#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hng s VAL 804 N 0.00 4.97 0.86 6.31 1.01 -1.26 -5.04 120.40 127.25 3hng s VAL 804 Ca 0.00 0.68 -0.13 0.00 0.00 0.00 0.00 61.98 62.53 3hng s VAL 804 Cb 0.00 -3.98 0.04 0.00 0.00 0.00 0.00 36.38 32.45 3hng s VAL 804 CO 0.00 -0.15 0.70 -2.65 0.00 0.00 0.00 175.10 172.99 3hng n PRO 805 N 5.82 -0.07 -0.18 2.72 -0.02 -1.26 -4.77 135.00 137.24 3hng n PRO 805 Ca -0.03 0.04 -0.05 0.00 -2.02 0.00 0.00 63.50 61.45 3hng n PRO 805 Cb 0.49 -2.04 0.14 0.00 -0.02 0.00 0.00 33.50 32.07 3hng n PRO 805 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3hng h LEU 806 N -1.18 0.89 -0.34 2.45 5.85 -1.00 -2.53 115.31 119.45 3hng h LEU 806 Ca -0.44 -0.17 -0.16 0.00 0.84 0.00 0.00 57.88 57.94 3hng h LEU 806 Cb 1.30 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 3hng h LEU 806 CO 0.39 0.87 -0.41 -2.24 -0.34 0.00 0.00 178.44 176.71 3hng h ASP 807 N 0.90 0.95 1.50 1.25 2.03 -1.90 -1.06 116.42 120.10 3hng h ASP 807 Ca 0.19 -0.49 0.00 0.00 -0.73 0.00 0.00 57.03 56.01 3hng h ASP 807 Cb 0.33 -0.27 0.00 0.00 -0.83 0.00 0.00 39.33 38.56 3hng h ASP 807 CO 0.00 1.25 0.00 -0.33 -1.03 0.00 0.00 179.24 179.13 3hng h GLU 808 N 0.68 0.00 0.00 4.15 5.08 -1.92 -2.87 114.58 119.70 3hng h GLU 808 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3hng h GLU 808 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 3hng h GLU 808 CO 0.10 0.00 -0.33 0.94 -1.00 0.00 0.00 179.01 178.72 3hng n GLN 809 N -2.70 0.27 -0.81 2.33 7.27 -0.96 -4.09 117.38 118.70 3hng n GLN 809 Ca 0.04 0.14 -0.13 0.00 0.07 0.00 0.00 57.00 57.12 3hng n GLN 809 Cb 0.42 -1.73 0.03 0.00 2.41 0.00 0.00 30.24 31.37 3hng n GLN 809 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3hng n GLU 811 N 0.56 2.25 0.00 0.00 4.71 -1.26 -4.87 120.64 122.03 3hng n GLU 811 Ca 0.24 -4.03 0.00 0.00 -0.01 0.00 0.00 57.16 53.36 3hng n GLU 811 Cb 0.57 -1.88 0.00 0.00 -1.01 0.00 0.00 31.44 29.12 3hng n GLU 811 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 3hng n ARG 812 N -0.14 0.00 0.00 3.49 1.74 -1.24 -5.18 116.66 115.33 3hng n ARG 812 Ca 0.26 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.34 3hng n ARG 812 Cb 0.63 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.07 3hng n ARG 812 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3hng n PRO 814 N 0.00 0.00 -2.88 5.56 -0.04 -1.26 -5.15 135.00 131.23 3hng n PRO 814 Ca 0.00 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.06 3hng n PRO 814 Cb 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.41 3hng n PRO 814 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 3hng s TYR 815 N 0.00 3.75 -0.91 0.54 5.04 -1.26 -5.01 117.35 119.50 3hng s TYR 815 Ca 0.00 1.59 -0.01 0.00 -2.44 0.00 0.00 57.07 56.21 3hng s TYR 815 Cb 0.00 -2.92 0.27 0.00 0.35 0.00 0.00 41.96 39.66 3hng s TYR 815 CO 0.00 0.23 1.08 -3.47 -1.34 0.00 0.00 175.55 172.05 3hng n ASP 816 N 2.90 5.08 -0.32 4.32 4.64 -1.26 -4.85 116.55 127.06 3hng n ASP 816 Ca -0.00 -3.33 0.19 0.00 -1.38 0.00 0.00 54.79 50.26 3hng n ASP 816 Cb 0.50 -1.05 0.44 0.00 -1.04 0.00 0.00 41.12 39.96 3hng n ASP 816 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3hng h ALA 817 N 5.28 2.00 -1.65 -1.67 0.00 -1.94 0.51 119.26 121.79 3hng h ALA 817 Ca 0.19 0.07 0.49 0.00 0.00 0.00 0.00 54.91 55.66 3hng h ALA 817 Cb 0.69 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.38 3hng h ALA 817 CO 1.06 -0.39 1.16 0.45 0.00 0.00 0.00 179.25 181.53 3hng n SER 818 N -4.69 0.04 -0.04 0.00 2.88 -1.26 -1.69 113.62 108.86 3hng n SER 818 Ca 0.24 0.96 -0.05 0.00 -1.33 0.00 0.00 58.87 58.70 3hng n SER 818 Cb 0.74 -0.48 -0.05 0.00 -0.75 0.00 0.00 64.21 63.68 3hng n SER 818 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 3hng n LYS 819 N -3.87 1.86 -0.00 -1.46 4.81 0.17 -4.83 118.16 114.84 3hng n LYS 819 Ca 0.39 0.02 0.02 0.00 -0.87 0.00 0.00 58.31 57.87 3hng n LYS 819 Cb 1.71 -1.18 -0.03 0.00 0.02 0.00 0.00 35.03 35.55 3hng n LYS 819 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 3hng n TRP 820 N -2.45 0.00 -1.94 5.64 7.02 -0.68 -5.02 117.44 120.01 3hng n TRP 820 Ca -0.13 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 55.94 3hng n TRP 820 Cb 0.71 -0.08 -0.00 0.00 -2.42 0.00 0.00 31.31 29.51 3hng n TRP 820 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 3hng s GLU 821 N -2.14 4.06 -0.03 -0.99 2.56 -0.74 -1.21 118.70 120.21 3hng s GLU 821 Ca -0.01 2.36 -0.01 0.00 0.00 0.00 0.00 54.97 57.31 3hng s GLU 821 Cb 0.03 -2.89 0.03 0.00 2.00 0.00 0.00 34.13 33.30 3hng s GLU 821 CO 0.18 -0.49 0.05 0.12 -0.56 0.00 0.00 175.26 174.57 3hng s PHE 822 N -1.17 0.00 0.10 5.30 5.36 -0.31 -4.79 117.98 122.48 3hng s PHE 822 Ca 0.54 0.21 -0.32 0.00 -0.96 0.00 0.00 56.93 56.40 3hng s PHE 822 Cb -0.42 -0.25 -0.11 0.00 -0.34 0.00 0.00 43.02 41.89 3hng s PHE 822 CO 0.56 -0.12 1.84 0.00 -1.46 0.00 0.00 175.22 176.04 3hng n ALA 823 N 4.38 2.00 -0.29 11.12 0.00 -1.26 -4.40 120.51 132.05 3hng n ALA 823 Ca -0.24 0.31 0.15 0.00 0.00 0.00 0.00 53.44 53.67 3hng n ALA 823 Cb 0.50 -2.58 0.41 0.00 0.00 0.00 0.00 19.45 17.79 3hng n ALA 823 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3hng h ARG 824 N 8.58 0.58 0.00 0.00 9.65 -1.97 -0.96 114.38 130.28 3hng h ARG 824 Ca -0.47 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.38 3hng h ARG 824 Cb 1.23 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.68 3hng h ARG 824 CO 0.94 0.39 0.00 0.93 2.80 0.00 0.00 179.97 185.03 3hng h GLU 825 N 0.60 0.00 -0.06 0.20 3.07 -2.02 -2.47 114.58 113.90 3hng h GLU 825 Ca 0.51 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.37 3hng h GLU 825 Cb 0.99 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.90 3hng h GLU 825 CO -0.26 0.00 0.00 0.54 -1.40 0.00 0.00 179.01 177.89 3hng n ARG 826 N -2.87 1.45 -4.54 2.33 1.74 -0.36 -4.81 116.66 109.61 3hng n ARG 826 Ca -0.03 -0.66 -0.33 0.00 -0.77 0.00 0.00 57.85 56.06 3hng n ARG 826 Cb 0.06 -1.42 -0.13 0.00 -1.02 0.00 0.00 32.46 29.95 3hng n ARG 826 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hng s LEU 827 N -1.79 3.08 -0.30 0.55 1.43 -0.93 -1.07 118.68 119.65 3hng s LEU 827 Ca 0.36 -0.18 -0.07 0.00 -1.03 0.00 0.00 54.13 53.21 3hng s LEU 827 Cb 0.19 -1.72 0.01 0.00 0.03 0.00 0.00 46.19 44.69 3hng s LEU 827 CO 0.30 0.18 0.10 -0.54 0.23 0.00 0.00 176.35 176.62 3hng s LYS 828 N 0.27 3.11 0.37 1.70 1.02 -0.38 -4.97 119.74 120.85 3hng s LYS 828 Ca -0.05 -0.85 -0.25 0.00 0.02 0.00 0.00 55.97 54.83 3hng s LYS 828 Cb -0.14 -3.42 -0.09 0.00 -0.52 0.00 0.00 37.83 33.66 3hng s LYS 828 CO 0.04 -0.45 1.04 -0.51 -0.92 0.00 0.00 175.35 174.54 3hng s LEU 829 N 1.52 4.24 0.00 3.17 1.43 -1.26 -1.22 118.68 126.55 3hng s LEU 829 Ca 0.03 2.05 0.00 0.00 -1.03 0.00 0.00 54.13 55.17 3hng s LEU 829 Cb -0.17 -4.06 0.00 0.00 0.03 0.00 0.00 46.19 41.99 3hng s LEU 829 CO 0.03 -0.37 0.00 0.61 0.23 0.00 0.00 176.35 176.86 3hng n GLY 830 N 0.52 5.46 3.67 -3.19 0.00 0.30 -4.94 105.19 107.02 3hng n GLY 830 Ca 0.03 -1.15 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 3hng n GLY 830 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3hng n LYS 831 N 0.00 0.82 -2.49 1.61 2.85 -1.25 -4.31 118.16 115.39 3hng n LYS 831 Ca 0.00 0.33 -0.35 0.00 -1.05 0.00 0.00 58.31 57.25 3hng n LYS 831 Cb 0.00 -2.35 -0.03 0.00 -0.65 0.00 0.00 35.03 32.00 3hng n LYS 831 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 3hng s SER 832 N -1.48 6.30 0.00 -5.58 0.15 -1.26 -0.99 113.70 110.84 3hng s SER 832 Ca 0.78 2.00 0.00 0.00 0.70 0.00 0.00 55.95 59.43 3hng s SER 832 Cb -0.37 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.37 3hng s SER 832 CO 0.45 -0.81 0.16 0.18 1.20 0.00 0.00 173.24 174.42 3hng n LEU 833 N -0.86 0.32 0.00 3.45 4.77 0.41 -4.82 117.00 120.27 3hng n LEU 833 Ca 0.09 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.47 3hng n LEU 833 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3hng n LEU 833 CO 0.41 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 3hng n GLY 834 N 0.55 1.83 3.22 -0.72 0.00 -1.11 -4.90 105.19 104.05 3hng n GLY 834 Ca 0.00 0.34 -0.32 0.00 0.00 0.00 0.00 46.02 46.03 3hng n GLY 834 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hng s ARG 835 N 0.00 3.09 0.00 1.61 0.52 -1.12 -0.25 118.95 122.79 3hng s ARG 835 Ca 0.00 -0.83 0.00 0.00 -0.52 0.00 0.00 55.73 54.38 3hng s ARG 835 Cb 0.00 -2.43 0.00 0.00 0.52 0.00 0.00 34.95 33.04 3hng s ARG 835 CO 0.00 0.07 0.00 0.41 0.02 0.00 0.00 175.30 175.80 3hng n GLY 836 N 3.85 2.43 0.06 -3.53 0.00 0.20 -2.71 105.19 