#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rl5 n HIS 816 N 0.00 -1.52 0.29 -0.32 8.25 -1.26 -4.89 115.22 115.77 2rl5 n HIS 816 Ca 0.00 0.40 0.15 0.00 -0.26 0.00 0.00 57.72 58.01 2rl5 n HIS 816 Cb 0.00 -3.74 0.89 0.00 1.12 0.00 0.00 29.99 28.27 2rl5 n HIS 816 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2rl5 h ALA 817 N 0.78 1.49 0.00 -1.41 0.00 -1.95 -2.05 119.26 116.12 2rl5 h ALA 817 Ca -0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2rl5 h ALA 817 Cb 1.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2rl5 h ALA 817 CO 0.45 0.02 0.04 -0.85 0.00 0.00 0.00 179.25 178.91 2rl5 n GLU 818 N -3.81 0.09 -0.34 0.00 0.00 -1.26 -1.38 120.64 113.93 2rl5 n GLU 818 Ca -0.03 0.57 0.09 0.00 0.00 0.00 0.00 57.16 57.79 2rl5 n GLU 818 Cb 0.10 -1.82 0.26 0.00 0.00 0.00 0.00 31.44 29.98 2rl5 n GLU 818 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2rl5 n ARG 819 N -1.97 2.95 -1.94 3.44 1.74 -0.77 -4.85 116.66 115.25 2rl5 n ARG 819 Ca -0.01 -2.47 -0.32 0.00 -0.77 0.00 0.00 57.85 54.28 2rl5 n ARG 819 Cb 0.06 -1.51 0.02 0.00 -1.02 0.00 0.00 32.46 30.00 2rl5 n ARG 819 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2rl5 s LEU 820 N -1.22 3.39 0.55 0.55 1.43 -0.48 -4.99 118.68 117.91 2rl5 s LEU 820 Ca 0.39 1.70 -0.22 0.00 -1.03 0.00 0.00 54.13 54.98 2rl5 s LEU 820 Cb 0.22 -4.52 -0.05 0.00 0.03 0.00 0.00 46.19 41.87 2rl5 s LEU 820 CO 0.24 -1.15 1.33 -2.65 0.23 0.00 0.00 176.35 174.34 2rl5 n PRO 821 N -2.33 1.63 -4.01 1.29 -0.02 -1.26 -5.01 135.00 125.29 2rl5 n PRO 821 Ca 0.08 0.60 -0.30 0.00 -2.02 0.00 0.00 63.50 61.86 2rl5 n PRO 821 Cb 0.53 -2.53 -0.16 0.00 -0.02 0.00 0.00 33.50 31.32 2rl5 n PRO 821 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2rl5 s TYR 822 N -1.30 2.26 -1.09 6.00 5.04 -1.26 -5.06 117.35 121.94 2rl5 s TYR 822 Ca 0.72 -1.37 -0.20 0.00 -2.44 0.00 0.00 57.07 53.77 2rl5 s TYR 822 Cb -0.42 -1.61 0.08 0.00 0.35 0.00 0.00 41.96 40.36 2rl5 s TYR 822 CO 0.49 -0.70 1.47 0.34 -1.34 0.00 0.00 175.55 175.81 2rl5 s ASP 823 N 1.45 6.65 0.25 4.32 -1.08 -1.26 -4.83 116.67 122.17 2rl5 s ASP 823 Ca 0.02 -1.91 -0.05 0.00 -0.52 0.00 0.00 52.55 50.09 2rl5 s ASP 823 Cb -0.14 -2.53 0.33 0.00 -1.46 0.00 0.00 42.92 39.12 2rl5 s ASP 823 CO -0.10 -1.30 1.87 0.00 0.52 0.00 0.00 175.17 176.17 2rl5 h ALA 824 N 8.90 1.23 -0.00 3.66 0.00 -1.97 -1.22 119.26 129.84 2rl5 h ALA 824 Ca 0.26 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2rl5 h ALA 824 Cb 0.97 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2rl5 h ALA 824 CO 1.37 0.37 0.03 0.66 0.00 0.00 0.00 179.25 181.68 2rl5 h SER 825 N 1.07 0.00 0.08 0.00 4.64 -1.93 -0.12 113.55 117.29 2rl5 h SER 825 Ca 0.38 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.34 2rl5 h SER 825 Cb 0.11 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.14 2rl5 h SER 825 CO -0.15 0.00 -2.29 1.17 -0.87 0.00 0.00 176.83 174.68 2rl5 n LYS 826 N -3.20 0.68 -0.02 4.77 4.81 -0.51 -4.78 118.16 119.90 2rl5 n LYS 826 Ca -0.03 0.10 -0.01 0.00 -0.87 0.00 0.00 58.31 57.50 2rl5 n LYS 826 Cb 0.10 -1.57 -0.06 0.00 0.02 0.00 0.00 35.03 33.52 2rl5 n LYS 826 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 2rl5 n TRP 827 N -2.99 0.00 -1.71 5.64 7.02 -0.88 -4.98 117.44 119.54 2rl5 n TRP 827 Ca -0.34 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 55.70 2rl5 n TRP 827 Cb 1.09 -0.29 -0.02 0.00 -2.42 0.00 0.00 31.31 29.66 2rl5 n TRP 827 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 2rl5 n GLU 828 N -2.07 2.45 -4.58 -0.99 4.07 -0.09 -1.04 120.64 118.40 2rl5 n GLU 828 Ca -0.08 0.88 -0.23 0.00 -0.06 0.00 0.00 57.16 57.67 2rl5 n GLU 828 Cb 0.52 -2.63 -0.16 0.00 -0.06 0.00 0.00 31.44 29.11 2rl5 n GLU 828 CO 0.00 0.00 0.00 0.12 -0.06 0.00 0.00 177.13 177.19 2rl5 s PHE 829 N 0.33 1.30 0.13 4.31 5.36 -0.07 -4.83 117.98 124.50 2rl5 s PHE 829 Ca 0.69 -0.37 -0.31 0.00 -0.96 0.00 0.00 56.93 55.98 2rl5 s PHE 829 Cb -0.57 -0.91 -0.10 0.00 -0.34 0.00 0.00 43.02 41.10 2rl5 s PHE 829 CO 0.44 -0.15 1.81 -2.14 -1.46 0.00 0.00 175.22 173.72 2rl5 s PRO 830 N 0.22 4.14 0.40 10.12 0.02 -1.26 -4.49 135.00 144.14 2rl5 s PRO 830 Ca -0.05 2.58 0.10 0.00 0.02 0.00 0.00 61.00 63.65 2rl5 s PRO 830 Cb -0.11 -3.55 0.89 0.00 0.02 0.00 0.00 34.50 31.76 2rl5 s PRO 830 CO 0.02 -0.83 1.99 0.00 -0.33 0.00 0.00 177.00 177.85 2rl5 h ARG 831 N 8.42 0.54 0.00 5.54 3.08 -1.96 -1.62 114.38 128.39 2rl5 h ARG 831 Ca -0.46 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2rl5 h ARG 831 Cb 1.22 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.14 2rl5 h ARG 831 CO 0.95 0.36 0.00 0.38 -1.07 0.00 0.00 179.97 180.59 2rl5 h ASP 832 N 0.56 0.00 -0.42 7.04 3.04 -2.03 -2.19 116.42 122.42 2rl5 h ASP 832 Ca 0.26 0.00 -0.12 0.00 -3.24 0.00 0.00 57.03 53.93 2rl5 h ASP 832 Cb 0.31 0.00 -0.07 0.00 -1.04 0.00 0.00 39.33 38.53 2rl5 h ASP 832 CO -0.08 0.00 0.15 0.54 -2.04 0.00 0.00 179.24 177.81 2rl5 n ARG 833 N -2.93 2.57 -4.71 4.15 1.74 -0.61 -4.81 116.66 112.06 2rl5 n ARG 833 Ca -0.00 -1.73 -0.23 0.00 -0.77 0.00 0.00 57.85 55.12 2rl5 n ARG 833 Cb 0.21 -1.82 -0.15 0.00 -1.02 0.00 0.00 32.46 29.68 2rl5 n ARG 833 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2rl5 s LEU 834 N -1.66 1.98 -0.55 0.55 2.96 -0.83 -1.18 118.68 119.95 2rl5 s LEU 834 Ca 0.31 -0.28 0.04 0.00 -0.22 0.00 0.00 54.13 53.98 2rl5 s LEU 834 Cb 0.25 -0.80 0.15 0.00 0.50 0.00 0.00 46.19 46.29 2rl5 s LEU 834 CO 0.08 0.17 0.36 -0.75 -1.32 0.00 0.00 176.35 174.89 2rl5 s LYS 835 N -0.21 1.78 0.21 1.98 2.20 -0.21 -4.96 119.74 120.52 2rl5 s LYS 835 Ca 0.03 -2.65 -0.32 0.00 -0.36 0.00 0.00 55.97 52.67 2rl5 s LYS 835 Cb -0.07 -2.73 -0.13 0.00 -1.51 0.00 0.00 37.83 33.38 2rl5 s LYS 835 CO 0.00 -1.25 1.51 1.28 -0.36 0.00 0.00 175.35 176.54 2rl5 n LEU 836 N 2.73 3.25 0.00 5.43 4.77 -1.26 -2.43 117.00 129.49 2rl5 n LEU 836 Ca 0.16 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.26 2rl5 n LEU 836 Cb 0.37 -1.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.01 2rl5 n LEU 836 CO 0.24 -0.31 0.00 0.61 -1.33 0.00 0.00 177.39 176.59 2rl5 n GLY 837 N 2.80 4.06 3.80 -0.72 0.00 0.27 -4.96 105.19 110.45 2rl5 n GLY 837 Ca 0.14 -1.67 -0.34 0.00 0.00 0.00 0.00 46.02 44.15 2rl5 n GLY 837 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rl5 s LYS 838 N 4.77 3.62 0.49 1.61 1.02 -1.26 -4.61 119.74 125.38 2rl5 s LYS 838 Ca 0.00 1.34 -0.21 0.00 0.02 0.00 0.00 55.97 57.11 2rl5 s LYS 838 Cb 0.00 -2.07 -0.07 0.00 -0.52 0.00 0.00 37.83 35.17 2rl5 s LYS 838 CO 0.00 -0.58 1.13 -2.14 -0.92 0.00 0.00 175.35 172.84 2rl5 s PRO 839 N -3.49 3.65 -0.03 -1.68 0.02 -1.26 -0.99 135.00 131.22 2rl5 s PRO 839 Ca 0.67 1.64 0.11 0.00 0.02 0.00 0.00 61.00 63.44 2rl5 s PRO 839 Cb -0.17 -2.24 -0.16 0.00 0.02 0.00 0.00 34.50 31.95 2rl5 s PRO 839 CO 0.26 -0.61 0.21 1.28 -0.33 0.00 0.00 177.00 177.80 2rl5 n LEU 840 N -0.80 0.00 0.00 -5.54 4.77 -0.07 -4.81 117.00 110.55 2rl5 n LEU 840 Ca 0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2rl5 n LEU 840 Cb 0.50 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 2rl5 n LEU 840 CO 0.44 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 2rl5 n GLY 841 N 1.95 2.19 3.29 -0.72 0.00 -1.12 -5.00 105.19 105.77 2rl5 n GLY 841 Ca -0.05 -0.67 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 2rl5 n GLY 841 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2rl5 s ARG 842 N -2.00 0.66 0.00 1.61 1.70 -1.26 -0.35 118.95 119.31 2rl5 s ARG 842 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 55.73 55.32 2rl5 s ARG 842 Cb 0.00 0.30 0.00 0.00 -0.57 0.00 0.00 34.95 34.68 2rl5 s ARG 842 CO 0.00 -0.17 0.00 0.41 -1.08 0.00 0.00 175.30 174.46 2rl5 n GLY 846 N 1.66 0.00 3.64 3.88 0.00 -1.26 -5.06 105.19 108.05 2rl5 n GLY 846 Ca -0.19 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.79 2rl5 n GLY 846 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rl5 s GLN 847 N 0.00 0.42 -0.16 1.61 -2.07 -1.10 -4.84 119.66 113.52 2rl5 s GLN 847 Ca 0.00 0.65 -0.12 0.00 -1.82 0.00 0.00 55.36 54.07 2rl5 s GLN 847 Cb 0.00 0.12 -0.05 0.00 -1.09 0.00 0.00 33.01 31.99 2rl5 s GLN 847 CO 0.00 -0.08 0.24 0.08 -1.32 0.00 0.00 175.29 174.21 2rl5 s VAL 848 N 1.03 5.34 0.04 3.63 1.01 0.53 -2.03 120.40 129.96 2rl5 s VAL 848 Ca -0.06 0.43 0.07 0.00 0.00 0.00 0.00 61.98 62.43 2rl5 s VAL 848 Cb -0.04 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 2rl5 s VAL 848 CO -0.13 0.43 -0.21 -0.63 0.00 0.00 0.00 175.10 174.56 2rl5 s ILE 849 N 0.22 1.71 0.37 2.22 1.01 0.16 -0.90 121.20 125.99 2rl5 s ILE 849 Ca 0.14 -1.22 -0.23 0.00 0.00 0.00 0.00 60.65 59.34 2rl5 s ILE 849 Cb -0.12 -1.49 -0.10 0.00 0.01 0.00 0.00 42.46 40.76 2rl5 s ILE 849 CO 0.03 0.22 0.93 -0.70 0.00 0.00 0.00 174.94 175.41 2rl5 s GLU 850 N -1.20 4.39 0.27 2.79 2.12 -0.17 -0.11 118.70 126.80 2rl5 s GLU 850 Ca 0.08 1.19 -0.20 0.00 0.36 0.00 0.00 54.97 56.40 2rl5 s GLU 850 Cb -0.09 -2.52 0.02 0.00 0.26 0.00 0.00 34.13 31.80 2rl5 s GLU 850 CO 0.02 0.14 0.67 0.00 -0.54 0.00 0.00 175.26 175.55 2rl5 s ALA 851 N -1.88 -1.06 -0.07 6.30 0.00 -0.41 0.97 121.76 125.61 2rl5 s ALA 851 Ca 0.55 -0.38 0.03 0.00 0.00 0.00 0.00 51.96 52.16 2rl5 s ALA 851 Cb -0.14 0.89 -0.02 0.00 0.00 0.00 0.00 23.12 23.84 2rl5 s ALA 851 CO 0.19 -1.00 -0.14 -0.51 0.00 0.00 0.00 175.76 174.30 2rl5 s ASP 852 N -2.93 4.03 -0.05 0.00 1.01 -1.02 -0.63 116.67 117.08 2rl5 s ASP 852 Ca 0.13 -0.23 0.06 0.00 0.71 0.00 0.00 52.55 53.22 2rl5 s ASP 852 Cb -0.05 -1.05 -0.01 0.00 1.01 0.00 0.00 42.92 42.81 2rl5 s ASP 852 CO 0.07 0.30 -0.25 0.00 0.21 0.00 0.00 175.17 175.50 2rl5 s ALA 853 N -0.45 2.19 -0.43 5.23 0.00 0.05 -1.04 121.76 127.30 2rl5 s ALA 853 Ca 0.05 -1.06 -0.17 0.00 0.00 0.00 0.00 51.96 50.78 2rl5 s ALA 853 Cb -0.12 -0.66 0.03 0.00 0.00 0.00 0.00 23.12 22.36 2rl5 s ALA 853 CO 0.02 0.44 0.46 0.12 0.00 0.00 0.00 175.76 176.80 2rl5 s PHE 854 N -0.27 3.16 -1.17 0.00 5.36 -0.32 -1.92 117.98 122.83 2rl5 s PHE 854 Ca -0.00 -0.41 -0.08 0.00 -0.96 0.00 0.00 56.93 55.48 2rl5 s PHE 854 Cb -0.13 -2.98 -0.02 0.00 -0.34 0.00 0.00 43.02 39.55 2rl5 s PHE 854 CO 0.03 -0.74 0.82 0.41 -1.46 