#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fvr s THR 814 N 0.00 1.90 -0.22 0.58 2.01 -1.26 -5.03 115.64 113.63 1fvr s THR 814 Ca 0.00 -0.97 -0.08 0.00 0.31 0.00 0.00 61.69 60.95 1fvr s THR 814 Cb 0.00 -1.62 -0.04 0.00 0.01 0.00 0.00 72.50 70.85 1fvr s THR 814 CO 0.00 0.53 0.07 -0.63 -0.69 0.00 0.00 174.62 173.90 1fvr s ILE 815 N -0.01 4.62 0.24 1.82 1.01 -1.26 -5.03 121.20 122.60 1fvr s ILE 815 Ca -0.07 -0.08 0.08 0.00 0.00 0.00 0.00 60.65 60.58 1fvr s ILE 815 Cb -0.14 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 1fvr s ILE 815 CO 0.04 0.39 0.11 -0.31 0.00 0.00 0.00 174.94 175.17 1fvr s TYR 816 N 0.98 2.95 0.74 3.97 1.51 -1.26 -3.81 117.35 122.43 1fvr s TYR 816 Ca 0.04 -0.14 -0.11 0.00 -1.01 0.00 0.00 57.07 55.85 1fvr s TYR 816 Cb -0.14 -1.34 0.04 0.00 -0.11 0.00 0.00 41.96 40.40 1fvr s TYR 816 CO 0.03 0.55 1.08 -1.25 -1.11 0.00 0.00 175.55 174.85 1fvr s PRO 817 N -3.62 2.56 -0.12 -1.71 0.04 -1.26 -4.18 135.00 126.70 1fvr s PRO 817 Ca 0.32 0.85 -0.29 0.00 0.04 0.00 0.00 61.00 61.91 1fvr s PRO 817 Cb -0.08 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 1fvr s PRO 817 CO 0.22 -1.34 1.02 0.08 0.04 0.00 0.00 177.00 177.02 1fvr s VAL 818 N -3.07 4.75 0.09 -0.36 1.01 -1.26 -2.31 120.40 119.25 1fvr s VAL 818 Ca 0.59 2.03 -0.04 0.00 0.00 0.00 0.00 61.98 64.56 1fvr s VAL 818 Cb -0.14 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 31.88 1fvr s VAL 818 CO 0.55 -0.02 0.32 -0.76 0.00 0.00 0.00 175.10 175.19 1fvr s LEU 819 N 2.16 4.31 -0.29 3.92 1.43 0.28 -4.92 118.68 125.57 1fvr s LEU 819 Ca 0.48 0.52 -0.17 0.00 -1.03 0.00 0.00 54.13 53.94 1fvr s LEU 819 Cb -0.18 -3.09 -0.02 0.00 0.03 0.00 0.00 46.19 42.92 1fvr s LEU 819 CO 0.17 0.12 0.45 -0.62 0.23 0.00 0.00 176.35 176.70 1fvr s ASP 820 N -2.28 6.32 0.38 2.29 2.15 -1.26 -4.57 116.67 119.70 1fvr s ASP 820 Ca 0.37 0.24 0.21 0.00 0.43 0.00 0.00 52.55 53.80 1fvr s ASP 820 Cb -0.13 -2.25 1.29 0.00 -0.30 0.00 0.00 42.92 41.54 1fvr s ASP 820 CO 0.23 -0.30 1.62 -0.25 -0.17 0.00 0.00 175.17 176.30 1fvr h TRP 821 N 8.22 0.78 0.00 -5.34 2.91 -1.96 0.83 115.95 121.39 1fvr h TRP 821 Ca -0.30 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.76 1fvr h TRP 821 Cb 1.14 -0.19 0.00 0.00 -0.51 0.00 0.00 29.16 29.60 1fvr h TRP 821 CO 0.74 -0.31 0.00 -0.91 -1.03 0.00 0.00 178.44 176.93 1fvr h ASN 822 N 0.13 0.00 -0.35 2.65 2.35 -2.03 -2.30 115.58 116.02 1fvr h ASN 822 Ca 0.81 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.56 1fvr h ASN 822 Cb 2.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.52 1fvr h ASN 822 CO -0.63 0.00 0.00 0.47 -1.65 0.00 0.00 177.43 175.62 1fvr n ASP 823 N -2.95 1.98 -4.50 5.81 8.00 0.29 -4.85 116.55 120.32 1fvr n ASP 823 Ca -0.00 -1.97 -0.35 0.00 0.71 0.00 0.00 54.79 53.18 1fvr n ASP 823 Cb 0.23 -0.23 -0.12 0.00 -0.02 0.00 0.00 41.12 40.98 1fvr n ASP 823 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1fvr s ILE 824 N -1.53 4.21 -0.23 0.53 1.01 -0.87 -3.73 121.20 120.59 1fvr s ILE 824 Ca 0.26 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.69 1fvr s ILE 824 Cb 0.14 -2.90 0.04 0.00 0.01 0.00 0.00 42.46 39.74 1fvr s ILE 824 CO 0.18 0.43 -0.13 -0.75 0.00 0.00 0.00 174.94 174.67 1fvr s LYS 825 N 0.84 2.62 0.04 2.79 2.20 -0.48 -4.98 119.74 122.76 1fvr s LYS 825 Ca 0.02 -1.10 -0.26 0.00 -0.36 0.00 0.00 55.97 54.27 1fvr s LYS 825 Cb -0.14 -2.81 -0.05 0.00 -1.51 0.00 0.00 37.83 33.32 1fvr s LYS 825 CO 0.02 -0.42 0.79 -0.06 -0.36 0.00 0.00 175.35 175.33 1fvr s PHE 826 N 1.21 3.73 0.00 4.03 0.40 -1.26 -1.01 117.98 125.08 1fvr s PHE 826 Ca -0.02 1.50 0.00 0.00 -0.60 0.00 0.00 56.93 57.81 1fvr s PHE 826 Cb -0.17 -2.85 0.00 0.00 0.51 0.00 0.00 43.02 40.51 1fvr s PHE 826 CO -0.08 0.25 0.00 1.04 0.70 0.00 0.00 175.22 177.13 1fvr n GLN 827 N 2.88 2.19 -3.82 0.44 6.02 0.65 -4.97 117.38 120.76 1fvr n GLN 827 Ca -0.02 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.95 1fvr n GLN 827 Cb 0.50 -1.00 0.01 0.00 1.02 0.00 0.00 30.24 30.77 1fvr n GLN 827 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1fvr s ASP 828 N -2.54 -0.06 -0.12 1.08 3.68 -1.07 -4.97 116.67 112.67 1fvr s ASP 828 Ca 0.00 -0.55 0.03 0.00 2.13 0.00 0.00 52.55 54.16 1fvr s ASP 828 Cb 0.00 0.47 0.01 0.00 -1.45 0.00 0.00 42.92 41.95 1fvr s ASP 828 CO 0.00 -0.91 -0.20 -0.69 0.13 0.00 0.00 175.17 173.50 1fvr s VAL 829 N -2.55 1.84 0.17 1.11 1.01 -1.26 0.43 120.40 121.14 1fvr s VAL 829 Ca 0.18 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.34 1fvr s VAL 829 Cb -0.02 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1fvr s VAL 829 CO 0.04 0.51 0.15 2.30 0.00 0.00 0.00 175.10 178.09 1fvr n ILE 830 N 3.99 0.00 -4.30 2.22 -5.35 0.01 -4.92 119.36 111.01 1fvr n ILE 830 Ca -0.20 -1.21 -0.24 0.00 -0.27 0.00 0.00 62.75 60.83 1fvr n ILE 830 Cb 0.52 0.61 -0.08 0.00 -1.74 0.00 0.00 39.64 38.95 1fvr n ILE 830 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1fvr s GLY 831 N -2.17 1.69 -0.49 3.28 0.00 -1.26 -0.13 107.32 108.24 1fvr s GLY 831 Ca 0.20 -1.62 0.06 0.00 0.00 0.00 0.00 44.72 43.37 1fvr s GLY 831 CO 0.14 -1.67 0.69 -2.21 0.00 0.00 0.00 173.10 170.05 1fvr n GLU 832 N -0.65 0.55 0.00 2.90 2.13 -0.77 -4.87 120.64 119.93 1fvr n GLU 832 Ca -0.07 -2.23 0.00 0.00 0.66 0.00 0.00 57.16 55.51 1fvr n GLU 832 Cb 0.58 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.81 1fvr n GLU 832 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1fvr n GLY 833 N 2.53 2.88 0.00 8.31 0.00 -1.26 -1.72 105.19 115.92 1fvr n GLY 833 Ca 0.18 -0.29 0.10 0.00 0.00 0.00 0.00 46.02 46.01 1fvr n GLY 833 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1fvr n ASN 834 N 1.36 0.00 0.04 1.61 2.04 -1.26 -1.81 115.26 117.24 1fvr n ASN 834 Ca 0.00 -0.69 0.13 0.00 -0.44 0.00 0.00 54.58 53.58 1fvr n ASN 834 Cb 0.00 0.00 0.52 0.00 -2.53 0.00 0.00 39.78 37.77 1fvr n ASN 834 CO 0.00 0.00 0.00 0.49 -0.44 0.00 0.00 177.26 177.31 1fvr n PHE 835 N -0.98 0.32 -4.57 -2.53 3.01 -0.70 -4.70 117.46 107.31 1fvr n PHE 835 Ca 0.15 0.10 0.00 0.00 1.01 0.00 0.00 57.45 58.71 1fvr n PHE 835 Cb 0.07 -0.66 0.00 0.00 -0.01 0.00 0.00 39.48 38.88 1fvr n PHE 835 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1fvr n GLY 836 N 1.18 0.93 3.72 1.37 0.00 -0.75 -4.67 105.19 106.97 1fvr n GLY 836 Ca 0.06 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 1fvr n GLY 836 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fvr s GLN 837 N 0.00 4.47 0.17 1.61 -1.52 -1.26 -1.84 119.66 121.29 1fvr s GLN 837 Ca 0.00 1.75 0.02 0.00 -1.95 0.00 0.00 55.36 55.17 1fvr s GLN 837 Cb 0.00 -3.33 -0.05 0.00 -0.22 0.00 0.00 33.01 29.41 1fvr s GLN 837 CO 0.00 -0.18 0.01 0.14 -0.25 0.00 0.00 175.29 175.01 1fvr s VAL 838 N 0.76 0.62 -0.20 1.09 -7.23 0.82 -4.80 120.40 111.47 1fvr s VAL 838 Ca 0.56 -1.97 -0.15 0.00 -1.81 0.00 0.00 61.98 58.61 1fvr s VAL 838 Cb -0.29 -2.11 -0.04 0.00 0.56 0.00 0.00 36.38 34.49 1fvr s VAL 838 CO 0.31 -0.47 0.38 -0.76 -0.31 0.00 0.00 175.10 174.24 1fvr s LEU 839 N -3.16 4.16 0.13 1.32 1.43 -0.26 -0.81 118.68 121.49 1fvr s LEU 839 Ca 0.24 0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 53.54 1fvr s LEU 839 Cb 0.06 -2.48 -0.06 0.00 0.03 0.00 0.00 46.19 43.74 1fvr s LEU 839 CO 0.04 -0.05 1.03 -0.75 0.23 0.00 0.00 176.35 176.85 1fvr s LYS 840 N 1.20 4.63 0.24 1.70 2.20 0.17 0.75 119.74 130.63 1fvr s LYS 840 Ca 0.18 1.58 -0.07 0.00 -0.36 0.00 0.00 55.97 57.30 1fvr s LYS 840 Cb -0.14 -3.34 0.03 0.00 -1.51 0.00 0.00 37.83 32.86 1fvr s LYS 840 CO 0.07 0.12 0.44 0.00 -0.36 0.00 0.00 175.35 175.62 1fvr n ALA 841 N 2.74 -0.83 -3.22 3.13 0.00 0.12 -0.25 120.51 122.20 1fvr n ALA 841 Ca 0.03 -0.87 -0.25 0.00 0.00 0.00 0.00 53.44 52.35 1fvr n ALA 841 Cb 0.48 0.70 -0.16 0.00 0.00 0.00 0.00 19.45 20.46 1fvr n ALA 841 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1fvr s ARG 842 N -2.20 1.80 0.46 0.00 0.52 -0.18 -0.90 118.95 118.45 1fvr s ARG 842 Ca 0.13 -0.51 0.02 0.00 -0.52 0.00 0.00 55.73 54.85 1fvr s ARG 842 Cb -0.02 -1.50 -0.02 0.00 0.52 0.00 0.00 34.95 33.94 1fvr s ARG 842 CO 0.09 0.12 0.07 0.96 0.02 0.00 0.00 175.30 176.57 1fvr s ILE 843 N 0.39 0.82 -0.31 1.52 -4.36 -0.56 -1.38 121.20 117.32 1fvr s ILE 843 Ca -0.11 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.31 1fvr s ILE 843 Cb -0.14 -2.23 0.08 0.00 1.25 0.00 0.00 42.46 41.43 1fvr s ILE 843 CO 0.03 0.00 -0.01 -0.75 0.24 0.00 0.00 174.94 174.45 1fvr s LYS 844 N -3.78 1.89 -0.09 0.37 2.20 -1.24 -1.48 119.74 117.60 1fvr s LYS 844 Ca 0.14 -1.61 0.02 0.00 -0.36 0.00 0.00 55.97 54.16 1fvr s LYS 844 Cb 0.02 -3.09 0.01 0.00 -1.51 0.00 0.00 37.83 33.26 1fvr s LYS 844 CO 0.09 -0.77 -0.15 0.21 -0.36 0.00 0.00 175.35 174.37 1fvr s LYS 845 N 1.02 2.16 -1.32 4.03 2.20 -0.46 -4.74 119.74 122.62 1fvr s LYS 845 Ca 0.01 -0.55 -0.07 0.00 -0.36 0.00 0.00 55.97 55.00 1fvr s LYS 845 Cb -0.20 -1.79 0.01 0.00 -1.51 0.00 0.00 37.83 34.34 1fvr s LYS 845 CO -0.06 -0.01 0.93 -0.25 -0.36 0.00 0.00 175.35 175.60 1fvr n ASP 846 N 4.01 -6.00 0.00 1.43 8.00 -1.26 -2.19 116.55 120.54 1fvr n ASP 846 Ca -0.20 -0.42 0.00 0.00 0.71 0.00 0.00 54.79 54.88 1fvr n ASP 846 Cb 0.52 -4.69 0.00 0.00 -0.02 0.00 0.00 41.12 36.93 1fvr n ASP 846 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fvr n GLY 847 N -1.77 1.94 3.58 0.44 0.00 -1.26 -5.00 105.19 103.13 1fvr n GLY 847 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1fvr n GLY 847 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fvr s LEU 848 N 0.00 3.11 -0.11 0.99 1.43 -0.93 -5.09 118.68 118.09 1fvr s LEU 848 Ca 0.00 -0.15 -0.24 0.00 -1.03 0.00 0.00 54.13 52.72 1fvr s LEU 848 Cb 0.00 -1.77 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 1fvr s LEU 848 CO 0.00 0.30 0.73 -0.13 0.23 0.00 0.00 176.35 177.48 1fvr s ARG 849 N -1.30 4.38 0.16 1.70 0.52 -1.26 -1.36 118.95 121.79 1fvr s ARG 849 Ca 0.16 0.90 0.00 0.00 -0.52 0.00 0.00 55.73 56.27 1fvr s ARG 849 Cb -0.11 -3.50 -0.04 0.00 0.52 0.00 0.00 34.95 31.82 1fvr s ARG 849 CO 0.06 -0.07 0.05 0.00 0.02 0.00 0.00 175.30 175.36 1fvr s MET 850 N 1.28 1.05 0.43 3.54 0.23 -0.55 -4.97 119.30 120.31 1fvr s MET 850 Ca 0.37 -1.51 -0.22 0.00 -1.03 0.00 0.00 55.69 53.30 1fvr s MET 850 Cb -0.17 0.04 -0.10 0.00 -1.53 0.00 0.00 34.83 33.07 1fvr s MET 850 CO 0.16 -0.23 0.98 -0.51 -2.03 0.00 0.00 175.02 173.38 1fvr