105.49 3hng n GLY 836 Ca -0.19 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 43.58 3hng n GLY 836 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hng h ALA 837 N 0.23 0.02 -0.03 4.61 0.00 -1.81 -3.37 119.26 118.92 3hng h ALA 837 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3hng h ALA 837 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3hng h ALA 837 CO 0.00 -0.25 0.00 1.19 0.00 0.00 0.00 179.25 180.19 3hng n PHE 838 N -4.86 0.04 -3.98 0.00 3.72 -1.26 -4.84 117.46 106.28 3hng n PHE 838 Ca -0.08 -0.11 -0.09 0.00 -0.05 0.00 0.00 57.45 57.12 3hng n PHE 838 Cb 0.23 -0.01 -0.10 0.00 -0.94 0.00 0.00 39.48 38.66 3hng n PHE 838 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3hng s GLY 839 N -0.47 0.25 0.07 1.37 0.00 -1.15 0.62 107.32 108.00 3hng s GLY 839 Ca 0.05 -0.69 -0.00 0.00 0.00 0.00 0.00 44.72 44.08 3hng s GLY 839 CO 0.05 -0.80 -0.04 -1.59 0.00 0.00 0.00 173.10 170.72 3hng s LYS 840 N -2.52 0.69 -0.11 2.90 -2.85 -0.20 0.60 119.74 118.25 3hng s LYS 840 Ca -0.06 -1.26 0.02 0.00 -1.00 0.00 0.00 55.97 53.67 3hng s LYS 840 Cb -0.02 0.06 -0.01 0.00 -2.06 0.00 0.00 37.83 35.80 3hng s LYS 840 CO -0.04 -0.08 -0.18 0.08 0.10 0.00 0.00 175.35 175.23 3hng s VAL 841 N -3.81 2.59 0.26 1.79 1.01 0.66 -1.77 120.40 121.13 3hng s VAL 841 Ca 0.09 -0.83 0.10 0.00 0.00 0.00 0.00 61.98 61.34 3hng s VAL 841 Cb 0.07 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.35 3hng s VAL 841 CO -0.08 0.54 -0.16 0.68 0.00 0.00 0.00 175.10 176.08 3hng s VAL 842 N 0.33 2.15 0.20 2.92 -7.23 0.22 -0.45 120.40 118.54 3hng s VAL 842 Ca -0.14 -2.31 -0.20 0.00 -1.81 0.00 0.00 61.98 57.52 3hng s VAL 842 Cb -0.17 -2.24 -0.08 0.00 0.56 0.00 0.00 36.38 34.45 3hng s VAL 842 CO 0.07 -0.45 0.71 -1.58 -0.31 0.00 0.00 175.10 173.54 3hng s GLN 843 N -3.58 4.27 0.16 4.82 0.74 -0.17 -0.72 119.66 125.19 3hng s GLN 843 Ca 0.27 0.87 -0.06 0.00 0.05 0.00 0.00 55.36 56.49 3hng s GLN 843 Cb -0.02 -2.97 -0.02 0.00 1.10 0.00 0.00 33.01 31.10 3hng s GLN 843 CO 0.12 0.45 0.22 0.00 -0.55 0.00 0.00 175.29 175.52 3hng s ALA 844 N -1.43 0.29 -0.12 1.58 0.00 -0.68 0.11 121.76 121.52 3hng s ALA 844 Ca 0.40 -1.09 0.03 0.00 0.00 0.00 0.00 51.96 51.30 3hng s ALA 844 Cb -0.18 0.89 -0.00 0.00 0.00 0.00 0.00 23.12 23.83 3hng s ALA 844 CO 0.21 -0.60 -0.21 -1.54 0.00 0.00 0.00 175.76 173.61 3hng s SER 845 N -3.00 3.26 -0.11 0.00 1.04 -0.36 -1.34 113.70 113.20 3hng s SER 845 Ca 0.20 -0.53 0.01 0.00 0.48 0.00 0.00 55.95 56.11 3hng s SER 845 Cb 0.05 -1.46 -0.02 0.00 0.10 0.00 0.00 66.02 64.69 3hng s SER 845 CO 0.01 0.14 -0.12 0.00 0.98 0.00 0.00 173.24 174.25 3hng s ALA 846 N 0.48 2.71 -0.31 5.32 0.00 0.13 -1.25 121.76 128.84 3hng s ALA 846 Ca -0.14 -0.90 -0.08 0.00 0.00 0.00 0.00 51.96 50.83 3hng s ALA 846 Cb -0.17 -1.19 0.01 0.00 0.00 0.00 0.00 23.12 21.77 3hng s ALA 846 CO 0.06 0.36 0.12 0.12 0.00 0.00 0.00 175.76 176.41 3hng s PHE 847 N -0.04 3.17 0.00 0.00 5.36 -0.23 -1.10 117.98 125.15 3hng s PHE 847 Ca -0.02 -0.86 0.00 0.00 -0.96 0.00 0.00 56.93 55.09 3hng s PHE 847 Cb -0.14 -2.30 0.00 0.00 -0.34 0.00 0.00 43.02 40.24 3hng s PHE 847 CO 0.04 -0.55 0.00 0.41 -1.46 0.00 0.00 175.22 173.66 3hng n GLY 848 N 4.91 0.86 3.60 13.12 0.00 -0.43 -4.86 105.19 122.40 3hng n GLY 848 Ca -0.14 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.42 3hng n GLY 848 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hng n ILE 849 N -1.79 1.30 -1.94 -0.61 -0.00 -1.25 -1.51 119.36 113.56 3hng n ILE 849 Ca 0.00 -0.33 -0.18 0.00 -0.00 0.00 0.00 62.75 62.24 3hng n ILE 849 Cb 0.00 -1.01 -0.04 0.00 -0.00 0.00 0.00 39.64 38.58 3hng n ILE 849 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 3hng n LYS 850 N 1.42 -1.35 -1.07 0.38 5.02 -1.26 -2.78 118.16 118.52 3hng n LYS 850 Ca 0.12 1.00 -0.02 0.00 -2.02 0.00 0.00 58.31 57.39 3hng n LYS 850 Cb 0.28 -5.39 -0.01 0.00 -0.02 0.00 0.00 35.03 29.90 3hng n LYS 850 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3hng n LYS 851 N -2.61 -0.38 -3.82 1.97 4.76 -0.57 -4.98 118.16 112.53 3hng n LYS 851 Ca -0.20 0.39 -0.36 0.00 -2.87 0.00 0.00 58.31 55.28 3hng n LYS 851 Cb 0.63 -3.91 -0.12 0.00 -1.84 0.00 0.00 35.03 29.78 3hng n LYS 851 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3hng s SER 852 N -2.49 5.15 -0.74 4.39 0.15 -1.12 -4.98 113.70 114.07 3hng s SER 852 Ca 0.00 -0.17 -0.07 0.00 0.70 0.00 0.00 55.95 56.41 3hng s SER 852 Cb 0.00 -1.92 -0.11 0.00 -1.71 0.00 0.00 66.02 62.28 3hng s SER 852 CO 0.00 -0.00 3.12 -0.81 1.20 0.00 0.00 173.24 176.75 3hng n PRO 853 N 4.70 2.92 -4.68 5.44 -0.04 -1.26 -2.99 135.00 139.09 3hng n PRO 853 Ca -0.16 -1.91 -0.31 0.00 -0.04 0.00 0.00 63.50 61.08 3hng n PRO 853 Cb 0.52 -2.35 -0.07 0.00 -0.04 0.00 0.00 33.50 31.56 3hng n PRO 853 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3hng s THR 854 N 0.51 0.79 -0.06 0.52 -4.23 -1.26 -4.85 115.64 107.06 3hng s THR 854 Ca 0.65 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.22 3hng s THR 854 Cb 0.27 -2.12 -0.01 0.00 1.34 0.00 0.00 72.50 71.98 3hng s THR 854 CO -0.07 0.00 -0.24 0.00 -0.54 0.00 0.00 174.62 173.78 3hng s ARG 856 N -0.22 0.52 -0.22 0.00 3.52 -0.26 -4.97 118.95 117.34 3hng s ARG 856 Ca -0.02 -0.49 -0.11 0.00 -0.13 0.00 0.00 55.73 54.98 3hng s ARG 856 Cb -0.13 0.21 -0.05 0.00 -1.56 0.00 0.00 34.95 33.42 3hng s ARG 856 CO 0.03 -0.13 0.17 0.99 -0.81 0.00 0.00 175.30 175.56 3hng s THR 857 N -1.73 5.37 0.30 4.11 2.01 -1.26 0.21 115.64 124.64 3hng s THR 857 Ca -0.12 0.25 0.02 0.00 0.31 0.00 0.00 61.69 62.15 3hng s THR 857 Cb -0.06 -3.51 -0.05 0.00 0.01 0.00 0.00 72.50 68.89 3hng s THR 857 CO -0.00 0.38 0.09 0.68 -0.69 0.00 0.00 174.62 175.08 3hng s VAL 858 N 0.75 0.75 -0.03 3.82 -7.23 -0.45 -3.96 120.40 114.05 3hng s VAL 858 Ca 0.09 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.32 3hng s VAL 858 Cb -0.13 -2.66 -0.02 0.00 0.56 0.00 0.00 36.38 34.13 3hng s VAL 858 CO 0.02 0.00 -0.19 0.00 -0.31 0.00 0.00 175.10 174.62 3hng s ALA 859 N -3.55 2.49 -0.13 1.32 0.00 -0.65 -1.68 121.76 119.56 3hng s ALA 859 Ca 0.36 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 51.27 3hng s ALA 859 Cb 0.07 -0.80 0.02 0.00 0.00 0.00 0.00 23.12 22.42 3hng s ALA 859 CO 0.15 0.55 -0.11 0.08 0.00 0.00 0.00 175.76 176.42 3hng s VAL 860 N -0.72 1.31 -0.08 0.00 1.01 0.10 -1.23 120.40 120.79 3hng s VAL 860 Ca 0.11 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.59 3hng s VAL 860 Cb -0.10 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 3hng s VAL 860 CO 0.01 0.41 0.04 -0.75 0.00 0.00 0.00 175.10 174.81 3hng s LYS 861 N 1.49 3.08 -0.01 2.72 2.20 -0.37 -0.61 119.74 128.26 3hng s LYS 861 Ca 0.03 -0.36 -0.28 0.00 -0.36 0.00 0.00 55.97 55.00 3hng s LYS 861 Cb -0.13 -2.88 0.10 0.00 -1.51 0.00 0.00 37.83 33.40 3hng s LYS 861 CO -0.08 0.71 0.82 0.00 -0.36 0.00 0.00 175.35 176.44 3hng s MET 862 N -1.03 0.91 0.47 4.03 0.23 -0.73 -1.01 119.30 122.17 3hng s MET 862 Ca 0.15 -0.18 -0.23 0.00 -1.03 0.00 0.00 55.69 54.40 3hng s MET 862 Cb -0.12 0.42 -0.07 0.00 -1.53 0.00 0.00 34.83 33.53 3hng s MET 862 CO 0.04 -0.36 1.16 -0.51 -2.03 0.00 0.00 175.02 173.32 3hng s LEU 863 N -2.11 3.99 0.38 0.18 1.43 -1.26 -1.04 118.68 120.25 3hng s LEU 863 Ca 0.01 2.30 0.00 0.00 -1.03 0.00 0.00 54.13 55.41 3hng s LEU 863 Cb -0.01 -4.27 -0.02 0.00 0.03 0.00 0.00 46.19 41.92 3hng s LEU 863 CO -0.05 -0.95 0.59 -0.54 0.23 0.00 0.00 176.35 175.64 3hng s LYS 864 N -2.75 3.37 0.55 1.70 1.02 0.20 -4.75 119.74 119.09 3hng s LYS 864 Ca 0.64 -0.36 -0.20 0.00 0.02 0.00 0.00 55.97 56.07 3hng s LYS 864 Cb -0.28 -2.62 -0.05 0.00 -0.52 0.00 0.00 37.83 34.36 3hng s LYS 864 CO 0.34 0.01 1.24 -1.83 -0.92 0.00 0.00 175.35 174.20 3hng s GLU 865 N -4.41 3.17 0.00 1.68 -1.05 -1.26 -1.95 118.70 114.89 3hng s GLU 865 Ca 0.43 1.94 0.00 0.00 -0.15 0.00 0.00 54.97 57.19 3hng s GLU 865 Cb -0.10 -2.12 0.00 0.00 -0.44 0.00 0.00 34.13 31.48 3hng s GLU 865 CO 0.37 -1.08 0.00 0.41 0.95 0.00 0.00 175.26 175.91 3hng n GLY 866 N 0.58 3.19 3.77 -3.83 0.00 -1.26 -4.91 105.19 102.72 3hng n GLY 866 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 3hng n GLY 866 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hng s ALA 867 N -2.98 3.20 0.40 4.61 0.00 -0.82 -5.03 121.76 121.14 3hng s ALA 867 Ca 0.00 1.06 0.04 0.00 0.00 0.00 0.00 51.96 53.06 3hng s ALA 867 Cb 0.00 -3.42 0.04 0.00 0.00 0.00 0.00 23.12 19.75 3hng s ALA 867 CO 0.00 -0.62 0.36 0.25 0.00 0.00 0.00 175.76 175.75 3hng n THR 868 N 0.14 0.00 0.24 0.00 -2.24 -1.26 -4.98 114.28 106.17 3hng n THR 868 Ca 