.39 2ayz h LEU 886 CO -0.00 0.43 -0.67 0.00 -0.00 0.00 0.00 178.44 178.20 2ayz h THR 887 N 0.12 1.24 -0.43 0.15 1.03 -1.25 -1.80 112.91 111.98 2ayz h THR 887 Ca 0.02 -2.51 -0.02 0.00 -0.01 0.00 0.00 66.41 63.89 2ayz h THR 887 Cb 0.60 2.45 -0.02 0.00 -1.07 0.00 0.00 68.15 70.12 2ayz h THR 887 CO 0.04 0.66 0.21 -0.61 -0.01 0.00 0.00 175.52 175.81 2ayz h GLN 888 N 0.00 0.61 0.00 0.00 -0.00 -0.91 -1.47 115.11 113.34 2ayz h GLN 888 Ca -0.01 -0.09 -0.02 0.00 -0.00 0.00 0.00 58.65 58.53 2ayz h GLN 888 Cb 1.40 -0.11 -0.00 0.00 0.00 0.00 0.00 27.48 28.77 2ayz h GLN 888 CO 0.09 0.53 -0.11 -0.09 0.00 0.00 0.00 178.83 179.25 2ayz h ARG 889 N 0.55 0.00 -0.44 1.69 1.12 -0.74 -0.03 114.38 116.53 2ayz h ARG 889 Ca 0.15 0.00 -0.14 0.00 -1.11 0.00 0.00 59.98 58.87 2ayz h ARG 889 Cb 0.11 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.06 2ayz h ARG 889 CO -0.02 0.11 -0.29 0.82 -3.11 0.00 0.00 179.97 177.48 2ayz h ILE 890 N 0.00 1.27 0.00 1.20 2.04 -0.65 0.26 117.51 121.63 2ayz h ILE 890 Ca -0.00 -1.45 -0.05 0.00 1.00 0.00 0.00 64.86 64.36 2ayz h ILE 890 Cb 0.20 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2ayz h ILE 890 CO 0.01 0.50 -0.22 0.08 0.00 0.00 0.00 178.15 178.52 2ayz h ARG 891 N 0.82 0.00 -0.23 2.37 -0.00 -0.35 0.07 114.38 117.06 2ayz h ARG 891 Ca 0.09 0.00 -0.17 0.00 -0.00 0.00 0.00 59.98 59.90 2ayz h ARG 891 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.84 2ayz h ARG 891 CO 0.08 0.22 -0.52 1.96 -0.00 0.00 0.00 179.97 181.71 2ayz h GLN 892 N 0.00 0.76 -0.48 0.08 4.20 -0.69 -3.25 115.11 115.73 2ayz h GLN 892 Ca -0.00 -0.51 -0.12 0.00 0.06 0.00 0.00 58.65 58.08 2ayz h GLN 892 Cb 0.80 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 2ayz h GLN 892 CO 0.03 1.13 -0.16 1.25 -0.67 0.00 0.00 178.83 180.42 2ayz h LEU 893 N 0.49 0.98 -0.00 1.46 5.85 -0.58 -3.49 115.31 120.02 2ayz h LEU 893 Ca 0.00 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.35 2ayz h LEU 893 Cb 1.13 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.89 2ayz h LEU 893 CO 0.11 1.13 0.00 0.61 -0.34 0.00 0.00 178.44 179.95 2ayz n GLY 894 N -0.17 0.75 3.73 3.75 0.00 -0.02 -5.04 105.19 108.19 2ayz n GLY 894 Ca 0.00 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 2ayz n GLY 894 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2ayz s LEU 895 N -0.00 4.36 -0.06 0.99 2.34 -1.16 -4.89 118.68 120.27 2ayz s LEU 895 Ca 0.00 2.83 0.15 0.00 0.06 0.00 0.00 54.13 57.17 2ayz s LEU 895 Cb 0.00 -3.61 0.48 0.00 -0.56 0.00 0.00 46.19 42.50 2ayz s LEU 895 CO 0.00 -0.91 1.40 0.35 -1.06 0.00 0.00 176.35 176.13 2ayz n THR 896 N 3.30 1.41 -3.57 5.48 -2.24 -1.26 -4.99 114.28 112.41 2ayz n THR 896 Ca 0.12 -1.20 -0.14 0.00 -2.27 0.00 0.00 64.05 60.57 2ayz n THR 896 Cb 0.37 0.29 -0.05 0.00 -2.10 