0.00 0.00 175.22 174.28 2rl5 n GLY 855 N 5.12 -0.77 0.11 13.12 0.00 0.49 -4.91 105.19 118.34 2rl5 n GLY 855 Ca -0.07 0.36 0.12 0.00 0.00 0.00 0.00 46.02 46.42 2rl5 n GLY 855 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2rl5 h ILE 856 N -1.63 0.00 -4.39 -0.61 2.10 -1.79 -3.47 117.51 107.72 2rl5 h ILE 856 Ca -0.62 -0.83 -0.18 0.00 1.08 0.00 0.00 64.86 64.31 2rl5 h ILE 856 Cb 1.34 1.39 -0.15 0.00 -1.09 0.00 0.00 36.82 38.31 2rl5 h ILE 856 CO 0.50 0.00 -0.62 1.51 -1.08 0.00 0.00 178.15 178.46 2rl5 s ASP 857 N -5.04 0.28 -0.46 2.19 1.47 -1.26 -4.99 116.67 108.85 2rl5 s ASP 857 Ca 0.02 -1.19 -0.02 0.00 1.18 0.00 0.00 52.55 52.55 2rl5 s ASP 857 Cb 0.10 0.31 0.23 0.00 -0.34 0.00 0.00 42.92 43.23 2rl5 s ASP 857 CO 0.76 -0.75 2.21 0.29 0.68 0.00 0.00 175.17 178.36 2rl5 n LYS 858 N -0.11 2.21 0.00 2.11 5.02 -1.26 -3.91 118.16 122.21 2rl5 n LYS 858 Ca -0.05 -2.26 0.00 0.00 -2.02 0.00 0.00 58.31 53.98 2rl5 n LYS 858 Cb 0.64 -1.93 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 2rl5 n LYS 858 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2rl5 n THR 859 N 0.15 0.00 0.00 -0.18 -2.24 -1.26 -5.07 114.28 105.68 2rl5 n THR 859 Ca 0.43 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 2rl5 n THR 859 Cb 0.56 1.22 0.00 0.00 -2.10 0.00 0.00 70.33 70.01 2rl5 n THR 859 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rl5 n ALA 860 N -0.27 0.00 0.21 6.98 0.00 -1.25 -5.03 120.51 121.14 2rl5 n ALA 860 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 2rl5 n ALA 860 Cb 0.05 0.00 0.45 0.00 0.00 0.00 0.00 19.45 19.95 2rl5 n ALA 860 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2rl5 h THR 861 N 0.00 0.99 -4.03 0.00 1.35 -1.94 -3.39 112.91 105.89 2rl5 h THR 861 Ca 0.00 -1.13 -0.43 0.00 -0.55 0.00 0.00 66.41 64.30 2rl5 h THR 861 Cb 0.00 1.65 -0.25 0.00 -1.73 0.00 0.00 68.15 67.82 2rl5 h THR 861 CO 0.00 0.30 -0.79 0.00 -0.25 0.00 0.00 175.52 174.78 2rl5 s ARG 863 N -1.08 0.93 0.28 0.00 3.52 -0.81 -4.94 118.95 116.85 2rl5 s ARG 863 Ca 0.01 0.56 -0.24 0.00 -0.13 0.00 0.00 55.73 55.93 2rl5 s ARG 863 Cb -0.08 0.44 -0.09 0.00 -1.56 0.00 0.00 34.95 33.66 2rl5 s ARG 863 CO 0.01 -0.22 0.87 0.99 -0.81 0.00 0.00 175.30 176.14 2rl5 s THR 864 N -0.49 4.33 0.22 4.11 2.01 -1.26 -0.77 115.64 123.78 2rl5 s THR 864 Ca -0.06 1.65 -0.06 0.00 0.31 0.00 0.00 61.69 63.53 2rl5 s THR 864 Cb -0.02 -3.97 -0.02 0.00 0.01 0.00 0.00 72.50 68.49 2rl5 s THR 864 CO 0.06 0.18 0.28 0.68 -0.69 0.00 0.00 174.62 175.13 2rl5 s VAL 865 N -1.56 0.00 -0.09 3.82 -7.23 0.20 -3.92 120.40 111.61 2rl5 s VAL 865 Ca 0.47 -1.73 0.02 0.00 -1.81 0.00 0.00 61.98 58.93 2rl5 s VAL 865 Cb -0.18 -2.36 -0.02 0.00 0.56 0.00 0.00 36.38 34.38 2rl5 s VAL 865 CO 0.23 -0.00 -0.15 0.00 -0.31 0.00 0.00 175.10 174.87 2rl5 s ALA 866 N -4.10 2.59 -0.11 1.32 0.00 -0.65 -1.29 121.76 119.53 2rl5 s ALA 866 Ca 0.31 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 51.36 2rl5 s ALA 866 Cb 0.04 -1.06 0.01 0.00 0.00 0.00 0.00 23.12 22.10 2rl5 s ALA 866 CO 0.11 0.39 -0.19 0.08 0.00 0.00 0.00 175.76 176.15 2rl5 s VAL 867 N -0.13 1.73 -0.21 0.00 1.01 0.85 -1.09 120.40 122.56 2rl5 s VAL 867 Ca -0.01 -0.80 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 2rl5 s VAL 867 Cb -0.14 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 2rl5 s VAL 867 CO 0.04 0.49 0.03 -0.75 0.00 0.00 0.00 175.10 174.90 2rl5 s LYS 868 N 0.75 3.71 0.06 2.72 2.20 0.50 0.40 119.74 130.09 2rl5 s LYS 868 Ca -0.11 -0.47 0.01 0.00 -0.36 0.00 0.00 55.97 55.04 2rl5 s LYS 868 Cb -0.16 -3.17 -0.04 0.00 -1.51 0.00 0.00 37.83 32.95 2rl5 s LYS 868 CO 0.01 0.02 -0.05 0.00 -0.36 0.00 0.00 175.35 174.98 2rl5 s MET 869 N 1.01 0.65 0.44 4.03 0.23 -0.86 -0.41 119.30 124.38 2rl5 s MET 869 Ca 0.03 -1.13 -0.24 0.00 -1.03 0.00 0.00 55.69 53.31 2rl5 s MET 869 Cb -0.14 -0.02 -0.08 0.00 -1.53 0.00 0.00 34.83 33.06 2rl5 s MET 869 CO 0.02 -0.05 1.24 -0.51 -2.03 0.00 0.00 175.02 173.70 2rl5 s LEU 870 N -2.62 4.11 0.00 0.18 1.43 -1.24 -2.71 118.68 117.84 2rl5 s LEU 870 Ca 0.04 2.50 -0.18 0.00 -1.03 0.00 0.00 54.13 55.46 2rl5 s LEU 870 Cb 0.02 -4.07 0.27 0.00 0.03 0.00 0.00 46.19 42.44 2rl5 s LEU 870 CO -0.06 -0.92 0.85 0.29 0.23 0.00 0.00 176.35 176.75 2rl5 n LYS 871 N -0.20 -3.19 -2.36 1.70 5.02 -1.26 -4.93 118.16 112.95 2rl5 n LYS 871 Ca 0.06 -1.38 -0.42 0.00 -2.02 0.00 0.00 58.31 54.55 2rl5 n LYS 871 Cb 0.46 -1.40 -0.03 0.00 -0.02 0.00 0.00 35.03 34.04 2rl5 n LYS 871 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2rl5 s GLU 872 N -4.96 4.38 -0.85 1.97 2.12 -1.26 -3.91 118.70 116.19 2rl5 s GLU 872 Ca 0.58 1.83 -0.04 0.00 0.36 0.00 0.00 54.97 57.70 2rl5 s GLU 872 Cb -0.07 -3.38 -0.00 0.00 0.26 0.00 0.00 34.13 30.94 2rl5 s GLU 872 CO 0.45 -0.35 0.67 0.41 -0.54 0.00 0.00 175.26 175.90 2rl5 n GLY 873 N 3.34 -1.23 3.91 -1.50 0.00 -1.26 -4.97 105.19 103.48 2rl5 n GLY 873 Ca 0.10 0.53 -0.30 0.00 0.00 0.00 0.00 46.02 46.35 2rl5 n GLY 873 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rl5 s ALA 874 N -3.08 3.84 1.01 4.61 0.00 -1.25 -5.07 121.76 121.81 2rl5 s ALA 874 Ca 0.09 -0.72 -0.11 0.00 0.00 0.00 0.00 51.96 51.22 2rl5 s ALA 874 Cb -0.03 -2.03 0.19 0.00 0.00 0.00 0.00 23.12 21.25 2rl5 s ALA 874 CO 0.84 0.59 1.08 0.25 0.00 0.00 0.00 175.76 178.52 2rl5 n THR 875 N -0.20 0.00 0.20 0.00 -2.24 -1.26 -4.80 114.28 105.98 2rl5 n THR 875 Ca -0.04 -0.15 0.04 0.00 -2.27 0.00 0.00 64.05 61.63 2rl5 n THR 875 Cb 0.52 -0.99 0.43 0.00 -2.10 0.00 0.00 70.33 68.20 2rl5 n THR 875 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 2rl5 h HIS 876 N -2.16 0.00 -0.38 4.78 2.76 -1.99 -1.81 115.15 116.35 2rl5 h HIS 876 Ca -0.49 0.00 -0.13 0.00 -2.20 0.00 0.00 60.37 57.55 2rl5 h HIS 876 Cb 1.29 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.24 2rl5 h HIS 876 CO 0.42 0.30 -0.28 1.03 -1.30 0.00 0.00 177.93 178.10 2rl5 h SER 877 N 0.00 0.83 0.41 3.26 0.87 -2.00 -1.08 113.55 115.85 2rl5 h SER 877 Ca -0.00 -0.33 -0.14 0.00 -1.23 0.00 0.00 61.79 60.09 2rl5 h SER 877 Cb 0.56 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 2rl5 h SER 877 CO 0.04 1.06 -0.59 -0.33 -0.53 0.00 0.00 176.83 176.48 2rl5 h GLU 878 N 0.69 0.18 -0.36 2.24 5.08 -1.77 -1.89 114.58 118.75 2rl5 h GLU 878 Ca 0.08 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2rl5 h GLU 878 Cb 0.81 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 2rl5 h GLU 878 CO 0.07 0.72 -0.02 1.25 -1.00 0.00 0.00 179.01 180.02 2rl5 h HIS 879 N 0.14 0.71 -0.76 4.33 2.76 -1.00 -2.31 115.15 119.02 2rl5 h HIS 879 Ca -0.00 -0.13 -0.04 0.00 -2.20 0.00 0.00 60.37 57.99 2rl5 h HIS 879 Cb 1.08 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.82 2rl5 h HIS 879 CO 0.02 0.76 0.31 0.00 -1.30 0.00 0.00 177.93 177.72 2rl5 h ARG 880 N 0.45 1.13 -0.46 5.26 3.08 -1.08 -2.34 114.38 120.43 2rl5 h ARG 880 Ca 0.10 -0.20 0.02 0.00 0.07 0.00 0.00 59.98 59.97 2rl5 h ARG 880 Cb 0.50 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 2rl5 h ARG 880 CO 0.02 0.92 0.27 0.00 -1.07 0.00 0.00 179.97 180.11 2rl5 h ALA 881 N 1.16 0.58 -0.33 0.04 0.00 -1.08 0.15 119.26 119.77 2rl5 h ALA 881 Ca 0.25 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.00 2rl5 h ALA 881 Cb 0.21 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2rl5 h ALA 881 CO -0.02 -0.04 -0.40 1.25 0.00 0.00 0.00 179.25 180.03 2rl5 h LEU 882 N 0.54 0.86 -1.12 0.00 5.85 -1.32 -2.11 115.31 118.01 2rl5 h LEU 882 Ca 0.18 -0.40 -0.08 0.00 0.84 0.00 0.00 57.88 58.42 2rl5 h LEU 882 Cb 0.02 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 2rl5 h LEU 882 CO -0.08 1.16 -0.30 -0.03 -0.34 0.00 0.00 178.44 178.84 2rl5 h MET 883 N 0.66 0.24 -0.40 1.25 4.05 -1.14 -2.00 114.93 117.59 2rl5 h MET 883 Ca 0.05 -0.09 -0.13 0.00 -0.28 0.00 0.00 59.70 59.25 2rl5 h MET 883 Cb 0.97 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.74 2rl5 h MET 883 CO 0.09 0.52 -0.28 1.03 0.23 0.00 0.00 176.91 178.50 2rl5 h SER 884 N 0.21 0.90 -0.64 1.39 0.87 -0.50 -2.02 113.55 113.75 2rl5 h SER 884 Ca 0.03 -0.36 -0.07 0.00 -1.23 0.00 0.00 61.79 60.16 2rl5 h SER 884 Cb 0.64 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 2rl5 h SER 884 CO 0.05 1.12 0.12 -0.08 -0.53 0.00 0.00 176.83 177.51 2rl5 h GLU 885 N 0.74 1.05 -0.33 2.24 4.81 -0.86 -0.42 114.58 121.80 2rl5 h GLU 885 Ca 0.09 -0.27 -0.01 0.00 -0.13 0.00 0.00 59.36 59.04 2rl5 h GLU 885 Cb 0.84 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 2rl5 h GLU 885 CO 0.07 0.96 0.17 1.25 -0.73 0.00 0.00 179.01 180.74 2rl5 h LEU 886 N 0.96 0.42 -1.03 1.64 5.85 -1.23 -0.75 115.31 121.18 2rl5 h LEU 886 Ca 0.20 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 2rl5 h LEU 886 Cb 0.41 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2rl5 h LEU 886 CO 0.01 0.41 0.31 0.11 -0.34 0.00 0.00 178.44 178.94 2rl5 h LYS 887 N 0.41 1.00 -0.45 1.25 1.79 -1.11 -0.38 116.57 119.08 2rl5 h LYS 887 Ca 0.12 -0.15 -0.07 0.00 -2.18 0.00 0.00 60.65 58.37 2rl5 h LYS 887 Cb 0.09 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 30.54 2rl5 h LYS 887 CO -0.02 0.79 0.03 0.82 -1.08 0.00 0.00 179.45 179.99 2rl5 h ILE 888 N 0.99 1.26 -0.69 1.86 2.04 -0.73 0.59 117.51 122.84 2rl5 h ILE 888 Ca 0.24 -1.