0.04 -1.52 0.09 0.00 -2.27 0.00 0.00 64.05 60.39 3hng n THR 868 Cb 0.45 -0.27 0.61 0.00 -2.10 0.00 0.00 70.33 69.03 3hng n THR 868 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hng h ALA 869 N 0.59 1.46 -0.29 6.98 0.00 -1.99 -2.25 119.26 123.76 3hng h ALA 869 Ca -0.24 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.59 3hng h ALA 869 Cb 0.91 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.61 3hng h ALA 869 CO 0.37 0.20 -0.11 0.77 0.00 0.00 0.00 179.25 180.48 3hng h SER 870 N 0.00 -0.37 0.20 0.00 0.02 -1.99 0.27 113.55 111.68 3hng h SER 870 Ca -0.00 0.10 -0.13 0.00 -0.84 0.00 0.00 61.79 60.92 3hng h SER 870 Cb 0.35 0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 3hng h SER 870 CO 0.02 -0.14 -0.47 -0.33 -1.14 0.00 0.00 176.83 174.77 3hng h GLU 871 N -0.05 0.33 -0.13 3.45 3.07 -1.81 -0.70 114.58 118.74 3hng h GLU 871 Ca 0.15 -0.18 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3hng h GLU 871 Cb 0.27 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 3hng h GLU 871 CO -0.33 0.73 0.08 -0.92 -1.40 0.00 0.00 179.01 177.17 3hng h TYR 872 N 0.26 0.14 -0.80 4.33 3.20 -1.09 -0.38 116.97 122.64 3hng h TYR 872 Ca 0.02 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 3hng h TYR 872 Cb 0.93 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 39.12 3hng h TYR 872 CO 0.02 0.09 0.44 -0.22 -1.64 0.00 0.00 178.16 176.85 3hng h LYS 873 N 0.16 1.10 -0.65 1.82 1.63 -0.81 0.56 116.57 120.38 3hng h LYS 873 Ca 0.05 -0.12 -0.02 0.00 -0.85 0.00 0.00 60.65 59.71 3hng h LYS 873 Cb -0.01 -0.22 -0.03 0.00 -0.60 0.00 0.00 32.23 31.37 3hng h LYS 873 CO -0.02 0.80 0.32 0.00 -3.45 0.00 0.00 179.45 177.10 3hng h ALA 874 N 1.37 0.84 0.02 5.00 0.00 -0.66 0.68 119.26 126.51 3hng h ALA 874 Ca 0.28 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.83 3hng h ALA 874 Cb 0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3hng h ALA 874 CO -0.05 0.39 -0.97 1.25 0.00 0.00 0.00 179.25 179.88 3hng h LEU 875 N 0.89 0.45 -0.95 0.00 5.85 -0.55 -0.86 115.31 120.14 3hng h LEU 875 Ca 0.22 -0.38 -0.04 0.00 0.84 0.00 0.00 57.88 58.52 3hng h LEU 875 Cb 0.11 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 3hng h LEU 875 CO -0.03 1.19 0.25 -0.03 -0.34 0.00 0.00 178.44 179.48 3hng h MET 876 N 0.18 1.01 -0.46 1.25 4.05 -0.77 -0.67 114.93 119.53 3hng h MET 876 Ca -0.08 -0.18 -0.09 0.00 -0.28 0.00 0.00 59.70 59.07 3hng h MET 876 Cb 1.61 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 32.23 3hng h MET 876 CO 0.16 0.84 -0.07 1.15 0.23 0.00 0.00 176.91 179.21 3hng h THR 877 N 0.99 1.25 -0.59 -0.77 2.02 -0.49 -1.71 112.91 113.61 3hng h THR 877 Ca 0.23 -1.13 -0.03 0.00 0.77 0.00 0.00 66.41 66.25 3hng h THR 877 Cb 0.22 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 3hng h THR 877 CO -0.02 0.39 0.24 -0.08 0.37 0.00 0.00 175.52 176.42 3hng h GLU 878 N 0.73 0.88 -0.02 6.66 4.81 -0.58 -1.82 114.58 125.24 3hng h GLU 878 Ca 0.13 -0.16 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3hng h GLU 878 Cb 0.55 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.79 3hng h GLU 878 CO 0.03 0.75 0.01 1.25 -0.73 0.00 0.00 179.01 180.33 3hng h LEU 879 N 0.81 0.03 -0.36 1.64 5.85 -0.89 -0.40 115.31 121.99 3hng h LEU 879 Ca 0.20 -0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.93 3hng h LEU 879 Cb 0.20 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 3hng h LEU 879 CO -0.02 0.07 -0.03 0.11 -0.34 0.00 0.00 178.44 178.23 3hng h LYS 880 N -0.02 0.06 -0.16 1.25 1.57 -1.20 -0.25 116.57 117.82 3hng h LYS 880 Ca 0.01 -0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 3hng h LYS 880 Cb 0.05 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 3hng h LYS 880 CO -0.00 0.04 -0.11 0.82 -0.57 0.00 0.00 179.45 179.63 3hng h ILE 881 N 0.06 0.68 0.00 1.86 2.04 -1.06 -0.87 117.51 120.21 3hng h ILE 881 Ca 0.17 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.03 3hng h ILE 881 Cb 0.25 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 3hng h ILE 881 CO -0.32 0.00 -0.02 -0.07 0.00 0.00 0.00 178.15 177.74 3hng h LEU 882 N -0.11 0.00 0.01 1.44 3.38 -0.21 -2.91 115.31 116.91 3hng h LEU 882 Ca 0.10 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 3hng h LEU 882 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3hng h LEU 882 CO -0.23 0.02 -0.34 0.71 0.09 0.00 0.00 178.44 178.69 3hng h THR 883 N 0.00 1.58 -0.91 0.22 1.35 0.28 -3.35 112.91 112.08 3hng h THR 883 Ca -0.00 -2.33 -0.72 0.00 -0.55 0.00 0.00 66.41 62.81 3hng h THR 883 Cb 0.15 3.13 -0.09 0.00 -1.73 0.00 0.00 68.15 69.61 3hng h THR 883 CO 0.00 0.56 2.64 1.41 -0.25 0.00 0.00 175.52 179.88 3hng n HIS 884 N -4.53 2.52 0.06 4.73 8.25 -0.70 -4.35 115.22 121.20 3hng n HIS 884 Ca -0.15 -2.85 0.00 0.00 -0.26 0.00 0.00 57.72 54.46 3hng n HIS 884 Cb 0.55 -1.95 0.00 0.00 1.12 0.00 0.00 29.99 29.71 3hng n HIS 884 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 3hng n ILE 885 N 2.07 1.04 0.00 1.59 3.06 -1.19 -4.91 119.36 121.03 3hng n ILE 885 Ca 0.65 0.34 0.00 0.00 -2.50 0.00 0.00 62.75 61.25 3hng n ILE 885 Cb 0.26 -1.43 0.00 0.00 0.54 0.00 0.00 39.64 39.01 3hng n ILE 885 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3hng n GLY 886 N 3.20 -0.80 0.54 4.50 0.00 -1.26 -5.02 105.19 106.35 3hng n GLY 886 Ca 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 3hng n GLY 886 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3hng n HIS 887 N 0.00 0.01 -4.17 1.61 -0.00 -1.26 -4.98 115.22 106.43 3hng n HIS 887 Ca 0.00 -0.42 -0.16 0.00 -0.00 0.00 0.00 57.72 57.13 3hng n HIS 887 Cb 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 29.87 3hng n HIS 887 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 3hng s HIS 888 N -1.82 0.90 0.35 4.41 5.04 -1.26 -5.04 115.29 117.87 3hng s HIS 888 Ca 0.04 -0.40 0.05 0.00 -1.54 0.00 0.00 55.06 53.21 3hng s HIS 888 Cb 0.00 -0.53 0.71 0.00 0.04 0.00 0.00 32.58 32.80 3hng s HIS 888 CO 0.03 -0.01 1.94 1.25 -2.34 0.00 0.00 174.74 175.60 3hng h LEU 889 N 4.77 0.71 -3.59 8.88 5.85 -1.99 -2.44 115.31 127.50 3hng h LEU 889 Ca -0.36 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.27 3hng h LEU 889 Cb 1.19 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.03 3hng h LEU 889 CO 0.43 0.45 0.11 0.59 -0.34 0.00 0.00 178.44 179.67 3hng n ASN 890 N -4.49 5.03 -4.20 1.25 5.03 -1.26 -4.79 115.26 111.83 3hng n ASN 890 Ca 0.12 -3.09 -0.23 0.00 0.87 0.00 0.00 54.58 52.24 3hng n ASN 890 Cb 0.25 -0.69 -0.14 0.00 -1.02 0.00 0.00 39.78 38.18 3hng n ASN 890 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3hng s VAL 891 N -2.89 1.41 -0.00 2.41 1.01 -0.92 -1.37 120.40 120.05 3hng s VAL 891 Ca 0.53 -1.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.12 3hng s VAL 891 Cb 0.42 -1.24 -0.08 0.00 0.00 0.00 0.00 36.38 35.47 3hng s VAL 891 CO 0.13 0.12 2.02 0.52 0.00 0.00 0.00 175.10 177.89 3hng n VAL 892 N 1.90 0.71 -2.94 2.92 0.31 -0.32 -4.57 118.33 116.35 3hng n VAL 892 Ca -0.17 -0.19 -0.41 0.00 -0.01 0.00 0.00 64.34 63.56 3hng n VAL 892 Cb 0.54 -2.36 -0.04 0.00 -0.91 0.00 0.00 33.84 31.07 3hng n VAL 892 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3hng s ASN 893 N 5.05 7.04 0.24 4.52 -0.87 -1.26 -4.90 114.94 124.76 3hng s ASN 893 Ca 0.91 1.26 -0.31 0.00 -1.57 0.00 0.00 52.86 53.15 3hng s ASN 893 Cb -0.42 -2.45 -0.12 0.00 -0.02 0.00 0.00 41.25 38.24 3hng s ASN 893 CO 0.41 -0.24 1.66 -0.22 -2.57 0.00 0.00 177.10 176.14 3hng s LEU 894 N 1.30 4.36 -0.11 0.60 2.96 -1.26 -1.51 118.68 125.02 3hng s LEU 894 Ca 0.40 2.88 0.10 0.00 -0.22 0.00 0.00 54.13 57.29 3hng s LEU 894 Cb -0.18 -3.61 -0.13 0.00 0.50 0.00 0.00 46.19 42.76 3hng s LEU 894 CO 0.18 -0.94 0.03 0.18 -1.32 0.00 0.00 176.35 174.49 3hng n LEU 895 N 3.22 0.06 0.00 -0.68 4.77 0.17 -4.89 117.00 119.65 3hng n LEU 895 Ca 0.12 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 3hng n LEU 895 Cb 0.36 0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 3hng n LEU 895 CO 0.64 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 3hng n GLY 896 N 2.33 -1.28 3.44 -0.72 0.00 -0.93 -4.53 105.19 103.50 3hng n GLY 896 Ca -0.18 -0.92 -0.17 0.00 0.00 0.00 0.00 46.02 44.75 3hng n GLY 896 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hng s ALA 897 N -1.00 -1.50 -0.22 4.61 0.00 -0.35 -1.43 121.76 121.87 3hng s ALA 897 Ca 0.00 1.05 -0.06 0.00 0.00 0.00 0.00 51.96 52.96 3hng s ALA 897 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 3hng s ALA 897 CO 0.00 -0.34 0.02 0.00 0.00 0.00 0.00 175.76 175.44 3hng n THR 899 N 4.47 0.03 -0.85 