0.00 0.00 70.33 68.83 2ayz n THR 896 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 2ayz s LEU 897 N -1.51 -0.08 0.26 3.22 2.34 -1.26 -5.13 118.68 116.53 2ayz s LEU 897 Ca 0.36 0.15 -0.30 0.00 0.06 0.00 0.00 54.13 54.40 2ayz s LEU 897 Cb 0.22 2.13 -0.10 0.00 -0.56 0.00 0.00 46.19 47.89 2ayz s LEU 897 CO 0.19 -0.73 1.32 -2.84 -1.06 0.00 0.00 176.35 173.23 2ayz s PRO 898 N -2.54 4.37 -0.18 1.48 0.02 -1.26 -4.91 135.00 131.97 2ayz s PRO 898 Ca -0.05 2.15 -0.02 0.00 0.02 0.00 0.00 61.00 63.10 2ayz s PRO 898 Cb -0.01 -3.13 -0.01 0.00 0.02 0.00 0.00 34.50 31.37 2ayz s PRO 898 CO -0.02 -0.23 -0.08 0.08 -0.33 0.00 0.00 177.00 176.41 2ayz s VAL 899 N -0.45 3.31 -0.32 3.83 1.01 -1.08 -2.71 120.40 124.00 2ayz s VAL 899 Ca 0.54 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.91 2ayz s VAL 899 Cb -0.38 -2.45 0.02 0.00 0.00 0.00 0.00 36.38 33.56 2ayz s VAL 899 CO 0.45 0.47 0.10 -0.63 0.00 0.00 0.00 175.10 175.49 2ayz s ILE 900 N 0.88 3.92 -0.40 2.22 1.01 0.26 -0.84 121.20 128.25 2ayz s ILE 900 Ca -0.02 -0.88 -0.21 0.00 0.00 0.00 0.00 60.65 59.54 2ayz s ILE 900 Cb -0.15 -3.11 0.01 0.00 0.01 0.00 0.00 42.46 39.23 2ayz s ILE 900 CO 0.01 -0.04 0.66 -0.83 0.00 0.00 0.00 174.94 174.74 2ayz s GLY 901 N 1.46 1.72 -0.48 6.18 0.00 -0.53 -2.00 107.32 113.67 2ayz s GLY 901 Ca 0.01 -1.00 -0.26 0.00 0.00 0.00 0.00 44.72 43.47 2ayz s GLY 901 CO 0.03 1.55 0.96 0.14 0.00 0.00 0.00 173.10 175.77 2ayz s VAL 902 N 2.83 4.42 0.33 1.40 1.01 -0.18 -0.66 120.40 129.55 2ayz s VAL 902 Ca 0.24 0.76 0.09 0.00 0.00 0.00 0.00 61.98 63.08 2ayz s VAL 902 Cb -0.14 -4.48 -0.05 0.00 0.00 0.00 0.00 36.38 31.71 2ayz s VAL 902 CO 0.17 -0.90 -0.01 0.42 0.00 0.00 0.00 175.10 174.78 2ayz s THR 903 N 3.90 2.67 -0.26 3.92 -4.23 -0.11 -0.72 115.64 120.80 2ayz s THR 903 Ca 0.38 -2.01 -0.03 0.00 -1.18 0.00 0.00 61.69 58.86 2ayz s THR 903 Cb -0.10 -2.76 0.11 0.00 1.34 0.00 0.00 72.50 71.09 2ayz s THR 903 CO 0.26 -0.23 0.21 0.00 -0.54 0.00 0.00 174.62 174.32 2ayz s ALA 904 N -2.51 0.02 -1.13 3.99 0.00 -1.26 -1.05 121.76 119.82 2ayz s ALA 904 Ca 0.34 -0.46 -0.23 0.00 0.00 0.00 0.00 51.96 51.61 2ayz s ALA 904 Cb -0.01 -1.50 0.01 0.00 0.00 0.00 0.00 23.12 21.62 2ayz s ALA 904 CO 0.19 -1.54 0.76 -1.71 0.00 0.00 0.00 175.76 173.45 2ayz n ASN 905 N 5.29 -5.09 -2.54 0.00 5.15 -1.26 -4.81 115.26 112.00 2ayz n ASN 905 Ca -0.05 -1.06 -0.34 0.00 -0.60 0.00 0.00 54.58 52.53 2ayz n ASN 905 Cb 0.46 -2.90 0.04 0.00 -0.53 0.00 0.00 39.78 36.85 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 -4.27 6.31 -0.47 5.20 0.00 -1.26 -4.86 120.51 121.16 2ayz n ALA 906 Ca -0.10 -3.50 0.00 0.00 0.00 0.00 0.00 53.44 49.84 2ayz n ALA 906 Cb 0.59 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.16 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 -0.41 0.00 -2.78 0.00 4.77 -1.26 -2.91 117.00 114.41 2ayz n LEU 907 Ca 0.54 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.41 2ayz n LEU 907 Cb 0.46 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.58 2ayz n LEU 907 CO 0.58 0.00 -0.08 0.00 -1.33 0.00 0.00 177.39 176.56 2ayz n ALA 908 N 0.47 2.84 0.25 -1.18 0.00 -1.26 -4.95 120.51 116.68 2ayz n ALA 908 Ca 0.00 -3.01 0.09 0.00 0.00 0.00 0.00 53.44 50.52 2ayz n ALA 908 Cb 0.00 -0.95 0.63 0.00 0.00 0.00 0.00 19.45 19.14 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 2.92 0.00 -0.34 0.00 9.09 -1.94 -1.67 114.58 122.65 2ayz h GLU 909 Ca -0.07 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.33 2ayz h GLU 909 Cb 1.14 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.23 2ayz h GLU 909 CO 0.45 0.14 0.17 1.49 0.05 0.00 0.00 179.01 181.31 2ayz h GLU 910 N 0.00 0.48 -0.32 1.06 4.57 -1.92 0.15 114.58 118.60 2ayz h GLU 910 Ca -0.00 -0.06 -0.15 0.00 -1.18 0.00 0.00 59.36 57.97 2ayz h GLU 910 Cb 0.29 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 2ayz h GLU 910 CO 0.02 0.42 -0.39 -0.22 -1.18 0.00 0.00 179.01 177.66 2ayz h LYS 911 N 0.42 0.77 -0.04 1.92 3.11 -1.77 -2.59 116.57 118.38 2ayz h LYS 911 Ca 0.12 -0.39 -0.12 0.00 -2.81 0.00 0.00 60.65 57.45 2ayz h LYS 911 Cb 0.09 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.32 2ayz h LYS 911 CO -0.02 1.02 -0.52 1.96 -2.81 0.00 0.00 179.45 179.09 2ayz h GLN 912 N 0.63 0.11 -0.73 1.90 7.50 -1.11 -1.60 115.11 121.80 2ayz h GLN 912 Ca 0.05 -0.06 -0.02 0.00 0.50 0.00 0.00 58.65 59.12 2ayz h GLN 912 Cb 0.94 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.44 2ayz h GLN 912 CO 0.09 0.60 0.36 -0.09 -1.50 0.00 0.00 178.83 178.29 2ayz h ARG 913 N 0.09 1.05 -0.10 1.46 1.12 -0.53 0.32 114.38 117.79 2ayz h ARG 913 Ca 0.00 -0.15 -0.07 0.00 -1.11 0.00 0.00 59.98 58.65 2ayz h ARG 913 Cb 0.94 -0.19 -0.01 0.00 -0.01 0.00 0.00 29.97 30.70 2ayz h ARG 913 CO 0.07 0.81 -0.24 0.00 -3.11 0.00 0.00 179.97 177.50 2ayz h LEU 915 N 0.16 -0.10 -0.96 0.00 5.85 -0.65 -3.31 115.31 116.30 2ayz h LEU 915 Ca 0.03 -0.48 -0.06 0.00 0.84 0.00 0.00 57.88 58.21 2ayz h LEU 915 Cb 0.53 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 2ayz h LEU 915 CO 0.04 0.48 -0.28 -0.33 -0.34 0.00 0.00 178.44 178.00 2ayz h GLU 916 N -0.73 0.00 -6.27 1.25 4.39 -0.89 -3.48 114.58 108.85 2ayz h GLU 916 Ca -0.01 0.00 -0.45 0.00 0.34 0.00 0.00 59.36 59.24 2ayz h GLU 916 Cb 0.57 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.24 2ayz h GLU 916 CO 0.02 0.28 -0.88 0.43 -1.16 0.00 0.00 179.01 177.71 2ayz n SER 917 N -3.42 -1.74 -1.09 1.42 7.64 0.05 -3.53 113.62 112.95 2ayz n SER 917 Ca 0.00 -0.94 0.02 0.00 1.01 0.00 0.00 58.87 58.97 2ayz n SER 917 Cb 0.48 -3.52 