s ASP 851 N -3.12 6.84 0.19 -1.18 -0.00 -1.26 -1.49 116.67 116.65 1fvr s ASP 851 Ca 0.26 1.79 -0.23 0.00 -0.00 0.00 0.00 52.55 54.37 1fvr s ASP 851 Cb 0.07 -2.55 0.07 0.00 -0.00 0.00 0.00 42.92 40.51 1fvr s ASP 851 CO 0.04 -0.43 0.99 0.00 -0.00 0.00 0.00 175.17 175.77 1fvr s ALA 852 N -2.03 -1.55 0.11 5.23 0.00 -0.07 -4.51 121.76 118.94 1fvr s ALA 852 Ca 0.61 -0.18 0.08 0.00 0.00 0.00 0.00 51.96 52.47 1fvr s ALA 852 Cb -0.13 0.70 -0.04 0.00 0.00 0.00 0.00 23.12 23.66 1fvr s ALA 852 CO 0.17 -1.05 -0.21 0.00 0.00 0.00 0.00 175.76 174.67 1fvr s ALA 853 N -2.62 1.84 -0.13 0.00 0.00 -0.38 -0.70 121.76 119.77 1fvr s ALA 853 Ca 0.17 -1.27 0.01 0.00 0.00 0.00 0.00 51.96 50.87 1fvr s ALA 853 Cb -0.02 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.87 1fvr s ALA 853 CO 0.05 0.36 -0.13 0.42 0.00 0.00 0.00 175.76 176.46 1fvr s ILE 854 N -1.21 1.46 -0.34 0.00 1.01 0.23 -0.69 121.20 121.66 1fvr s ILE 854 Ca 0.07 -0.58 -0.16 0.00 0.00 0.00 0.00 60.65 59.99 1fvr s ILE 854 Cb -0.10 -1.38 -0.01 0.00 0.01 0.00 0.00 42.46 40.98 1fvr s ILE 854 CO 0.04 0.44 0.40 -0.75 0.00 0.00 0.00 174.94 175.07 1fvr s LYS 855 N 1.40 3.61 -0.27 2.79 2.47 0.11 -1.10 119.74 128.75 1fvr s LYS 855 Ca 0.02 -0.33 -0.22 0.00 -1.56 0.00 0.00 55.97 53.88 1fvr s LYS 855 Cb -0.13 -3.79 -0.01 0.00 -1.46 0.00 0.00 37.83 32.44 1fvr s LYS 855 CO -0.08 -0.53 0.72 0.50 0.16 0.00 0.00 175.35 176.12 1fvr s ARG 856 N 2.10 4.05 -0.19 4.03 3.52 -1.26 -0.73 118.95 130.47 1fvr s ARG 856 Ca 0.13 0.61 -0.01 0.00 -0.13 0.00 0.00 55.73 56.34 1fvr s ARG 856 Cb -0.16 -3.68 0.01 0.00 -1.56 0.00 0.00 34.95 29.55 1fvr s ARG 856 CO 0.12 -0.54 -0.14 -1.64 -0.81 0.00 0.00 175.30 172.29 1fvr s MET 857 N 2.73 3.14 0.08 5.12 -1.94 0.26 -4.96 119.30 123.74 1fvr s MET 857 Ca 0.30 -0.75 -0.31 0.00 -1.71 0.00 0.00 55.69 53.22 1fvr s MET 857 Cb -0.15 -2.73 -0.07 0.00 2.01 0.00 0.00 34.83 33.89 1fvr s MET 857 CO 0.10 -0.19 1.35 -1.59 -0.01 0.00 0.00 175.02 174.68 1fvr s LYS 858 N 1.32 4.33 0.05 2.03 0.00 -1.26 -0.50 119.74 125.72 1fvr s LYS 858 Ca 0.05 1.99 0.13 0.00 0.00 0.00 0.00 55.97 58.14 1fvr s LYS 858 Cb -0.14 -3.33 -0.17 0.00 0.00 0.00 0.00 37.83 34.19 1fvr s LYS 858 CO -0.09 -0.43 0.92 0.93 0.00 0.00 0.00 175.35 176.69 1fvr h GLU 859 N 7.02 0.00 -4.39 1.78 5.08 -1.83 -3.46 114.58 118.78 1fvr h GLU 859 Ca -0.41 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 57.24 1fvr h GLU 859 Cb 1.20 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 30.13 1fvr h GLU 859 CO 0.86 0.54 -0.48 0.71 -1.00 0.00 0.00 179.01 179.65 1fvr s TYR 860 N -2.75 3.52 0.00 4.33 4.12 -1.26 -4.87 117.35 120.44 1fvr s TYR 860 Ca -0.02 -2.18 0.00 0.00 0.02 0.00 0.00 57.07 54.89 1fvr s TYR 860 Cb 0.09 -3.35 0.00 0.00 -1.52 0.00 0.00 41.96 37.17 1fvr s TYR 860 CO 0.81 -0.98 0.00 -2.13 0.02 0.00 0.00 175.55 173.27 1fvr n ARG 867 N 4.72 0.00 0.08 -0.62 0.63 -1.26 -5.06 116.66 115.16 1fvr n ARG 867 Ca -0.05 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.78 1fvr n ARG 867 Cb 0.41 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.26 1fvr n ARG 867 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 1fvr h ASP 868 N 0.00 0.30 0.17 6.15 1.82 -1.99 -3.06 116.42 119.80 1fvr h ASP 868 Ca 0.00 -0.27 -0.01 0.00 -0.39 0.00 0.00 57.03 56.36 1fvr h ASP 868 Cb 0.00 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 39.92 1fvr h ASP 868 CO 0.00 1.12 -0.08 0.15 -1.61 0.00 0.00 179.24 178.82 1fvr h PHE 869 N 0.10 -0.21 -0.79 0.28 3.57 -1.89 -2.83 116.94 115.17 1fvr h PHE 869 Ca -0.07 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.51 1fvr h PHE 869 Cb 1.65 0.07 -0.05 0.00 2.79 0.00 0.00 35.95 40.41 1fvr h PHE 869 CO 0.04 0.12 0.52 0.00 -2.23 0.00 0.00 178.31 176.75 1fvr h ALA 870 N 0.20 1.69 -0.13 2.41 0.00 -1.92 -1.51 119.26 120.00 1fvr h ALA 870 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1fvr h ALA 870 Cb 0.42 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1fvr h ALA 870 CO 0.04 0.16 0.03 0.78 0.00 0.00 0.00 179.25 180.26 1fvr h GLY 871 N 0.80 0.23 1.39 0.00 0.00 -1.50 -0.77 103.07 103.22 1fvr h GLY 871 Ca 0.35 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 1fvr h GLY 871 CO -0.13 0.13 0.26 0.83 0.00 0.00 0.00 176.54 177.63 1fvr h GLU 872 N 0.01 0.79 -0.38 4.80 5.08 -1.19 -2.48 114.58 121.20 1fvr h GLU 872 Ca 0.04 -0.10 -0.16 0.00 -1.00 0.00 0.00 59.36 58.14 1fvr h GLU 872 Cb 0.26 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1fvr h GLU 872 CO 0.00 0.62 -0.37 1.25 -1.00 0.00 0.00 179.01 179.51 1fvr h LEU 873 N 0.79 0.97 -0.86 1.33 6.46 -1.12 -2.01 115.31 120.87 1fvr h LEU 873 Ca 0.19 -0.44 -0.01 0.00 -0.12 0.00 0.00 57.88 57.50 1fvr h LEU 873 Cb 0.10 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 39.72 1fvr h LEU 873 CO -0.02 1.23 0.49 -0.08 -0.62 0.00 0.00 178.44 179.44 1fvr h GLU 874 N 0.75 1.19 -0.21 1.25 4.57 -0.71 -1.61 114.58 119.80 1fvr h GLU 874 Ca 0.06 -0.13 -0.04 0.00 -1.18 0.00 0.00 59.36 58.08 1fvr h GLU 874 Cb 0.96 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 29.30 1fvr h GLU 874 CO 0.09 0.86 -0.01 0.28 -1.18 0.00 0.00 179.01 179.04 1fvr h VAL 875 N 1.19 1.26 -0.84 0.32 2.07 -1.35 -3.18 116.25 115.73 1fvr h VAL 875 Ca 0.31 -0.92 0.07 0.00 0.82 0.00 0.00 66.70 66.97 1fvr h VAL 875 Cb -0.00 1.46 -0.06 0.00 -1.52 0.00 0.00 31.29 31.16 1fvr h VAL 875 CO -0.05 0.28 0.51 -0.07 0.02 0.00 0.00 177.57 178.26 1fvr h LEU 876 N 0.13 0.78 -2.06 2.57 3.38 -1.00 -1.60 115.31 117.50 1fvr h LEU 876 Ca 0.06 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1fvr h LEU 876 Cb 0.43 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1fvr h LEU 876 CO 0.01 0.49 0.00 0.00 0.09 0.00 0.00 178.44 179.03 1fvr n LYS 878 N -2.85 1.88 -0.23 0.00 5.02 -0.61 -4.27 118.16 117.10 1fvr n LYS 878 Ca -0.01 -1.28 -0.07 0.00 -2.02 0.00 0.00 58.31 54.92 1fvr n LYS 878 Cb 0.15 -1.47 0.05 0.00 -0.02 0.00 0.00 35.03 33.74 1fvr n LYS 878 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1fvr h LEU 879 N 3.07 1.05 0.00 -0.35 3.38 -1.33 -3.48 115.31 117.65 1fvr h LEU 879 Ca 0.00 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1fvr h LEU 879 Cb 0.65 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1fvr h LEU 879 CO 0.00 1.04 0.00 0.61 0.09 0.00 0.00 178.44 180.18 1fvr n GLY 880 N -0.60 0.21 3.07 0.83 0.00 -1.26 -4.83 105.19 102.61 1fvr n GLY 880 Ca 0.04 -0.90 -0.19 0.00 0.00 0.00 0.00 46.02 44.98 1fvr n GLY 880 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1fvr s HIS 881 N 0.00 0.97 -0.26 1.61 0.09 -1.26 -4.73 115.29 111.71 1fvr s HIS 881 Ca 0.00 -0.26 -0.25 0.00 -0.00 0.00 0.00 55.06 54.55 1fvr s HIS 881 Cb 0.00 -0.60 0.09 0.00 -0.00 0.00 0.00 32.58 32.07 1fvr s HIS 881 CO 0.00 -0.01 0.86 -1.58 -0.00 0.00 0.00 174.74 174.01 1fvr s HIS 882 N -0.54 -0.64 0.48 1.40 5.04 -1.26 -5.06 115.29 114.71 1fvr s HIS 882 Ca 0.02 1.52 0.17 0.00 -1.54 0.00 0.00 55.06 55.23 1fvr s HIS 882 Cb -0.06 0.32 1.19 0.00 0.04 0.00 0.00 32.58 34.07 1fvr s HIS 882 CO 0.00 -0.33 2.03 -1.35 -2.34 0.00 0.00 174.74 172.75 1fvr h PRO 883 N 4.48 0.19 -0.86 2.88 0.11 -2.00 -2.98 132.00 133.82 1fvr h PRO 883 Ca -0.28 -0.01 -0.36 0.00 0.11 0.00 0.00 66.00 65.45 1fvr h PRO 883 Cb 1.17 -0.04 -0.22 0.00 0.11 0.00 0.00 31.00 32.02 1fvr h PRO 883 CO 0.10 0.13 0.46 0.09 -0.21 0.00 0.00 178.00 178.56 1fvr n ASN 884 N -4.46 4.30 -4.26 -2.05 5.03 -1.26 -4.76 115.26 107.80 1fvr n ASN 884 Ca 0.06 -3.42 -0.14 0.00 0.87 0.00 0.00 54.58 51.95 1fvr n ASN 884 Cb 0.36 -0.79 -0.10 0.00 -1.02 0.00 0.00 39.78 38.23 1fvr n ASN 884 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 1fvr s ILE 885 N -3.15 0.70 -0.29 2.41 -4.36 -1.13 -1.26 121.20 114.12 1fvr s ILE 885 Ca 0.56 -1.99 -0.28 0.00 -0.26 0.00 0.00 60.65 58.68 1fvr s ILE 885 Cb 0.46 -2.20 0.01 0.00 1.25 0.00 0.00 42.46 41.99 1fvr s ILE 885 CO 0.12 -0.41 1.03 -0.63 0.24 0.00 0.00 174.94 175.30 1fvr s ILE 886 N -3.64 4.59 0.18 8.37 -1.09 -0.35 -4.59 121.20 124.66 1fvr s ILE 886 Ca 0.26 1.75 -0.16 0.00 -2.23 0.00 0.00 60.65 60.26 1fvr s ILE 886 Cb 0.06 -4.36 -0.07 0.00 -1.58 0.00 0.00 42.46 36.51 1fvr s ILE 886 CO 0.05 -0.37 0.62 0.20 -1.23 0.00 0.00 174.94 174.21 1fvr s ASN 887 N 1.53 6.91 0.01 3.58 0.01 -1.26 -4.80 114.94 120.92 1fvr s ASN 887 Ca 0.43 1.21 -0.27 0.00 -0.71 0.00 0.00 52.86 53.53 1fvr s ASN 887 Cb -0.13 -2.34 -0.04 0.00 0.41 0.00 0.00 41.25 39.15 1fvr s ASN 887 CO 0.13 0.07 0.86 -0.76 -1.51 0.00 0.00 177.10 175.88 1fvr s LEU 888 N -1.99 4.39 0.00 0.60 1.43 -1.26 -1.91 118.68 119.94 1fvr s LEU 888 Ca 0.40 1.51 0.22 0.00 -1.03 0.00 0.00 54.13 55.23 1fvr s LEU 888 Cb -0.15 -3.37 -0.05 0.00 0.03 0.00 0.00 46.19 42.65 1fvr s LEU 888 CO 0.20 -0.14 1.06 0.18 0.23 0.00 0.00 176.35 177.88 1fvr n LEU 889 N 3.48 1.85 0.00 1.79 4.77 0.16 -4.97 117.00 124.09 1fvr n LEU 889 Ca 0.02 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.28 1fvr n LEU 889 Cb 0.51 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1fvr n LEU 889 CO 0.49 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 1fvr n GLY 890 N 1.44 1.01 3.39 -0.72 0.00 -1.22 -4.25 105.19 104.83 1fvr n GLY 890 Ca 0.08 -1.