0.00 -2.24 -1.26 -2.05 114.28 112.37 3hng n THR 899 Ca -0.17 -0.08 -0.33 0.00 -2.27 0.00 0.00 64.05 61.19 3hng n THR 899 Cb 0.52 1.69 -0.05 0.00 -2.10 0.00 0.00 70.33 70.38 3hng n THR 899 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3hng n LYS 900 N -0.01 0.00 -1.92 -0.78 4.76 -1.26 -4.80 118.16 114.15 3hng n LYS 900 Ca 0.00 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.03 3hng n LYS 900 Cb 0.26 -0.80 -0.01 0.00 -1.84 0.00 0.00 35.03 32.65 3hng n LYS 900 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3hng s GLN 901 N 0.66 4.20 0.00 1.97 -0.21 -1.26 -1.12 119.66 123.90 3hng s GLN 901 Ca 0.51 2.44 0.00 0.00 0.02 0.00 0.00 55.36 58.34 3hng s GLN 901 Cb -0.73 -3.01 0.00 0.00 1.00 0.00 0.00 33.01 30.28 3hng s GLN 901 CO 0.36 -0.41 0.00 0.41 -2.12 0.00 0.00 175.29 173.53 3hng n GLY 902 N 0.64 2.64 3.92 3.09 0.00 -1.26 -5.04 105.19 109.18 3hng n GLY 902 Ca 0.01 -0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 3hng n GLY 902 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hng s GLY 903 N -1.26 1.55 0.27 -0.02 0.00 -0.27 -5.04 107.32 102.55 3hng s GLY 903 Ca 0.00 -0.72 -0.29 0.00 0.00 0.00 0.00 44.72 43.70 3hng s GLY 903 CO 0.00 -0.51 1.29 2.56 0.00 0.00 0.00 173.10 176.44 3hng s PRO 904 N -4.80 4.40 0.23 2.90 0.04 -1.26 -4.81 135.00 131.70 3hng s PRO 904 Ca 0.50 2.11 -0.30 0.00 0.04 0.00 0.00 61.00 63.35 3hng s PRO 904 Cb -0.10 -3.13 -0.09 0.00 0.04 0.00 0.00 34.50 31.22 3hng s PRO 904 CO 0.43 -0.17 1.28 -1.17 0.04 0.00 0.00 177.00 177.41 3hng s LEU 905 N -1.08 4.43 -0.13 -3.56 2.96 -1.26 -4.59 118.68 115.45 3hng s LEU 905 Ca 0.52 2.42 -0.07 0.00 -0.22 0.00 0.00 54.13 56.78 3hng s LEU 905 Cb -0.38 -3.62 0.05 0.00 0.50 0.00 0.00 46.19 42.75 3hng s LEU 905 CO 0.46 -0.48 0.31 -0.04 -1.32 0.00 0.00 176.35 175.28 3hng s MET 906 N -0.54 0.27 -0.26 1.98 -1.94 -0.87 -4.29 119.30 113.66 3hng s MET 906 Ca 0.54 0.66 -0.07 0.00 -1.71 0.00 0.00 55.69 55.11 3hng s MET 906 Cb -0.36 -0.06 -0.02 0.00 2.01 0.00 0.00 34.83 36.40 3hng s MET 906 CO 0.41 -0.18 0.06 0.08 -0.01 0.00 0.00 175.02 175.38 3hng s VAL 907 N 1.47 4.15 -0.19 -6.03 1.01 -0.18 -0.69 120.40 119.94 3hng s VAL 907 Ca -0.08 -0.31 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 3hng s VAL 907 Cb -0.10 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.28 3hng s VAL 907 CO -0.10 0.29 -0.01 -0.63 0.00 0.00 0.00 175.10 174.65 3hng s ILE 908 N 1.58 3.97 0.33 2.22 1.01 -0.51 -1.23 121.20 128.57 3hng s ILE 908 Ca 0.06 -0.31 0.04 0.00 0.00 0.00 0.00 60.65 60.43 3hng s ILE 908 Cb -0.15 -2.78 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 3hng s ILE 908 CO 0.03 0.45 0.15 0.68 0.00 0.00 0.00 174.94 176.25 3hng s VAL 909 N 0.77 0.45 0.40 2.92 -7.23 -0.37 0.42 120.40 117.78 3hng s VAL 909 Ca -0.00 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 57.93 3hng s VAL 909 Cb -0.14 -2.49 -0.09 0.00 0.56 0.00 0.00 36.38 34.22 3hng s VAL 909 CO 0.02 0.00 1.09 -1.83 -0.31 0.00 0.00 175.10 174.07 3hng s GLU 910 N -3.77 4.11 -0.05 4.82 -1.05 -0.57 -1.64 118.70 120.55 3hng s GLU 910 Ca 0.33 1.62 -0.22 0.00 -0.15 0.00 0.00 54.97 56.55 3hng s GLU 910 Cb 0.05 -2.58 -0.04 0.00 -0.44 0.00 0.00 34.13 31.11 3hng s GLU 910 CO 0.17 -0.21 0.64 -0.47 0.95 0.00 0.00 175.26 176.34 3hng s TYR 911 N -1.58 3.61 -0.40 4.83 5.04 -1.25 -4.52 117.35 123.08 3hng s TYR 911 Ca 0.58 1.20 -0.08 0.00 -2.44 0.00 0.00 57.07 56.33 3hng s TYR 911 Cb -0.25 -2.71 0.07 0.00 0.35 0.00 0.00 41.96 39.42 3hng s TYR 911 CO 0.31 0.19 0.22 0.00 -1.34 0.00 0.00 175.55 174.93 3hng h LYS 913 N 8.34 0.00 -0.55 0.00 3.64 -1.89 -3.25 116.57 122.86 3hng h LYS 913 Ca -0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 3hng h LYS 913 Cb 1.08 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 3hng h LYS 913 CO 0.72 0.16 0.00 0.66 -2.27 0.00 0.00 179.45 178.72 3hng n TYR 914 N -4.32 1.88 -4.97 1.91 4.01 -0.84 -5.05 117.16 109.78 3hng n TYR 914 Ca -0.03 -0.73 0.00 0.00 -0.16 0.00 0.00 57.90 56.98 3hng n TYR 914 Cb 0.22 -0.46 0.00 0.00 -0.31 0.00 0.00 39.34 38.80 3hng n TYR 914 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hng n GLY 915 N 0.55 -0.48 3.87 2.72 0.00 -1.23 -4.73 105.19 105.90 3hng n GLY 915 Ca 0.27 -0.96 -0.30 0.00 0.00 0.00 0.00 46.02 45.03 3hng n GLY 915 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hng s ASN 916 N -4.00 5.05 0.08 1.61 2.20 -1.26 -1.58 114.94 117.05 3hng s ASN 916 Ca 0.00 1.11 0.03 0.00 -0.94 0.00 0.00 52.86 53.06 3hng s ASN 916 Cb 0.00 -1.84 -0.24 0.00 -2.00 0.00 0.00 41.25 37.17 3hng s ASN 916 CO 0.00 -1.59 1.15 0.25 -2.94 0.00 0.00 177.10 173.97 3hng h LEU 917 N -0.83 0.16 0.19 3.54 5.85 -1.01 -2.60 115.31 120.61 3hng h LEU 917 Ca -0.46 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.09 3hng h LEU 917 Cb 1.27 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 3hng h LEU 917 CO 0.63 1.15 -0.25 -1.28 -0.34 0.00 0.00 178.44 178.35 3hng h SER 918 N 0.03 -0.68 -0.58 1.25 0.87 -1.84 -0.73 113.55 111.88 3hng h SER 918 Ca -0.09 0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.51 3hng h SER 918 Cb 1.87 0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 64.05 3hng h SER 918 CO 0.15 -0.35 0.23 0.78 -0.53 0.00 0.00 176.83 177.11 3hng h ASN 919 N -0.49 0.80 -0.49 6.23 2.35 -1.89 -1.79 115.58 120.29 3hng h ASN 919 Ca 0.01 -0.17 0.05 0.00 -0.55 0.00 0.00 56.30 55.64 3hng h ASN 919 Cb 0.48 -0.21 -0.05 0.00 0.05 0.00 0.00 38.32 38.60 3hng h ASN 919 CO -0.09 0.76 0.23 0.22 -1.65 0.00 0.00 177.43 176.90 3hng h TYR 920 N 0.80 0.43 -0.22 1.19 3.20 -1.32 -0.54 116.97 120.51 3hng h TYR 920 Ca 0.19 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 62.01 3hng h TYR 920 Cb 0.20 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.35 3hng h TYR 920 CO 0.01 0.20 -0.16 -0.07 -1.64 0.00 0.00 178.16 176.49 3hng h LEU 921 N 0.46 0.52 -1.90 2.82 3.38 -0.95 -1.94 115.31 117.70 3hng h LEU 921 Ca 0.22 -0.45 0.28 0.00 0.09 0.00 0.00 57.88 58.03 3hng h LEU 921 Cb 0.16 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 3hng h LEU 921 CO -0.17 0.86 0.78 0.11 0.09 0.00 0.00 178.44 180.10 3hng h LYS 922 N 0.19 0.00 0.00 1.13 1.57 -1.04 0.55 116.57 118.97 3hng h LYS 922 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3hng h LYS 922 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3hng h LYS 922 CO 0.04 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.79 3hng n SER 923 N -4.00 0.00 0.00 0.86 3.41 -0.24 -2.76 113.62 110.90 3hng n SER 923 Ca 0.20 -0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 3hng n SER 923 Cb 1.10 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 3hng n SER 923 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3hng n LYS 924 N -1.22 4.13 0.00 4.33 5.02 0.71 -5.09 118.16 126.04 3hng n LYS 924 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 3hng n LYS 924 Cb 0.20 -0.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.71 3hng n LYS 924 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3hng n ARG 925 N -0.81 0.00 -3.48 1.97 0.63 0.16 -5.01 116.66 110.11 3hng n ARG 925 Ca 0.00 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.50 3hng n ARG 925 Cb 0.00 -0.95 -0.06 0.00 0.45 0.00 0.00 32.46 31.91 3hng n ARG 925 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 3hng s LYS 991 N -1.18 3.00 0.07 -0.14 2.47 -1.26 -5.06 119.74 117.64 3hng s LYS 991 Ca 0.00 -2.22 -0.07 0.00 -1.56 0.00 0.00 55.97 52.11 3hng s LYS 991 Cb 0.00 -4.12 -0.01 0.00 -1.46 0.00 0.00 37.83 32.24 3hng s LYS 991 CO 0.00 -1.24 0.15 -1.21 0.16 0.00 0.00 175.35 173.21 3hng s GLU 992 N 0.57 0.76 0.17 4.03 2.02 -1.26 -5.15 118.70 119.85 3hng s GLU 992 Ca 0.13 -0.90 -0.30 0.00 0.02 0.00 0.00 54.97 53.91 3hng s GLU 992 Cb -0.19 0.30 -0.08 0.00 0.10 0.00 0.00 34.13 34.26 3hng s GLU 992 CO -0.04 -0.22 1.29 -1.25 0.02 0.00 0.00 175.26 175.05 3hng s PRO 993 N -3.47 4.41 0.23 0.39 0.04 -1.26 -5.00 135.00 130.34 3hng s PRO 993 Ca 0.02 1.99 -0.23 0.00 0.04 0.00 0.00 61.00 62.83 3hng s PRO 993 Cb 0.03 -3.23 -0.09 0.00 0.04 0.00 0.00 34.50 31.26 3hng s PRO 993 CO -0.09 -0.24 0.79 -1.50 0.04 0.00 0.00 177.00 176.00 3hng s ILE 994 N 0.30 4.43 0.22 0.56 1.10 -1.26 -5.07 121.20 121.48 3hng s ILE 994 Ca 0.57 1.51 0.07 0.00 -0.51 0.00 0.00 60.65 62.30 3hng s ILE 994 Cb -0.35 -3.96 -0.05 0.00 0.15 0.00 0.00 42.46 38.25 3hng s ILE 994 CO 0.36 0.27 -0.12 0.42 -2.11 0.00 0.00 174.94 173.76 3hng s THR 995 N -1.45 1.66 0.26 4.00 -4.23 -1.26 -5.02 115.64 109.59 3hng s THR 995 Ca 0.43 -2.18 -0.02 0.00 -1.18 0.00 0.00 