0.01 0.00 -1.01 0.00 0.00 64.21 60.17 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 0.80 0.00 0.23 0.00 -1.18 -4.58 105.19 98.70 2ayz n GLY 918 Ca -0.26 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.26 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 0.29 0.00 0.00 1.61 1.56 -1.26 -4.60 117.12 114.72 2ayz n MET 919 Ca 0.03 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.46 2ayz n MET 919 Cb 0.96 0.00 0.00 0.00 2.15 0.00 0.00 33.22 36.33 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 -3.99 6.12 2.03 -0.02 -2.62 116.55 118.08 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 0.16 0.05 1.67 0.01 -1.07 -5.01 113.70 109.50 2ayz s SER 921 Ca 0.00 -0.90 0.07 0.00 1.31 0.00 0.00 55.95 56.43 2ayz s SER 921 Cb 0.00 0.36 -0.03 0.00 0.21 0.00 0.00 66.02 66.56 2ayz s SER 921 CO 0.00 -0.79 -0.18 0.00 0.41 0.00 0.00 173.24 172.68 2ayz s LEU 923 N -1.49 1.98 -0.07 0.00 1.43 0.17 -4.90 118.68 115.80 2ayz s LEU 923 Ca 0.15 -1.68 0.03 0.00 -1.03 0.00 0.00 54.13 51.60 2ayz s LEU 923 Cb -0.10 -0.07 -0.02 0.00 0.03 0.00 0.00 46.19 46.03 2ayz s LEU 923 CO 0.06 -0.94 -0.16 -0.44 0.23 0.00 0.00 176.35 175.09 2ayz s SER 924 N -3.59 3.83 0.22 2.29 0.01 -1.26 -0.94 113.70 114.25 2ayz s SER 924 Ca 0.25 -0.30 -0.13 0.00 1.31 0.00 0.00 55.95 57.08 2ayz s SER 924 Cb 0.02 -1.04 0.26 0.00 0.21 0.00 0.00 66.02 65.47 2ayz s SER 924 CO 0.15 0.28 1.61 0.50 0.41 0.00 0.00 173.24 176.19 2ayz h LYS 925 N 5.85 -0.01 -3.73 12.44 3.64 -1.36 -3.02 116.57 130.38 2ayz h LYS 925 Ca -0.38 0.00 -0.51 0.00 -1.27 0.00 0.00 60.65 58.49 2ayz h LYS 925 Cb 1.17 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.02 2ayz h LYS 925 CO 0.51 -0.01 2.70 -0.35 -2.27 0.00 0.00 179.45 180.03 2ayz n PRO 926 N -5.46 2.15 -3.01 1.90 -0.04 -1.26 -4.91 135.00 124.37 2ayz n PRO 926 Ca 0.08 -1.73 -0.40 0.00 -0.04 0.00 0.00 63.50 61.42 2ayz n PRO 926 Cb 0.35 -2.68 -0.05 0.00 -0.04 0.00 0.00 33.50 31.08 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 3.71 4.76 0.54 0.52 1.01 -1.14 -5.07 120.40 124.72 2ayz s VAL 927 Ca 0.48 1.58 0.03 0.00 0.00 0.00 0.00 61.98 64.07 2ayz s VAL 927 Cb 0.12 -4.09 0.04 0.00 0.00 0.00 0.00 36.38 32.45 2ayz s VAL 927 CO 0.00 0.37 0.75 0.42 0.00 0.00 0.00 175.10 176.64 2ayz s THR 928 N -0.06 2.66 0.12 3.92 -4.23 -1.26 -4.92 115.64 111.86 2ayz s THR 928 Ca 0.38 -0.76 -0.19 0.00 -1.18 0.00 0.00 61.69 59.93 2ayz s THR 928 Cb -0.20 -2.90 -0.06 0.00 1.34 0.00 0.00 72.50 70.68 2ayz s THR 928 CO 0.22 0.00 1.74 0.25 -0.54 0.00 0.00 174.62 176.29 2ayz h LEU 929 N 0.15 0.29 -0.46 4.79 7.12 -1.98 -0.39 115.31 124.83 2ayz h LEU 929 Ca -0.40 -0.06 -0.17 0.00 0.13 0.00 0.00 57.88 57.38 2ayz h LEU 929 Cb 1.29 -0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 41.34 2ayz h