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.08 2rl5 h ILE 888 Cb 0.14 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2rl5 h ILE 888 CO -0.03 0.35 0.34 -0.07 0.00 0.00 0.00 178.15 178.74 2rl5 h LEU 889 N 0.63 0.89 -0.50 1.44 3.38 -0.66 0.57 115.31 121.06 2rl5 h LEU 889 Ca 0.13 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2rl5 h LEU 889 Cb 0.46 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2rl5 h LEU 889 CO 0.02 0.76 0.21 0.40 0.09 0.00 0.00 178.44 179.92 2rl5 h ILE 890 N 0.95 1.21 -0.51 1.22 2.04 -0.84 -2.44 117.51 119.14 2rl5 h ILE 890 Ca 0.24 -0.64 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 2rl5 h ILE 890 Cb 0.10 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2rl5 h ILE 890 CO -0.03 0.24 0.25 -0.74 0.00 0.00 0.00 178.15 177.87 2rl5 h HIS 891 N 0.67 0.74 -0.62 1.37 2.76 -0.46 -2.99 115.15 116.62 2rl5 h HIS 891 Ca 0.17 -0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.31 2rl5 h HIS 891 Cb 0.19 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 28.88 2rl5 h HIS 891 CO 0.00 0.58 0.41 0.82 -1.30 0.00 0.00 177.93 178.44 2rl5 h ILE 892 N 0.68 1.15 0.00 6.26 2.04 -0.73 -3.49 117.51 123.42 2rl5 h ILE 892 Ca 0.18 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.75 2rl5 h ILE 892 Cb 0.11 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 2rl5 h ILE 892 CO -0.02 0.15 0.00 0.61 0.00 0.00 0.00 178.15 178.89 2rl5 n GLY 893 N -1.27 -2.99 3.78 5.37 0.00 -0.93 -4.97 105.19 104.19 2rl5 n GLY 893 Ca 0.05 -1.94 -0.39 0.00 0.00 0.00 0.00 46.02 43.74 2rl5 n GLY 893 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2rl5 s HIS 894 N -0.58 3.72 -0.20 1.61 2.46 -1.26 -4.96 115.29 116.09 2rl5 s HIS 894 Ca 0.00 1.21 -0.19 0.00 0.47 0.00 0.00 55.06 56.55 2rl5 s HIS 894 Cb 0.00 -2.56 0.05 0.00 -0.13 0.00 0.00 32.58 29.94 2rl5 s HIS 894 CO 0.00 0.43 0.54 -1.58 -2.47 0.00 0.00 174.74 171.66 2rl5 s HIS 895 N -0.50 -0.59 0.48 3.88 5.04 -1.26 -5.05 115.29 117.28 2rl5 s HIS 895 Ca 0.30 1.45 0.17 0.00 -1.54 0.00 0.00 55.06 55.43 2rl5 s HIS 895 Cb -0.18 0.20 1.16 0.00 0.04 0.00 0.00 32.58 33.80 2rl5 s HIS 895 CO 0.17 -0.29 2.02 1.25 -2.34 0.00 0.00 174.74 175.56 2rl5 h LEU 896 N 5.31 0.20 -3.67 8.88 5.85 -1.97 -2.52 115.31 127.38 2rl5 h LEU 896 Ca -0.28 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.25 2rl5 h LEU 896 Cb 1.17 -0.04 -0.12 0.00 0.37 0.00 0.00 40.66 42.04 2rl5 h LEU 896 CO 0.17 0.13 0.23 0.59 -0.34 0.00 0.00 178.44 179.21 2rl5 n ASN 897 N -4.46 4.58 -3.84 1.25 4.13 -1.26 -4.75 115.26 110.92 2rl5 n ASN 897 Ca 0.07 -3.25 -0.24 0.00 1.68 0.00 0.00 54.58 52.83 2rl5 n ASN 897 Cb 0.36 -0.72 -0.17 0.00 -1.54 0.00 0.00 39.78 37.70 2rl5 n ASN 897 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2rl5 s VAL 898 N -3.01 0.66 -0.39 2.41 1.01 -0.95 -0.74 120.40 119.39 2rl5 s VAL 898 Ca 0.53 -0.07 -0.37 0.00 0.00 0.00 0.00 61.98 62.08 2rl5 s VAL 898 Cb 0.43 -0.75 -0.16 0.00 0.00 0.00 0.00 36.38 35.90 2rl5 s VAL 898 CO 0.12 0.30 1.26 0.55 0.00 0.00 0.00 175.10 177.34 2rl5 n VAL 899 N 4.98 0.00 -2.52 2.92 3.14 -0.74 -4.57 118.33 121.53 2rl5 n VAL 899 Ca -0.11 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.85 2rl5 n VAL 899 Cb 0.50 -0.39 -0.03 0.00 -1.06 0.00 0.00 33.84 32.86 2rl5 n VAL 899 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 2rl5 s ASN 900 N 2.33 7.16 -0.04 6.55 0.02 -1.26 -4.93 114.94 124.78 2rl5 s ASN 900 Ca 0.83 1.86 -0.26 0.00 -1.02 0.00 0.00 52.86 54.27 2rl5 s ASN 900 Cb -1.19 -2.57 -0.03 0.00 0.02 0.00 0.00 41.25 37.47 2rl5 s ASN 900 CO 0.65 -0.43 0.82 -0.22 0.02 0.00 0.00 177.10 177.95 2rl5 s LEU 901 N 1.26 4.34 -0.18 0.60 2.96 -1.26 -1.11 118.68 125.29 2rl5 s LEU 901 Ca 0.56 1.40 0.10 0.00 -0.22 0.00 0.00 54.13 55.97 2rl5 s LEU 901 Cb -0.26 -3.30 -0.18 0.00 0.50 0.00 0.00 46.19 42.95 2rl5 s LEU 901 CO 0.27 -0.18 -0.03 0.18 -1.32 0.00 0.00 176.35 175.27 2rl5 n LEU 902 N 3.84 1.04 0.00 -0.68 4.77 0.65 -4.92 117.00 121.69 2rl5 n LEU 902 Ca 0.02 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2rl5 n LEU 902 Cb 0.51 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2rl5 n LEU 902 CO 0.49 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.72 2rl5 n GLY 903 N 2.17 -1.31 3.38 -0.72 0.00 -1.10 -4.94 105.19 102.67 2rl5 n GLY 903 Ca -0.30 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.65 2rl5 n GLY 903 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rl5 s ALA 904 N -1.28 -1.26 -0.36 4.61 0.00 -0.20 -1.29 121.76 121.99 2rl5 s ALA 904 Ca 0.00 0.51 0.01 0.00 0.00 0.00 0.00 51.96 52.49 2rl5 s ALA 904 Cb 0.00 0.41 0.10 0.00 0.00 0.00 0.00 23.12 23.62 2rl5 s ALA 904 CO 0.00 -0.51 0.09 0.00 0.00 0.00 0.00 175.76 175.34 2rl5 n THR 906 N 4.40 0.28 -1.48 0.00 -2.24 -1.26 -1.62 114.28 112.36 2rl5 n THR 906 Ca 0.00 -0.23 -0.32 0.00 -2.27 0.00 0.00 64.05 61.22 2rl5 n THR 906 Cb 0.42 -0.39 0.08 0.00 -2.10 0.00 0.00 70.33 68.33 2rl5 n THR 906 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2rl5 s LYS 907 N -2.28 2.40 0.64 -0.78 1.02 -1.26 -4.91 119.74 114.57 2rl5 s LYS 907 Ca -0.03 1.39 -0.17 0.00 0.02 0.00 0.00 55.97 57.18 2rl5 s LYS 907 Cb 0.03 -1.90 -0.06 0.00 -0.52 0.00 0.00 37.83 35.38 2rl5 s LYS 907 CO 0.28 -1.56 0.63 -2.30 -0.92 0.00 0.00 175.35 171.47 2rl5 n PRO 908 N -2.94 0.50 0.00 -1.68 -0.02 -1.26 -4.07 135.00 125.54 2rl5 n PRO 908 Ca 0.10 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 2rl5 n PRO 908 Cb 0.52 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2rl5 n PRO 908 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rl5 n GLY 909 N 1.62 0.85 0.85 -1.23 0.00 -1.26 -5.07 105.19 100.94 2rl5 n GLY 909 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.12 2rl5 n GLY 909 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rl5 n GLY 910 N 0.00 1.80 3.82 -0.02 0.00 -1.26 -5.16 105.19 104.37 2rl5 n GLY 910 Ca 0.00 -1.08 -0.31 0.00 0.00 0.00 0.00 46.02 44.63 2rl5 n GLY 910 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2rl5 s PRO 911 N -2.03 2.83 0.07 1.61 0.04 -1.26 -4.95 135.00 131.31 2rl5 s PRO 911 Ca 0.04 0.92 -0.31 0.00 0.04 0.00 0.00 61.00 61.69 2rl5 s PRO 911 Cb -0.01 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.49 2rl5 s PRO 911 CO 0.03 -1.17 1.30 -1.17 0.04 0.00 0.00 177.00 176.03 2rl5 s LEU 912 N -5.58 4.36 -0.04 -3.56 2.96 -1.26 -4.74 118.68 110.83 2rl5 s LEU 912 Ca 0.58 2.13 0.01 0.00 -0.22 0.00 0.00 54.13 56.64 2rl5 s LEU 912 Cb -0.14 -3.58 0.02 0.00 0.50 0.00 0.00 46.19 42.99 2rl5 s LEU 912 CO 0.55 -0.58 -0.03 -0.04 -1.32 0.00 0.00 176.35 174.93 2rl5 s MET 913 N 1.34 0.62 -0.22 1.98 -1.94 -0.64 -3.61 119.30 116.83 2rl5 s MET 913 Ca 0.61 -0.05 -0.07 0.00 -1.71 0.00 0.00 55.69 54.48 2rl5 s MET 913 Cb -0.32 -0.69 -0.03 0.00 2.01 0.00 0.00 34.83 35.80 2rl5 s MET 913 CO 0.29 -0.09 0.05 0.08 -0.01 0.00 0.00 175.02 175.34 2rl5 s VAL 914 N 0.89 4.38 -0.18 -6.03 1.01 0.45 -1.16 120.40 119.77 2rl5 s VAL 914 Ca -0.11 -0.16 -0.03 0.00 0.00 0.00 0.00 61.98 61.68 2rl5 s VAL 914 Cb -0.14 -3.01 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 2rl5 s VAL 914 CO -0.00 0.39 -0.05 -0.63 0.00 0.00 0.00 175.10 174.81 2rl5 s ILE 915 N 1.09 3.58 0.37 2.22 1.01 -0.41 -0.37 121.20 128.69 2rl5 s ILE 915 Ca 0.04 -0.45 0.04 0.00 0.00 0.00 0.00 60.65 60.28 2rl5 s ILE 915 Cb -0.14 -2.58 -0.06 0.00 0.01 0.00 0.00 42.46 39.69 2rl5 s ILE 915 CO 0.03 0.47 0.05 0.42 0.00 0.00 0.00 174.94 175.90 2rl5 s THR 916 N 0.81 1.31 0.85 2.92 -4.23 -0.25 -0.25 115.64 116.79 2rl5 s THR 916 Ca -0.02 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.39 2rl5 s THR 916 Cb -0.15 -2.73 0.10 0.00 1.34 0.00 0.00 72.50 71.07 2rl5 s THR 916 CO 0.02 0.00 1.10 -1.83 -0.54 0.00 0.00 174.62 173.36 2rl5 s GLU 917 N -3.82 1.62 -0.14 3.99 -1.05 -0.27 -1.64 118.70 117.39 2rl5 s GLU 917 Ca 0.32 1.12 -0.07 0.00 -0.15 0.00 0.00 54.97 56.19 2rl5 s GLU 917 Cb 0.08 -1.83 -0.04 0.00 -0.44 0.00 0.00 34.13 31.90 2rl5 s GLU 917 CO 0.15 -2.07 0.09 0.12 0.95 0.00 0.00 175.26 174.50 2rl5 s PHE 918 N -2.85 3.40 -0.54 4.83 5.36 -1.25 -4.07 117.98 122.85 2rl5 s PHE 918 Ca 0.63 0.32 -0.04 0.00 -0.96 0.00 0.00 56.93 56.88 2rl5 s PHE 918 Cb -0.19 -1.98 0.14 0.00 -0.34 0.00 0.00 43.02 40.65 2rl5 s PHE 918 CO 0.57 0.47 0.37 0.00 -1.46 0.00 0.00 175.22 175.17 2rl5 n LYS 920 N 4.06 -0.06 0.00 0.00 4.81 -1.25 -1.87 118.16 123.86 2rl5 n LYS 920 Ca 0.03 1.12 0.14 0.00 -0.87 0.00 0.00 58.31 58.72 2rl5 n LYS 920 Cb 0.40 -1.75 0.47 0.00 0.02 0.00 0.00 35.03 34.17 2rl5 n LYS 920 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2rl5 n PHE 921 N -5.06 0.00 -4.18 5.64 3.01 -0.51 -5.06 117.46 111.30 2rl5 n PHE 921 Ca 0.16 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.62 2rl5 n PHE 921 Cb 0.52 -0.08 0.00 0.00 -0.01 0.00 0.00 39.48 39.91 2rl5 n PHE 921 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2rl5 n GLY 922 N 1.26 -1.07 3.77 1.37 0.00 -0.78 -4.74 105.19 105.00 2rl5 n GLY 922 Ca 0.15 -1.22 -0.40 0.00 0.00 0.00 0.00 46.02 44.54 2rl5 n GLY 922 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rl5 s ASN 923 N -4.00 6.55 0.33 1.61 2.20 -1.26 -0.77 114.94 119.60 2rl5 s ASN 923 Ca 0.00 2.75 0.00 0.00 -0.94 0.00 0.00 52.86 54.68 2rl5 s ASN 923 Cb 0.00 -2.65 0.55 0.00 -2.00 0.00 0.00 41.25 37.15 2rl5 s ASN 923 CO 0.00 -0.69 1.98 0.25 -2.94 0.00 0.00 177.10 175.70 2rl5 h LEU 924 N 3.10 0.81 0.52 3.54 5.85 0.43 -2.63 115.31 126.94 2rl5 h LEU 924 Ca -0.50 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.18 2rl5 h LEU 924 Cb 1.23 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 2rl5 h LEU 924 CO 0.64 0.60 -0.31 -1.28 -0.34 0.00 0.00 178.44 177.75 2rl5 h SER 925 N 0.95 -0.77 -0.81 1.25 0.87 -1.79 0.30 113.55 113.55 2rl5 h SER 925 Ca 0.25 0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.87 2rl5 h SER 925 Cb -0.08 0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 62.06 2rl5 h SER 925 CO -0.05 -0.49 0.54 0.74 -0.53 0.00 0.00 176.83 177.03 2rl5 h THR 926 N -0.79 1.20 0.29 2.23 2.02 -1.88 -2.58 112.91 113.40 2rl5 h THR 926 Ca -0.06 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 2rl5 h THR 926 Cb 0.64 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 2rl5 h THR 926 CO 0.07 0.20 -0.15 0.22 0.37 0.00 0.00 175.52 176.23 2rl5 h TYR 927 N 1.09 -0.39 -0.58 3.16 3.20 -1.25 -2.82 116.97 119.39 2rl5 h TYR 927 Ca 0.30 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.24 2rl5 h TYR 927 Cb -0.12 0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.23 2rl5 h TYR 927 CO -0.02 -0.24 0.26 -0.07 -1.64 0.00 0.00 178.16 176.45 2rl5 h LEU 928 N -0.41 0.31 -2.35 2.82 3.38 -0.77 0.46 115.31 118.76 2rl5 h LEU 928 Ca -0.04 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.02 2rl5 h LEU 928 Cb 0.32 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 2rl5 h LEU 928 CO 0.05 0.20 0.13 0.03 0.09 0.00 0.00 178.44 178.94 2rl5 h ARG 929 N 0.47 0.00 -0.00 1.13 3.08 -1.30 0.21 114.38 117.97 2rl5 h ARG 929 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 2rl5 h ARG 929 