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.02 1fvr n GLY 890 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fvr s ALA 891 N -1.01 -0.37 -0.14 4.61 0.00 -0.98 -0.70 121.76 123.17 1fvr s ALA 891 Ca 0.00 -0.61 -0.06 0.00 0.00 0.00 0.00 51.96 51.29 1fvr s ALA 891 Cb 0.00 0.82 0.07 0.00 0.00 0.00 0.00 23.12 24.01 1fvr s ALA 891 CO 0.00 -0.69 0.31 0.00 0.00 0.00 0.00 175.76 175.39 1fvr s GLU 893 N 2.06 4.41 -0.22 0.00 2.02 -1.26 0.30 118.70 126.01 1fvr s GLU 893 Ca -0.03 0.79 -0.05 0.00 0.02 0.00 0.00 54.97 55.70 1fvr s GLU 893 Cb -0.11 -3.44 0.11 0.00 0.10 0.00 0.00 34.13 30.79 1fvr s GLU 893 CO -0.10 0.10 0.41 -1.58 0.02 0.00 0.00 175.26 174.11 1fvr s HIS 894 N 0.71 -0.84 -1.38 1.61 2.46 0.18 -4.95 115.29 113.09 1fvr s HIS 894 Ca 0.35 1.24 -0.07 0.00 0.47 0.00 0.00 55.06 57.04 1fvr s HIS 894 Cb -0.17 0.19 0.03 0.00 -0.13 0.00 0.00 32.58 32.50 1fvr s HIS 894 CO 0.17 -0.60 1.00 2.89 -2.47 0.00 0.00 174.74 175.73 1fvr n ARG 895 N 5.38 -6.42 -0.88 2.88 -4.01 -1.26 -2.25 116.66 110.10 1fvr n ARG 895 Ca -0.06 0.72 0.00 0.00 -1.04 0.00 0.00 57.85 57.47 1fvr n ARG 895 Cb 0.50 -5.63 0.00 0.00 -3.04 0.00 0.00 32.46 24.29 1fvr n ARG 895 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1fvr n GLY 896 N -1.69 0.80 3.23 2.89 0.00 -1.26 -5.03 105.19 104.14 1fvr n GLY 896 Ca -0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 1fvr n GLY 896 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fvr s TYR 897 N -3.11 1.97 -0.22 1.61 2.02 -0.95 -2.25 117.35 116.42 1fvr s TYR 897 Ca 0.00 -0.40 -0.16 0.00 -0.37 0.00 0.00 57.07 56.14 1fvr s TYR 897 Cb 0.00 -1.27 -0.04 0.00 -0.40 0.00 0.00 41.96 40.25 1fvr s TYR 897 CO 0.00 -0.05 0.41 -1.17 -1.57 0.00 0.00 175.55 173.16 1fvr s LEU 898 N -0.45 4.12 -0.67 -1.29 2.96 0.34 -0.64 118.68 123.04 1fvr s LEU 898 Ca 0.07 0.47 -0.15 0.00 -0.22 0.00 0.00 54.13 54.30 1fvr s LEU 898 Cb -0.09 -2.52 0.17 0.00 0.50 0.00 0.00 46.19 44.25 1fvr s LEU 898 CO -0.00 -0.12 0.63 -0.31 -1.32 0.00 0.00 176.35 175.23 1fvr s TYR 899 N 1.58 3.47 -0.22 5.38 2.02 0.15 -0.57 117.35 129.15 1fvr s TYR 899 Ca 0.18 -1.59 -0.27 0.00 -0.37 0.00 0.00 57.07 55.02 1fvr s TYR 899 Cb -0.15 -3.82 0.00 0.00 -0.40 0.00 0.00 41.96 37.59 1fvr s TYR 899 CO 0.08 -1.02 0.96 -1.17 -1.57 0.00 0.00 175.55 172.83 1fvr s LEU 900 N 1.02 4.11 -0.07 -1.29 2.96 0.09 -1.65 118.68 123.84 1fvr s LEU 900 Ca 0.10 1.26 -0.19 0.00 -0.22 0.00 0.00 54.13 55.09 1fvr s LEU 900 Cb -0.21 -3.41 -0.05 0.00 0.50 0.00 0.00 46.19 43.03 1fvr s LEU 900 CO -0.02 -0.59 0.51 0.00 -1.32 0.00 0.00 176.35 174.93 1fvr s ALA 901 N 2.96 3.50 0.21 5.97 0.00 0.12 0.08 121.76 134.59 1fvr s ALA 901 Ca 0.41 -0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.27 1fvr s ALA 901 Cb -0.15 -2.66 -0.05 0.00 0.00 0.00 0.00 23.12 20.26 1fvr s ALA 901 CO 0.07 0.10 0.05 0.96 0.00 0.00 0.00 175.76 176.95 1fvr s ILE 902 N 0.19 0.57 0.33 0.00 -4.36 0.13 -0.67 121.20 117.40 1fvr s ILE 902 Ca 0.28 -1.99 -0.29 0.00 -0.26 0.00 0.00 60.65 58.39 1fvr s ILE 902 Cb -0.16 -2.34 -0.11 0.00 1.25 0.00 0.00 42.46 41.10 1fvr s ILE 902 CO 0.13 -0.26 1.49 -1.61 0.24 0.00 0.00 174.94 174.92 1fvr s GLU 903 N -3.98 4.16 -0.07 0.37 2.02 -0.80 -1.25 118.70 119.15 1fvr s GLU 903 Ca 0.30 2.50 -0.18 0.00 0.02 0.00 0.00 54.97 57.61 1fvr s GLU 903 Cb 0.07 -3.01 -0.05 0.00 0.10 0.00 0.00 34.13 31.24 1fvr s GLU 903 CO 0.08 -0.50 0.47 -0.47 0.02 0.00 0.00 175.26 174.86 1fvr s TYR 904 N -0.69 3.59 -0.42 1.61 5.04 -1.26 -4.52 117.35 120.70 1fvr s TYR 904 Ca 0.56 0.95 -0.11 0.00 -2.44 0.00 0.00 57.07 56.03 1fvr s TYR 904 Cb -0.45 -2.49 0.06 0.00 0.35 0.00 0.00 41.96 39.43 1fvr s TYR 904 CO 0.55 0.32 0.29 0.00 -1.34 0.00 0.00 175.55 175.37 1fvr s ALA 905 N 0.07 3.37 0.56 3.97 0.00 -1.26 -4.64 121.76 123.82 1fvr s ALA 905 Ca 0.26 -2.03 0.25 0.00 0.00 0.00 0.00 51.96 50.43 1fvr s ALA 905 Cb -0.16 -2.76 1.59 0.00 0.00 0.00 0.00 23.12 21.79 1fvr s ALA 905 CO 0.12 -1.61 2.18 -1.35 0.00 0.00 0.00 175.76 175.10 1fvr h PRO 906 N 8.51 0.00 -0.44 0.00 0.11 -1.85 -2.97 132.00 135.37 1fvr h PRO 906 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1fvr h PRO 906 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1fvr h PRO 906 CO 0.77 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 179.28 1fvr n HIS 907 N -4.11 1.26 -4.72 0.65 8.25 -1.02 -5.09 115.22 110.44 1fvr n HIS 907 Ca -0.02 -0.73 0.00 0.00 -0.26 0.00 0.00 57.72 56.72 1fvr n HIS 907 Cb 0.15 -0.30 0.00 0.00 1.12 0.00 0.00 29.99 30.96 1fvr n HIS 907 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fvr n GLY 908 N 0.28 -0.34 3.85 -1.41 0.00 -1.12 -4.66 105.19 101.79 1fvr n GLY 908 Ca 0.22 -1.02 -0.32 0.00 0.00 0.00 0.00 46.02 44.90 1fvr n GLY 908 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fvr s ASN 909 N -4.00 6.54 0.33 1.61 2.20 -1.26 -0.81 114.94 119.55 1fvr s ASN 909 Ca 0.00 1.51 0.01 0.00 -0.94 0.00 0.00 52.86 53.44 1fvr s ASN 909 Cb 0.00 -2.49 0.56 0.00 -2.00 0.00 0.00 41.25 37.32 1fvr s ASN 909 CO 0.00 -0.63 1.99 0.25 -2.94 0.00 0.00 177.10 175.77 1fvr h LEU 910 N 0.69 0.82 0.08 3.54 5.85 -0.56 -2.33 115.31 123.40 1fvr h LEU 910 Ca -0.46 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.23 1fvr h LEU 910 Cb 1.19 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.01 1fvr h LEU 910 CO 0.62 0.59 -0.04 0.25 -0.34 0.00 0.00 178.44 179.52 1fvr h LEU 911 N 0.96 -0.09 -1.05 2.25 5.85 -1.80 0.12 115.31 121.55 1fvr h LEU 911 Ca 0.26 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.86 1fvr h LEU 911 Cb -0.10 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1fvr h LEU 911 CO -0.06 -0.02 -0.17 0.44 -0.34 0.00 0.00 178.44 178.29 1fvr h ASP 912 N -0.16 0.47 -0.27 1.25 3.32 -1.88 -1.36 116.42 117.78 1fvr h ASP 912 Ca -0.01 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 1fvr h ASP 912 Cb 0.13 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1fvr h ASP 912 CO 0.02 0.66 0.08 0.15 -1.72 0.00 0.00 179.24 178.43 1fvr h PHE 913 N 0.43 0.44 -0.45 4.55 3.57 -1.04 0.43 116.94 124.86 1fvr h PHE 913 Ca 0.08 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1fvr h PHE 913 Cb 0.55 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 1fvr h PHE 913 CO 0.02 0.48 0.29 -0.07 -2.23 0.00 0.00 178.31 176.80 1fvr h LEU 914 N 0.27 0.53 -0.65 0.59 3.38 -0.51 -2.64 115.31 116.28 1fvr h LEU 914 Ca 0.09 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1fvr h LEU 914 Cb 0.25 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1fvr h LEU 914 CO -0.00 0.40 -0.01 0.03 0.09 0.00 0.00 178.44 178.95 1fvr h ARG 915 N 0.61 1.04 0.00 1.13 3.08 -1.08 -2.49 114.38 116.67 1fvr h ARG 915 Ca 0.16 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1fvr h ARG 915 Cb -0.05 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.91 1fvr h ARG 915 CO -0.03 1.02 0.00 1.63 -1.07 0.00 0.00 179.97 181.52 1fvr n LYS 916 N -4.18 0.02 0.03 0.04 5.02 0.13 -2.42 118.16 116.79 1fvr n LYS 916 Ca 0.03 0.26 0.13 0.00 -2.02 0.00 0.00 58.31 56.70 1fvr n LYS 916 Cb 0.35 -1.54 0.33 0.00 -0.02 0.00 0.00 35.03 34.15 1fvr n LYS 916 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1fvr n SER 917 N -1.58 0.47 -3.95 4.39 3.41 -0.94 -4.59 113.62 110.83 1fvr n SER 917 Ca 0.03 0.11 -0.37 0.00 -0.26 0.00 0.00 58.87 58.38 1fvr n SER 917 Cb 0.18 -0.05 -0.07 0.00 -0.26 0.00 0.00 64.21 64.01 1fvr n SER 917 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1fvr n ARG 918 N -1.74 1.27 0.29 4.33 1.74 -1.02 -2.02 116.66 119.52 1fvr n ARG 918 Ca 0.05 -1.93 0.18 0.00 -0.77 0.00 0.00 57.85 55.38 1fvr n ARG 918 Cb 0.37 -3.17 0.98 0.00 -1.02 0.00 0.00 32.46 29.62 1fvr n ARG 918 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 1fvr h VAL 919 N 5.18 0.35 0.00 1.55 3.04 -1.80 -0.97 116.25 123.59 1fvr h VAL 919 Ca 0.32 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.01 1fvr h VAL 919 Cb 0.77 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 31.00 1fvr h VAL 919 CO 1.70 0.00 0.00 0.25 -1.01 0.00 0.00 177.57 178.51 1fvr h LEU 920 N 0.00 0.00 0.00 3.16 5.85 -1.81 0.20 115.31 122.71 1fvr h LEU 920 Ca 0.02 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.49 1fvr h LEU 920 Cb 0.13 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 1fvr h LEU 920 CO -0.00 0.00 -1.93 -0.62 -0.34 0.00 0.00 178.44 175.55 1fvr n GLU 921 N -3.06 1.15 0.11 1.25 1.02 -0.41 -4.04 120.64 116.67 1fvr n GLU 921 Ca -0.02 0.04 0.06 0.00 -0.02 0.00 0.00 57.16 57.22 1fvr n GLU 921 Cb 0.14 -1.34 0.01 0.00 -0.02 0.00 0.00 31.44 30.24 1fvr n GLU 921 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1fvr h THR 922 N 0.00 0.40 0.00 2.62 1.35 -1.29 -3.42 112.91 112.57 1fvr h THR 922 Ca -0.37 -1.65 -0.18 0.00 -0.55 0.00 0.00 66.41 63.67 1fvr h THR 922 Cb 1.70 2.02 -0.14 0.00 -1.73 0.00 0.00 68.15 70.00 1fvr h THR 922 CO -0.02 0.23 -0.33 -0.67 -0.25 0.00 0.00 175.52 174.48 1fvr n ASP 923 N -2.98 -2.32 -0.29 5.36 2.03 0.66 -5.03 116.55 113.99 1fvr n ASP 923 Ca -0.01 -2.88 0.29 0.00 0.52 0.00 0.00 54.79 52.71 1fvr n ASP 923 Cb 0.69 1.52 0.65 0.00 -0.72 0.00 0.00 41.12 43.26 1fvr n ASP 923 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1fvr h PRO 924 N 3.54 0.15 0.13 -0.67 0.13 -1.58 -0.32 132.00 133.39 1fvr h PRO 924 Ca -0.18 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 1fvr h PRO 924 Cb 1.10 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 1fvr h PRO 924 CO 0.15 0.10 -0.12 0.00 -0.23 0.00 0.00 178.00 177.90 1fvr h ALA 925 N 1.52 -0.24 -0.14 -0.56 0.00 -1.92 0.21 119.26 118.12 1fvr h ALA 925 Ca 0.54 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.43 1fvr h ALA 925 Cb 1.85 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.79 1fvr h ALA 925 CO -0.11 -0.65 0.04 0.35 0.00 0.00 0.00 179.25 178.88 1fvr h PHE 926 N -0.27 0.07 -0.34 0.00 3.57 -1.42 -0.09 116.94 118.47 1fvr h PHE 926 Ca 0.00 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.57 1fvr h PHE 926 Cb 0.25 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 38.91 1fvr h PHE 926 CO -0.11 0.04 -0.07 0.00 -2.23 0.00 0.00 178.31 175.93 1fvr h ALA 927 N 1.09 0.23 -0.44 2.41 0.00 -1.01 0.25 119.26 121.79 1fvr h ALA 927 Ca 0.06 0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1fvr h ALA 927 Cb 0.04 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1fvr h ALA 927 CO -0.07 -0.45 -0.01 0.82 0.00 0.00 0.00 179.25 179.54 1fvr h ILE 928 N 0.01 1.26 -0.36 0.00 1.08 -0.38 0.26 117.51 119.39 1fvr h ILE 928 Ca 0.16 -1.05 -0.03 0.00 -0.39 0.00 0.00 64.86 63.54 1fvr h ILE 928 Cb 0.24 1.07 -0.02 0.00 -3.07 0.00 0.00 36.82 35.04 1fvr h ILE 928 CO -0.34 0.36 0.08 0.00 -0.69 0.00 0.00 178.15 177.56 1fvr h ALA 929 N 0.90 1.47 -0.52 1.87 0.00 -0.50 -2.70 119.26 119.79 1fvr h ALA 929 Ca 0.12 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1fvr h ALA 929 Cb 0.50 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1fvr h ALA 929 CO 0.02 0.39 0.00 0.09 0.00 0.00 0.00 179.25 179.75 1fvr n ASN 930 N -4.34 3.41 -4.05 0.00 3.02 0.83 -4.97 115.26 109.18 1fvr n ASN 930 Ca 0.02 -1.98 -0.33 0.00 -0.03 0.00 0.00 54.58 52.26 1fvr n ASN 930 Cb 0.19 -0.34 -0.01 0.00 -0.61 0.00 0.00 39.78 39.01 1fvr n ASN 930 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1fvr n SER 931 N 1.12 -3.73 -4.21 6.41 7.64 0.79 -4.94 113.62 116.70 1fvr n SER 931 Ca 0.18 -0.88 -0.18 0.00 1.01 0.00 0.00 58.87 59.00 1fvr n SER 931 Cb 0.53 -3.03 -0.12 0.00 -1.01 0.00 0.00 64.21 60.58 1fvr n SER 931 