LEU 929 CO 0.48 0.26 -0.69 -0.78 -0.13 0.00 0.00 178.44 177.59 2ayz h ASP 930 N 0.29 0.46 -0.21 1.25 1.82 -1.99 -1.86 116.42 116.18 2ayz h ASP 930 Ca 0.08 -0.29 -0.02 0.00 -0.39 0.00 0.00 57.03 56.42 2ayz h ASP 930 Cb 0.03 -0.13 -0.01 0.00 0.68 0.00 0.00 39.33 39.90 2ayz h ASP 930 CO -0.02 1.01 0.07 0.58 -1.61 0.00 0.00 179.24 179.27 2ayz h VAL 931 N 0.27 1.18 0.00 2.25 2.07 -1.91 -2.04 116.25 118.08 2ayz h VAL 931 Ca -0.02 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 2ayz h VAL 931 Cb 1.25 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 2ayz h VAL 931 CO 0.12 0.18 -0.20 -0.29 0.02 0.00 0.00 177.57 177.40 2ayz h ILE 932 N 0.18 0.97 -0.11 4.57 2.10 -1.03 -2.80 117.51 121.39 2ayz h ILE 932 Ca 0.07 -0.74 -0.01 0.00 1.08 0.00 0.00 64.86 65.25 2ayz h ILE 932 Cb 0.22 1.42 -0.00 0.00 -1.09 0.00 0.00 36.82 37.37 2ayz h ILE 932 CO -0.00 0.20 0.02 0.50 -1.08 0.00 0.00 178.15 177.78 2ayz h LYS 933 N 0.00 0.18 -0.03 2.19 3.11 -0.71 -0.04 116.57 121.28 2ayz h LYS 933 Ca -0.00 -0.05 -0.00 0.00 -2.81 0.00 0.00 60.65 57.79 2ayz h LYS 933 Cb 0.40 -0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 31.61 2ayz h LYS 933 CO 0.03 0.39 0.01 -0.56 -2.81 0.00 0.00 179.45 176.51 2ayz h GLN 934 N -0.05 0.04 -0.46 1.90 3.07 -1.21 0.03 115.11 118.43 2ayz h GLN 934 Ca 0.03 -0.01 -0.02 0.00 0.09 0.00 0.00 58.65 58.75 2ayz h GLN 934 Cb 0.30 -0.01 -0.02 0.00 0.08 0.00 0.00 27.48 27.83 2ayz h GLN 934 CO 0.00 0.19 0.21 1.15 0.09 0.00 0.00 178.83 180.48 2ayz h THR 935 N -0.11 1.19 -0.36 1.86 2.02 -1.51 -0.68 112.91 115.32 2ayz h THR 935 Ca 0.01 -0.56 -0.14 0.00 0.77 0.00 0.00 66.41 66.49 2ayz h THR 935 Cb 0.17 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2ayz h THR 935 CO -0.00 0.21 -0.35 0.25 0.37 0.00 0.00 175.52 176.01 2ayz h LEU 936 N 0.61 0.87 -0.30 2.58 5.85 -0.94 -0.22 115.31 123.75 2ayz h LEU 936 Ca 0.16 -0.38 -0.06 0.00 0.84 0.00 0.00 57.88 58.44 2ayz h LEU 936 Cb 0.14 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2ayz h LEU 936 CO -0.02 1.13 -0.04 0.74 -0.34 0.00 0.00 178.44 179.92 2ayz h THR 937 N 0.69 1.27 -0.36 1.05 2.02 -0.81 0.11 112.91 116.87 2ayz h THR 937 Ca 0.07 -1.03 -0.03 0.00 0.77 0.00 0.00 66.41 66.19 2ayz h THR 937 Cb 0.91 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.63 2ayz h THR 937 CO 0.08 0.33 0.12 0.25 0.37 0.00 0.00 175.52 176.67 2ayz h LEU 938 N 0.34 0.52 -0.26 2.58 5.85 -1.07 -2.26 115.31 121.02 2ayz h LEU 938 Ca 0.08 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 2ayz h LEU 938 Cb 0.50 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2ayz h LEU 938 CO 0.02 0.58 0.03 1.88 -0.34 0.00 0.00 178.44 180.61 2ayz h TYR 939 N 0.43 0.47 -0.73 1.25 0.05 -0.96 -1.38 116.97 116.10 2ayz h TYR 939 Ca 0.12 -0.07 0.03 0.00 0.05 