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2rl5 h ARG 929 CO -0.24 0.00 -0.01 -1.13 -1.07 0.00 0.00 179.97 177.52 2rl5 n SER 930 N -3.74 0.04 -0.50 7.04 3.41 0.15 -3.35 113.62 116.67 2rl5 n SER 930 Ca -0.00 -0.61 0.06 0.00 -0.26 0.00 0.00 58.87 58.05 2rl5 n SER 930 Cb 0.23 -0.13 0.14 0.00 -0.26 0.00 0.00 64.21 64.19 2rl5 n SER 930 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2rl5 n LYS 931 N -1.11 2.74 -0.29 4.33 4.76 0.73 -4.72 118.16 124.60 2rl5 n LYS 931 Ca 0.19 -2.18 0.17 0.00 -2.87 0.00 0.00 58.31 53.62 2rl5 n LYS 931 Cb 0.18 -1.38 0.43 0.00 -1.84 0.00 0.00 35.03 32.43 2rl5 n LYS 931 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2rl5 h ARG 932 N 1.32 0.54 -0.73 1.97 2.47 -1.58 0.92 114.38 119.29 2rl5 h ARG 932 Ca 0.00 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 2rl5 h ARG 932 Cb 0.88 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 29.08 2rl5 h ARG 932 CO 0.05 0.36 0.00 0.09 0.56 0.00 0.00 179.97 181.03 2rl5 n ASN 933 N -4.60 3.91 -2.86 7.04 5.03 -1.26 -4.39 115.26 118.12 2rl5 n ASN 933 Ca 0.21 -2.00 -0.21 0.00 0.87 0.00 0.00 54.58 53.44 2rl5 n ASN 933 Cb 0.64 -0.49 -0.02 0.00 -1.02 0.00 0.00 39.78 38.90 2rl5 n ASN 933 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2rl5 n GLU 934 N 1.64 2.30 -3.81 3.52 1.02 0.31 -5.05 120.64 120.57 2rl5 n GLU 934 Ca 0.24 -4.10 -0.13 0.00 -0.02 0.00 0.00 57.16 53.16 2rl5 n GLU 934 Cb 0.62 -1.92 -0.13 0.00 -0.02 0.00 0.00 31.44 29.99 2rl5 n GLU 934 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2rl5 s PHE 935 N -3.14 -0.18 -0.15 -0.32 2.19 -1.23 -0.81 117.98 114.34 2rl5 s PHE 935 Ca 0.43 0.44 -0.14 0.00 0.33 0.00 0.00 56.93 57.98 2rl5 s PHE 935 Cb 0.36 0.05 0.04 0.00 -1.31 0.00 0.00 43.02 42.15 2rl5 s PHE 935 CO -0.10 -0.09 0.41 0.14 1.83 0.00 0.00 175.22 177.40 2rl5 s VAL 936 N 0.19 -0.00 0.20 3.12 -7.23 -0.83 -4.96 120.40 110.90 2rl5 s VAL 936 Ca -0.01 0.00 -0.11 0.00 -1.81 0.00 0.00 61.98 60.05 2rl5 s VAL 936 Cb -0.02 -0.57 0.15 0.00 0.56 0.00 0.00 36.38 36.50 2rl5 s VAL 936 CO -0.00 0.00 1.70 -0.65 -0.31 0.00 0.00 175.10 175.83 2rl5 h PRO 937 N 5.52 0.20 -3.72 4.82 0.11 -1.94 -3.34 132.00 133.65 2rl5 h PRO 937 Ca -0.27 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.63 2rl5 h PRO 937 Cb 1.18 -0.04 -0.25 0.00 0.11 0.00 0.00 31.00 32.00 2rl5 h PRO 937 CO 0.25 0.13 -0.66 0.71 -0.21 0.00 0.00 178.00 178.22 2rl5 s TYR 938 N -6.13 0.06 0.51 0.65 1.51 -1.26 -2.11 117.35 110.57 2rl5 s TYR 938 Ca -0.13 -0.11 -0.17 0.00 -1.01 0.00 0.00 57.07 55.65 2rl5 s TYR 938 Cb 0.17 -0.05 -0.08 0.00 -0.11 0.00 0.00 41.96 41.89 2rl5 s TYR 938 CO 0.73 -0.10 0.99 0.15 -1.11 0.00 0.00 175.55 176.21 2rl5 s LYS 939 N -0.58 3.94 -0.05 -0.62 1.02 -1.26 -5.06 119.74 117.14 2rl5 s LYS 939 Ca -0.06 1.01 0.05 0.00 0.02 0.00 0.00 55.97 56.98 2rl5 s LYS 939 Cb -0.04 -2.13 -0.00 0.00 -0.52 0.00 0.00 37.83 35.13 2rl5 s LYS 939 CO -0.00 -0.28 -0.19 0.08 -0.92 0.00 0.00 175.35 174.05 2rl5 s VAL 990 N -2.52 1.56 0.34 3.17 1.01 -1.26 -5.03 120.40 117.67 2rl5 s VAL 990 Ca 0.60 -0.79 -0.29 0.00 0.00 0.00 0.00 61.98 61.51 2rl5 s VAL 990 Cb -0.10 -1.34 -0.11 0.00 0.00 0.00 0.00 36.38 34.83 2rl5 s VAL 990 CO 0.28 0.45 1.42 0.00 0.00 0.00 0.00 175.10 177.25 2rl5 s ALA 991 N 0.04 3.56 -0.10 5.51 0.00 -1.26 -3.29 121.76 126.22 2rl5 s ALA 991 Ca -0.05 1.43 -0.30 0.00 0.00 0.00 0.00 51.96 53.04 2rl5 s ALA 991 Cb -0.12 -3.56 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 2rl5 s ALA 991 CO 0.03 -0.86 1.30 -1.25 0.00 0.00 0.00 175.76 174.98 2rl5 s PRO 992 N -1.72 4.27 0.09 0.00 0.04 -1.26 -5.09 135.00 131.33 2rl5 s PRO 992 Ca 0.52 1.76 0.13 0.00 0.04 0.00 0.00 61.00 63.45 2rl5 s PRO 992 Cb -0.43 -3.70 0.58 0.00 0.04 0.00 0.00 34.50 30.98 2rl5 s PRO 992 CO 0.56 -0.63 1.40 0.39 0.04 0.00 0.00 177.00 178.76 2rl5 n GLU 993 N 6.11 0.05 0.15 4.56 4.71 -1.21 -2.73 120.64 132.28 2rl5 n GLU 993 Ca 0.13 0.40 0.11 0.00 -0.01 0.00 0.00 57.16 57.80 2rl5 n GLU 993 Cb 0.45 -1.63 0.54 0.00 -1.01 0.00 0.00 31.44 29.79 2rl5 n GLU 993 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 2rl5 n ASP 994 N -1.73 0.61 0.10 1.62 5.68 -1.26 -0.94 116.55 120.62 2rl5 n ASP 994 Ca 0.02 0.71 0.12 0.00 -0.50 0.00 0.00 54.79 55.14 2rl5 n ASP 994 Cb 0.12 -0.82 0.45 0.00 -1.14 0.00 0.00 41.12 39.73 2rl5 n ASP 994 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2rl5 n LEU 995 N -2.24 0.60 -1.62 -2.12 4.77 -1.11 -3.06 117.00 112.23 2rl5 n LEU 995 Ca 0.00 0.61 -0.08 0.00 -0.03 0.00 0.00 56.01 56.51 2rl5 n LEU 995 Cb 0.13 -0.48 0.09 0.00 -2.33 0.00 0.00 43.42 40.83 2rl5 n LEU 995 CO 0.14 -0.36 0.20 -1.22 -1.33 0.00 0.00 177.39 174.82 2rl5 n TYR 996 N -2.12 1.32 -1.68 -1.77 4.01 -0.12 -5.05 117.16 111.75 2rl5 n TYR 996 Ca 0.04 -1.78 -0.46 0.00 -0.16 0.00 0.00 57.90 55.54 2rl5 n TYR 996 Cb 0.30 -0.27 -0.04 0.00 -0.31 0.00 0.00 39.34 39.02 2rl5 n TYR 996 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2rl5 n LYS 997 N -0.69 2.31 -0.98 -0.72 4.81 -1.17 -1.58 118.16 120.13 2rl5 n LYS 997 Ca 0.26 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.54 2rl5 n LYS 997 Cb 0.88 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 33.26 2rl5 n LYS 997 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2rl5 n ASP 998 N 5.01 -5.06 -4.76 3.14 8.00 -1.26 -4.98 116.55 116.64 2rl5 n ASP 998 Ca 0.19 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.36 2rl5 n ASP 998 Cb 0.31 -2.73 0.05 0.00 -0.02 0.00 0.00 41.12 38.73 2rl5 n ASP 998 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2rl5 s PHE 999 N -1.26 2.54 0.31 1.24 0.40 -0.62 -5.03 117.98 115.56 2rl5 s PHE 999 Ca 0.00 1.56 -0.06 0.00 -0.60 0.00 0.00 56.93 57.83 2rl5 s PHE 999 Cb 0.00 -3.23 -0.05 0.00 0.51 0.00 0.00 43.02 40.25 2rl5 s PHE 999 CO 0.00 -1.81 0.59 -0.51 0.70 0.00 0.00 175.22 174.19 2rl5 s LEU 1000N -4.76 4.02 0.22 -0.37 1.43 0.01 -4.97 118.68 114.26 2rl5 s LEU 1000Ca 0.69 0.79 -0.00 0.00 -1.03 0.00 0.00 54.13 54.58 2rl5 s LEU 1000Cb -0.22 -3.62 -0.04 0.00 0.03 0.00 0.00 46.19 42.33 2rl5 s LEU 1000CO 0.40 -0.23 0.12 0.42 0.23 0.00 0.00 176.35 177.29 2rl5 s THR 1001N -2.13 0.15 0.38 5.49 -4.23 -1.26 -1.96 115.64 112.08 2rl5 s THR 1001Ca 0.45 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 59.07 2rl5 s THR 1001Cb -0.11 -2.54 0.33 0.00 1.34 0.00 0.00 72.50 71.53 2rl5 s THR 1001CO 0.30 0.00 1.89 -0.07 -0.54 0.00 0.00 174.62 176.20 2rl5 h LEU 1002N 2.55 0.58 -1.11 4.79 3.38 -1.54 0.83 115.31 124.79 2rl5 h LEU 1002Ca -0.37 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 2rl5 h LEU 1002Cb 1.25 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.88 2rl5 h LEU 1002CO 0.55 0.30 0.52 -0.08 0.09 0.00 0.00 178.44 179.82 2rl5 h GLU 1003N 0.62 1.12 0.44 1.13 4.81 -1.93 -0.23 114.58 120.54 2rl5 h GLU 1003Ca 0.42 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 59.54 2rl5 h GLU 1003Cb 0.74 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2rl5 h GLU 1003CO -0.18 0.77 -0.21 0.45 -0.73 0.00 0.00 179.01 179.11 2rl5 h HIS 1004N 1.14 -0.55 -0.74 0.92 3.86 -1.24 -0.44 115.15 118.11 2rl5 h HIS 1004Ca 0.30 -0.01 0.07 0.00 -1.16 0.00 0.00 60.37 59.57 2rl5 h HIS 1004Cb -0.07 0.18 -0.06 0.00 1.06 0.00 0.00 27.41 28.52 2rl5 h HIS 1004CO 0.00 -0.26 0.41 -0.07 0.86 0.00 0.00 177.93 178.88 2rl5 h LEU 1005N -0.78 0.60 -0.69 2.43 3.38 -1.19 -0.13 115.31 118.92 2rl5 h LEU 1005Ca -0.06 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 2rl5 h LEU 1005Cb 0.54 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2rl5 h LEU 1005CO 0.10 0.37 -0.27 0.40 0.09 0.00 0.00 178.44 179.13 2rl5 h ILE 1006N 0.73 1.28 -0.56 1.22 2.04 -1.03 -2.12 117.51 119.06 2rl5 h ILE 1006Ca 0.34 -1.39 -0.02 0.00 1.00 0.00 0.00 64.86 64.79 2rl5 h ILE 1006Cb 0.25 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 2rl5 h ILE 1006CO -0.21 0.46 0.27 0.00 0.00 0.00 0.00 178.15 178.67 2rl5 h TYR 1008N 0.76 0.61 -0.74 0.00 0.05 -0.92 -0.21 116.97 116.53 2rl5 h TYR 1008Ca 0.19 -0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.95 2rl5 h TYR 1008Cb 0.12 -0.19 -0.04 0.00 1.01 0.00 0.00 36.73 37.64 2rl5 h TYR 1008CO -0.00 0.51 0.49 0.77 -1.05 0.00 0.00 178.16 178.87 2rl5 h SER 1009N 0.53 0.84 -0.71 3.88 0.02 -1.11 -1.58 113.55 115.42 2rl5 h SER 1009Ca 0.14 -0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 61.00 2rl5 h SER 1009Cb 0.13 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.43 2rl5 h SER 1009CO -0.02 0.61 0.18 0.15 -1.14 0.00 0.00 176.83 176.61 2rl5 h PHE 1010N 1.00 1.19 -0.33 3.45 3.57 -0.64 -2.17 116.94 123.01 2rl5 h PHE 1010Ca 0.27 -0.14 -0.15 0.00 3.53 0.00 0.00 57.97 61.48 2rl5 h PHE 1010Cb -0.11 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.28 2rl5 h PHE 1010CO -0.02 0.96 -0.38 1.96 -2.23 0.00 0.00 178.31 178.60 2rl5 h GLN 1011N 1.08 0.78 -0.39 1.11 4.20 -0.58 -2.24 115.11 119.07 2rl5 h GLN 1011Ca 0.23 -0.40 -0.14 0.00 0.06 0.00 0.00 58.65 58.40 2rl5 h GLN 1011Cb 0.37 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2rl5 h GLN 1011CO 0.00 1.03 -0.30 0.28 -0.67 0.00 0.00 178.83 179.16 2rl5 h VAL 1012N 0.64 1.28 -0.74 -0.54 2.07 -1.22 -1.48 116.25 116.26 2rl5 h VAL 1012Ca 0.06 -1.46 0.01 0.00 0.82 0.00 0.00 66.70 66.13 2rl5 h VAL 1012Cb 0.93 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.96 2rl5 h VAL 1012CO 0.09 0.49 0.49 0.00 0.02 0.00 0.00 177.57 178.65 2rl5 h ALA 1013N 0.93 0.95 -0.10 1.67 0.00 -1.29 0.11 119.26 121.52 2rl5 h ALA 1013Ca 0.08 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2rl5 h ALA 1013Cb 0.86 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2rl5 h ALA 1013CO 0.08 0.34 -0.34 0.87 0.00 0.00 0.00 179.25 180.19 2rl5 h LYS 1014N 0.99 0.19 -0.19 0.00 1.57 -1.14 0.16 116.57 118.16 2rl5 h LYS 1014Ca 0.28 -0.08 -0.12 0.00 -1.87 0.00 0.00 60.65 58.86 2rl5 h LYS 1014Cb -0.09 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 2rl5 h LYS 1014CO -0.07 0.52 -0.33 0.78 -0.57 0.00 0.00 179.45 179.78 2rl5 h GLY 1015N 1.11 0.62 1.36 3.86 0.00 -0.42 -2.19 103.07 107.41 2rl5 h GLY 1015Ca 0.02 -0.71 -0.11 0.00 0.00 0.00 0.00 47.33 46.53 2rl5 h GLY 