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1fvr s THR 932 N -3.23 1.26 -2.06 0.44 -1.32 -0.40 -2.15 115.64 108.17 1fvr s THR 932 Ca 0.69 -1.54 0.20 0.00 -1.21 0.00 0.00 61.69 59.83 1fvr s THR 932 Cb -0.37 -1.35 0.04 0.00 -1.51 0.00 0.00 72.50 69.32 1fvr s THR 932 CO 0.85 -0.32 1.05 0.00 -2.21 0.00 0.00 174.62 173.98 1fvr n ALA 933 N 0.86 3.13 -3.24 11.08 0.00 0.86 -4.54 120.51 128.67 1fvr n ALA 933 Ca -0.18 -0.62 -0.14 0.00 0.00 0.00 0.00 53.44 52.50 1fvr n ALA 933 Cb 0.56 -0.70 -0.07 0.00 0.00 0.00 0.00 19.45 19.24 1fvr n ALA 933 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1fvr s SER 934 N -2.11 -0.33 0.06 0.00 0.15 -1.26 -3.35 113.70 106.87 1fvr s SER 934 Ca 0.19 0.12 0.27 0.00 0.70 0.00 0.00 55.95 57.24 1fvr s SER 934 Cb 0.16 0.43 1.09 0.00 -1.71 0.00 0.00 66.02 65.99 1fvr s SER 934 CO 0.43 -0.63 1.86 0.35 1.20 0.00 0.00 173.24 176.46 1fvr n THR 935 N 0.68 0.22 -3.97 6.45 -2.24 -0.86 -4.77 114.28 109.80 1fvr n THR 935 Ca -0.19 -0.06 -0.36 0.00 -2.27 0.00 0.00 64.05 61.16 1fvr n THR 935 Cb 0.59 -0.56 -0.07 0.00 -2.10 0.00 0.00 70.33 68.19 1fvr n THR 935 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1fvr s LEU 936 N -3.45 4.19 0.58 3.22 1.43 -1.26 -5.11 118.68 118.29 1fvr s LEU 936 Ca 0.13 0.37 -0.03 0.00 -1.03 0.00 0.00 54.13 53.56 1fvr s LEU 936 Cb 0.17 -2.02 0.03 0.00 0.03 0.00 0.00 46.19 44.39 1fvr s LEU 936 CO 0.53 0.37 0.86 -0.94 0.23 0.00 0.00 176.35 177.41 1fvr s SER 937 N -0.83 5.36 0.19 2.29 1.04 -1.26 -4.91 113.70 115.59 1fvr s SER 937 Ca 0.14 0.40 -0.12 0.00 0.48 0.00 0.00 55.95 56.84 1fvr s SER 937 Cb -0.12 -1.32 0.15 0.00 0.10 0.00 0.00 66.02 64.83 1fvr s SER 937 CO 0.03 -1.15 1.82 -1.28 0.98 0.00 0.00 173.24 173.63 1fvr h SER 938 N -0.12 0.54 -0.26 7.02 0.87 -1.96 -1.77 113.55 117.86 1fvr h SER 938 Ca -0.44 0.01 0.04 0.00 -1.23 0.00 0.00 61.79 60.16 1fvr h SER 938 Cb 1.28 -0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 63.10 1fvr h SER 938 CO 0.58 0.37 0.04 1.56 -0.53 0.00 0.00 176.83 178.85 1fvr h GLN 939 N 0.67 0.13 -1.00 2.24 1.08 -1.94 -1.46 115.11 114.83 1fvr h GLN 939 Ca 0.24 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.46 1fvr h GLN 939 Cb 0.06 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.41 1fvr h GLN 939 CO -0.12 0.09 0.66 1.96 -0.95 0.00 0.00 178.83 180.47 1fvr h GLN 940 N 0.14 1.27 -0.44 1.46 4.20 -1.83 -1.26 115.11 118.65 1fvr h GLN 940 Ca 0.12 -0.08 -0.10 0.00 0.06 0.00 0.00 58.65 58.65 1fvr h GLN 940 Cb 0.13 -0.29 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 1fvr h GLN 940 CO -0.17 0.84 -0.13 -0.07 -0.67 0.00 0.00 178.83 178.63 1fvr h LEU 941 N 1.31 0.88 -1.10 1.46 3.38 -0.90 -2.36 115.31 117.99 1fvr h LEU 941 Ca 0.38 -0.37 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1fvr h LEU 941 Cb -0.08 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.42 1fvr h LEU 941 CO -0.10 1.05 -0.39 -0.07 0.09 0.00 0.00 178.44 179.02 1fvr h LEU 942 N 0.70 0.13 -0.96 1.67 3.38 -0.98 -2.41 115.31 116.84 1fvr h LEU 942 Ca 0.11 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1fvr h LEU 942 Cb 0.68 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1fvr h LEU 942 CO 0.05 0.51 -0.21 0.45 0.09 0.00 0.00 178.44 179.32 1fvr h HIS 943 N 0.11 0.56 -0.35 1.13 3.86 -1.00 0.88 115.15 120.34 1fvr h HIS 943 Ca 0.01 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.08 1fvr h HIS 943 Cb 0.73 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.05 1fvr h HIS 943 CO 0.01 0.68 0.11 0.74 0.86 0.00 0.00 177.93 180.33 1fvr h PHE 944 N 0.45 0.56 -0.45 2.45 0.05 -1.05 0.12 116.94 119.07 1fvr h PHE 944 Ca 0.07 -0.06 -0.01 0.00 3.82 0.00 0.00 57.97 61.80 1fvr h PHE 944 Cb 0.62 -0.16 -0.02 0.00 2.00 0.00 0.00 35.95 38.39 1fvr h PHE 944 CO 0.02 0.55 0.26 0.00 -0.18 0.00 0.00 178.31 178.95 1fvr h ALA 945 N 0.95 0.58 -0.57 2.45 0.00 -0.95 -1.93 119.26 119.78 1fvr h ALA 945 Ca 0.11 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1fvr h ALA 945 Cb 0.25 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1fvr h ALA 945 CO -0.00 0.08 0.19 0.00 0.00 0.00 0.00 179.25 179.52 1fvr h ALA 946 N 1.11 0.75 -0.36 0.00 0.00 -0.68 -1.48 119.26 118.59 1fvr h ALA 946 Ca 0.16 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1fvr h ALA 946 Cb 0.03 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.54 1fvr h ALA 946 CO -0.03 0.41 0.00 -0.44 0.00 0.00 0.00 179.25 179.19 1fvr h ASP 947 N 0.80 -0.14 -0.60 0.00 3.45 -0.43 0.27 116.42 119.77 1fvr h ASP 947 Ca 0.19 0.08 -0.09 0.00 0.43 0.00 0.00 57.03 57.63 1fvr h ASP 947 Cb 0.27 0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 39.16 1fvr h ASP 947 CO -0.01 -0.03 0.01 0.58 -1.57 0.00 0.00 179.24 178.22 1fvr h VAL 948 N 0.10 1.26 -0.36 -1.35 2.07 -1.13 -0.73 116.25 116.12 1fvr h VAL 948 Ca 0.18 -1.14 -0.04 0.00 0.82 0.00 0.00 66.70 66.52 1fvr h VAL 948 Cb 0.24 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1fvr h VAL 948 CO -0.29 0.42 0.06 0.00 0.02 0.00 0.00 177.57 177.78 1fvr h ALA 949 N 1.02 0.48 -0.43 1.67 0.00 -0.77 0.14 119.26 121.37 1fvr h ALA 949 Ca 0.18 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1fvr h ALA 949 Cb 0.54 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1fvr h ALA 949 CO 0.03 0.18 0.28 -0.09 0.00 0.00 0.00 179.25 179.65 1fvr h ARG 950 N 0.44 0.55 -0.47 0.00 2.43 -0.36 0.22 114.38 117.20 1fvr h ARG 950 Ca 0.11 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.18 1fvr h ARG 950 Cb 0.35 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1fvr h ARG 950 CO 0.01 0.36 0.02 0.78 -1.51 0.00 0.00 179.97 179.63 1fvr h GLY 951 N 0.57 0.82 2.00 2.80 0.00 -0.88 -2.23 103.07 106.14 1fvr h GLY 951 Ca 0.16 -0.52 -0.11 0.00 0.00 0.00 0.00 47.33 46.85 1fvr h GLY 951 CO -0.04 0.49 -0.53 -0.33 0.00 0.00 0.00 176.54 176.12 1fvr h MET 952 N 0.71 0.00 -0.33 4.80 2.86 -0.29 -2.06 114.93 120.63 1fvr h MET 952 Ca 0.14 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.73 1fvr h MET 952 Cb 0.41 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1fvr h MET 952 CO 0.01 0.53 -0.01 0.22 1.06 0.00 0.00 176.91 178.73 1fvr h ASP 953 N 0.00 0.58 -0.21 1.22 -0.00 -0.65 0.33 116.42 117.70 1fvr h ASP 953 Ca -0.01 -0.32 0.01 0.00 -0.00 0.00 0.00 57.03 56.72 1fvr h ASP 953 Cb 1.22 -0.16 -0.01 0.00 -0.00 0.00 0.00 39.33 40.38 1fvr h ASP 953 CO 0.07 0.76 0.12 0.22 -0.00 0.00 0.00 179.24 180.40 1fvr h TYR 954 N 0.39 0.22 -0.29 0.28 3.20 -1.26 -1.04 116.97 118.48 1fvr h TYR 954 Ca 0.09 0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.81 1fvr h TYR 954 Cb 0.47 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.67 1fvr h TYR 954 CO 0.04 0.13 -0.43 -0.07 -1.64 0.00 0.00 178.16 176.19 1fvr h LEU 955 N 0.24 0.87 -0.29 2.82 3.38 -1.27 -3.23 115.31 117.84 1fvr h LEU 955 Ca 0.08 -0.51 0.02 0.00 0.09 0.00 0.00 57.88 57.56 1fvr h LEU 955 Cb 0.00 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1fvr h LEU 955 CO -0.04 1.21 0.13 -1.28 0.09 0.00 0.00 178.44 178.56 1fvr h SER 956 N 0.55 0.19 0.18 -0.43 0.87 -0.25 -1.09 113.55 113.58 1fvr h SER 956 Ca 0.03 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1fvr h SER 956 Cb 1.03 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.97 1fvr h SER 956 CO 0.10 0.15 0.00 0.00 -0.53 0.00 0.00 176.83 176.54 1fvr n GLN 957 N -4.98 0.03 -0.43 2.24 6.02 -0.40 -1.13 117.38 118.73 1fvr n GLN 957 Ca -0.01 0.34 0.09 0.00 -0.01 0.00 0.00 57.00 57.41 1fvr n GLN 957 Cb 0.08 -1.50 0.25 0.00 1.02 0.00 0.00 30.24 30.09 1fvr n GLN 957 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1fvr n LYS 958 N -1.43 2.89 -0.97 -1.09 4.76 -0.50 -4.96 118.16 116.85 1fvr n LYS 958 Ca 0.02 -2.81 0.00 0.00 -2.87 0.00 0.00 58.31 52.65 1fvr n LYS 958 Cb 0.06 -1.82 0.00 0.00 -1.84 0.00 0.00 35.03 31.44 1fvr n LYS 958 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1fvr n GLN 959 N -0.49 -0.37 -2.50 1.97 1.13 -0.28 -4.89 117.38 111.95 1fvr n GLN 959 Ca 0.21 0.09 -0.39 0.00 -1.94 0.00 0.00 57.00 54.97 1fvr n GLN 959 Cb 0.87 -3.37 -0.04 0.00 0.11 0.00 0.00 30.24 27.81 1fvr n GLN 959 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 1fvr s PHE 960 N -2.10 3.49 -0.20 1.08 0.40 -0.65 -0.71 117.98 119.29 1fvr s PHE 960 Ca 0.00 1.69 0.01 0.00 -0.60 0.00 0.00 56.93 58.03 1fvr s PHE 960 Cb 0.00 -3.23 0.05 0.00 0.51 0.00 0.00 43.02 40.35 1fvr s PHE 960 CO 0.00 -0.55 -0.08 0.42 0.70 0.00 0.00 175.22 175.71 1fvr s ILE 961 N -1.31 1.54 0.01 0.64 1.01 0.18 -4.31 121.20 118.96 1fvr s ILE 961 Ca 0.49 -1.01 -0.25 0.00 0.00 0.00 0.00 60.65 59.88 1fvr s ILE 961 Cb -0.29 -1.67 -0.18 0.00 0.01 0.00 0.00 42.46 40.33 1fvr s ILE 961 CO 0.37 0.10 1.35 -0.74 0.00 0.00 0.00 174.94 176.01 1fvr h HIS 962 N 7.99 -0.20 0.00 3.97 2.76 -1.90 -1.82 115.15 125.95 1fvr h HIS 962 Ca -0.25 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.92 1fvr h HIS 962 Cb 1.09 0.06 0.00 0.00 1.55 0.00 0.00 27.41 30.12 1fvr h HIS 962 CO 0.50 0.13 0.00 0.54 -1.30 0.00 0.00 177.93 177.79 1fvr n ARG 963 N -5.04 0.00 -2.75 5.26 1.74 -1.26 -4.65 116.66 109.96 1fvr n ARG 963 Ca -0.09 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.89 1fvr n ARG 963 Cb 0.22 -1.00 0.04 0.00 -1.02 0.00 0.00 32.46 30.70 1fvr n ARG 963 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1fvr n ASP 964 N 0.00 0.46 -4.64 0.55 2.03 -1.26 -5.02 116.55 108.67 1fvr n ASP 964 Ca 0.00 -2.76 -0.43 0.00 0.52 0.00 0.00 54.79 52.12 1fvr n ASP 964 Cb 0.00 -0.10 -0.02 0.00 -0.72 0.00 0.00 41.12 40.28 1fvr n ASP 964 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1fvr s LEU 965 N -2.98 3.97 0.03 -2.67 2.96 -1.26 -4.76 118.68 113.96 1fvr s LEU 965 Ca 0.28 1.44 -0.28 0.00 -0.22 0.00 0.00 54.13 55.35 1fvr s LEU 965 Cb 0.42 -3.54 0.09 0.00 0.50 0.00 0.00 46.19 43.67 1fvr s LEU 965 CO -0.01 -1.04 0.85 0.00 -1.32 0.00 0.00 176.35 174.84 1fvr s ALA 966 N 4.33 -1.77 0.47 5.97 0.00 -1.26 -4.59 121.76 124.90 1fvr s ALA 966 Ca 0.60 0.86 0.20 0.00 0.00 0.00 0.00 51.96 53.61 1fvr s ALA 966 Cb -0.20 0.50 1.20 0.00 0.00 0.00 0.00 23.12 24.63 1fvr s ALA 966 CO 0.23 -0.73 1.95 0.00 0.00 0.00 0.00 175.76 177.20 1fvr h ALA 967 N 2.00 2.29 0.00 0.00 0.00 -1.93 0.12 119.26 121.74 1fvr h ALA 967 Ca -0.24 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1fvr h ALA 967 Cb 1.25 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1fvr