61.69 58.74 3hng s THR 995 Cb -0.19 -2.14 0.24 0.00 1.34 0.00 0.00 72.50 71.75 3hng s THR 995 CO 0.23 -0.52 1.79 -0.03 -0.54 0.00 0.00 174.62 175.54 3hng h MET 996 N 2.50 0.71 -0.90 3.99 4.05 -1.97 0.15 114.93 123.46 3hng h MET 996 Ca -0.38 -0.04 0.07 0.00 -0.28 0.00 0.00 59.70 59.06 3hng h MET 996 Cb 1.22 -0.16 -0.06 0.00 -0.80 0.00 0.00 31.60 31.80 3hng h MET 996 CO 0.63 0.47 0.58 1.49 0.23 0.00 0.00 176.91 180.31 3hng h GLU 997 N 0.73 0.97 0.14 0.39 4.81 -1.97 -1.85 114.58 117.80 3hng h GLU 997 Ca 0.45 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.61 3hng h GLU 997 Cb 0.54 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.70 3hng h GLU 997 CO -0.31 0.64 -0.07 -0.44 -0.73 0.00 0.00 179.01 178.11 3hng h ASP 998 N 1.00 -0.16 -0.77 1.04 3.32 -1.13 -1.23 116.42 118.48 3hng h ASP 998 Ca 0.39 -0.06 0.10 0.00 0.02 0.00 0.00 57.03 57.49 3hng h ASP 998 Cb 0.22 0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.76 3hng h ASP 998 CO -0.15 -0.05 0.51 -0.07 -1.72 0.00 0.00 179.24 177.76 3hng h LEU 999 N -0.27 0.60 0.02 1.55 3.38 -0.57 -1.44 115.31 118.58 3hng h LEU 999 Ca -0.02 0.02 -0.27 0.00 0.09 0.00 0.00 57.88 57.70 3hng h LEU 999 Cb 0.21 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.87 3hng h LEU 999 CO 0.03 0.35 -1.14 0.40 0.09 0.00 0.00 178.44 178.18 3hng h ILE 1000N 0.67 1.38 -0.11 1.22 2.04 -1.26 -1.91 117.51 119.53 3hng h ILE 1000Ca 0.36 -2.60 0.03 0.00 1.00 0.00 0.00 64.86 63.65 3hng h ILE 1000Cb 0.51 2.66 -0.03 0.00 -0.74 0.00 0.00 36.82 39.21 3hng h ILE 1000CO -0.14 0.78 -0.10 -1.28 0.00 0.00 0.00 178.15 177.42 3hng h SER 1001N 0.21 -0.30 -0.15 1.72 0.87 -0.38 0.63 113.55 116.15 3hng h SER 1001Ca -0.14 0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.48 3hng h SER 1001Cb 1.81 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 63.92 3hng h SER 1001CO 0.20 -0.13 0.09 1.88 -0.53 0.00 0.00 176.83 178.34 3hng h TYR 1002N -0.11 0.20 -0.95 2.24 0.05 -1.26 -0.21 116.97 116.93 3hng h TYR 1002Ca 0.08 -0.00 0.16 0.00 0.05 0.00 0.00 58.73 59.02 3hng h TYR 1002Cb 0.22 -0.06 -0.10 0.00 1.01 0.00 0.00 36.73 37.80 3hng h TYR 1002CO -0.21 0.17 0.55 0.77 -1.05 0.00 0.00 178.16 178.38 3hng h SER 1003N 0.17 0.72 -0.03 3.88 0.02 -1.17 -1.60 113.55 115.53 3hng h SER 1003Ca 0.05 0.09 -0.17 0.00 -0.84 0.00 0.00 61.79 60.92 3hng h SER 1003Cb 0.03 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 3hng h SER 1003CO -0.01 0.29 -0.59 0.15 -1.14 0.00 0.00 176.83 175.54 3hng h PHE 1004N 0.75 0.80 -0.43 3.45 3.57 -0.00 -2.21 116.94 122.88 3hng h PHE 1004Ca 0.52 -0.30 -0.13 0.00 3.53 0.00 0.00 57.97 61.59 3hng h PHE 1004Cb 0.73 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 3hng h PHE 1004CO -0.04 1.06 -0.25 1.96 -2.23 0.00 0.00 178.31 178.81 3hng h GLN 1005N 0.48 0.93 -0.49 1.11 4.20 -0.70 0.46 115.11 121.09 3hng h GLN 1005Ca 0.00 -0.43 -0.13 0.00 0.06 0.00 0.00 58.65 58.16 3hng h GLN 1005Cb 1.16 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.91 3hng h GLN 1005CO 0.11 1.08 -0.19 0.28 -0.67 0.00 0.00 178.83 179.45 3hng h VAL 1006N 0.76 1.27 -0.72 -0.54 2.07 -1.26 -0.19 116.25 117.63 3hng h VAL 1006Ca 0.09 -1.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.23 3hng h VAL 1006Cb 0.83 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 3hng h VAL 1006CO 0.07 0.47 0.34 0.00 0.02 0.00 0.00 177.57 178.48 3hng h ALA 1007N 0.88 1.25 -0.68 1.67 0.00 -1.19 0.63 119.26 121.82 3hng h ALA 1007Ca 0.12 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3hng h ALA 1007Cb 0.77 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 3hng h ALA 1007CO 0.06 0.57 0.12 -0.09 0.00 0.00 0.00 179.25 179.91 3hng h ARG 1008N 1.02 1.12 -0.40 0.00 2.43 -0.25 -0.87 114.38 117.42 3hng h ARG 1008Ca 0.25 -0.30 -0.11 0.00 -0.81 0.00 0.00 59.98 59.01 3hng h ARG 1008Cb 0.10 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 3hng h ARG 1008CO -0.03 1.02 -0.20 0.78 -1.51 0.00 0.00 179.97 180.03 3hng h GLY 1009N 1.05 0.85 2.00 2.80 0.00 -0.52 -2.35 103.07 106.90 3hng h GLY 1009Ca 0.21 -0.71 -0.12 0.00 0.00 0.00 0.00 47.33 46.70 3hng h GLY 1009CO 0.01 0.65 -0.58 -0.33 0.00 0.00 0.00 176.54 176.29 3hng h MET 1010N 0.69 0.00 -0.49 4.80 2.86 -0.67 -2.13 114.93 120.00 3hng h MET 1010Ca 0.10 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.64 3hng h MET 1010Cb 0.71 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.35 3hng h MET 1010CO 0.05 0.58 -0.08 1.49 1.06 0.00 0.00 176.91 180.01 3hng h GLU 1011N 0.00 0.87 0.24 1.72 4.81 -0.86 -0.73 114.58 120.64 3hng h GLU 1011Ca -0.01 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 58.92 3hng h GLU 1011Cb 1.16 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.47 3hng h GLU 1011CO 0.08 0.92 -0.11 0.35 -0.73 0.00 0.00 179.01 179.51 3hng h PHE 1012N 0.79 -0.30 0.02 0.92 3.57 -1.27 -2.26 116.94 118.42 3hng h PHE 1012Ca 0.14 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 3hng h PHE 1012Cb 0.59 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.43 3hng h PHE 1012CO 0.03 -0.18 -0.01 -0.07 -2.23 0.00 0.00 178.31 175.85 3hng h LEU 1013N -0.32 -0.02 -0.55 0.59 3.38 -1.22 -2.67 115.31 114.49 3hng h LEU 1013Ca -0.03 -0.12 0.10 0.00 0.09 0.00 0.00 57.88 57.92 3hng h LEU 1013Cb 0.25 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 40.89 3hng h LEU 1013CO 0.05 0.10 -0.30 0.28 0.09 0.00 0.00 178.44 178.67 3hng h SER 1014N -0.15 -1.04 0.11 -0.43 0.02 -1.18 0.14 113.55 111.03 3hng h SER 1014Ca -0.00 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 3hng h SER 1014Cb 0.14 0.53 0.00 0.00 0.14 0.00 0.00 62.40 63.20 3hng h SER 1014CO 0.00 -0.29 0.00 -1.54 -1.14 0.00 0.00 176.83 173.86 3hng n SER 1015N -5.43 0.00 -0.70 3.07 3.41 -0.85 -0.38 113.62 112.74 3hng n SER 1015Ca 0.04 0.27 0.06 0.00 -0.26 0.00 0.00 58.87 58.98 3hng n SER 1015Cb 0.35 -0.33 0.15 0.00 -0.26 0.00 0.00 64.21 64.12 3hng n SER 1015CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3hng n ARG 1016N -1.33 2.48 -1.60 4.33 3.00 0.41 -4.95 116.66 119.01 3hng n ARG 1016Ca 0.02 -1.98 -0.03 0.00 -0.01 0.00 0.00 57.85 55.86 3hng n ARG 1016Cb 0.05 -1.30 -0.01 0.00 0.00 0.00 0.00 32.46 31.20 3hng n ARG 1016CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 3hng n LYS 1017N 0.68 -0.21 -3.91 5.56 4.76 0.49 -4.56 118.16 120.96 3hng n LYS 1017Ca 0.12 0.35 -0.35 0.00 -2.87 0.00 0.00 58.31 55.57 3hng n LYS 1017Cb 0.43 -4.00 -0.14 0.00 -1.84 0.00 0.00 35.03 29.48 3hng n LYS 1017CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3hng s ILE 1019N 1.44 5.34 -0.10 0.00 1.01 -1.26 -3.76 121.20 123.87 3hng s ILE 1019Ca 0.05 0.29 -0.26 0.00 0.00 0.00 0.00 60.65 60.72 3hng s ILE 1019Cb -0.15 -3.54 -0.27 0.00 0.01 0.00 0.00 42.46 38.51 3hng s ILE 1019CO -0.04 0.34 0.85 -0.74 0.00 0.00 0.00 174.94 175.36 3hng h HIS 1020N 7.36 0.21 0.00 3.97 2.76 -1.97 -3.48 115.15 123.99 3hng h HIS 1020Ca -0.38 -0.14 0.00 0.00 -2.20 0.00 0.00 60.37 57.64 3hng h HIS 1020Cb 1.17 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 30.11 3hng h HIS 1020CO 0.66 1.08 0.00 0.54 -1.30 0.00 0.00 177.93 178.91 3hng n ARG 1021N -4.45 0.00 -2.69 5.26 1.74 -1.26 -4.73 116.66 110.53 3hng n ARG 1021Ca -0.11 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.89 3hng n ARG 1021Cb 0.59 -1.88 0.09 0.00 -1.02 0.00 0.00 32.46 30.24 3hng n ARG 1021CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3hng n ASP 1022N 0.00 -0.71 -4.72 0.55 2.03 -1.26 -4.99 116.55 107.45 3hng n ASP 1022Ca 0.00 -2.57 -0.41 0.00 0.52 0.00 0.00 54.79 52.33 3hng n ASP 1022Cb 0.00 0.47 -0.04 0.00 -0.72 0.00 0.00 41.12 40.83 3hng n ASP 1022CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3hng s LEU 1023N -3.15 4.40 0.00 -2.67 2.96 -1.26 -4.79 118.68 114.16 3hng s LEU 1023Ca 0.24 1.57 0.00 0.00 -0.22 0.00 0.00 54.13 55.72 3hng s LEU 1023Cb 0.42 -3.43 0.00 0.00 0.50 0.00 0.00 46.19 43.68 3hng s LEU 1023CO -0.04 -0.16 0.00 0.00 -1.32 0.00 0.00 176.35 174.83 3hng n ALA 1024N 3.52 0.00 0.22 5.97 0.00 -1.26 -4.68 120.51 124.28 3hng n ALA 1024Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.55 3hng n ALA 1024Cb 0.51 0.00 0.52 0.00 0.00 0.00 0.00 19.45 20.47 3hng n ALA 1024CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hng h ALA 1025N 0.00 1.26 0.00 0.00 0.00 -1.93 0.33 119.26 118.92 3hng h ALA 1025Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3hng h ALA 1025Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3hng h ALA 1025CO 0.00 0.31 0.00 0.07 0.00 0.00 0.00 179.25 179.63 3hng h ARG 1026N 0.00 0.00 -0.34 0.00 0.11 -1.96 -1.93 114.38 110.26 3hng h ARG 1026Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3hng h ARG 1026Cb 0.56 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.64 3hng h ARG 1026CO 0.03 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.19 3hng n ASN 1027N -2.52 4.31 -4.24 0.08 3.02 0.10 -4.86 115.26 111.15 3hng n ASN 1027Ca 0.01 -2.96 -0.33 0.00 -0.03 0.00 0.00 54.58 51.27 3hng n ASN 1027Cb 0.22 -0.57 -0.15 0.00 -0.61 0.00 0.00 39.78 38.67 3hng n ASN 1027CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hng s ILE 1028N -2.74 2.62 0.07 2.41 -1.09 -0.73 -1.87 121.20 119.87 3hng s ILE 1028Ca 0.45 -0.78 0.06 0.00 -2.23 0.00 0.00 60.65 58.15 3hng s ILE 1028Cb 0.35 -2.11 -0.04 0.00 -1.58 0.00 0.00 42.46 39.08 3hng s ILE 1028CO 0.11 0.51 -0.09 -0.76 -1.23 0.00 0.00 174.94 173.48 3hng s LEU 1029N 0.96 3.07 -0.20 2.97 1.02 0.52 -0.95 118.68 126.07 3hng s LEU 1029Ca -0.03 -0.31 -0.05 0.00 0.02 0.00 0.00 54.13 53.77 3hng s LEU 1029Cb -0.15 -1.83 -0.02 0.00 0.02 0.00 0.00 46.19 44.21 3hng s LEU 1029CO -0.02 0.21 -0.01 -0.22 0.02 0.00 0.00 176.35 176.33 3hng s LEU 1030N -1.93 3.20 0.00 1.79 2.96 -0.62 -0.02 118.68 124.06 3hng s LEU 1030Ca 0.20 -0.22 0.00 0.00 -0.22 0.00 0.00 54.13 53.89 3hng s LEU 1030Cb -0.11 -1.81 0.00 0.00 0.50 0.00 0.00 46.19 44.77 3hng s LEU 1030CO 0.12 0.07 0.00 -0.24 -1.32 0.00 0.00 176.35 174.98 3hng n SER 1031N 4.21 0.77 -4.87 3.68 2.88 0.13 -2.00 113.62 118.42 3hng n SER 1031Ca -0.17 -0.20 -0.30 0.00 -1.33 0.00 0.00 58.87 56.87 3hng n SER 1031Cb 0.52 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.03 3hng n SER 1031CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 3hng s GLU 1032N 1.39 2.72 -1.53 -1.46 2.02 -1.26 -3.99 118.70 116.58 3hng s GLU 1032Ca 0.00 0.49 0.00 0.00 0.02 0.00 0.00 54.97 55.48 3hng s GLU 1032Cb 0.00 -2.00 0.00 0.00 0.10 0.00 0.00 34.13 32.23 3hng s GLU 1032CO 0.00 -1.14 0.00 0.09 0.02 0.00 0.00 175.26 174.23 3hng n ASN 1033N -3.08 -5.06 -0.84 -0.19 3.02 -1.26 -1.88 115.26 105.97 3hng n ASN 1033Ca 0.07 0.11 -0.11 0.00 -0.03 0.00 0.00 54.58 54.62 3hng n ASN 1033Cb 0.57 -4.27 -0.05 0.00 -0.61 0.00 0.00 39.78 35.42 3hng n ASN 1033CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3hng n ASN 1034N -1.83 -4.62 -4.73 6.41 5.15 -1.26 -4.96 115.26 109.44 3hng n ASN 1034Ca -0.20 0.27 -0.40 0.00 -0.60 0.00 0.00 54.58 53.65 3hng n ASN 1034Cb 0.65 -3.08 -0.05 0.00 -0.53 0.00 0.00 39.78 36.77 3hng n ASN 1034CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hng s VAL 1035N -2.31 4.96 0.04 3.44 1.01 -0.79 -4.93 120.40 121.83 3hng s VAL 1035Ca 0.00 1.48 0.03 0.00 0.00 0.00 0.00 61.98 63.49 3hng s VAL 1035Cb 0.00 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 3hng s VAL 1035CO 0.00 0.29 0.01 0.68 0.00 0.00 0.00 175.10 176.08 3hng s VAL 1036N 0.51 4.14 -0.05 2.92 -7.23 -1.26 -0.70 120.40 118.73 3hng s VAL 1036Ca 0.37 -0.75 0.00 0.00 -1.81 0.00 0.00 61.98 59.80 3hng s VAL 1036Cb -0.18 -2.90 0.02 0.00 0.56 0.00 0.00 36.38 33.88 3hng s VAL 1036CO 0.19 0.27 -0.02 -0.54 -0.31 0.00 0.00 175.10 174.69 3hng s LYS 1037N -1.88 0.64 0.04 4.82 1.02 0.97 -4.41 119.74 120.94 3hng s LYS 1037Ca 0.22 -0.00 -0.31 0.00 0.02 0.00 0.00 55.97 55.91 3hng s LYS 1037Cb -0.12 -0.79 -0.07 0.00 -0.52 0.00 0.00 37.83 36.34 3hng s LYS 1037CO 0.14 -0.15 1.45 0.42 -0.92 0.00 0.00 175.35 176.28 3hng s ILE 1038N 1.23 3.48 0.41 2.17 1.01 -0.47 -0.35 121.20 128.67 3hng s ILE 1038Ca -0.06 0.94 0.05 0.00 0.00 0.00 0.00 60.65 61.57 3hng s ILE 1038Cb -0.14 -3.60 -0.02 0.00 0.01 0.00 0.00 42.46 38.71 3hng s ILE 1038CO -0.02 0.02 0.16 0.00 0.00 0.00 0.00 174.94 175.10 3hng s ASP 1040N -3.58 0.14 0.31 0.00 3.68 -1.26 -4.78 116.67 111.18 3hng s ASP 1040Ca 0.25 0.41 0.07 0.00 2.13 0.00 0.00 52.55 55.41 3hng s ASP 1040Cb 0.02 1.15 0.52 0.00 -1.45 0.00 0.00 42.92 43.16 3hng s ASP 1040CO 0.17 -0.28 1.75 -0.26 0.13 0.00 0.00 175.17 176.68 3hng h PHE 1041N 8.19 0.30 0.00 -5.34 0.04 -1.94 -3.47 116.94 114.72 3hng h PHE 1041Ca -0.18 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 60.52 3hng h PHE 1041Cb 1.14 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 39.22 3hng h PHE 1041CO 0.17 0.57 0.00 0.41 -0.60 0.00 0.00 178.31 178.86 3hng n GLY 1042N -0.37 3.45 0.14 -1.45 0.00 -1.26 -0.99 105.19 104.70 3hng n GLY 1042Ca -0.01 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.04 3hng n GLY 1042CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hng n LEU 1043N 0.00 0.48 -0.83 0.99 4.77 -1.26 -2.18 117.00 118.96 3hng n LEU 1043Ca 0.00 0.72 0.09 0.00 -0.03 0.00 0.00 56.01 56.79 3hng n LEU 1043Cb 0.00 -0.78 0.15 0.00 -2.33 0.00 0.00 43.42 40.46 3hng n LEU 1043CO 0.00 -0.89 0.61 0.00 -1.33 0.00 0.00 177.39 175.78 3hng n ALA 1044N -1.74 2.37 -2.69 -1.18 0.00 -0.16 -2.95 120.51 114.16 3hng n ALA 1044Ca -0.01 -0.93 -0.42 0.00 0.00 0.00 0.00 53.44 52.08 3hng n ALA 1044Cb 0.03 -0.62 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 3hng n ALA 1044CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3hng s ARG 1045N -1.21 4.42 -0.11 0.00 6.06 -0.93 -2.81 118.95 124.37 3hng s ARG 1045Ca 0.28 1.22 -0.24 0.00 -2.50 0.00 0.00 55.73 54.49 3hng s ARG 1045Cb 0.16 -3.52 -0.03 0.00 0.06 0.00 0.00 34.95 31.62 3hng s ARG 1045CO 0.23 -0.21 0.73 0.34 -2.50 0.00 0.00 175.30 173.89 3hng s ASP 1046N 1.05 6.95 0.00 -2.12 -1.08 -1.10 -4.33 116.67 116.05 3hng s ASP 1046Ca 0.45 1.15 0.00 0.00 -0.52 0.00 0.00 52.55 53.63 3hng s ASP 1046Cb -0.18 -2.42 0.00 0.00 -1.46 0.00 0.00 42.92 38.86 3hng s ASP 1046CO 0.18 -0.21 0.00 0.00 0.52 0.00 0.00 175.17 175.66 3hng n ILE 1047N 4.13 0.00 0.03 4.11 3.06 -1.26 -3.64 119.36 125.80 3hng n ILE 1047Ca 0.00 -0.06 -0.10 0.00 -2.50 0.00 0.00 62.75 60.09 3hng n ILE 1047Cb 0.50 0.62 0.03 0.00 0.54 0.00 0.00 39.64 41.34 3hng n ILE 1047CO 0.00 0.00 0.00 0.22 -2.50 0.00 0.00 176.55 174.27 3hng h TYR 1048N 0.00 0.63 0.00 9.51 3.20 -1.94 -3.36 116.97 125.01 3hng h TYR 1048Ca 0.00 -0.26 -0.31 0.00 3.14 0.00 0.00 58.73 61.30 3hng h TYR 1048Cb 0.00 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.12 3hng h TYR 1048CO 0.00 1.02 -1.72 1.63 -1.64 0.00 0.00 178.16 177.44 3hng n LYS 1049N -3.88 0.57 -1.58 1.82 5.02 -1.26 -4.91 118.16 113.94 3hng n LYS 1049Ca -0.04 0.45 -0.49 0.00 -2.02 0.00 0.00 58.31 56.21 3hng n LYS 1049Cb 0.68 -1.64 -0.05 0.00 -0.02 0.00 0.00 35.03 33.99 3hng n LYS 1049CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3hng n ASN 1050N -4.37 2.85 0.00 4.39 2.85 -1.24 -4.79 115.26 114.95 3hng n ASN 1050Ca -0.40 0.62 0.05 0.00 -0.11 0.00 0.00 54.58 54.75 3hng n ASN 1050Cb 0.75 -1.35 0.28 0.00 1.24 0.00 0.00 39.78 40.69 3hng n ASN 1050CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3hng n PRO 1051N 7.57 0.15 0.06 1.20 -0.04 -1.26 -1.94 135.00 140.74 3hng n PRO 1051Ca 0.31 0.19 0.07 0.00 -0.04 0.00 0.00 63.50 64.03 3hng n PRO 1051Cb 0.29 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.57 3hng n PRO 1051CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3hng n ASP 1052N -1.30 0.26 -4.09 3.54 8.00 -1.26 -4.60 116.55 117.09 3hng n ASP 1052Ca 0.05 0.58 -0.32 0.00 0.71 0.00 0.00 54.79 55.82 3hng n ASP 1052Cb 0.09 -0.63 -0.16 0.00 -0.02 0.00 0.00 41.12 40.40 3hng n ASP 1052CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3hng s TYR 1053N -3.17 2.58 0.03 1.24 2.02 -0.82 -4.10 117.35 115.14 3hng s TYR 1053Ca 0.03 -1.50 0.04 0.00 -0.37 0.00 0.00 57.07 55.27 3hng s TYR 1053Cb 0.06 -1.81 -0.04 0.00 -0.40 0.00 0.00 41.96 39.78 3hng s TYR 1053CO 0.21 -0.75 -0.04 0.08 -1.57 0.00 0.00 175.55 173.48 3hng s VAL 1054N 1.32 3.83 0.05 0.71 1.01 -0.09 -4.60 120.40 122.63 3hng s VAL 1054Ca 0.04 -0.83 -0.31 0.00 0.00 0.00 0.00 61.98 60.88 3hng s VAL 1054Cb -0.13 -2.73 -0.07 0.00 0.00 0.00 0.00 36.38 33.46 3hng s VAL 1054CO -0.12 0.30 1.39 0.00 0.00 0.00 0.00 175.10 176.67 3hng s ARG 1055N -1.74 4.31 -0.10 2.72 3.03 -1.26 -0.14 118.95 125.76 3hng s ARG 1055Ca 0.20 2.00 0.01 0.00 2.03 0.00 0.00 55.73 59.97 3hng s ARG 1055Cb -0.11 -3.43 -0.07 0.00 -1.03 0.00 0.00 34.95 30.31 3hng s ARG 1055CO 0.11 -0.50 -0.09 1.63 -1.13 0.00 0.00 175.30 175.33 3hng n LYS 1056N 4.70 0.40 -0.74 3.89 5.02 -1.26 -4.93 118.16 125.24 3hng n LYS 1056Ca 0.12 0.06 0.01 0.00 -2.02 0.00 0.00 58.31 56.48 3hng n LYS 1056Cb 0.43 -1.21 -0.01 0.00 -0.02 0.00 0.00 35.03 34.22 3hng n LYS 1056CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3hng n THR 1059N -2.78 -0.18 -4.97 -0.18 -1.04 -1.26 -5.08 114.28 98.79 3hng n THR 1059Ca -0.18 0.13 -0.32 0.00 -2.04 0.00 0.00 