1015CO 0.05 0.64 -0.19 -0.33 0.00 0.00 0.00 176.54 176.71 2rl5 h MET 1016N 0.23 0.75 -0.73 4.80 2.86 -0.59 -0.87 114.93 121.37 2rl5 h MET 1016Ca 0.01 -0.28 0.01 0.00 -2.06 0.00 0.00 59.70 57.38 2rl5 h MET 1016Cb 0.92 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.50 2rl5 h MET 1016CO 0.08 0.88 0.48 1.49 1.06 0.00 0.00 176.91 180.89 2rl5 h GLU 1017N 0.66 0.97 -0.12 1.72 4.81 -0.62 -0.16 114.58 121.84 2rl5 h GLU 1017Ca 0.10 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 2rl5 h GLU 1017Cb 0.68 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 2rl5 h GLU 1017CO 0.05 0.65 -0.04 0.35 -0.73 0.00 0.00 179.01 179.29 2rl5 h PHE 1018N 0.99 0.26 -0.56 0.92 3.57 -0.72 -2.29 116.94 119.13 2rl5 h PHE 1018Ca 0.27 -0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.74 2rl5 h PHE 1018Cb -0.10 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.53 2rl5 h PHE 1018CO 0.00 0.55 0.32 -0.07 -2.23 0.00 0.00 178.31 176.88 2rl5 h LEU 1019N -0.10 0.50 -0.71 0.59 3.38 -0.75 -1.74 115.31 116.47 2rl5 h LEU 1019Ca 0.03 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.09 2rl5 h LEU 1019Cb 0.47 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.07 2rl5 h LEU 1019CO 0.01 0.34 0.38 0.00 0.09 0.00 0.00 178.44 179.27 2rl5 h ALA 1020N 1.27 0.98 0.00 1.53 0.00 -0.97 0.16 119.26 122.23 2rl5 h ALA 1020Ca 0.23 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2rl5 h ALA 1020Cb 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2rl5 h ALA 1020CO -0.12 0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.01 2rl5 n SER 1021N -4.81 0.00 -0.99 0.00 3.41 -0.69 -0.23 113.62 110.31 2rl5 n SER 1021Ca 0.10 0.40 0.09 0.00 -0.26 0.00 0.00 58.87 59.21 2rl5 n SER 1021Cb 0.24 -0.44 0.21 0.00 -0.26 0.00 0.00 64.21 63.95 2rl5 n SER 1021CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2rl5 n ARG 1022N -1.44 2.49 -2.73 4.33 5.12 0.51 -4.95 116.66 119.98 2rl5 n ARG 1022Ca 0.03 -2.22 -0.21 0.00 -1.93 0.00 0.00 57.85 53.53 2rl5 n ARG 1022Cb 0.11 -1.42 0.02 0.00 -1.16 0.00 0.00 32.46 30.00 2rl5 n ARG 1022CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2rl5 n LYS 1023N 1.15 -3.42 -4.75 5.56 5.02 0.68 -4.99 118.16 117.41 2rl5 n LYS 1023Ca 0.17 0.90 -0.33 0.00 -2.02 0.00 0.00 58.31 57.04 2rl5 n LYS 1023Cb 0.52 -5.60 -0.12 0.00 -0.02 0.00 0.00 35.03 29.81 2rl5 n LYS 1023CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2rl5 s ILE 1025N -0.80 3.57 0.04 0.00 1.01 -1.26 -3.99 121.20 119.77 2rl5 s ILE 1025Ca 0.13 -0.45 -0.23 0.00 0.00 0.00 0.00 60.65 60.09 2rl5 s ILE 1025Cb -0.11 -2.59 -0.16 0.00 0.01 0.00 0.00 42.46 39.61 2rl5 s ILE 1025CO 0.02 0.46 1.51 -0.74 0.00 0.00 0.00 174.94 176.18 2rl5 h HIS 1026N 7.40 0.08 0.00 3.97 -0.00 -1.97 -3.47 115.15 121.16 2rl5 h HIS 1026Ca -0.35 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.01 2rl5 h HIS 1026Cb 1.18 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.57 2rl5 h HIS 1026CO 0.56 0.30 0.00 0.54 -0.00 0.00 0.00 177.93 179.34 2rl5 n ARG 1027N -4.92 0.00 -2.80 5.26 1.74 -1.26 -4.78 116.66 109.90 2rl5 n ARG 1027Ca -0.07 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.91 2rl5 n ARG 1027Cb 0.15 -1.11 0.04 0.00 -1.02 0.00 0.00 32.46 30.53 2rl5 n ARG 1027CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2rl5 n ASP 1028N 0.00 0.08 -4.62 0.55 2.03 -1.26 -5.04 116.55 108.29 2rl5 n ASP 1028Ca 0.00 -2.84 -0.43 0.00 0.52 0.00 0.00 54.79 52.04 2rl5 n ASP 1028Cb 0.00 0.10 -0.02 0.00 -0.72 0.00 0.00 41.12 40.48 2rl5 n ASP 1028CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2rl5 s LEU 1029N -2.88 3.82 0.17 -2.67 2.96 -1.26 -4.83 118.68 113.98 2rl5 s LEU 1029Ca 0.28 1.27 -0.14 0.00 -0.22 0.00 0.00 54.13 55.33 2rl5 s LEU 1029Cb 0.40 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.57 2rl5 s LEU 1029CO -0.03 -1.23 0.40 0.00 -1.32 0.00 0.00 176.35 174.18 2rl5 s ALA 1030N 4.93 -0.55 0.44 5.97 0.00 -1.26 -4.65 121.76 126.64 2rl5 s ALA 1030Ca 0.63 -0.47 0.21 0.00 0.00 0.00 0.00 51.96 52.32 2rl5 s ALA 1030Cb -0.19 0.82 1.22 0.00 0.00 0.00 0.00 23.12 24.97 2rl5 s ALA 1030CO 0.27 -0.71 2.03 0.00 0.00 0.00 0.00 175.76 177.35 2rl5 h ALA 1031N 2.37 1.49 0.00 0.00 0.00 -1.93 -1.46 119.26 119.74 2rl5 h ALA 1031Ca -0.31 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2rl5 h ALA 1031Cb 1.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2rl5 h ALA 1031CO 0.43 0.20 0.00 0.07 0.00 0.00 0.00 179.25 179.95 2rl5 h ARG 1032N 0.00 0.00 -0.42 0.00 0.11 -1.95 -2.32 114.38 109.81 2rl5 h ARG 1032Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2rl5 h ARG 1032Cb 0.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.41 2rl5 h ARG 1032CO 0.02 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.18 2rl5 n ASN 1033N -2.52 4.83 -4.27 0.08 3.02 -0.55 -4.79 115.26 111.07 2rl5 n ASN 1033Ca 0.01 -2.98 -0.33 0.00 -0.03 0.00 0.00 54.58 51.26 2rl5 n ASN 1033Cb 0.23 -0.62 -0.16 0.00 -0.61 0.00 0.00 39.78 38.63 2rl5 n ASN 1033CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2rl5 s ILE 1034N -2.80 2.56 -0.05 2.41 -1.09 -0.88 -0.92 121.20 120.43 2rl5 s ILE 1034Ca 0.49 -0.82 -0.01 0.00 -2.23 0.00 0.00 60.65 58.08 2rl5 s ILE 1034Cb 0.38 -2.05 -0.03 0.00 -1.58 0.00 0.00 42.46 39.17 2rl5 s ILE 1034CO 0.12 0.53 0.02 -0.76 -1.23 0.00 0.00 174.94 173.62 2rl5 s LEU 1035N 0.62 3.62 -0.25 2.97 1.43 0.61 0.77 118.68 128.45 2rl5 s LEU 1035Ca -0.10 0.10 -0.06 0.00 -1.03 0.00 0.00 54.13 53.04 2rl5 s LEU 1035Cb -0.16 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.09 2rl5 s LEU 1035CO 0.03 0.33 0.05 -0.22 0.23 0.00 0.00 176.35 176.77 2rl5 s LEU 1036N -1.24 3.38 0.00 1.79 2.96 0.05 0.13 118.68 125.76 2rl5 s LEU 1036Ca 0.17 -0.32 0.00 0.00 -0.22 0.00 0.00 54.13 53.75 2rl5 s LEU 1036Cb -0.11 -1.88 0.00 0.00 0.50 0.00 0.00 46.19 44.70 2rl5 s LEU 1036CO 0.07 -0.06 0.00 -1.20 -1.32 0.00 0.00 176.35 173.84 2rl5 n SER 1037N 4.89 0.00 -4.89 3.68 7.64 0.21 -1.42 113.62 123.72 2rl5 n SER 1037Ca -0.16 -0.17 -0.29 0.00 1.01 0.00 0.00 58.87 59.25 2rl5 n SER 1037Cb 0.51 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.76 2rl5 n SER 1037CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2rl5 s GLU 1038N 1.52 2.76 -1.43 1.43 2.02 -1.26 -4.06 118.70 119.67 2rl5 s GLU 1038Ca 0.00 0.32 -0.07 0.00 0.02 0.00 0.00 54.97 55.24 2rl5 s GLU 1038Cb 0.00 -2.06 0.04 0.00 0.10 0.00 0.00 34.13 32.21 2rl5 s GLU 1038CO 0.00 -1.04 0.61 1.63 0.02 0.00 0.00 175.26 176.48 2rl5 n LYS 1039N -2.96 -4.44 -3.57 1.61 5.02 -1.26 -2.56 118.16 110.00 2rl5 n LYS 1039Ca 0.07 0.70 -0.26 0.00 -2.02 0.00 0.00 58.31 56.79 2rl5 n LYS 1039Cb 0.58 -5.51 0.02 0.00 -0.02 0.00 0.00 35.03 30.10 2rl5 n LYS 1039CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2rl5 n ASN 1040N -2.47 -4.86 -4.60 4.39 3.02 -1.26 -4.97 115.26 104.51 2rl5 n ASN 1040Ca -0.06 -0.56 -0.36 0.00 -0.03 0.00 0.00 54.58 53.58 2rl5 n ASN 1040Cb 0.58 -3.92 -0.10 0.00 -0.61 0.00 0.00 39.78 35.73 2rl5 n ASN 1040CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2rl5 s VAL 1041N -3.17 4.88 0.02 2.41 1.01 -1.06 -4.89 120.40 119.60 2rl5 s VAL 1041Ca 0.52 0.01 -0.00 0.00 0.00 0.00 0.00 61.98 62.51 2rl5 s VAL 1041Cb -0.26 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 2rl5 s VAL 1041CO 0.64 0.40 0.13 0.68 0.00 0.00 0.00 175.10 176.94 2rl5 s VAL 1042N 0.85 4.96 -0.05 2.92 -7.23 -1.26 -0.62 120.40 119.96 2rl5 s VAL 1042Ca 0.05 -0.43 0.04 0.00 -1.81 0.00 0.00 61.98 59.83 2rl5 s VAL 1042Cb -0.13 -3.33 -0.00 0.00 0.56 0.00 0.00 36.38 33.47 2rl5 s VAL 1042CO 0.02 0.26 -0.17 -0.54 -0.31 0.00 0.00 175.10 174.37 2rl5 s LYS 1043N -2.05 1.84 0.13 4.82 3.01 0.12 -4.41 119.74 123.20 2rl5 s LYS 1043Ca 0.27 -0.60 -0.30 0.00 -1.01 0.00 0.00 55.97 54.34 2rl5 s LYS 1043Cb -0.12 -1.57 -0.06 0.00 -1.01 0.00 0.00 37.83 35.07 2rl5 s LYS 1043CO 0.19 0.21 0.97 0.42 0.51 0.00 0.00 175.35 177.65 2rl5 s ILE 1044N 0.14 4.40 0.19 2.17 1.01 0.08 -0.29 121.20 128.90 2rl5 s ILE 1044Ca -0.06 2.05 0.01 0.00 0.00 0.00 0.00 60.65 62.64 2rl5 s ILE 1044Cb -0.12 -4.31 -0.00 0.00 0.01 0.00 0.00 42.46 38.04 2rl5 s ILE 1044CO 0.03 0.34 0.22 0.00 0.00 0.00 0.00 174.94 175.53 2rl5 s ASP 1046N -2.21 0.50 0.04 0.00 3.68 -1.26 -4.73 116.67 112.70 2rl5 s ASP 1046Ca 0.18 0.27 0.28 0.00 2.13 0.00 0.00 52.55 55.41 2rl5 s ASP 1046Cb 0.00 0.88 1.14 0.00 -1.45 0.00 0.00 42.92 43.49 2rl5 s ASP 1046CO 0.13 -0.29 1.89 0.49 0.13 0.00 0.00 175.17 177.52 2rl5 n PHE 1047N 5.35 0.20 -2.54 -5.34 3.01 -1.26 -4.96 117.46 111.92 2rl5 n PHE 1047Ca -0.05 0.06 -0.08 0.00 1.01 0.00 0.00 57.45 58.38 2rl5 n PHE 1047Cb 0.50 -0.59 0.04 0.00 -0.01 0.00 0.00 39.48 39.42 2rl5 n PHE 1047CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2rl5 n GLY 1048N 1.46 -0.14 0.00 1.37 0.00 -1.26 -5.04 105.19 101.58 2rl5 n GLY 1048Ca 0.07 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2rl5 n GLY 1048CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2rl5 n LEU 1049N -2.50 0.00 0.00 0.99 4.77 -1.26 -5.10 117.00 113.89 2rl5 n LEU 1049Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 2rl5 n LEU 1049Cb 0.57 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 2rl5 n LEU 1049CO 0.32 0.00 0.00 -0.90 -1.33 0.00 0.00 177.39 175.48 2rl5 n ASP 1064N 0.00 0.00 0.07 -1.43 5.68 -1.26 -5.19 116.55 114.42 2rl5 n ASP 1064Ca 0.00 0.00 0.02 0.00 -0.50 0.00 0.00 54.79 54.31 2rl5 n ASP 1064Cb 0.00 0.00 0.13 0.00 -1.14 0.00 0.00 41.12 40.11 2rl5 n ASP 1064CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2rl5 n ALA 1065N 1.69 0.51 0.69 2.12 0.00 -1.26 0.10 120.51 124.36 2rl5 n ALA 1065Ca 0.00 0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.61 2rl5 n ALA 1065Cb 0.00 -0.57 0.26 0.00 0.00 0.00 0.00 19.45 19.14 2rl5 n ALA 1065CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2rl5 n ARG 1066N -1.58 0.21 -4.02 0.00 5.12 -1.26 -4.97 116.66 110.16 2rl5 n ARG 1066Ca -0.00 0.08 -0.30 0.00 -1.93 0.00 0.00 57.85 55.70 2rl5 n ARG 1066Cb 0.31 -1.65 -0.03 0.00 -1.16 0.00 0.00 32.46 29.93 2rl5 n ARG 1066CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2rl5 n LEU 1067N -1.97 -1.76 0.27 0.55 4.77 0.11 -4.82 117.00 114.16 2rl5 n LEU 1067Ca 0.04 -1.11 0.18 0.00 -0.03 0.00 0.00 56.01 55.09 2rl5 n LEU 1067Cb 0.41 -2.02 0.87 0.00 -2.33 0.00 0.00 43.42 40.35 2rl5 n LEU 1067CO 0.34 0.50 1.15 1.55 -1.33 0.00 0.00 177.39 179.60 2rl5 h PRO 1068N -1.94 0.00 0.00 3.23 0.13 -1.94 -1.85 132.00 129.64 2rl5 h PRO 1068Ca -0.65 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.47 2rl5 h PRO 1068Cb 1.38 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.51 2rl5 h PRO 1068CO 0.61 0.00 -0.04 1.25 -0.23 0.00 0.00 178.00 179.59 2rl5 h LEU 1069N 0.00 0.00 -0.31 1.56 5.85 -1.96 -2.14 115.31 118.32 2rl5 h LEU 1069Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2rl5 h LEU 1069Cb 0.60 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.63 2rl5 h LEU 1069CO -0.00 0.04 0.00 0.29 -0.34 0.00 0.00 178.44 178.43 2rl5 n LYS 1070N -3.49 0.13 0.00 1.25 5.02 -0.69 -2.51 118.16 117.87 2rl5 n LYS 1070Ca -0.02 0.29 0.07 0.00 -2.02 0.00 0.00 58.31 56.62 2rl5 n LYS 1070Cb 0.15 -1.72 -0.04 0.00 -0.02 0.00 0.00 35.03 33.40 2rl5 n LYS 1070CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2rl5 n TRP 1071N -1.97 0.00 -2.85 2.13 8.01 -0.81 -4.97 117.44 116.98 2rl5 n TRP 1071Ca 0.04 0.00 -0.40 0.00 -1.31 0.00 0.00 57.50 55.82 2rl5 n TRP 1071Cb 0.26 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 29.52 2rl5 n TRP 1071CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 2rl5 s MET 1072N -1.99 4.62 0.64 -0.99 -1.94 -1.05 -3.97 119.30 114.63 2rl5 s MET 1072Ca 0.08 1.28 -0.15 0.00 -1.71 0.00 0.00 55.69 55.19 2rl5 s MET 1072Cb 0.11 -3.35 -0.01 0.00 2.01 0.00 0.00 34.83 33.58 2rl5 s MET 1072CO 0.45 0.30 1.09 0.00 -0.01 0.00 0.00 175.02 176.85 2rl5 s ALA 1073N -0.22 2.55 0.16 3.03 0.00 -1.26 -4.81 121.76 121.21 2rl5 s ALA 1073Ca 0.42 0.49 -0.18 0.00 0.00 0.00 0.00 51.96 52.69 2rl5 s ALA 1073Cb -0.22 -3.29 0.08 0.00 0.00 0.00 0.00 23.12 19.68 2rl5 s ALA 1073CO 0.27 -1.15 1.66 -1.35 0.00 0.00 0.00 175.76 175.20 2rl5 h PRO 1074N 0.12 -0.04 -0.06 0.00 0.11 -1.94 -0.43 132.00 129.77 2rl5 h PRO 1074Ca -0.47 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.66 2rl5 h PRO 1074Cb 1.24 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2rl5 h PRO 1074CO 0.55 -0.02 0.05 1.05 -0.21 0.00 0.00 178.00 179.42 2rl5 h GLU 1075N -0.04 0.00 0.07 1.05 9.09 -1.92 -0.43 114.58 122.41 2rl5 h GLU 1075Ca 0.18 0.00 -0.29 0.00 0.05 0.00 0.00 59.36 59.30 2rl5 h GLU 1075Cb 0.31 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 27.43 2rl5 h GLU 1075CO -0.39 0.00 -1.17 1.15 0.05 0.00 0.00 179.01 178.65 2rl5 h THR 1076N 0.00 1.28 0.46 -1.06 2.02 -1.26 0.64 112.91 115.00 2rl5 h THR 1076Ca 0.03 -2.39 -0.02 0.00 0.77 0.00 0.00 66.41 64.80 2rl5 h THR 1076Cb 0.13 2.57 0.00 0.00 -1.74 0.00 0.00 68.15 69.12 2rl5 h THR 1076CO -0.00 0.73 -0.22 0.40 0.37 0.00 0.00 175.52 176.80 2rl5 h ILE 1077N 0.32 0.51 0.00 3.11 2.04 -0.08 0.55 117.51 123.96 2rl5 h ILE 1077Ca -0.17 -0.32 -0.19 0.00 1.00 0.00 0.00 64.86 65.19 2rl5 h ILE 1077Cb 1.83 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 38.53 2rl5 h ILE 1077CO 0.23 0.05 -0.89 -0.26 0.00 0.00 0.00 178.15 177.28 2rl5 h PHE 1078N -0.82 0.00 -0.00 1.37 0.04 -1.24 -3.37 116.94 112.92 2rl5 h PHE 1078Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 2rl5 h PHE 1078Cb 0.56 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.71 2rl5 h PHE 1078CO -0.00 0.89 -0.05 -0.25 -0.60 0.00 0.00 178.31 178.30 2rl5 n ASP 1079N -3.44 0.87 -2.18 2.17 8.00 0.20 -5.01 116.55 117.16 2rl5 n ASP 1079Ca -0.00 -0.93 -0.20 0.00 0.71 0.00 0.00 54.79 54.36 2rl5 n ASP 1079Cb 0.86 0.36 -0.02 0.00 -0.02 0.00 0.00 41.12 42.30 2rl5 n ASP 1079CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2rl5 n ARG 1080N -0.27 -1.58 -3.61 -1.24 1.74 0.19 -4.95 116.66 106.94 2rl5 n ARG 1080Ca 0.01 1.02 -0.36 0.00 -0.77 0.00 0.00 57.85 57.75 2rl5 n ARG 1080Cb 0.07 -5.60 -0.08 0.00 -1.02 0.00 0.00 32.46 25.83 2rl5 n ARG 1080CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2rl5 s VAL 1081N -2.97 5.34 -0.16 1.55 -7.23 -1.23 -4.97 120.40 110.73 2rl5 s VAL 1081Ca 0.00 0.36 -0.03 0.00 -1.81 0.00 0.00 61.98 60.51 2rl5 s VAL 1081Cb 0.00 -3.56 -0.02 0.00 0.56 0.00 0.00 36.38 33.36 2rl5 s VAL 1081CO 0.00 0.38 -0.07 -0.31 -0.31 0.00 0.00 175.10 174.79 2rl5 s TYR 1082N 0.65 2.94 0.15 2.82 1.51 -1.26 -3.97 117.35 120.19 2rl5 s TYR 1082Ca 0.12 -0.55 -0.06 0.00 -1.01 0.00 0.00 57.07 55.56 2rl5 s TYR 1082Cb -0.13 -1.95 -0.02 0.00 -0.11 0.00 0.00 41.96 39.75 2rl5 s TYR 1082CO 0.02 -0.21 0.21 0.95 -1.11 0.00 0.00 175.55 175.42 2rl5 s THR 1083N 0.61 0.08 0.59 -0.71 -4.23 -1.26 -4.99 115.64 105.73 2rl5 s THR 1083Ca -0.04 -1.55 0.29 0.00 -1.18 0.00 0.00 61.69 59.20 2rl5 s THR 1083Cb -0.15 -1.91 0.36 0.00 1.34 0.00 0.00 72.50 72.14 2rl5 s THR 1083CO 0.03 -0.34 2.10 -0.29 -0.54 0.00 0.00 174.62 175.58 2rl5 h ILE 1084N 2.64 0.47 0.00 2.99 6.09 -1.99 0.29 117.51 128.00 2rl5 h ILE 1084Ca -0.33 0.00 -0.05 0.00 -1.37 0.00 0.00 64.86 63.12 2rl5 h ILE 1084Cb 1.22 0.84 -0.01 0.00 0.47 0.00 0.00 36.82 39.34 2rl5 h ILE 1084CO 0.51 0.00 -0.23 1.56 -3.07 0.00 0.00 178.15 176.93 2rl5 h GLN 1085N 0.00 0.00 0.00 2.19 7.50 -1.95 -2.19 115.11 120.67 2rl5 h GLN 1085Ca 0.08 0.00 -0.19 0.00 0.50 0.00 0.00 58.65 59.04 2rl5 h GLN 1085Cb 0.48 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.98 2rl5 h GLN 1085CO -0.00 0.23 -0.96 0.66 -1.50 0.00 0.00 178.83 177.26 2rl5 h SER 1086N 0.00 0.00 -0.29 1.46 4.64 -0.84 -3.01 113.55 115.51 2rl5 h SER 1086Ca -0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.24 2rl5 h SER 1086Cb 1.13 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 2rl5 h SER 1086CO 0.03 0.87 -0.06 0.44 -0.87 0.00 0.00 176.83 177.24 2rl5 h ASP 1087N 0.00 0.64 -0.27 4.97 5.19 -1.01 -1.83 116.42 124.11 2rl5 h ASP 1087Ca -0.04 -0.16 -0.07 0.00 -0.62 0.00 0.00 57.03 56.14 2rl5 h ASP 1087Cb 1.69 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 41.02 2rl5 h ASP 1087CO 0.11 0.75 -0.05 0.58 -3.12 0.00 0.00 179.24 177.50 2rl5 h VAL 1088N 0.62 1.23 -0.28 -1.35 2.07 -1.33 0.92 116.25 118.13 2rl5 h VAL 1088Ca 0.12 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 2rl5 h VAL 1088Cb 0.47 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2rl5 h VAL 1088CO 0.02 0.34 0.15 -0.25 0.02 0.00 0.00 177.57 177.85 2rl5 h TRP 1089N 0.60 0.39 -0.55 1.57 2.91 -1.24 -1.96 115.95 117.67 2rl5 h TRP 1089Ca 0.12 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.11 2rl5 h TRP 1089Cb 0.46 -0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 28.96 2rl5 h TRP 1089CO 0.02 0.34 0.31 0.77 -1.03 0.00 0.00 178.44 178.85 2rl5 h SER 1090N 0.33 0.66 -0.25 2.65 0.02 -0.64 -0.11 113.55 116.22 2rl5 h SER 1090Ca 0.10 -0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.01 2rl5 h SER 1090Cb 0.08 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 2rl5 h SER 1090CO -0.01 0.53 0.16 0.15 -1.14 0.00 0.00 176.83 176.52 2rl5 h PHE 1091N 0.76 0.30 -0.53 3.45 3.57 -0.13 -0.75 116.94 123.61 2rl5 h PHE 1091Ca 0.20 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.61 2rl5 h PHE 1091Cb 0.01 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 2rl5 h PHE 1091CO 0.00 0.18 -0.04 0.78 -2.23 0.00 0.00 178.31 177.01 2rl5 h GLY 1092N 0.32 1.04 1.47 2.40 0.00 -0.33 -0.82 103.07 107.14 2rl5 h GLY 1092Ca 0.09 -0.80 -0.10 0.00 0.00 0.00 0.00 47.33 46.52 2rl5 h GLY 1092CO -0.02 0.73 -0.22 -2.08 0.00 0.00 0.00 176.54 174.95 2rl5 h VAL 1093N 0.83 1.27 -0.85 4.60 2.07 -1.11 -2.13 116.25 120.92 2rl5 h VAL 1093Ca 0.14 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.38 2rl5 h VAL 1093Cb 0.59 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 2rl5 h VAL 1093CO 0.04 0.41 0.47 0.25 0.02 0.00 0.00 177.57 178.76 2rl5 h LEU 1094N 0.54 1.06 -0.65 2.57 6.46 -0.71 0.10 115.31 124.68 2rl5 h LEU 1094Ca 0.08 -0.10 -0.05 0.00 -0.12 0.00 0.00 57.88 57.69 2rl5 h LEU 1094Cb 0.67 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 40.30 2rl5 h LEU 1094CO 0.05 0.85 0.21 -0.07 -0.62 0.00 0.00 178.44 178.86 2rl5 h LEU 1095N 1.19 0.94 -0.71 2.25 3.38 -0.78 0.12 115.31 121.70 2rl5 h LEU 1095Ca 0.30 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2rl5 h LEU 1095Cb 0.02 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 2rl5 h LEU 1095CO -0.05 0.89 0.41 -0.25 0.09 0.00 0.00 178.44 179.54 2rl5 h TRP 1096N 0.94 0.95 -0.35 1.13 7.01 -0.72 0.93 115.95 125.84 2rl5 h TRP 1096Ca 0.21 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.18 2rl5 h TRP 1096Cb 0.28 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 27.02 2rl5 h TRP 1096CO 0.02 0.65 0.15 0.93 -2.79 0.00 0.00 178.44 177.40 2rl5 h GLU 1097N 0.97 0.51 -0.30 2.65 5.08 -0.50 -2.18 114.58 120.81 2rl5 h GLU 1097Ca 0.25 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2rl5 h GLU 1097Cb -0.01 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2rl5 h GLU 1097CO -0.04 0.49 0.18 0.82 -1.00 0.00 0.00 179.01 179.46 2rl5 h ILE 1098N 0.42 1.11 -0.19 3.13 2.04 -0.21 0.28 117.51 124.09 2rl5 h ILE 1098Ca 0.12 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2rl5 h ILE 1098Cb 0.16 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 2rl5 h ILE 1098CO -0.01 0.11 0.00 0.49 0.00 0.00 0.00 178.15 178.74 2rl5 n PHE 1099N -4.83 0.47 -0.23 1.37 3.72 0.27 -2.09 117.46 116.13 2rl5 n PHE 1099Ca -0.02 -0.18 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 2rl5 n PHE 1099Cb 0.06 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.47 2rl5 n PHE 1099CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2rl5 n SER 1100N 0.16 0.92 -3.37 4.37 3.41 -0.83 -1.62 113.62 116.66 2rl5 n SER 1100Ca 0.08 -1.15 -0.18 0.00 -0.26 0.00 0.00 58.87 57.36 2rl5 n SER 1100Cb 0.38 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.38 2rl5 n SER 1100CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2rl5 n LEU 1101N -0.07 -4.85 -0.63 1.04 4.77 -0.89 -3.50 117.00 112.87 2rl5 n LEU 1101Ca 0.00 -0.70 -0.08 0.00 -0.03 0.00 0.00 56.01 55.21 2rl5 n LEU 1101Cb 0.11 -2.92 -0.03 0.00 -2.33 0.00 0.00 43.42 38.25 2rl5 n LEU 1101CO 0.00 0.00 -0.08 0.61 -1.33 0.00 0.00 177.39 176.60 2rl5 n GLY 1102N -1.48 0.81 3.73 -0.72 0.00 0.04 -3.34 105.19 104.22 2rl5 n GLY 1102Ca -0.07 -0.68 -0.29 0.00 0.00 0.00 0.00 46.02 44.97 2rl5 n GLY 1102CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rl5 s ALA 1103N -2.30 1.49 -0.21 4.61 0.00 -1.23 -4.76 121.76 119.36 2rl5 s ALA 1103Ca 0.00 -0.27 -0.18 0.00 0.00 0.00 0.00 51.96 51.51 2rl5 s ALA 1103Cb 0.00 -3.13 -0.03 0.00 0.00 0.00 0.00 23.12 19.96 2rl5 s ALA 1103CO 0.00 -2.41 0.52 0.45 0.00 0.00 0.00 175.76 174.32 2rl5 s SER 1104N -3.61 6.53 0.27 0.00 0.15 -1.26 -4.80 113.70 110.99 2rl5 s SER 1104Ca 0.64 0.64 -0.29 0.00 0.70 0.00 0.00 55.95 57.64 2rl5 s SER 1104Cb -0.17 -2.29 -0.14 0.00 -1.71 0.00 0.00 66.02 61.71 2rl5 s SER 1104CO 0.56 -0.21 1.05 -2.65 1.20 0.00 0.00 173.24 173.19 2rl5 n PRO 1105N 4.98 1.37 -3.38 5.44 -0.02 -1.26 -3.15 135.00 138.98 2rl5 n PRO 1105Ca -0.04 0.48 -0.18 0.00 -2.02 0.00 0.00 63.50 61.74 2rl5 n PRO 1105Cb 0.50 -1.88 0.04 0.00 -0.02 0.00 0.00 33.50 32.14 2rl5 n PRO 1105CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2rl5 n TYR 1106N 0.46 -2.38 -1.68 6.00 4.01 -1.26 -4.81 117.16 117.50 2rl5 n TYR 1106Ca 0.10 0.79 -0.59 0.00 -0.16 0.00 0.00 57.90 58.04 2rl5 n TYR 1106Cb 0.31 -3.83 -0.08 0.00 -0.31 0.00 0.00 39.34 35.43 2rl5 n TYR 1106CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2rl5 n PRO 1107N -3.19 0.83 -0.51 -0.72 -0.02 -1.19 -1.89 135.00 128.31 2rl5 n PRO 1107Ca -0.08 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 2rl5 n PRO 1107Cb 0.59 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2rl5 n PRO 1107CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rl5 n GLY 1108N 3.65 0.06 3.73 -1.23 0.00 -1.26 -4.96 105.19 105.18 2rl5 n GLY 1108Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 2rl5 n GLY 1108CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rl5 s VAL 1109N -1.16 4.56 0.07 1.61 1.01 -0.79 -5.01 120.40 120.69 2rl5 s VAL 1109Ca 0.00 1.95 -0.31 0.00 0.00 0.00 0.00 61.98 63.63 2rl5 s VAL 1109Cb 0.00 -4.27 -0.06 0.00 0.00 0.00 0.00 36.38 32.05 2rl5 s VAL 1109CO 0.00 0.33 1.20 -0.54 0.00 0.00 0.00 175.10 176.09 2rl5 s LYS 1110N -0.01 4.43 -1.21 2.72 1.02 -1.26 -4.93 119.74 120.50 2rl5 s LYS 1110Ca 0.45 1.78 -0.09 0.00 0.02 0.00 0.00 55.97 58.12 2rl5 s LYS 1110Cb -0.23 -3.34 0.21 0.00 -0.52 0.00 0.00 37.83 33.95 2rl5 s LYS 1110CO 0.28 -0.25 1.63 -0.89 -0.92 0.00 0.00 175.35 175.20 2rl5 n ILE 1111N 3.87 4.57 -2.99 2.17 2.08 -1.26 -4.57 119.36 123.22 2rl5 n ILE 1111Ca 0.09 -4.89 0.00 0.00 0.56 0.00 0.00 62.75 58.51 2rl5 n ILE 1111Cb 0.46 -2.34 0.00 0.00 -0.75 0.00 0.00 39.64 37.01 2rl5 n ILE 1111CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 2rl5 n ASP 1112N 3.57 1.28 -0.10 4.38 3.85 -1.26 -4.99 116.55 123.29 2rl5 n ASP 1112Ca 0.35 -0.35 -0.06 0.00 -0.71 0.00 0.00 54.79 54.02 2rl5 n ASP 1112Cb 0.37 0.00 0.13 0.00 -1.35 0.00 0.00 41.12 40.27 2rl5 n ASP 1112CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 2rl5 h GLU 1113N 0.00 0.78 -0.33 0.11 4.39 -2.01 -2.67 114.58 114.86 2rl5 h GLU 1113Ca 0.00 -0.25 -0.01 0.00 0.34 0.00 0.00 59.36 59.44 2rl5 h GLU 1113Cb 0.00 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 2rl5 h GLU 1113CO 0.00 0.85 0.15 1.49 -1.16 0.00 0.00 179.01 180.33 2rl5 h GLU 1114N 0.71 0.45 0.08 2.33 4.81 -1.96 -0.82 114.58 120.17 2rl5 h GLU 1114Ca 0.12 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2rl5 h GLU 1114Cb 0.57 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2rl5 h GLU 1114CO 0.04 0.36 -0.04 0.35 -0.73 0.00 0.00 179.01 178.99 2rl5 h PHE 1115N 0.45 -0.10 -0.50 0.92 3.57 -1.72 0.55 116.94 120.12 2rl5 h PHE 1115Ca 0.12 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 2rl5 h PHE 1115Cb 0.07 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 2rl5 h PHE 1115CO 0.00 -0.03 0.19 0.00 -2.23 0.00 0.00 178.31 176.24 2rl5 h ARG 1117N 0.71 -0.01 0.00 0.00 2.43 -0.69 -2.27 114.38 114.55 2rl5 h ARG 1117Ca 0.17 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.29 2rl5 h ARG 1117Cb 0.16 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2rl5 h ARG 1117CO -0.02 0.29 -0.24 0.00 -1.51 0.00 0.00 179.97 178.50 2rl5 h ARG 1118N -0.31 0.00 -0.38 0.20 3.08 -0.72 -2.28 114.38 113.97 2rl5 h ARG 1118Ca -0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 2rl5 h ARG 1118Cb 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 2rl5 h ARG 1118CO 0.00 0.24 -0.34 1.25 -1.07 0.00 0.00 179.97 180.05 2rl5 h LEU 1119N 0.00 0.96 -0.80 3.04 5.85 -0.81 0.12 115.31 123.67 2rl5 h LEU 1119Ca -0.00 -0.46 -0.04 0.00 0.84 0.00 0.00 57.88 58.22 2rl5 h LEU 1119Cb 0.69 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 2rl5 h LEU 1119CO 0.03 1.22 -0.20 0.50 -0.34 0.00 0.00 178.44 179.64 2rl5 h LYS 1120N 0.72 0.00 0.00 1.25 3.64 -1.21 -2.84 116.57 118.13 2rl5 h LYS 1120Ca 0.07 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2rl5 h LYS 1120Cb 0.93 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 2rl5 h LYS 1120CO 0.09 0.20 -0.18 0.39 -2.27 0.00 0.00 179.45 177.68 2rl5 n GLU 1121N -3.27 0.00 0.00 1.90 1.02 -0.87 -4.93 120.64 114.48 2rl5 n GLU 1121Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2rl5 n GLU 1121Cb 0.48 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 2rl5 n GLU 1121CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2rl5 n GLY 1122N 1.50 0.99 3.72 0.62 0.00 -0.85 -5.06 105.19 106.09 2rl5 n GLY 1122Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2rl5 n GLY 1122CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rl5 s THR 1123N -2.00 3.10 0.13 2.61 2.01 0.37 -5.00 115.64 116.86 2rl5 s THR 1123Ca 0.00 0.79 0.05 0.00 0.31 0.00 0.00 61.69 62.83 2rl5 s THR 1123Cb 0.00 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 2rl5 s THR 1123CO 0.00 0.06 -0.11 -0.13 -0.69 0.00 0.00 174.62 173.75 2rl5 s ARG 1124N 1.14 1.01 0.66 4.92 1.81 -1.26 -4.57 118.95 122.66 2rl5 s ARG 1124Ca 0.66 -1.35 -0.16 0.00 -1.72 0.00 0.00 55.73 53.16 2rl5 s ARG 1124Cb -0.39 -0.65 -0.00 0.00 -0.45 0.00 0.00 34.95 33.46 2rl5 s ARG 1124CO 0.30 0.09 1.16 -1.64 -0.68 0.00 0.00 175.30 174.54 2rl5 s MET 1125N -3.36 2.67 0.73 3.54 -1.94 -1.26 -5.02 119.30 114.66 2rl5 s MET 1125Ca 0.13 1.63 -0.11 0.00 -1.71 0.00 0.00 55.69 55.63 2rl5 s MET 1125Cb 0.00 -1.91 0.04 0.00 2.01 0.00 0.00 34.83 34.97 2rl5 s MET 1125CO 0.01 -1.40 1.11 1.03 -0.01 0.00 0.00 175.02 175.76 2rl5 s ARG 1126N -3.79 2.51 0.18 2.03 0.52 -1.26 -4.98 118.95 114.17 2rl5 s ARG 1126Ca 0.72 0.27 -0.31 0.00 -0.52 0.00 0.00 55.73 55.89 2rl5 s ARG 1126Cb -0.26 -2.02 -0.10 0.00 0.52 0.00 0.00 34.95 33.09 2rl5 s ARG 1126CO 0.39 -1.22 1.54 0.00 0.02 0.00 0.00 175.30 176.03 2rl5 s ALA 1127N -3.40 3.74 0.90 2.13 0.00 -1.26 -4.98 121.76 118.88 2rl5 s ALA 1127Ca 0.59 1.36 -0.12 0.00 0.00 0.00 0.00 51.96 53.80 2rl5 s ALA 1127Cb -0.11 -3.61 0.13 0.00 0.00 0.00 0.00 23.12 19.53 2rl5 s ALA 1127CO 0.50 -0.77 1.09 -1.25 0.00 0.00 0.00 175.76 175.33 2rl5 s PRO 1128N 0.79 1.26 0.26 0.00 0.04 -1.26 -4.97 135.00 131.12 2rl5 s PRO 1128Ca 0.68 0.73 -0.02 0.00 0.04 0.00 0.00 61.00 62.43 2rl5 s PRO 1128Cb -0.43 -1.82 0.44 0.00 0.04 0.00 0.00 34.50 32.73 2rl5 s PRO 1128CO 0.34 -2.22 1.85 -0.44 0.04 0.00 0.00 177.00 176.57 2rl5 h ASP 1129N -1.53 0.92 -0.64 6.66 3.32 -1.92 -3.17 116.42 120.07 2rl5 h ASP 1129Ca -0.50 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2rl5 h ASP 1129Cb 1.29 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.68 2rl5 h ASP 1129CO 0.56 0.54 0.00 -1.22 -1.72 0.00 0.00 179.24 177.40 2rl5 n TYR 1130N -4.60 1.20 -1.34 4.55 4.02 -0.64 -5.00 117.16 115.36 2rl5 n TYR 1130Ca 0.16 -0.57 -0.29 0.00 -0.01 0.00 0.00 57.90 57.19 2rl5 n TYR 1130Cb 0.25 -0.14 0.15 0.00 -0.02 0.00 0.00 39.34 39.58 2rl5 n TYR 1130CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 2rl5 s THR 1131N -1.51 2.20 0.29 -0.72 -1.32 -1.20 -4.96 115.64 108.43 2rl5 s THR 1131Ca 0.48 0.07 0.10 0.00 -1.21 0.00 0.00 61.69 61.12 2rl5 s THR 1131Cb 0.29 -2.67 -0.05 0.00 -1.51 0.00 0.00 72.50 68.55 2rl5 s THR 1131CO 0.26 -0.09 -0.04 0.42 -2.21 0.00 0.00 174.62 172.97 2rl5 s THR 1132N -3.09 2.99 0.25 5.08 -4.23 -1.26 -5.01 115.64 110.36 2rl5 s THR 1132Ca 0.64 -2.04 -0.04 0.00 -1.18 0.00 0.00 61.69 59.07 2rl5 s THR 1132Cb -0.17 -2.71 0.22 0.00 1.34 0.00 0.00 72.50 71.18 2rl5 s THR 1132CO 0.56 -0.33 1.81 -0.65 -0.54 0.00 0.00 174.62 175.47 2rl5 h PRO 1133N 1.95 0.78 -0.46 3.99 0.11 -2.00 -2.28 132.00 134.10 2rl5 h PRO 1133Ca -0.43 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 2rl5 h PRO 1133Cb 1.25 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2rl5 h PRO 1133CO 0.62 0.52 -0.18 0.93 -0.21 0.00 0.00 178.00 179.68 2rl5 h GLU 1134N 0.81 0.93 -0.26 1.05 3.07 -1.99 -2.48 114.58 115.71 2rl5 h GLU 1134Ca 0.40 -0.39 -0.06 0.00 -0.50 0.00 0.00 59.36 58.82 2rl5 h GLU 1134Cb 0.35 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 2rl5 h GLU 1134CO -0.24 1.05 -0.08 0.52 -1.40 0.00 0.00 179.01 178.85 2rl5 h MET 1135N 0.77 0.41 -0.17 2.33 2.86 -1.88 -0.86 114.93 118.39 2rl5 h MET 1135Ca 0.11 -0.10 -0.17 0.00 -2.06 0.00 0.00 59.70 57.48 2rl5 h MET 1135Cb 0.75 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.35 2rl5 h MET 1135CO 0.06 0.51 -0.59 -0.92 1.06 0.00 0.00 176.91 177.03 2rl5 h TYR 1136N 0.39 0.69 -0.25 -0.22 3.20 -1.29 -1.82 116.97 117.67 2rl5 h TYR 1136Ca 0.08 -0.26 -0.11 0.00 3.14 0.00 0.00 58.73 61.58 2rl5 h TYR 1136Cb 0.39 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 2rl5 h TYR 1136CO 0.01 1.00 -0.31 0.37 -1.64 0.00 0.00 178.16 177.58 2rl5 h GLN 1137N 0.41 0.53 -0.39 1.82 5.75 -0.99 -1.58 115.11 120.65 2rl5 h GLN 1137Ca -0.00 -0.23 -0.10 0.00 -0.15 0.00 0.00 58.65 58.17 2rl5 h GLN 1137Cb 1.14 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.66 2rl5 h GLN 1137CO 0.11 0.78 -0.16 1.15 -2.65 0.00 0.00 178.83 178.06 2rl5 h THR 1138N 0.45 1.26 -0.37 2.39 2.02 -0.99 0.29 112.91 117.96 2rl5 h THR 1138Ca 0.06 -1.22 -0.01 0.00 0.77 0.00 0.00 66.41 66.01 2rl5 h THR 1138Cb 0.77 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 68.30 2rl5 