h ALA 967 CO 0.31 -0.47 -0.13 0.07 0.00 0.00 0.00 179.25 179.03 1fvr h ARG 968 N 0.24 0.00 -0.62 0.00 0.11 -1.95 -2.52 114.38 109.64 1fvr h ARG 968 Ca 0.32 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.40 1fvr h ARG 968 Cb 0.93 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.01 1fvr h ARG 968 CO -0.07 0.13 0.00 0.09 0.10 0.00 0.00 179.97 180.22 1fvr n ASN 969 N -3.62 5.26 -4.30 0.08 3.02 0.41 -4.28 115.26 111.84 1fvr n ASN 969 Ca -0.02 -2.71 -0.32 0.00 -0.03 0.00 0.00 54.58 51.51 1fvr n ASN 969 Cb 0.25 -0.64 -0.16 0.00 -0.61 0.00 0.00 39.78 38.63 1fvr n ASN 969 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1fvr s ILE 970 N -2.34 2.36 -0.01 2.41 -1.09 -0.96 -1.10 121.20 120.45 1fvr s ILE 970 Ca 0.52 -0.94 0.00 0.00 -2.23 0.00 0.00 60.65 58.01 1fvr s ILE 970 Cb 0.37 -1.90 -0.04 0.00 -1.58 0.00 0.00 42.46 39.31 1fvr s ILE 970 CO 0.20 0.56 0.04 -0.76 -1.23 0.00 0.00 174.94 173.75 1fvr s LEU 971 N 0.03 3.71 -0.62 2.97 2.01 0.98 -0.24 118.68 127.51 1fvr s LEU 971 Ca -0.08 0.08 -0.17 0.00 0.01 0.00 0.00 54.13 53.97 1fvr s LEU 971 Cb -0.15 -2.11 0.13 0.00 0.01 0.00 0.00 46.19 44.07 1fvr s LEU 971 CO 0.05 0.29 0.67 -0.69 1.01 0.00 0.00 176.35 177.68 1fvr s VAL 972 N -1.11 5.03 0.00 -1.59 1.01 0.01 0.18 120.40 123.92 1fvr s VAL 972 Ca 0.20 -1.36 0.00 0.00 0.00 0.00 0.00 61.98 60.82 1fvr s VAL 972 Cb -0.12 -4.46 0.00 0.00 0.00 0.00 0.00 36.38 31.80 1fvr s VAL 972 CO 0.11 -1.06 0.00 0.61 0.00 0.00 0.00 175.10 174.76 1fvr n GLY 973 N 5.13 -0.65 3.69 4.51 0.00 0.65 -2.42 105.19 116.09 1fvr n GLY 973 Ca -0.06 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 1fvr n GLY 973 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1fvr n GLU 974 N -0.44 2.16 -1.37 1.61 4.07 -1.26 -1.03 120.64 124.38 1fvr n GLU 974 Ca 0.00 0.76 -0.13 0.00 -0.06 0.00 0.00 57.16 57.74 1fvr n GLU 974 Cb 0.00 -2.39 -0.05 0.00 -0.06 0.00 0.00 31.44 28.94 1fvr n GLU 974 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1fvr n ASN 975 N 1.36 -4.87 -2.11 4.31 5.03 -1.26 -2.60 115.26 115.14 1fvr n ASN 975 Ca 0.07 0.31 -0.17 0.00 0.87 0.00 0.00 54.58 55.66 1fvr n ASN 975 Cb 0.35 -3.48 0.01 0.00 -1.02 0.00 0.00 39.78 35.64 1fvr n ASN 975 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1fvr n TYR 976 N -2.52 -1.09 -2.95 3.10 4.02 -0.20 -4.99 117.16 112.54 1fvr n TYR 976 Ca -0.13 0.16 -0.41 0.00 -0.01 0.00 0.00 57.90 57.52 1fvr n TYR 976 Cb 0.47 -3.53 -0.05 0.00 -0.02 0.00 0.00 39.34 36.21 1fvr n TYR 976 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1fvr s VAL 977 N -2.91 4.90 0.05 -0.72 1.01 -1.07 -4.75 120.40 116.91 1fvr s VAL 977 Ca 0.09 1.50 -0.31 0.00 0.00 0.00 0.00 61.98 63.27 1fvr s VAL 977 Cb -0.04 -4.08 -0.06 0.00 0.00 0.00 0.00 36.38 32.19 1fvr s VAL 977 CO 0.12 0.01 1.29 0.00 0.00 0.00 0.00 175.10 176.53 1fvr s ALA 978 N 2.31 3.50 -0.09 5.51 0.00 -1.26 -0.25 121.76 131.48 1fvr s ALA 978 Ca 0.35 0.91 0.03 0.00 0.00 0.00 0.00 51.96 53.25 1fvr s ALA 978 Cb -0.16 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1fvr s ALA 978 CO 0.10 -0.61 -0.20 0.15 0.00 0.00 0.00 175.76 175.20 1fvr s LYS 979 N 1.44 2.57 0.01 0.00 1.02 0.13 -4.49 119.74 120.43 1fvr s LYS 979 Ca 0.61 -0.71 -0.30 0.00 0.02 0.00 0.00 55.97 55.59 1fvr s LYS 979 Cb -0.32 -1.99 -0.04 0.00 -0.52 0.00 0.00 37.83 34.96 1fvr s LYS 979 CO 0.28 0.12 1.17 0.42 -0.92 0.00 0.00 175.35 176.43 1fvr s ILE 980 N 0.47 4.22 -0.01 2.17 1.01 -0.39 -0.01 121.20 128.66 1fvr s ILE 980 Ca -0.17 1.58 -0.30 0.00 0.00 0.00 0.00 60.65 61.76 1fvr s ILE 980 Cb -0.17 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.23 1fvr s ILE 980 CO 0.07 0.08 1.37 0.00 0.00 0.00 0.00 174.94 176.45 1fvr s ALA 981 N 1.50 3.57 -0.33 9.38 0.00 -0.26 -1.21 121.76 134.40 1fvr s ALA 981 Ca 0.57 0.83 0.10 0.00 0.00 0.00 0.00 51.96 53.46 1fvr s ALA 981 Cb -0.27 -3.58 0.46 0.00 0.00 0.00 0.00 23.12 19.73 1fvr s ALA 981 CO 0.26 -0.89 1.13 -0.40 0.00 0.00 0.00 175.76 175.86 1fvr n ASP 982 N 5.37 4.00 -4.81 0.00 3.85 -1.26 -4.79 116.55 118.90 1fvr n ASP 982 Ca 0.13 -3.36 -0.36 0.00 -0.71 0.00 0.00 54.79 50.49 1fvr n ASP 982 Cb 0.44 -0.41 -0.07 0.00 -1.35 0.00 0.00 41.12 39.73 1fvr n ASP 982 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 1fvr s PHE 983 N -3.58 3.48 -1.08 2.11 5.36 -1.26 -4.44 117.98 118.57 1fvr s PHE 983 Ca 0.44 0.42 0.00 0.00 -0.96 0.00 0.00 56.93 56.83 1fvr s PHE 983 Cb 0.40 -1.97 0.00 0.00 -0.34 0.00 0.00 43.02 41.11 1fvr s PHE 983 CO -0.03 0.58 0.00 0.41 -1.46 0.00 0.00 175.22 174.72 1fvr n GLY 984 N 2.38 0.12 3.88 13.12 0.00 -1.26 -4.78 105.19 118.64 1fvr n GLY 984 Ca -0.19 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 1fvr n GLY 984 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fvr s LEU 985 N -3.38 3.09 0.27 0.99 1.43 -1.26 -5.07 118.68 114.75 1fvr s LEU 985 Ca 0.00 1.25 0.05 0.00 -1.03 0.00 0.00 54.13 54.40 1fvr s LEU 985 Cb 0.00 -4.17 -0.02 0.00 0.03 0.00 0.00 46.19 42.03 1fvr s LEU 985 CO 0.00 -1.09 0.40 -0.44 0.23 0.00 0.00 176.35 175.45 1fvr s SER 986 N -4.27 6.21 -0.04 2.29 0.01 -0.68 -4.96 113.70 112.26 1fvr s SER 986 Ca 0.56 -0.01 -0.01 0.00 1.31 0.00 0.00 55.95 57.80 1fvr s SER 986 Cb -0.11 -1.66 0.03 0.00 0.21 0.00 0.00 66.02 64.49 1fvr s SER 986 CO 0.52 -0.19 0.06 -0.60 0.41 0.00 0.00 173.24 173.45 1fvr s ARG 987 N -4.05 -0.04 0.00 12.44 3.52 -1.26 -0.65 118.95 128.92 1fvr s ARG 987 Ca 0.38 0.31 0.00 0.00 -0.13 0.00 0.00 55.73 56.29 1fvr s ARG 987 Cb -0.09 -0.35 0.00 0.00 -1.56 0.00 0.00 34.95 32.95 1fvr s ARG 987 CO 0.30 -0.24 0.00 0.41 -0.81 0.00 0.00 175.30 174.95 1fvr n GLY 988 N 4.72 0.57 0.14 8.12 0.00 0.11 -4.96 105.19 113.90 1fvr n GLY 988 Ca -0.16 -1.72 -0.12 0.00 0.00 0.00 0.00 46.02 44.02 1fvr n GLY 988 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1fvr h GLN 989 N 2.12 -0.22 -2.35 1.61 5.75 -1.96 -3.45 115.11 116.61 1fvr h GLN 989 Ca 0.00 0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.44 1fvr h GLN 989 Cb 0.00 0.05 -0.21 0.00 1.07 0.00 0.00 27.48 28.40 1fvr h GLN 989 CO 0.00 0.19 0.00 -2.00 -2.65 0.00 0.00 178.83 174.38 1fvr s GLU 990 N -3.82 0.83 -0.04 1.69 2.12 -1.26 -4.69 118.70 113.52 1fvr s GLU 990 Ca -0.14 0.38 0.03 0.00 0.36 0.00 0.00 54.97 55.61 1fvr s GLU 990 Cb 0.01 0.39 0.00 0.00 0.26 0.00 0.00 34.13 34.79 1fvr s GLU 990 CO 0.52 -0.20 -0.13 0.54 -0.54 0.00 0.00 175.26 175.45 1fvr s VAL 991 N -0.63 1.12 -0.22 3.70 0.11 -0.50 -4.96 120.40 119.02 1fvr s VAL 991 Ca -0.07 -0.54 -0.08 0.00 -2.93 0.00 0.00 61.98 58.36 1fvr s VAL 991 Cb -0.03 -0.98 -0.04 0.00 -1.53 0.00 0.00 36.38 33.80 1fvr s VAL 991 CO 0.05 0.34 0.08 -0.47 -3.33 0.00 0.00 175.10 171.77 1fvr s TYR 992 N 0.16 3.20 -0.18 1.54 5.04 -1.26 -0.60 117.35 125.24 1fvr s TYR 992 Ca -0.04 -0.05 -0.01 0.00 -2.44 0.00 0.00 57.07 54.52 1fvr s TYR 992 Cb -0.11 -2.17 0.05 0.00 0.35 0.00 0.00 41.96 40.09 1fvr s TYR 992 CO 0.02 -0.03 -0.01 0.08 -1.34 0.00 0.00 175.55 174.26 1fvr s VAL 993 N 0.93 0.86 0.31 3.14 1.01 -0.77 -5.03 120.40 120.83 1fvr s VAL 993 Ca 0.05 -0.63 -0.28 0.00 0.00 0.00 0.00 61.98 61.11 1fvr s VAL 993 Cb -0.14 -1.19 -0.10 0.00 0.00 0.00 0.00 36.38 34.95 1fvr s VAL 993 CO 0.03 -0.05 1.13 -1.59 0.00 0.00 0.00 175.10 174.63 1fvr s LYS 994 N 1.72 4.50 1.11 2.72 0.00 -1.26 -4.82 119.74 123.72 1fvr s LYS 994 Ca -0.01 1.85 -0.18 0.00 0.00 0.00 0.00 55.97 57.63 1fvr s LYS 994 Cb -0.16 -3.07 0.13 0.00 0.00 0.00 0.00 37.83 34.72 1fvr s LYS 994 CO -0.07 0.07 0.07 1.63 0.00 0.00 0.00 175.35 177.05 1fvr n LYS 995 N 0.92 -1.91 0.00 1.78 4.01 -1.26 -5.19 118.16 116.51 1fvr n LYS 995 Ca 0.00 -0.55 0.00 0.00 -0.51 0.00 0.00 58.31 57.25 1fvr n LYS 995 Cb 0.45 -1.64 0.00 0.00 -0.51 0.00 0.00 35.03 33.33 1fvr n LYS 995 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1fvr n ARG 999 N -2.07 0.00 -4.28 1.97 0.00 -1.26 -5.28 116.66 105.73 1fvr n ARG 999 Ca 0.02 0.00 -0.34 0.00 -0.00 0.00 0.00 57.85 57.53 1fvr n ARG 999 Cb 0.56 -0.67 -0.12 0.00 0.00 0.00 0.00 32.46 32.24 1fvr n ARG 999 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1fvr s LEU 1000N 0.00 3.36 -1.02 6.15 2.96 -1.26 -5.01 118.68 123.86 1fvr s LEU 1000Ca 0.00 -0.10 -0.07 0.00 -0.22 0.00 0.00 54.13 53.74 1fvr s LEU 1000Cb 0.00 -1.82 -0.10 0.00 0.50 0.00 0.00 46.19 44.77 1fvr s LEU 1000CO 0.00 0.16 2.63 -0.81 -1.32 0.00 0.00 176.35 177.01 1fvr n PRO 1001N 3.63 2.64 -0.32 0.98 -0.04 -1.26 -4.73 135.00 135.90 1fvr n PRO 1001Ca -0.17 -1.62 0.17 0.00 -0.04 0.00 0.00 63.50 61.83 1fvr n PRO 1001Cb 0.52 -2.48 0.36 0.00 -0.04 0.00 0.00 33.50 31.87 1fvr n PRO 1001CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1fvr h VAL 1002N 3.01 0.42 0.00 0.52 2.07 -1.96 -1.50 116.25 118.81 1fvr h VAL 1002Ca 0.58 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.97 1fvr h VAL 1002Cb 0.42 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1fvr h VAL 1002CO 1.35 0.07 0.00 0.54 0.02 0.00 0.00 177.57 179.55 1fvr n ARG 1003N -5.04 0.14 0.00 1.57 1.74 -1.26 -2.20 116.66 111.60 1fvr n ARG 1003Ca 0.25 0.51 0.04 0.00 -0.77 0.00 0.00 57.85 57.89 1fvr n ARG 1003Cb 0.76 -1.85 -0.01 0.00 -1.02 0.00 0.00 32.46 30.34 1fvr n ARG 1003CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1fvr n TRP 1004N -2.13 0.00 -2.70 -1.55 8.01 -0.58 -4.98 117.44 113.51 1fvr n TRP 1004Ca 0.00 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.79 1fvr n TRP 1004Cb 0.12 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 29.37 1fvr n TRP 1004CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 1fvr s MET 1005N -1.36 4.74 0.67 -0.99 -1.94 -0.94 -3.89 119.30 115.60 1fvr s MET 1005Ca 0.06 1.51 -0.13 0.00 -1.71 0.00 0.00 55.69 55.42 1fvr s MET 1005Cb 0.07 -3.32 0.00 0.00 2.01 0.00 0.00 34.83 33.58 1fvr s MET 1005CO 0.25 0.31 1.07 0.00 -0.01 0.00 0.00 175.02 176.64 1fvr s ALA 1006N -0.50 2.58 0.23 3.03 0.00 -1.26 -4.80 121.76 121.05 1fvr s ALA 1006Ca 0.45 0.31 -0.07 0.00 0.00 0.00 0.00 51.96 52.65 1fvr s ALA 1006Cb -0.25 -3.24 0.40 0.00 0.00 0.00 0.00 23.12 20.03 1fvr s ALA 1006CO 0.32 -1.19 1.68 0.82 0.00 0.00 0.00 175.76 177.39 1fvr h ILE 1007N -0.25 0.53 0.00 0.00 2.04 -1.96 0.70 117.51 118.57 1fvr h ILE 1007Ca -0.45 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 1fvr h ILE 1007Cb 1.22 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1fvr h ILE 1007CO 0.55 