64.05 61.63 3hng n THR 1059Cb 0.70 -0.20 -0.15 0.00 -1.82 0.00 0.00 70.33 68.86 3hng n THR 1059CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3hng s ARG 1060N -4.72 3.07 0.05 -2.82 0.52 -1.26 -4.93 118.95 108.86 3hng s ARG 1060Ca 0.00 -0.77 0.04 0.00 -0.52 0.00 0.00 55.73 54.49 3hng s ARG 1060Cb 0.00 -2.45 -0.02 0.00 0.52 0.00 0.00 34.95 33.00 3hng s ARG 1060CO 0.00 0.29 -0.13 -0.51 0.02 0.00 0.00 175.30 174.97 3hng s LEU 1061N 0.13 2.22 -1.17 2.53 1.43 0.80 -4.72 118.68 119.89 3hng s LEU 1061Ca -0.09 -0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 52.39 3hng s LEU 1061Cb -0.15 -0.48 -0.07 0.00 0.03 0.00 0.00 46.19 45.51 3hng s LEU 1061CO 0.06 -0.05 2.33 -0.81 0.23 0.00 0.00 176.35 178.11 3hng n PRO 1062N 1.64 2.55 -0.24 1.29 -0.04 -1.26 -0.91 135.00 138.03 3hng n PRO 1062Ca -0.20 -1.90 0.00 0.00 -0.04 0.00 0.00 63.50 61.37 3hng n PRO 1062Cb 0.55 -2.75 0.07 0.00 -0.04 0.00 0.00 33.50 31.33 3hng n PRO 1062CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3hng h LEU 1063N 9.17 -0.67 -1.61 1.53 3.38 -1.92 -1.51 115.31 123.67 3hng h LEU 1063Ca 0.60 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.78 3hng h LEU 1063Cb 0.35 0.44 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3hng h LEU 1063CO 1.70 -0.23 0.00 0.11 0.09 0.00 0.00 178.44 180.10 3hng h LYS 1064N -0.01 0.00 -0.08 1.13 1.57 -1.85 -1.02 116.57 116.31 3hng h LYS 1064Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 3hng h LYS 1064Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3hng h LYS 1064CO -0.72 0.00 0.00 0.91 -0.57 0.00 0.00 179.45 179.07 3hng n TRP 1065N -2.47 0.09 -3.94 -1.35 8.01 -0.57 -4.97 117.44 112.23 3hng n TRP 1065Ca -0.01 -0.07 -0.35 0.00 -1.31 0.00 0.00 57.50 55.77 3hng n TRP 1065Cb 0.09 -0.00 -0.09 0.00 -2.01 0.00 0.00 31.31 29.30 3hng n TRP 1065CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 3hng s MET 1066N -1.27 3.97 0.64 -0.99 -1.94 -0.39 -3.76 119.30 115.56 3hng s MET 1066Ca 0.20 -0.30 -0.18 0.00 -1.71 0.00 0.00 55.69 53.70 3hng s MET 1066Cb 0.14 -3.25 -0.03 0.00 2.01 0.00 0.00 34.83 33.69 3hng s MET 1066CO 0.20 0.32 1.00 0.00 -0.01 0.00 0.00 175.02 176.54 3hng n ALA 1067N 3.39 0.22 0.01 3.03 0.00 -1.26 -4.81 120.51 121.09 3hng n ALA 1067Ca -0.17 -0.04 0.03 0.00 0.00 0.00 0.00 53.44 53.26 3hng n ALA 1067Cb 0.52 -2.14 0.39 0.00 0.00 0.00 0.00 19.45 18.22 3hng n ALA 1067CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3hng h PRO 1068N 0.31 0.50 0.00 0.00 0.11 -1.93 -2.30 132.00 128.70 3hng h PRO 1068Ca -0.49 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 65.41 3hng h PRO 1068Cb 1.36 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 3hng h PRO 1068CO 0.50 0.41 -0.73 1.05 -0.21 0.00 0.00 178.00 179.02 3hng h GLU 1069N 0.51 0.00 -0.04 1.05 9.09 -1.91 -0.35 114.58 122.92 3hng h GLU 1069Ca 0.13 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.53 3hng h GLU 1069Cb 0.08 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.18 3hng h GLU 1069CO -0.02 0.73 -0.01 0.77 0.05 0.00 0.00 179.01 180.53 3hng h SER 1070N 0.00 0.08 -0.11 3.06 0.02 -1.20 -0.73 113.55 114.67 3hng h SER 1070Ca -0.01 -0.38 0.03 0.00 -0.84 0.00 0.00 61.79 60.59 3hng h SER 1070Cb 1.29 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.78 3hng h SER 1070CO 0.09 0.44 -0.06 0.40 -1.14 0.00 0.00 176.83 176.57 3hng h ILE 1071N -0.27 0.81 0.05 3.27 2.04 -1.26 -1.32 117.51 120.82 3hng h ILE 1071Ca 0.01 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.70 3hng h ILE 1071Cb 0.41 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 3hng h ILE 1071CO 0.00 0.00 -0.89 -0.26 0.00 0.00 0.00 178.15 177.00 3hng h PHE 1072N -0.05 0.19 -0.22 1.37 0.04 -1.09 -3.37 116.94 113.81 3hng h PHE 1072Ca 0.06 -0.14 0.00 0.00 2.80 0.00 0.00 57.97 60.69 3hng h PHE 1072Cb 0.15 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.29 3hng h PHE 1072CO -0.18 1.35 0.00 -0.25 -0.60 0.00 0.00 178.31 178.62 3hng n ASP 1073N -4.29 3.02 -3.79 2.17 8.00 -0.31 -4.95 116.55 116.39 3hng n ASP 1073Ca -0.21 -1.90 -0.27 0.00 0.71 0.00 0.00 54.79 53.11 3hng n ASP 1073Cb 0.70 -0.13 0.05 0.00 -0.02 0.00 0.00 41.12 41.72 3hng n ASP 1073CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3hng n LYS 1074N 1.22 -6.38 -3.86 -1.24 5.02 -0.50 -4.96 118.16 107.46 3hng n LYS 1074Ca 0.15 0.68 -0.35 0.00 -2.02 0.00 0.00 58.31 56.77 3hng n LYS 1074Cb 0.53 -5.62 -0.10 0.00 -0.02 0.00 0.00 35.03 29.82 3hng n LYS 1074CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hng s ILE 1075N -3.33 4.94 0.06 -0.18 1.01 -1.03 -4.93 121.20 117.75 3hng s ILE 1075Ca 0.59 0.03 0.07 0.00 0.00 0.00 0.00 60.65 61.34 3hng s ILE 1075Cb -0.28 -3.26 -0.03 0.00 0.01 0.00 0.00 42.46 38.90 3hng s ILE 1075CO 0.79 0.41 -0.20 -0.31 0.00 0.00 0.00 174.94 175.64 3hng s TYR 1076N 0.69 1.72 0.12 3.97 1.51 -1.26 -2.61 117.35 121.49 3hng s TYR 1076Ca 0.05 -0.39 -0.25 0.00 -1.01 0.00 0.00 57.07 55.47 3hng s TYR 1076Cb -0.13 -1.00 0.08 0.00 -0.11 0.00 0.00 41.96 40.81 3hng s TYR 1076CO 0.02 0.12 1.08 -1.54 -1.11 0.00 0.00 175.55 174.12 3hng s SER 1077N -1.43 -0.07 0.44 2.29 1.04 -1.26 -4.96 113.70 109.75 3hng s SER 1077Ca 0.06 -0.44 0.10 0.00 0.48 0.00 0.00 55.95 56.15 3hng s SER 1077Cb -0.09 0.40 0.98 0.00 0.10 0.00 0.00 66.02 67.41 3hng s SER 1077CO 0.03 -0.77 2.07 0.74 0.98 0.00 0.00 173.24 176.29 3hng h THR 1078N 2.00 1.08 0.00 2.02 2.02 -1.98 -0.32 112.91 117.73 3hng h THR 1078Ca -0.26 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 66.66 3hng h THR 1078Cb 1.22 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 3hng h THR 1078CO 0.30 0.09 -0.25 0.11 0.37 0.00 0.00 175.52 176.14 3hng h LYS 1079N 0.35 0.00 0.02 6.66 1.79 -1.94 -1.73 116.57 121.72 3hng h LYS 1079Ca 0.09 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.36 3hng h LYS 1079Cb 0.01 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.64 3hng h LYS 1079CO -0.02 0.25 -0.96 0.66 -1.08 0.00 0.00 179.45 178.31 3hng h SER 1080N 0.00 0.09 -0.52 0.86 4.64 -1.45 -3.04 113.55 114.13 3hng h SER 1080Ca -0.00 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.22 3hng h SER 1080Cb 0.72 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 3hng h SER 1080CO 0.03 0.99 0.29 0.44 -0.87 0.00 0.00 176.83 177.72 3hng h ASP 1081N 0.02 0.66 -0.17 4.97 3.32 -0.87 -2.40 116.42 121.95 3hng h ASP 1081Ca -0.03 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 3hng h ASP 1081Cb 1.67 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 41.04 3hng h ASP 1081CO 0.13 0.53 0.10 0.58 -1.72 0.00 0.00 179.24 178.87 3hng h VAL 1082N 0.75 1.07 -0.47 -1.35 2.07 -1.30 0.54 116.25 117.55 3hng h VAL 1082Ca 0.19 -0.15 0.09 0.00 0.82 0.00 0.00 66.70 67.65 3hng h VAL 1082Cb 0.02 0.87 -0.10 0.00 -1.52 0.00 0.00 31.29 30.56 3hng h VAL 1082CO -0.03 0.06 -0.26 -0.25 0.02 0.00 0.00 177.57 177.12 3hng h TRP 1083N 0.21 -0.67 -0.65 1.57 2.91 -1.37 0.14 115.95 118.08 3hng h TRP 1083Ca 0.06 0.06 -0.04 0.00 1.13 0.00 0.00 58.89 60.10 3hng h TRP 1083Cb 0.01 0.37 -0.03 0.00 -0.51 0.00 0.00 29.16 29.00 3hng h TRP 1083CO -0.06 -0.33 0.24 0.77 -1.03 0.00 0.00 178.44 178.03 3hng h SER 1084N -0.15 0.89 -0.82 2.65 0.02 -0.82 0.18 113.55 115.49 3hng h SER 1084Ca 0.22 -0.13 0.07 0.00 -0.84 0.00 0.00 61.79 61.11 3hng h SER 1084Cb 0.49 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.75 3hng h SER 1084CO -0.56 0.81 0.53 0.22 -1.14 0.00 0.00 176.83 176.68 3hng h TYR 1085N 0.94 0.88 -0.39 3.45 3.20 0.11 0.30 116.97 125.46 3hng h TYR 1085Ca 0.22 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.15 3hng h TYR 1085Cb 0.21 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 3hng h TYR 1085CO 0.02 0.45 0.16 0.78 -1.64 0.00 0.00 178.16 177.93 3hng h GLY 1086N 0.86 0.52 1.28 1.82 0.00 0.21 -0.73 103.07 107.02 3hng h GLY 1086Ca 0.36 -0.10 -0.11 0.00 0.00 0.00 0.00 47.33 47.48 3hng h GLY 1086CO -0.13 0.06 -0.15 -2.08 0.00 0.00 0.00 176.54 174.24 3hng h VAL 1087N 0.34 1.26 -0.78 4.60 2.07 -0.67 -2.11 116.25 120.97 3hng h VAL 1087Ca 0.18 -1.25 0.10 0.00 0.82 0.00 0.00 66.70 66.55 3hng h VAL 1087Cb 0.13 1.08 -0.07 0.00 -1.52 0.00 0.00 31.29 30.90 3hng h VAL 1087CO -0.16 0.43 0.42 0.25 0.02 0.00 0.00 177.57 178.53 3hng h LEU 1088N 0.75 0.56 -0.52 2.57 5.85 -0.00 0.30 115.31 124.82 3hng h LEU 1088Ca 0.12 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 3hng h LEU 1088Cb 0.66 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 3hng h LEU 1088CO 0.05 0.31 0.18 -0.07 -0.34 0.00 0.00 178.44 178.57 3hng h LEU 1089N 0.69 0.74 -0.82 2.25 