0.00 0.00 58.73 58.86 2ayz h TYR 939 Cb 0.24 -0.13 -0.05 0.00 1.01 0.00 0.00 36.73 37.81 2ayz h TYR 939 CO 0.01 0.57 0.46 0.00 -1.05 0.00 0.00 178.16 178.14 2ayz h ALA 940 N 0.85 0.96 -0.09 3.88 0.00 -0.74 1.00 119.26 125.11 2ayz h ALA 940 Ca 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2ayz h ALA 940 Cb 0.36 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ayz h ALA 940 CO 0.01 0.24 0.02 1.49 0.00 0.00 0.00 179.25 181.00 2ayz h GLU 941 N 0.89 0.15 -0.17 0.00 4.81 -1.30 -1.61 114.58 117.35 2ayz h GLU 941 Ca 0.30 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.37 2ayz h GLU 941 Cb 0.03 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 2ayz h GLU 941 CO -0.12 0.34 -0.40 0.07 -0.73 0.00 0.00 179.01 178.18 2ayz h ARG 942 N -0.07 0.39 -0.00 1.92 0.11 -0.76 -1.52 114.38 114.45 2ayz h ARG 942 Ca 0.03 -0.19 -0.19 0.00 0.10 0.00 0.00 59.98 59.73 2ayz h ARG 942 Cb 0.26 -0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.33 2ayz h ARG 942 CO 0.00 0.73 -0.85 -0.39 0.10 0.00 0.00 179.97 179.56 2ayz h VAL 943 N 0.33 1.50 0.03 0.08 -1.51 -0.84 -1.22 116.25 114.62 2ayz h VAL 943 Ca 0.03 -2.59 -0.00 0.00 -1.23 0.00 0.00 66.70 62.91 2ayz h VAL 943 Cb 0.85 2.44 0.00 0.00 -2.13 0.00 0.00 31.29 32.44 2ayz h VAL 943 CO 0.07 0.75 -0.01 0.03 -1.23 0.00 0.00 177.57 177.18 2ayz h ARG 944 N 0.10 -0.04 0.00 5.19 3.08 -0.76 -2.48 114.38 119.47 2ayz h ARG 944 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2ayz h ARG 944 Cb 1.47 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.53 2ayz h ARG 944 CO 0.13 0.05 0.00 1.57 -1.07 0.00 0.00 179.97 180.65 2ayz h LYS 945 N -0.12 0.00 -0.30 0.04 2.10 -1.33 0.33 116.57 117.28 2ayz h LYS 945 Ca -0.00 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.61 2ayz h LYS 945 Cb 0.11 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.43 2ayz h LYS 945 CO 0.01 0.00 0.06 0.77 -2.00 0.00 0.00 179.45 178.29 2ayz h SER 946 N 0.00 0.46 0.08 7.07 0.02 -0.77 -3.26 113.55 117.15 2ayz h SER 946 Ca 0.00 -0.24 -0.36 0.00 -0.84 0.00 0.00 61.79 60.35 2ayz h SER 946 Cb 0.68 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 2ayz h SER 946 CO 0.00 0.59 -2.01 -2.11 -1.14 0.00 0.00 176.83 172.16 2ayz n ARG 947 N -4.65 0.70 -3.80 3.45 -4.01 -1.07 -4.77 116.66 102.50 2ayz n ARG 947 Ca -0.02 0.29 -0.35 0.00 -1.04 0.00 0.00 57.85 56.73 2ayz n ARG 947 Cb 0.20 -1.67 -0.12 0.00 -3.04 0.00 0.00 32.46 27.83 2ayz n ARG 947 CO 0.00 0.00 0.00 0.34 -3.04 0.00 0.00 177.63 174.93 2ayz s ASP 948 N -6.95 5.12 0.00 2.89 2.15 0.10 -5.13 116.67 114.85 2ayz s ASP 948 Ca -0.27 -2.35 0.24 0.00 0.43 0.00 0.00 52.55 50.61 2ayz s ASP 948 Cb 0.07 -1.80 0.19 0.00 -0.30 0.00 0.00 42.92 41.09 2ayz s ASP 948 CO 0.70 -0.45 1.26 -1.20 -0.17 0.00 0.00 175.17 175.30