0.04 -0.18 1.05 0.00 0.00 0.00 178.15 179.62 1fvr h GLU 1008N 0.24 0.00 -0.08 2.37 9.09 -1.91 -1.80 114.58 122.49 1fvr h GLU 1008Ca 0.38 0.00 -0.24 0.00 0.05 0.00 0.00 59.36 59.55 1fvr h GLU 1008Cb 0.63 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.74 1fvr h GLU 1008CO -0.50 0.18 -0.88 0.77 0.05 0.00 0.00 179.01 178.63 1fvr h SER 1009N 0.00 0.87 -0.46 3.06 0.02 -1.00 -0.39 113.55 115.66 1fvr h SER 1009Ca -0.00 -0.63 -0.06 0.00 -0.84 0.00 0.00 61.79 60.26 1fvr h SER 1009Cb 0.32 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 1fvr h SER 1009CO 0.02 1.42 0.06 -0.07 -1.14 0.00 0.00 176.83 177.13 1fvr h LEU 1010N 0.45 0.73 0.12 5.07 3.38 -1.00 0.55 115.31 124.61 1fvr h LEU 1010Ca -0.08 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 1fvr h LEU 1010Cb 1.52 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1fvr h LEU 1010CO 0.17 0.82 -0.06 0.78 0.09 0.00 0.00 178.44 180.24 1fvr h ASN 1011N 0.62 -0.14 -0.08 -0.43 2.35 -1.35 -3.40 115.58 113.16 1fvr h ASN 1011Ca 0.14 -0.42 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 1fvr h ASN 1011Cb 0.40 0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.81 1fvr h ASN 1011CO 0.01 0.41 0.00 -1.22 -1.65 0.00 0.00 177.43 174.98 1fvr n TYR 1012N -4.91 0.11 -2.14 1.19 4.02 -0.16 -5.00 117.16 110.27 1fvr n TYR 1012Ca -0.08 -0.33 -0.20 0.00 -0.01 0.00 0.00 57.90 57.27 1fvr n TYR 1012Cb 0.27 -0.03 -0.03 0.00 -0.02 0.00 0.00 39.34 39.53 1fvr n TYR 1012CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1fvr n SER 1013N -0.02 -5.71 -4.90 7.72 7.64 0.18 -4.89 113.62 113.64 1fvr n SER 1013Ca 0.03 0.14 -0.29 0.00 1.01 0.00 0.00 58.87 59.77 1fvr n SER 1013Cb 0.24 -4.81 -0.04 0.00 -1.01 0.00 0.00 64.21 58.59 1fvr n SER 1013CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1fvr s VAL 1014N -2.94 5.21 -0.00 0.44 -7.23 -1.25 -1.85 120.40 112.77 1fvr s VAL 1014Ca 0.00 -0.56 0.02 0.00 -1.81 0.00 0.00 61.98 59.63 1fvr s VAL 1014Cb 0.00 -3.59 -0.01 0.00 0.56 0.00 0.00 36.38 33.34 1fvr s VAL 1014CO 0.00 0.05 -0.07 -0.31 -0.31 0.00 0.00 175.10 174.47 1fvr s TYR 1015N -1.58 0.61 0.33 2.82 1.51 0.23 -3.81 117.35 117.46 1fvr s TYR 1015Ca 0.34 -0.12 -0.04 0.00 -1.01 0.00 0.00 57.07 56.24 1fvr s TYR 1015Cb -0.12 -0.39 0.00 0.00 -0.11 0.00 0.00 41.96 41.34 1fvr s TYR 1015CO 0.27 -0.01 0.48 0.95 -1.11 0.00 0.00 175.55 176.13 1fvr s THR 1016N -0.17 0.00 0.42 -0.71 -4.23 -1.26 -1.41 115.64 108.27 1fvr s THR 1016Ca 0.02 -1.57 0.09 0.00 -1.18 0.00 0.00 61.69 59.05 1fvr s THR 1016Cb -0.03 -2.61 0.23 0.00 1.34 0.00 0.00 72.50 71.43 1fvr s THR 1016CO -0.00 0.00 2.03 0.74 -0.54 0.00 0.00 174.62 176.84 1fvr h THR 1017N 2.13 1.11 -0.67 3.99 2.02 -1.87 -1.25 112.91 118.36 1fvr h THR 1017Ca -0.28 -0.35 -0.08 0.00 0.77 0.00 0.00 66.41 66.47 1fvr h THR 1017Cb 1.24 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 68.43 1fvr h THR 1017CO 0.39 0.13 0.11 0.78 0.37 0.00 0.00 175.52 177.30 1fvr h ASN 1018N 0.36 1.06 0.88 4.18 2.35 -1.96 -1.56 115.58 120.91 1fvr h ASN 1018Ca 0.09 -0.25 -0.07 0.00 -0.55 0.00 0.00 56.30 55.52 1fvr h ASN 1018Cb 0.09 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 1fvr h ASN 1018CO -0.01 1.05 -0.35 0.77 -1.65 0.00 0.00 177.43 177.24 1fvr h SER 1019N 1.04 0.00 -0.24 5.81 4.64 -1.69 -2.27 113.55 120.84 1fvr h SER 1019Ca 0.21 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.43 1fvr h SER 1019Cb 0.44 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.51 1fvr h SER 1019CO 0.01 0.35 -0.18 0.44 -0.87 0.00 0.00 176.83 176.58 1fvr h ASP 1020N 0.00 0.68 -0.58 4.97 3.32 -0.66 -1.92 116.42 122.23 1fvr h ASP 1020Ca -0.00 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 56.76 1fvr h ASP 1020Cb 0.89 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 1fvr h ASP 1020CO 0.05 0.86 0.11 0.58 -1.72 0.00 0.00 179.24 179.12 1fvr h VAL 1021N 0.60 1.25 -0.38 -1.35 2.07 -0.74 0.21 116.25 117.93 1fvr h VAL 1021Ca 0.09 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 1fvr h VAL 1021Cb 0.65 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1fvr h VAL 1021CO 0.05 0.36 0.22 -0.25 0.02 0.00 0.00 177.57 177.96 1fvr h TRP 1022N 0.93 0.50 -0.58 1.57 2.91 -1.09 -1.23 115.95 118.97 1fvr h TRP 1022Ca 0.19 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 60.16 1fvr h TRP 1022Cb 0.39 -0.16 -0.03 0.00 -0.51 0.00 0.00 29.16 28.85 1fvr h TRP 1022CO 0.03 0.38 0.19 0.77 -1.03 0.00 0.00 178.44 178.77 1fvr h SER 1023N 0.48 0.80 -0.73 2.65 0.02 -0.81 -1.72 113.55 114.24 1fvr h SER 1023Ca 0.13 -0.12 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1fvr h SER 1023Cb 0.03 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.33 1fvr h SER 1023CO -0.02 0.75 0.49 0.22 -1.14 0.00 0.00 176.83 177.13 1fvr h TYR 1024N 0.85 0.92 -0.58 3.45 3.20 0.14 -0.57 116.97 124.37 1fvr h TYR 1024Ca 0.19 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.11 1fvr h TYR 1024Cb 0.24 -0.31 -0.04 0.00 1.54 0.00 0.00 36.73 38.16 1fvr h TYR 1024CO 0.02 0.57 0.35 0.78 -1.64 0.00 0.00 178.16 178.23 1fvr h GLY 1025N 0.98 0.83 1.54 1.82 0.00 -0.31 0.75 103.07 108.68 1fvr h GLY 1025Ca 0.27 -0.26 -0.09 0.00 0.00 0.00 0.00 47.33 47.25 1fvr h GLY 1025CO -0.06 0.21 -0.21 -2.08 0.00 0.00 0.00 176.54 174.40 1fvr h VAL 1026N 0.69 1.26 -0.53 4.60 2.07 -1.17 -1.77 116.25 121.40 1fvr h VAL 1026Ca 0.24 -1.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.49 1fvr h VAL 1026Cb 0.03 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1fvr h VAL 1026CO -0.11 0.39 0.17 0.25 0.02 0.00 0.00 177.57 178.30 1fvr h LEU 1027N 0.48 0.76 -1.12 2.57 7.12 -0.35 -0.15 115.31 124.62 1fvr h LEU 1027Ca 0.07 -0.20 -0.04 0.00 0.13 0.00 0.00 57.88 57.84 1fvr h LEU 1027Cb 0.64 -0.20 -0.02 0.00 -0.53 0.00 0.00 40.66 40.54 1fvr h LEU 1027CO 0.05 0.76 0.16 0.25 -0.13 0.00 0.00 178.44 179.53 1fvr h LEU 1028N 0.72 0.72 -0.82 2.25 5.85 -0.54 -0.76 115.31 122.74 1fvr h LEU 1028Ca 0.17 -0.11 -0.10 0.00 0.84 0.00 0.00 57.88 58.68 1fvr h LEU 1028Cb 0.27 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1fvr h LEU 1028CO -0.01 0.69 -0.17 -0.25 -0.34 0.00 0.00 178.44 178.36 1fvr h TRP 1029N 0.76 0.78 -0.57 1.25 7.01 -0.83 -0.82 115.95 123.53 1fvr h TRP 1029Ca 0.18 -0.15 -0.06 0.00 2.11 0.00 0.00 58.89 60.96 1fvr h TRP 1029Cb 0.23 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 27.07 1fvr h TRP 1029CO 0.01 0.83 0.14 0.93 -2.79 0.00 0.00 178.44 177.55 1fvr h GLU 1030N 0.63 0.92 -0.06 2.65 5.08 0.08 -0.55 114.58 123.34 1fvr h GLU 1030Ca 0.10 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 1fvr h GLU 1030Cb 0.64 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1fvr h GLU 1030CO 0.04 0.86 0.02 0.82 -1.00 0.00 0.00 179.01 179.75 1fvr h ILE 1031N 0.83 1.18 -0.83 3.13 2.04 -0.88 0.35 117.51 123.32 1fvr h ILE 1031Ca 0.18 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 1fvr h ILE 1031Cb 0.35 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.80 1fvr h ILE 1031CO 0.00 0.15 0.47 0.58 0.00 0.00 0.00 178.15 179.35 1fvr h VAL 1032N -0.09 1.24 -0.17 1.67 2.07 -1.08 -1.92 116.25 117.96 1fvr h VAL 1032Ca 0.02 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.97 1fvr h VAL 1032Cb 0.22 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 1fvr h VAL 1032CO -0.00 0.26 0.00 -1.54 0.02 0.00 0.00 177.57 176.31 1fvr n SER 1033N -4.41 1.23 -3.80 0.57 3.41 -0.22 -4.90 113.62 105.49 1fvr n SER 1033Ca 0.08 -2.05 -0.27 0.00 -0.26 0.00 0.00 58.87 56.37 1fvr n SER 1033Cb 0.08 -0.21 0.04 0.00 -0.26 0.00 0.00 64.21 63.86 1fvr n SER 1033CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1fvr n LEU 1034N 0.06 -2.88 0.00 1.04 4.77 -0.72 -2.94 117.00 116.33 1fvr n LEU 1034Ca 0.06 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.34 1fvr n LEU 1034Cb 0.22 -2.72 0.00 0.00 -2.33 0.00 0.00 43.42 38.59 1fvr n LEU 1034CO 0.05 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 1fvr n GLY 1035N -1.77 0.79 3.77 -0.72 0.00 0.12 -3.71 105.19 103.66 1fvr n GLY 1035Ca 0.00 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1fvr n GLY 1035CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fvr s GLY 1036N -2.26 2.39 -0.05 -0.02 0.00 -1.15 -4.89 107.32 101.33 1fvr s GLY 1036Ca 0.00 0.71 -0.30 0.00 0.00 0.00 0.00 44.72 45.13 1fvr s GLY 1036CO 0.00 1.07 1.04 -1.59 0.00 0.00 0.00 173.10 173.63 1fvr s THR 1037N -2.04 4.67 0.25 0.90 2.01 -0.34 -4.78 115.64 116.31 1fvr s THR 1037Ca 0.71 1.93 -0.30 0.00 0.31 0.00 0.00 61.69 64.33 1fvr s THR 1037Cb -0.23 -4.24 -0.11 0.00 0.01 0.00 0.00 72.50 67.93 1fvr s THR 1037CO 0.36 0.06 1.58 -2.84 -0.69 0.00 0.00 174.62 173.09 1fvr s PRO 1038N 1.65 4.16 -1.44 4.92 0.02 -1.26 -2.45 135.00 140.60 1fvr s PRO 1038Ca 0.51 2.50 -0.11 0.00 0.02 0.00 0.00 61.00 63.93 1fvr s PRO 1038Cb -0.21 -3.06 0.04 0.00 0.02 0.00 0.00 34.50 31.29 1fvr s PRO 1038CO 0.23 -0.61 1.07 0.66 -0.33 0.00 0.00 177.00 178.01 1fvr n TYR 1039N 2.72 -2.59 -1.67 6.54 4.01 -1.26 -4.84 117.16 120.07 1fvr n TYR 1039Ca 0.10 0.94 -0.50 0.00 -0.16 0.00 0.00 57.90 58.28 1fvr n TYR 1039Cb 0.38 -4.54 -0.05 0.00 -0.31 0.00 0.00 39.34 34.82 1fvr n TYR 1039CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1fvr n GLY 1041N 3.81 3.08 3.80 0.00 0.00 -1.26 -5.06 105.19 109.56 1fvr n GLY 1041Ca 0.21 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.94 1fvr n GLY 1041CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fvr s MET 1042N 0.00 4.00 0.53 1.61 1.00 -0.55 -5.06 119.30 120.84 1fvr s MET 1042Ca 0.00 1.29 -0.00 0.00 0.00 0.00 0.00 55.69 56.97 1fvr s MET 1042Cb 0.00 -2.17 0.02 0.00 0.00 0.00 0.00 34.83 32.68 1fvr s MET 1042CO 0.00 -0.25 0.77 0.95 0.00 0.00 0.00 175.02 176.49 1fvr s THR 1043N -2.02 3.18 0.30 2.05 -4.23 -1.26 -4.98 115.64 108.68 1fvr s THR 1043Ca 0.64 -0.51 0.02 0.00 -1.18 0.00 0.00 61.69 60.66 1fvr s THR 1043Cb -0.14 -3.21 0.12 0.00 1.34 0.00 0.00 72.50 70.61 1fvr s THR 1043CO 0.18 -0.16 1.79 0.00 -0.54 0.00 0.00 174.62 175.90 1fvr h ALA 1045N 1.37 0.72 -0.21 0.00 0.00 -2.00 -2.00 119.26 117.13 1fvr h ALA 1045Ca 0.11 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1fvr h ALA 1045Cb 0.47 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1fvr h ALA 1045CO 0.02 0.30 -0.01 0.93 0.00 0.00 0.00 179.25 180.50 1fvr h GLU 1046N 0.75 0.31 -0.21 0.00 5.08 -1.83 -2.83 114.58 115.85 