h THR 1138CO 0.06 0.41 0.20 0.24 0.37 0.00 0.00 175.52 176.80 2rl5 h MET 1139N 0.64 0.52 -0.40 6.66 2.86 -0.91 -0.20 114.93 124.09 2rl5 h MET 1139Ca 0.10 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.65 2rl5 h MET 1139Cb 0.63 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.17 2rl5 h MET 1139CO 0.04 0.42 0.12 -0.07 1.06 0.00 0.00 176.91 178.49 2rl5 h LEU 1140N 0.47 0.54 -0.53 1.22 3.38 -0.79 -1.68 115.31 117.93 2rl5 h LEU 1140Ca 0.13 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2rl5 h LEU 1140Cb 0.06 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2rl5 h LEU 1140CO -0.02 0.52 -0.16 0.44 0.09 0.00 0.00 178.44 179.31 2rl5 h ASP 1141N 0.58 1.04 0.79 -0.43 3.32 -0.24 -2.62 116.42 118.86 2rl5 h ASP 1141Ca 0.14 -0.37 -0.03 0.00 0.02 0.00 0.00 57.03 56.79 2rl5 h ASP 1141Cb 0.18 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 2rl5 h ASP 1141CO -0.01 1.17 -0.13 0.00 -1.72 0.00 0.00 179.24 178.56 2rl5 n TRP 1143N -3.34 2.22 -1.99 0.00 8.01 -0.70 -3.88 117.44 117.77 2rl5 n TRP 1143Ca -0.00 -1.16 -0.41 0.00 -1.31 0.00 0.00 57.50 54.62 2rl5 n TRP 1143Cb 0.34 -0.66 -0.02 0.00 -2.01 0.00 0.00 31.31 28.96 2rl5 n TRP 1143CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 2rl5 s HIS 1144N -2.66 2.92 0.30 -5.99 2.46 -1.09 -4.89 115.29 106.35 2rl5 s HIS 1144Ca 0.47 1.19 0.02 0.00 0.47 0.00 0.00 55.06 57.21 2rl5 s HIS 1144Cb 0.38 -3.83 0.58 0.00 -0.13 0.00 0.00 32.58 29.58 2rl5 s HIS 1144CO 0.11 -2.50 1.88 0.78 -2.47 0.00 0.00 174.74 172.55 2rl5 h GLY 1145N 3.96 1.39 -6.88 1.59 0.00 -1.93 -3.38 103.07 97.82 2rl5 h GLY 1145Ca -0.48 -0.40 -0.63 0.00 0.00 0.00 0.00 47.33 45.82 2rl5 h GLY 1145CO 0.70 0.23 0.20 -0.54 0.00 0.00 0.00 176.54 177.13 2rl5 s GLU 1146N -5.88 3.63 0.26 4.80 0.41 -1.26 -4.94 118.70 115.72 2rl5 s GLU 1146Ca -0.11 0.05 -0.05 0.00 -0.41 0.00 0.00 54.97 54.45 2rl5 s GLU 1146Cb 0.21 -3.83 0.52 0.00 -1.78 0.00 0.00 34.13 29.24 2rl5 s GLU 1146CO 0.80 -0.81 1.62 -1.35 -0.49 0.00 0.00 175.26 175.03 2rl5 h PRO 1147N 8.54 0.09 0.00 0.39 0.11 -1.94 0.25 132.00 139.44 2rl5 h PRO 1147Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2rl5 h PRO 1147Cb 1.10 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2rl5 h PRO 1147CO 0.86 0.06 0.00 0.66 -0.21 0.00 0.00 178.00 179.37 2rl5 h SER 1148N 0.09 0.00 -0.07 -2.05 4.64 -1.94 -2.20 113.55 112.03 2rl5 h SER 1148Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 2rl5 h SER 1148Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2rl5 h SER 1148CO -0.73 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.23 2rl5 n GLN 1149N -2.88 1.82 -2.95 4.77 1.13 0.87 -4.90 117.38 115.25 2rl5 n GLN 1149Ca -0.00 -1.21 -0.33 0.00 -1.94 0.00 0.00 57.00 53.52 2rl5 n GLN 1149Cb 0.20 -1.46 -0.06 0.00 0.11 0.00 0.00 30.24 29.03 2rl5 n GLN 1149CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2rl5 s ARG 1150N -1.93 4.08 0.79 -1.09 0.52 -0.83 -4.92 118.95 115.57 2rl5 s ARG 1150Ca 0.35 0.86 -0.11 0.00 -0.52 0.00 0.00 55.73 56.31 2rl5 s ARG 1150Cb 0.20 -2.31 0.07 0.00 0.52 0.00 0.00 34.95 33.43 2rl5 s ARG 1150CO 0.31 0.04 1.09 -1.25 0.02 0.00 0.00 175.30 175.52 2rl5 s PRO 1151N -3.18 2.08 0.27 3.54 0.04 -1.26 -5.03 135.00 131.46 2rl5 s PRO 1151Ca 0.57 1.06 -0.00 0.00 0.04 0.00 0.00 61.00 62.68 2rl5 s PRO 1151Cb -0.10 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 2rl5 s PRO 1151CO 0.17 -1.74 0.47 0.95 0.04 0.00 0.00 177.00 176.90 2rl5 s THR 1152N -2.93 5.15 0.51 1.26 -4.23 -1.26 -4.94 115.64 109.19 2rl5 s THR 1152Ca 0.61 -0.41 0.21 0.00 -1.18 0.00 0.00 61.69 60.92 2rl5 s THR 1152Cb -0.17 -3.79 0.35 0.00 1.34 0.00 0.00 72.50 70.22 2rl5 s THR 1152CO 0.56 -0.36 2.04 -0.26 -0.54 0.00 0.00 174.62 176.06 2rl5 h PHE 1153N 1.40 0.08 -0.54 3.99 0.04 -1.94 0.82 116.94 120.80 2rl5 h PHE 1153Ca -0.49 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.26 2rl5 h PHE 1153Cb 1.21 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 39.30 2rl5 h PHE 1153CO 0.53 0.04 0.23 0.77 -0.60 0.00 0.00 178.31 179.28 2rl5 h SER 1154N 0.08 0.73 0.14 2.17 0.02 -1.93 0.18 113.55 114.92 2rl5 h SER 1154Ca 0.19 -0.16 -0.09 0.00 -0.84 0.00 0.00 61.79 60.89 2rl5 h SER 1154Cb 0.64 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 2rl5 h SER 1154CO -0.02 0.68 -0.32 -0.33 -1.14 0.00 0.00 176.83 175.71 2rl5 h GLU 1155N 0.72 0.28 -0.28 3.45 5.08 -1.30 -2.40 114.58 120.13 2rl5 h GLU 1155Ca 0.18 -0.11 -0.16 0.00 -1.00 0.00 0.00 59.36 58.27 2rl5 h GLU 1155Cb 0.17 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2rl5 h GLU 1155CO -0.02 0.58 -0.46 -0.07 -1.00 0.00 0.00 179.01 178.04 2rl5 h LEU 1156N 0.24 0.80 -0.23 1.33 3.38 -0.41 -0.43 115.31 120.00 2rl5 h LEU 1156Ca 0.03 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 2rl5 h LEU 1156Cb 0.69 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2rl5 h LEU 1156CO 0.05 1.14 0.10 0.58 0.09 0.00 0.00 178.44 180.40 2rl5 h VAL 1157N 0.59 1.16 -0.10 1.22 2.07 -0.44 0.16 116.25 120.92 2rl5 h VAL 1157Ca 0.04 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 2rl5 h VAL 1157Cb 1.02 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.83 2rl5 h VAL 1157CO 0.10 0.16 0.04 -0.08 0.02 0.00 0.00 177.57 177.81 2rl5 h GLU 1158N 0.23 0.14 -0.27 1.57 4.81 -1.37 -0.72 114.58 118.97 2rl5 h GLU 1158Ca 0.08 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 2rl5 h GLU 1158Cb 0.16 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 2rl5 h GLU 1158CO -0.01 0.23 0.09 1.25 -0.73 0.00 0.00 179.01 179.84 2rl5 h HIS 1159N 0.02 0.42 -0.13 0.92 2.76 -0.94 -2.01 115.15 116.19 2rl5 h HIS 1159Ca 0.03 -0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 58.09 2rl5 h HIS 1159Cb 0.14 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 28.96 2rl5 h HIS 1159CO -0.03 0.45 -0.25 -0.07 -1.30 0.00 0.00 177.93 176.74 2rl5 h LEU 1160N 0.27 0.23 -1.32 0.26 3.38 -0.68 -1.56 115.31 115.90 2rl5 h LEU 1160Ca 0.09 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 2rl5 h LEU 1160Cb 0.22 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2rl5 h LEU 1160CO -0.00 0.49 -0.14 1.23 0.09 0.00 0.00 178.44 180.10 2rl5 h GLY 1161N 0.95 0.31 0.96 0.83 0.00 -0.78 -1.35 103.07 103.99 2rl5 h GLY 1161Ca 0.03 -0.20 -0.18 0.00 0.00 0.00 0.00 47.33 46.99 2rl5 h GLY 1161CO 0.04 0.18 -0.63 3.43 0.00 0.00 0.00 176.54 179.56 2rl5 h ASN 1162N 0.27 0.71 -0.17 0.19 -0.26 -0.62 -2.43 115.58 113.27 2rl5 h ASN 1162Ca 0.05 -0.66 -0.03 0.00 -0.56 0.00 0.00 56.30 55.10 2rl5 h ASN 1162Cb 0.42 -0.21 -0.01 0.00 -1.06 0.00 0.00 38.32 37.45 2rl5 h ASN 1162CO 0.02 1.27 0.03 -0.07 -1.06 0.00 0.00 177.43 177.62 2rl5 h LEU 1163N 0.21 0.35 -0.16 1.61 3.38 -0.97 0.80 115.31 120.54 2rl5 h LEU 1163Ca -0.05 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 2rl5 h LEU 1163Cb 1.28 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.93 2rl5 h LEU 1163CO 0.13 0.39 -0.12 0.25 0.09 0.00 0.00 178.44 179.18 2rl5 h LEU 1164N 0.38 0.39 -0.77 1.67 5.85 -1.22 0.31 115.31 121.92 2rl5 h LEU 1164Ca 0.09 -0.46 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 2rl5 h LEU 1164Cb 0.21 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2rl5 h LEU 1164CO 0.00 0.76 0.31 -0.61 -0.34 0.00 0.00 178.44 178.56 2rl5 h GLN 1165N 0.02 1.14 -0.22 1.25 4.15 -1.03 -2.55 115.11 117.87 2rl5 h GLN 1165Ca 0.03 -0.20 -0.13 0.00 0.77 0.00 0.00 58.65 59.11 2rl5 h GLN 1165Cb 0.64 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.13 2rl5 h GLN 1165CO 0.03 0.93 -0.42 0.00 -1.93 0.00 0.00 178.83 177.44 2rl5 h ALA 1166N 1.16 0.87 -0.68 3.38 0.00 -0.76 -2.96 119.26 120.27 2rl5 h ALA 1166Ca 0.26 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2rl5 h ALA 1166Cb 0.20 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2rl5 h ALA 1166CO -0.02 0.64 0.27 -0.97 0.00 0.00 0.00 179.25 179.17 2rl5 h ASN 1167N 0.43 0.94 -0.09 0.00 -1.24 -0.62 -2.10 115.58 112.90 2rl5 h ASN 1167Ca 0.04 -0.17 -0.00 0.00 0.71 0.00 0.00 56.30 56.87 2rl5 h ASN 1167Cb 0.91 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 39.71 2rl5 h ASN 1167CO 0.08 0.86 0.05 0.00 -1.29 0.00 0.00 177.43 177.13 2rl5 h ALA 1168N 1.12 1.88 0.00 1.57 0.00 -1.33 -0.89 119.26 121.61 2rl5 h ALA 1168Ca 0.23 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2rl5 h ALA 1168Cb 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2rl5 h ALA 1168CO -0.02 0.10 0.00 0.37 0.00 0.00 0.00 179.25 179.71 2rl5 h GLN 1169N 0.15 0.00 0.00 0.00 5.75 -1.22 -1.81 115.11 117.99 2rl5 h GLN 1169Ca 0.04 0.00 -0.15 0.00 -0.15 0.00 0.00 58.65 58.39 2rl5 h GLN 1169Cb 0.03 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.55 2rl5 h GLN 1169CO -0.01 0.00 -1.06 1.96 -2.65 0.00 0.00 178.83 177.07 2rl5 h GLN 1170N 0.00 0.00 -3.01 1.69 1.08 -1.17 -3.39 115.11 110.31 2rl5 h GLN 1170Ca 0.00 0.00 -0.80 0.00 -1.45 0.00 0.00 58.65 56.40 2rl5 h GLN 1170Cb 0.23 0.00 -0.26 0.00 -0.05 0.00 0.00 27.48 27.40 2rl5 h GLN 1170CO 0.00 0.40 0.98 -3.47 -0.95 0.00 0.00 178.83 175.79 2rl5 n ASP 1171N -3.03 6.22 -1.40 1.46 -0.08 -0.68 -4.83 116.55 114.21 2rl5 n ASP 1171Ca -0.05 -3.37 0.07 0.00 -1.51 0.00 0.00 54.79 49.94 2rl5 n ASP 1171Cb 0.80 -1.30 0.30 0.00 2.34 0.00 0.00 41.12 43.26 2rl5 n ASP 1171CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2rl5 n ARG 1172N 1.73 3.40 -0.26 -0.67 1.74 -1.26 -4.57 116.66 116.76 2rl5 n ARG 1172Ca 0.28 -2.37 0.04 0.00 -0.77 0.00 0.00 57.85 55.03 2rl5 n ARG 1172Cb 0.34 -1.84 0.17 0.00 -1.02 0.00 0.00 32.46 30.11 2rl5 n ARG 1172CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2rl5 h HIS 1173N 3.33 0.62 -0.69 -1.55 2.76 -1.95 -2.60 115.15 115.07 2rl5 h HIS 1173Ca 0.00 0.03 -0.29 0.00 -2.20 0.00 0.00 60.37 57.92 2rl5 h HIS 1173Cb 1.31 -0.16 -0.17 0.00 1.55 0.00 0.00 27.41 29.94 2rl5 h HIS 1173CO 0.68 0.16 0.36 0.72 -1.30 0.00 0.00 177.93 178.55 2rl5 n HIS 1174N -4.91 2.20 1.29 5.26 8.25 -1.26 -5.20 115.22 120.86 2rl5 n HIS 1174Ca 0.13 -1.27 0.13 0.00 -0.26 0.00 0.00 57.72 56.46 2rl5 n HIS 1174Cb 0.35 -0.69 0.35 0.00 1.12 0.00 0.00 29.99 31.12 2rl5 n HIS 1174CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70