1fvr h GLU 1046Ca 0.19 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1fvr h GLU 1046Cb 0.16 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1fvr h GLU 1046CO -0.02 0.35 -0.12 -0.07 -1.00 0.00 0.00 179.01 178.14 1fvr h LEU 1047N 0.30 0.47 -2.09 1.33 3.38 -0.75 0.75 115.31 118.70 1fvr h LEU 1047Ca 0.07 -0.43 0.02 0.00 0.09 0.00 0.00 57.88 57.64 1fvr h LEU 1047Cb 0.23 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1fvr h LEU 1047CO 0.01 0.79 0.07 1.88 0.09 0.00 0.00 178.44 181.28 1fvr h TYR 1048N 0.14 0.00 0.00 1.13 -1.99 -1.17 -1.76 116.97 113.31 1fvr h TYR 1048Ca 0.04 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.72 1fvr h TYR 1048Cb 0.63 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.35 1fvr h TYR 1048CO 0.07 0.00 -0.45 1.49 -0.00 0.00 0.00 178.16 179.27 1fvr h GLU 1049N 0.00 0.00 -0.21 4.88 4.81 -1.33 -3.39 114.58 119.34 1fvr h GLU 1049Ca 0.04 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1fvr h GLU 1049Cb 0.17 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1fvr h GLU 1049CO -0.00 0.37 0.06 0.87 -0.73 0.00 0.00 179.01 179.58 1fvr h LYS 1050N -1.00 0.33 -0.24 1.92 1.79 -0.82 -3.31 116.57 115.23 1fvr h LYS 1050Ca -0.08 -0.07 0.06 0.00 -2.18 0.00 0.00 60.65 58.38 1fvr h LYS 1050Cb 0.61 -0.05 -0.07 0.00 -1.58 0.00 0.00 32.23 31.15 1fvr h LYS 1050CO -0.05 0.43 -0.31 -0.07 -1.08 0.00 0.00 179.45 178.38 1fvr h LEU 1051N 0.16 -1.00 -2.55 2.94 3.38 -1.52 0.98 115.31 117.69 1fvr h LEU 1051Ca 0.07 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1fvr h LEU 1051Cb 0.25 0.45 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1fvr h LEU 1051CO -0.00 -0.33 0.06 -0.65 0.09 0.00 0.00 178.44 177.60 1fvr h PRO 1052N -0.32 0.00 -0.00 1.13 0.11 -1.76 -0.21 132.00 130.94 1fvr h PRO 1052Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1fvr h PRO 1052Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 1fvr h PRO 1052CO -0.42 0.00 -0.10 1.04 -0.21 0.00 0.00 178.00 178.31 1fvr n GLN 1053N -2.90 0.32 0.00 1.05 6.02 0.32 -4.89 117.38 117.30 1fvr n GLN 1053Ca -0.03 -0.07 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 1fvr n GLN 1053Cb 0.12 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.88 1fvr n GLN 1053CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1fvr n GLY 1054N 1.38 0.84 3.75 1.08 0.00 -0.09 -5.10 105.19 107.05 1fvr n GLY 1054Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1fvr n GLY 1054CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1fvr s TYR 1055N -2.00 3.40 0.05 1.61 6.14 -1.10 -5.02 117.35 120.43 1fvr s TYR 1055Ca 0.00 1.53 -0.01 0.00 0.64 0.00 0.00 57.07 59.23 1fvr s TYR 1055Cb 0.00 -3.43 -0.04 0.00 0.42 0.00 0.00 41.96 38.91 1fvr s TYR 1055CO 0.00 -1.10 -0.02 1.03 0.64 0.00 0.00 175.55 176.10 1fvr s ARG 1056N -1.09 0.58 0.61 4.97 1.81 -1.26 -4.45 118.95 120.12 1fvr s ARG 1056Ca 0.49 -1.13 -0.18 0.00 -1.72 0.00 0.00 55.73 53.18 1fvr s ARG 1056Cb -0.34 0.20 -0.04 0.00 -0.45 0.00 0.00 34.95 34.32 1fvr s ARG 1056CO 0.42 -0.11 0.99 1.28 -0.68 0.00 0.00 175.30 177.21 1fvr n LEU 1057N 0.28 3.93 -4.91 2.53 4.77 -1.26 -4.98 117.00 117.36 1fvr n LEU 1057Ca -0.15 0.81 -0.28 0.00 -0.03 0.00 0.00 56.01 56.35 1fvr n LEU 1057Cb 0.60 -1.41 -0.02 0.00 -2.33 0.00 0.00 43.42 40.26 1fvr n LEU 1057CO 0.27 -1.78 0.27 -1.61 -1.33 0.00 0.00 177.39 173.20 1fvr s GLU 1058N -2.82 3.62 0.08 3.23 2.02 -1.26 -5.02 118.70 118.54 1fvr s GLU 1058Ca 0.77 0.04 -0.31 0.00 0.02 0.00 0.00 54.97 55.49 1fvr s GLU 1058Cb -0.41 -2.57 -0.08 0.00 0.10 0.00 0.00 34.13 31.16 1fvr s GLU 1058CO 0.46 0.11 1.65 0.21 0.02 0.00 0.00 175.26 177.71 1fvr s LYS 1059N -3.89 4.20 0.68 1.61 2.20 -1.26 -4.96 119.74 118.32 1fvr s LYS 1059Ca 0.45 2.33 -0.17 0.00 -0.36 0.00 0.00 55.97 58.22 1fvr s LYS 1059Cb -0.10 -3.57 0.00 0.00 -1.51 0.00 0.00 37.83 32.65 1fvr s LYS 1059CO 0.33 -0.73 1.14 -2.30 -0.36 0.00 0.00 175.35 173.44 1fvr n PRO 1060N 5.49 0.78 0.20 4.03 -0.02 -1.26 -4.87 135.00 139.35 1fvr n PRO 1060Ca 0.16 0.32 0.14 0.00 -2.02 0.00 0.00 63.50 62.10 1fvr n PRO 1060Cb 0.40 -2.38 0.66 0.00 -0.02 0.00 0.00 33.50 32.17 1fvr n PRO 1060CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1fvr h LEU 1061N 0.10 0.00 -3.02 2.45 3.38 -1.93 -2.29 115.31 114.01 1fvr h LEU 1061Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1fvr h LEU 1061Cb 1.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1fvr h LEU 1061CO 0.50 0.00 0.00 -0.46 0.09 0.00 0.00 178.44 178.57 1fvr n ASN 1062N -2.53 3.60 -4.70 -0.43 6.94 -1.26 -4.98 115.26 111.89 1fvr n ASN 1062Ca 0.00 -2.33 -0.36 0.00 -0.02 0.00 0.00 54.58 51.87 1fvr n ASN 1062Cb 0.16 -0.39 -0.08 0.00 -2.36 0.00 0.00 39.78 37.11 1fvr n ASN 1062CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1fvr s ASP 1064N 0.63 5.62 0.41 0.00 2.15 -0.61 -4.86 116.67 120.00 1fvr s ASP 1064Ca 0.09 2.29 0.12 0.00 0.43 0.00 0.00 52.55 55.48 1fvr s ASP 1064Cb -0.12 -2.59 0.97 0.00 -0.30 0.00 0.00 42.92 40.87 1fvr s ASP 1064CO 0.01 -1.30 1.95 0.44 -0.17 0.00 0.00 175.17 176.11 1fvr h ASP 1065N 1.26 0.45 -0.37 -0.34 3.32 -1.98 -2.29 116.42 116.47 1fvr h ASP 1065Ca -0.50 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.46 1fvr h ASP 1065Cb 1.27 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.73 1fvr h ASP 1065CO 0.57 0.26 -0.13 -0.08 -1.72 0.00 0.00 179.24 178.14 1fvr h GLU 1066N 0.49 0.82 -0.25 3.56 4.81 -1.96 -0.20 114.58 121.86 1fvr h GLU 1066Ca 0.32 -0.29 -0.13 0.00 -0.13 0.00 0.00 59.36 59.13 1fvr h GLU 1066Cb 0.59 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 1fvr h GLU 1066CO -0.10 0.91 -0.39 0.28 -0.73 0.00 0.00 179.01 178.98 1fvr h VAL 1067N 0.74 1.30 -0.35 0.32 2.07 -1.78 -2.49 116.25 116.06 1fvr h VAL 1067Ca 0.12 -1.55 -0.15 0.00 0.82 0.00 0.00 66.70 65.94 1fvr h VAL 1067Cb 0.63 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1fvr h VAL 1067CO 0.04 0.49 -0.39 0.22 0.02 0.00 0.00 177.57 177.95 1fvr h TYR 1068N 0.48 1.00 0.00 1.57 3.20 -1.15 -2.22 116.97 119.85 1fvr h TYR 1068Ca 0.04 -0.30 -0.06 0.00 3.14 0.00 0.00 58.73 61.56 1fvr h TYR 1068Cb 0.89 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 1fvr h TYR 1068CO 0.04 1.09 -0.28 -0.44 -1.64 0.00 0.00 178.16 176.93 1fvr h ASP 1069N 0.68 0.00 -0.19 -2.11 3.32 -0.92 0.36 116.42 117.56 1fvr h ASP 1069Ca 0.06 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 1fvr h ASP 1069Cb 0.96 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 1fvr h ASP 1069CO 0.09 0.28 -0.02 0.25 -1.72 0.00 0.00 179.24 178.12 1fvr h LEU 1070N 0.00 0.35 -0.42 1.55 5.85 -1.17 -1.20 115.31 120.27 1fvr h LEU 1070Ca -0.00 -0.34 0.06 0.00 0.84 0.00 0.00 57.88 58.44 1fvr h LEU 1070Cb 0.52 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1fvr h LEU 1070CO 0.04 0.60 0.11 0.24 -0.34 0.00 0.00 178.44 179.09 1fvr h MET 1071N 0.08 0.25 -0.37 1.25 2.86 -0.72 -2.01 114.93 116.28 1fvr h MET 1071Ca 0.05 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 1fvr h MET 1071Cb 0.44 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 1fvr h MET 1071CO 0.01 0.17 0.20 0.00 1.06 0.00 0.00 176.91 178.35 1fvr h ARG 1072N 0.26 0.51 -0.76 1.72 2.47 -0.75 -2.00 114.38 115.82 1fvr h ARG 1072Ca 0.20 -0.05 -0.06 0.00 -1.26 0.00 0.00 59.98 58.82 1fvr h ARG 1072Cb 0.22 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 28.40 1fvr h ARG 1072CO -0.24 0.38 0.26 1.96 0.56 0.00 0.00 179.97 182.89 1fvr h GLN 1073N 0.52 1.17 0.00 0.04 4.20 -0.48 -2.50 115.11 118.05 1fvr h GLN 1073Ca 0.13 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1fvr h GLN 1073Cb 0.02 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.63 1fvr h GLN 1073CO -0.02 0.97 -0.05 0.00 -0.67 0.00 0.00 178.83 179.06 1fvr n TRP 1075N -3.24 1.69 -2.03 0.00 8.01 -0.95 -3.53 117.44 117.40 1fvr n TRP 1075Ca -0.01 -1.11 -0.41 0.00 -1.31 0.00 0.00 57.50 54.67 1fvr n TRP 1075Cb 0.25 -0.51 -0.02 0.00 -2.01 0.00 0.00 31.31 29.02 1fvr n TRP 1075CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 1fvr s ARG 1076N -2.96 4.28 0.16 -0.99 0.52 -1.17 -4.91 118.95 113.88 1fvr s ARG 1076Ca 0.49 2.31 -0.18 0.00 -0.52 0.00 0.00 55.73 57.83 1fvr s ARG 1076Cb 0.40 -3.06 0.08 0.00 0.52 0.00 0.00 34.95 32.88 1fvr s ARG 1076CO 0.10 -0.33 1.66 1.49 0.02 0.00 0.00 175.30 178.25 1fvr h GLU 1077N 3.85 -0.04 -6.23 3.54 4.81 -1.93 -3.38 114.58 115.20 1fvr h GLU 1077Ca -0.48 0.00 -0.57 0.00 -0.13 0.00 0.00 59.36 58.18 1fvr h GLU 1077Cb 1.23 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.56 1fvr h GLU 1077CO 0.69 -0.03 0.88 0.15 -0.73 0.00 0.00 179.01 179.98 1fvr s LYS 1078N -6.20 4.12 0.32 1.92 1.02 -1.26 -4.92 119.74 114.74 1fvr s LYS 1078Ca -0.14 1.34 0.08 0.00 0.02 0.00 0.00 55.97 57.28 1fvr s LYS 1078Cb 0.14 -3.76 0.83 0.00 -0.52 0.00 0.00 37.83 34.52 1fvr s LYS 1078CO 0.70 -0.84 1.75 -1.35 -0.92 0.00 0.00 175.35 174.69 1fvr h PRO 1079N 8.29 0.64 0.00 -1.68 0.11 -1.97 -0.50 132.00 136.88 1fvr h PRO 1079Ca -0.23 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1fvr h PRO 1079Cb 1.08 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1fvr h PRO 1079CO 1.00 0.42 0.00 2.48 -0.21 0.00 0.00 178.00 181.70 1fvr n TYR 1080N -4.82 0.00 0.09 0.65 0.18 -1.26 -2.73 117.16 109.26 1fvr n TYR 1080Ca 0.25 0.00 0.07 0.00 1.88 0.00 0.00 57.90 60.10 1fvr n TYR 1080Cb 0.67 -0.13 -0.02 0.00 -0.38 0.00 0.00 39.34 39.48 1fvr n TYR 1080CO 0.00 0.00 0.00 0.93 -2.08 0.00 0.00 176.86 175.71 1fvr h GLU 1081N 0.00 0.00 -7.07 -3.48 4.39 -1.44 -3.47 114.58 103.50 1fvr h GLU 1081Ca 0.00 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 59.19 1fvr h GLU 1081Cb 0.12 0.00 0.08 0.00 -0.10 0.00 0.00 28.75 28.84 1fvr h GLU 1081CO 0.00 0.12 0.45 1.03 -1.16 0.00 0.00 179.01 179.45 1fvr s ARG 1082N -3.18 3.35 0.93 2.33 0.52 -1.11 -4.99 118.95 116.80 1fvr s ARG 1082Ca -0.01 1.69 -0.12 0.00 -0.52 0.00 0.00 55.73 56.77 1fvr s ARG 1082Cb 0.09 -2.06 0.15 0.00 0.52 0.00 0.00 34.95 33.65 1fvr s ARG 1082CO 0.79 -0.87 1.10 -1.25 0.02 0.00 0.00 175.30 175.09 1fvr s PRO 1083N -3.19 0.95 0.43 3.54 0.04 -1.26 -5.05 135.00 130.46 1fvr s PRO 1083Ca 0.72 0.60 0.01 0.00 0.04 0.00 0.00 61.00 62.37 1fvr s PRO 1083Cb -0.26 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 1fvr s PRO 1083CO 0.30 -2.39 0.64 -1.54 0.04 0.00 0.00 177.00 174.04 1fvr s SER 1084N -3.56 5.87 0.45 6.66 1.04 -1.26 -4.93 113.70 117.96 1fvr s SER 1084Ca 0.64 0.23 0.12 0.00 0.48 0.00 0.00 55.95 57.42 1fvr s SER 1084Cb -0.17 -1.51 1.00 0.00 0.10 0.00 0.00 66.02 65.43 1fvr s SER 1084CO 0.56 -0.65 2.05 -0.26 0.98 0.00 0.00 173.24 175.92 1fvr h PHE 1085N 0.48 0.22 -0.63 5.02 0.04 -1.93 -1.00 116.94 119.14 1fvr h PHE 1085Ca -0.46 -0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.22 1fvr h PHE 1085Cb 1.25 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 39.31 1fvr h PHE 1085CO 0.45 0.21 0.05 0.00 -0.60 0.00 0.00 178.31 178.42 1fvr h ALA 1086N 1.82 0.89 -0.38 2.45 0.00 -1.94 -0.85 119.26 121.24 1fvr h ALA 1086Ca 0.06 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.52 1fvr h ALA 1086Cb 0.11 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1fvr h ALA 1086CO -0.00 0.67 -0.36 1.96 0.00 0.00 0.00 179.25 181.51 1fvr h GLN 1087N 1.00 0.90 -0.75 0.00 4.20 -1.66 -2.20 115.11 116.60 1fvr h GLN 1087Ca 0.19 -0.46 0.01 0.00 0.06 0.00 0.00 58.65 58.45 1fvr h GLN 1087Cb 0.50 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.25 1fvr h GLN 1087CO 0.02 1.11 0.50 0.82 -0.67 0.00 0.00 178.83 180.61 1fvr h ILE 1088N 0.74 1.19 -0.50 2.54 2.04 -0.98 -1.53 117.51 121.01 1fvr h ILE 1088Ca 0.07 -0.35 -0.07 0.00 1.00 0.00 0.00 64.86 65.50 1fvr h ILE 1088Cb 0.94 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1fvr h ILE 1088CO 0.09 0.18 0.01 0.25 0.00 0.00 0.00 178.15 178.68 1fvr h LEU 1089N 1.01 0.80 -0.68 1.44 5.85 -1.01 -1.05 115.31 121.68 1fvr h LEU 1089Ca 0.28 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 1fvr h LEU 1089Cb -0.11 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.68 1fvr h LEU 1089CO -0.06 0.86 0.11 0.58 -0.34 0.00 0.00 178.44 179.59 1fvr h VAL 1090N 0.77 1.26 -0.30 1.05 2.07 -0.80 -0.54 116.25 119.77 1fvr h VAL 1090Ca 0.15 -1.04 -0.04 0.00 0.82 0.00 0.00 66.70 66.60 1fvr h VAL 1090Cb 0.46 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1fvr h VAL 1090CO 0.02 0.39 0.04 0.28 0.02 0.00 0.00 177.57 178.32 1fvr h SER 1091N 1.04 0.48 -0.45 0.57 0.02 -0.92 -1.59 113.55 112.70 1fvr h SER 1091Ca 0.21 -0.27 -0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1fvr h SER 1091Cb 0.44 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 1fvr h SER 1091CO 0.01 0.63 0.27 -0.07 -1.14 0.00 0.00 176.83 176.52 1fvr h LEU 1092N 0.32 0.55 -1.44 5.07 3.38 -1.03 -2.35 115.31 119.81 1fvr h LEU 1092Ca 0.09 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1fvr h LEU 1092Cb 0.35 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1fvr h LEU 1092CO 0.01 0.46 0.20 0.78 0.09 0.00 0.00 178.44 179.98 1fvr h ASN 1093N 0.60 0.52 -0.34 -0.43 -0.26 -0.99 -0.23 115.58 114.46 1fvr h ASN 1093Ca 0.16 -0.04 -0.05 0.00 -0.56 0.00 0.00 56.30 55.81 1fvr h ASN 1093Cb 0.02 -0.13 -0.01 0.00 -1.06 0.00 0.00 38.32 37.13 1fvr h ASN 1093CO -0.03 0.45 0.03 0.03 -1.06 0.00 0.00 177.43 176.84 1fvr h ARG 1094N 0.59 0.58 -0.50 0.81 3.08 -0.78 -1.18 114.38 116.97 1fvr h ARG 1094Ca 0.15 -0.17 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 1fvr h ARG 1094Cb 0.06 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1fvr h ARG 1094CO -0.02 0.68 0.04 0.52 -1.07 0.00 0.00 179.97 180.12 1fvr h MET 1095N 0.39 0.86 -0.68 0.04 2.86 -1.05 -3.00 114.93 114.35 1fvr h MET 1095Ca 0.10 -0.25 0.02 0.00 -2.06 0.00 0.00 59.70 57.51 1fvr h MET 1095Cb 0.40 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.93 1fvr h MET 1095CO 0.01 0.87 0.43 -0.07 1.06 0.00 0.00 176.91 179.22 1fvr h LEU 1096N 0.73 0.72 -2.13 1.22 3.38 -0.91 -2.57 115.31 115.75 1fvr h LEU 1096Ca 0.15 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.17 1fvr h LEU 1096Cb 0.46 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1fvr h LEU 1096CO 0.02 0.50 0.16 -0.08 0.09 0.00 0.00 178.44 179.13 1fvr h GLU 1097N 0.85 0.00 -6.71 1.13 4.57 -1.07 -3.42 114.58 109.93 1fvr h GLU 1097Ca 0.27 0.00 -0.50 0.00 -1.18 0.00 0.00 59.36 57.94 1fvr h GLU 1097Cb -0.01 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 1fvr h GLU 1097CO -0.09 0.00 0.05 -1.21 -1.18 0.00 0.00 179.01 176.58 1fvr s GLU 1098N -4.86 3.84 0.04 1.92 2.02 -0.97 -5.01 118.70 115.68 1fvr s GLU 1098Ca -0.05 0.46 -0.23 0.00 0.02 0.00 0.00 54.97 55.17 1fvr s GLU 1098Cb 0.17 -2.46 -0.13 0.00 0.10 0.00 0.00 34.13 31.80 1fvr s GLU 1098CO 0.63 0.10 1.35 0.07 0.02 0.00 0.00 175.26 177.43 1fvr h ARG 1099N 1.81 -0.81 0.00 1.61 -0.00 -1.84 -3.47 114.38 111.68 1fvr h ARG 1099Ca -0.47 0.06 0.00 0.00 -0.00 0.00 0.00 59.98 59.56 1fvr h ARG 1099Cb 1.18 0.18 0.00 0.00 -0.00 0.00 0.00 29.97 31.33 1fvr h ARG 1099CO 0.65 -0.54 0.00 1.17 -0.00 0.00 0.00 179.97 181.25 1fvr n LYS 1100N -4.26 0.00 -3.24 0.08 4.81 -1.26 -4.87 118.16 109.41 1fvr n LYS 1100Ca -0.10 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 56.94 1fvr n LYS 1100Cb 0.33 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.31 1fvr n LYS 1100CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1fvr s THR 1101N 0.00 5.09 -0.18 3.15 2.01 -1.26 -4.95 115.64 119.51 1fvr s THR 1101Ca 0.00 0.93 0.11 0.00 0.31 0.00 0.00 61.69 63.04 1fvr s THR 1101Cb 0.00 -3.84 -0.18 0.00 0.01 0.00 0.00 72.50 68.49 1fvr s THR 1101CO 0.00 0.15 -0.01 -1.22 -0.69 0.00 0.00 174.62 172.84 1fvr n TYR 1102N 5.02 0.00 -3.95 4.92 4.02 -1.26 -4.80 117.16 121.11 1fvr n TYR 1102Ca -0.05 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.53 1fvr n TYR 1102Cb 0.50 -0.81 -0.14 0.00 -0.02 0.00 0.00 39.34 38.87 1fvr n TYR 1102CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1fvr s VAL 1103N -2.40 2.59 0.31 -0.72 1.01 -1.26 -1.58 120.40 118.34 1fvr s VAL 1103Ca -0.14 -2.87 -0.29 0.00 0.00 0.00 0.00 61.98 58.68 1fvr s VAL 1103Cb 0.06 -2.82 -0.10 0.00 0.00 0.00 0.00 36.38 33.51 1fvr s VAL 1103CO 0.62 -0.72 1.37 0.21 0.00 0.00 0.00 175.10 176.57 1fvr s ASN 1104N 0.33 6.68 -0.01 3.32 2.47 -0.55 -4.06 114.94 123.13 1fvr s ASN 1104Ca 0.14 2.73 0.01 0.00 0.42 0.00 0.00 52.86 56.16 1fvr s ASN 1104Cb -0.23 -2.64 0.02 0.00 -1.45 0.00 0.00 41.25 36.94 1fvr s ASN 1104CO -0.03 -0.63 0.72 0.35 -3.72 0.00 0.00 177.10 173.78 1fvr n THR 1105N 1.26 0.22 -3.47 -5.21 -2.24 -1.26 -4.84 114.28 98.74 1fvr n THR 1105Ca 0.02 -0.24 -0.37 0.00 -2.27 0.00 0.00 64.05 61.19 1fvr n THR 1105Cb 0.41 0.75 -0.07 0.00 -2.10 0.00 0.00 70.33 69.32 1fvr n THR 1105CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1fvr s THR 1106N -0.27 5.27 0.11 4.28 2.01 -1.26 -0.10 115.64 125.68 1fvr s THR 1106Ca 0.02 0.65 -0.27 0.00 0.31 0.00 0.00 61.69 62.39 1fvr s THR 1106Cb 0.01 -3.68 -0.09 0.00 0.01 0.00 0.00 72.50 68.75 1fvr s THR 1106CO 0.00 0.36 1.64 -0.07 -0.69 0.00 0.00 174.62 175.85 1fvr h LEU 1107N 6.83 -0.75 0.00 4.42 3.38 -1.75 -3.47 115.31 123.97 1fvr h LEU 1107Ca -0.40 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1fvr h LEU 1107Cb 1.17 0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.20 1fvr h LEU 1107CO 0.75 -0.36 0.00 -1.22 0.09 0.00 0.00 178.44 177.70 1fvr n TYR 1108N -5.38 0.00 0.17 1.13 4.01 -1.26 -2.18 117.16 113.64 1fvr n TYR 1108Ca -0.07 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.78 1fvr n TYR 1108Cb 0.29 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.28 1fvr n TYR 1108CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1fvr n GLU 1109N 14.00 0.55 -3.64 -0.72 -0.58 -1.26 -4.97 120.64 124.02 1fvr n GLU 1109Ca 0.00 0.01 -0.08 0.00 -0.42 0.00 0.00 57.16 56.67 1fvr n GLU 1109Cb 0.00 -1.70 -0.07 0.00 -0.57 0.00 0.00 31.44 29.10 1fvr n GLU 1109CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1fvr s LYS 1110N -3.37 0.49 -0.04 3.49 2.20 -0.93 -5.16 119.74 116.42 1fvr s LYS 1110Ca -0.02 0.62 -0.03 0.00 -0.36 0.00 0.00 55.97 56.18 1fvr s LYS 1110Cb 0.12 0.22 0.01 0.00 -1.51 0.00 0.00 37.83 36.67 1fvr s LYS 1110CO 0.82 -0.06 0.09 0.12 -0.36 0.00 0.00 175.35 175.96 1fvr s PHE 1111N 0.40 -0.10 -0.10 4.03 5.36 -1.26 -4.92 117.98 121.39 1fvr s PHE 1111Ca 0.01 0.26 0.02 0.00 -0.96 0.00 0.00 56.93 56.26 1fvr s PHE 1111Cb -0.05 0.00 0.01 0.00 -0.34 0.00 0.00 43.02 42.65 1fvr s PHE 1111CO -0.08 -0.06 -0.16 0.99 -1.46 0.00 0.00 175.22 174.45 1fvr s THR 1112N 0.25 1.51 0.04 0.12 2.01 -1.26 -5.11 115.64 113.20 1fvr s THR 1112Ca -0.02 -0.66 -0.27 0.00 0.31 0.00 0.00 61.69 61.05 1fvr s THR 1112Cb -0.03 -1.38 -0.05 0.00 0.01 0.00 0.00 72.50 71.06 1fvr s THR 1112CO -0.01 0.44 0.85 -0.31 -0.69 0.00 0.00 174.62 174.90 1fvr s TYR 1113N 0.90 3.72 0.47 4.92 2.02 -1.26 -4.91 117.35 123.21 1fvr s TYR 1113Ca -0.08 1.57 -0.23 0.00 -0.37 0.00 0.00 57.07 57.95 1fvr s TYR 1113Cb -0.15 -2.94 -0.07 0.00 -0.40 0.00 0.00 41.96 38.40 1fvr s TYR 1113CO -0.00 0.17 1.28 0.00 -1.57 0.00 0.00 175.55 175.43 1fvr s ALA 1114N 0.30 3.01 0.58 3.71 0.00 -1.26 -4.96 121.76 123.14 1fvr s ALA 1114Ca 0.43 1.18 -0.18 0.00 0.00 0.00 0.00 51.96 53.38 1fvr s ALA 1114Cb -0.21 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 1fvr s ALA 1114CO 0.25 -0.97 1.14 0.20 0.00 0.00 0.00 175.76 176.38 1fvr s GLY 1115N -1.01 2.55 -0.23 0.00 0.00 -1.26 -4.67 107.32 102.69 1fvr s GLY 1115Ca 0.64 0.80 0.02 0.00 0.00 0.00 0.00 44.72 46.18 1fvr s GLY 1115CO 0.44 1.16 -0.13 -0.42 0.00 0.00 0.00 173.10 174.15 1fvr s ILE 1116N -1.86 2.07 -0.43 0.90 1.01 -1.26 -1.20 121.20 120.43 1fvr s ILE 1116Ca 0.72 -1.40 -0.14 0.00 0.00 0.00 0.00 60.65 59.84 1fvr s ILE 1116Cb -0.24 -2.11 0.05 0.00 0.01 0.00 0.00 42.46 40.17 1fvr s ILE 1116CO 0.31 0.13 0.32 -0.62 0.00 0.00 0.00 174.94 175.08 1fvr s ASP 1117N 1.18 6.01 0.43 3.58 3.68 -1.26 -4.92 116.67 125.38 1fvr s ASP 1117Ca -0.05 -1.18 0.25 0.00 2.13 0.00 0.00 52.55 53.71 1fvr s ASP 1117Cb -0.18 -2.13 0.61 0.00 -1.45 0.00 0.00 42.92 39.78 1fvr s ASP 1117CO -0.07 -0.54 1.70 0.00 0.13 0.00 0.00 175.17 176.39 1fvr h SER 1119N 0.00 -0.56 -1.13 0.00 0.02 -2.06 -1.93 113.55 107.89 1fvr h SER 1119Ca 0.00 0.04 -0.59 0.00 -0.84 0.00 0.00 61.79 60.40 1fvr h SER 1119Cb 0.86 0.18 -0.16 0.00 0.14 0.00 0.00 62.40 63.42 1fvr h SER 1119CO 0.00 -0.33 1.11 0.00 -1.14 0.00 0.00 176.83 176.47 1fvr n ALA 1120N -2.44 6.58 -0.34 3.77 0.00 -1.21 -5.24 120.51 121.63 1fvr n ALA 1120Ca -0.09 -3.45 0.00 0.00 0.00 0.00 0.00 53.44 49.90 1fvr n ALA 1120Cb 0.25 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.34 1fvr n ALA 1120CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59