3.38 -0.58 0.24 115.31 121.20 3hng h LEU 1089Ca 0.39 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 58.23 3hng h LEU 1089Cb 0.40 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.90 3hng h LEU 1089CO -0.27 0.74 0.50 -0.25 0.09 0.00 0.00 178.44 179.24 3hng h TRP 1090N 0.71 0.92 -0.90 1.13 7.01 -0.74 -0.51 115.95 123.57 3hng h TRP 1090Ca 0.17 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.20 3hng h TRP 1090Cb 0.25 -0.29 -0.04 0.00 -2.10 0.00 0.00 29.16 26.97 3hng h TRP 1090CO 0.01 0.45 0.57 0.93 -2.79 0.00 0.00 178.44 177.62 3hng h GLU 1091N 0.90 1.20 0.03 2.65 5.08 0.72 -1.87 114.58 123.29 3hng h GLU 1091Ca 0.36 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.63 3hng h GLU 1091Cb 0.19 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.18 3hng h GLU 1091CO -0.18 0.81 -0.01 0.82 -1.00 0.00 0.00 179.01 179.45 3hng h ILE 1092N 1.23 1.42 -0.02 3.13 2.04 -0.37 0.17 117.51 125.11 3hng h ILE 1092Ca 0.33 -1.52 0.00 0.00 1.00 0.00 0.00 64.86 64.66 3hng h ILE 1092Cb -0.10 2.42 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 3hng h ILE 1092CO -0.07 0.38 0.00 0.49 0.00 0.00 0.00 178.15 178.95 3hng n PHE 1093N -4.79 0.02 0.29 1.37 3.72 -0.26 -0.47 117.46 117.35 3hng n PHE 1093Ca -0.09 -0.01 0.10 0.00 -0.05 0.00 0.00 57.45 57.40 3hng n PHE 1093Cb 0.32 0.00 0.18 0.00 -0.94 0.00 0.00 39.48 39.05 3hng n PHE 1093CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3hng n SER 1094N -0.64 3.21 -3.17 4.37 3.41 -0.71 -1.20 113.62 118.89 3hng n SER 1094Ca 0.12 -1.93 -0.16 0.00 -0.26 0.00 0.00 58.87 56.64 3hng n SER 1094Cb 0.08 -0.21 0.08 0.00 -0.26 0.00 0.00 64.21 63.90 3hng n SER 1094CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hng n LEU 1095N 1.28 -3.74 -0.08 1.04 4.77 0.38 -3.52 117.00 117.12 3hng n LEU 1095Ca 0.17 -0.54 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 3hng n LEU 1095Cb 0.55 -2.83 0.00 0.00 -2.33 0.00 0.00 43.42 38.81 3hng n LEU 1095CO 0.14 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 3hng n GLY 1096N -1.21 0.80 3.89 -0.72 0.00 0.58 -2.81 105.19 105.72 3hng n GLY 1096Ca -0.22 -0.65 -0.29 0.00 0.00 0.00 0.00 46.02 44.86 3hng n GLY 1096CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hng s GLY 1097N -2.76 1.62 -0.07 -0.02 0.00 -1.21 -4.71 107.32 100.17 3hng s GLY 1097Ca 0.00 -0.44 -0.14 0.00 0.00 0.00 0.00 44.72 44.14 3hng s GLY 1097CO 0.00 -0.11 0.35 -1.35 0.00 0.00 0.00 173.10 171.99 3hng s SER 1098N -4.33 6.65 0.68 1.64 1.04 -1.26 -4.63 113.70 113.50 3hng s SER 1098Ca 0.56 0.78 -0.17 0.00 0.48 0.00 0.00 55.95 57.60 3hng s SER 1098Cb -0.11 -2.21 -0.03 0.00 0.10 0.00 0.00 66.02 63.77 3hng s SER 1098CO 0.50 0.25 0.79 -2.65 0.98 0.00 0.00 173.24 173.10 3hng n PRO 1099N 2.46 0.52 -3.99 4.02 -0.02 -1.26 -3.63 135.00 133.10 3hng n PRO 1099Ca -0.14 0.22 -0.43 0.00 -2.02 0.00 0.00 63.50 61.14 3hng n PRO 1099Cb 0.52 -2.04 0.02 0.00 -0.02 0.00 0.00 33.50 31.99 3hng n PRO 1099CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3hng n TYR 1100N -2.25 -1.53 -2.15 6.00 4.01 -1.26 -4.82 117.16 115.15 3hng n TYR 1100Ca 0.12 0.19 -0.42 0.00 -0.16 0.00 0.00 57.90 57.63 3hng n TYR 1100Cb 0.49 -2.89 -0.03 0.00 -0.31 0.00 0.00 39.34 36.60 3hng n TYR 1100CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 3hng s PRO 1101N -6.98 4.30 0.00 -0.72 0.04 -1.24 -2.66 135.00 127.73 3hng s PRO 1101Ca 0.45 2.08 0.00 0.00 0.04 0.00 0.00 61.00 63.57 3hng s PRO 1101Cb -0.23 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 30.96 3hng s PRO 1101CO 0.95 -0.50 0.00 0.41 0.04 0.00 0.00 177.00 177.90 3hng n GLY 1102N 3.58 0.61 3.48 0.56 0.00 -1.26 -5.04 105.19 107.12 3hng n GLY 1102Ca 0.12 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3hng n GLY 1102CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hng s VAL 1103N -2.00 3.21 0.40 1.61 1.01 -1.09 -5.13 120.40 118.41 3hng s VAL 1103Ca 0.00 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.33 3hng s VAL 1103Cb 0.00 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 3hng s VAL 1103CO 0.00 0.58 0.61 -1.10 0.00 0.00 0.00 175.10 175.19 3hng s GLN 1104N -0.54 3.25 -0.90 2.72 -0.21 -1.26 -5.03 119.66 117.68 3hng s GLN 1104Ca 0.08 -0.46 -0.01 0.00 0.02 0.00 0.00 55.36 54.98 3hng s GLN 1104Cb -0.12 -2.62 0.24 0.00 1.00 0.00 0.00 33.01 31.51 3hng s GLN 1104CO 0.02 -0.07 0.89 -1.33 -2.12 0.00 0.00 175.29 172.67 3hng n MET 1105N -1.93 2.90 -1.56 2.91 2.81 -1.26 -4.65 117.12 116.35 3hng n MET 1105Ca -0.01 -4.52 0.00 0.00 -1.81 0.00 0.00 57.70 51.36 3hng n MET 1105Cb 0.57 -2.41 0.00 0.00 -0.71 0.00 0.00 33.22 30.67 3hng n MET 1105CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3hng n ASP 1106N 1.98 1.99 0.14 7.83 5.68 -1.26 -4.96 116.55 127.95 3hng n ASP 1106Ca 0.24 -0.78 0.17 0.00 -0.50 0.00 0.00 54.79 53.91 3hng n ASP 1106Cb 0.37 0.00 0.75 0.00 -1.14 0.00 0.00 41.12 41.10 3hng n ASP 1106CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3hng h GLU 1107N 0.00 0.00 -0.03 0.11 5.08 -2.02 -2.40 114.58 115.32 3hng h GLU 1107Ca 0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 3hng h GLU 1107Cb 0.00 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.27 3hng h GLU 1107CO 0.00 0.00 -0.82 -0.44 -1.00 0.00 0.00 179.01 176.75 3hng h ASP 1108N 0.00 0.77 -1.08 1.42 3.32 -1.95 -3.13 116.42 115.77 3hng h ASP 1108Ca 0.13 -0.72 0.29 0.00 0.02 0.00 0.00 57.03 56.75 3hng h ASP 1108Cb 0.59 -0.23 -0.09 0.00 0.22 0.00 0.00 39.33 39.82 3hng h ASP 1108CO -0.00 1.39 0.71 0.15 -1.72 0.00 0.00 179.24 179.77 3hng h PHE 1109N 0.23 0.53 0.00 4.55 3.57 -1.69 -2.84 116.94 121.29 3hng h PHE 1109Ca -0.09 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.42 3hng h PHE 1109Cb 1.49 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.08 3hng h PHE 1109CO 0.12 0.03 0.00 0.00 -2.23 0.00 0.00 178.31 176.22 3hng n SER 1111N -1.66 0.23 0.04 0.00 3.41 -1.16 0.36 113.62 114.84 3hng n SER 1111Ca 0.00 1.22 -0.12 0.00 -0.26 0.00 0.00 58.87 59.70 3hng n SER 1111Cb 0.00 -0.59 -0.08 0.00 -0.26 0.00 0.00 64.21 63.28 3hng n SER 1111CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3hng h ARG 1112N 0.00 -0.04 -0.72 4.33 3.08 -1.61 -2.54 114.38 116.88 3hng h ARG 1112Ca 0.67 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.77 3hng h ARG 1112Cb 1.91 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 31.93 3hng h ARG 1112CO -0.52 0.10 0.47 1.25 -1.07 0.00 0.00 179.97 180.21 3hng h LEU 1113N -0.18 0.71 -0.88 3.04 5.85 0.65 0.67 115.31 125.16 3hng h LEU 1113Ca -0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3hng h LEU 1113Cb 0.17 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.04 3hng h LEU 1113CO 0.01 0.47 0.00 -1.14 -0.34 0.00 0.00 178.44 177.44 3hng n ARG 1114N -4.47 1.53 -1.13 1.25 0.63 0.63 -3.54 116.66 111.57 3hng n ARG 1114Ca 0.10 -0.66 0.02 0.00 -0.92 0.00 0.00 57.85 56.39 3hng n ARG 1114Cb 0.17 -1.27 0.12 0.00 0.45 0.00 0.00 32.46 31.94 3hng n ARG 1114CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 3hng n GLU 1115N 0.05 1.27 -0.99 -0.14 2.13 0.23 -4.95 120.64 118.23 3hng n GLU 1115Ca 0.06 -2.98 0.00 0.00 0.66 0.00 0.00 57.16 54.90 3hng n GLU 1115Cb 0.23 -1.16 0.00 0.00 0.27 0.00 0.00 31.44 30.78 3hng n GLU 1115CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3hng n GLY 1116N -0.54 0.72 3.67 8.31 0.00 -1.19 -4.98 105.19 111.18 3hng n GLY 1116Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 3hng n GLY 1116CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hng s MET 1117N -0.05 4.31 0.24 1.61 0.00 -0.91 -5.01 119.30 119.48 3hng s MET 1117Ca 0.00 1.45 0.01 0.00 0.00 0.00 0.00 55.69 57.16 3hng s MET 1117Cb 0.00 -3.63 -0.05 0.00 0.00 0.00 0.00 34.83 31.15 3hng s MET 1117CO 0.00 -0.55 0.09 1.03 0.00 0.00 0.00 175.02 175.59 3hng s ARG 1118N 2.85 1.36 0.55 4.11 1.81 -1.26 -4.52 118.95 123.85 3hng s ARG 1118Ca 0.48 -1.72 -0.14 0.00 -1.72 0.00 0.00 55.73 52.62 3hng s ARG 1118Cb -0.18 -0.21 -0.06 0.00 -0.45 0.00 0.00 34.95 34.05 3hng s ARG 1118CO 0.12 -0.29 1.00 -1.64 -0.68 0.00 0.00 175.30 173.81 3hng s MET 1119N -4.03 3.82 0.51 3.54 -1.94 -1.26 -5.07 119.30 114.86 3hng s MET 1119Ca 0.36 0.87 -0.11 0.00 -1.71 0.00 0.00 55.69 55.11 3hng s MET 1119Cb 0.08 -2.12 -0.06 0.00 2.01 0.00 0.00 34.83 34.74 3hng s MET 1119CO 0.12 -0.38 0.90 1.03 -0.01 0.00 0.00 175.02 176.68 3hng s ARG 1120N -4.49 3.72 0.39 2.03 0.52 -1.26 -4.99 118.95 114.87 3hng s ARG 1120Ca 0.57 0.62 -0.25 0.00 -0.52 0.00 0.00 55.73 56.15 3hng s ARG 1120Cb -0.10 -2.24 -0.11 0.00 0.52 0.00 0.00 34.95 33.02 3hng s ARG 1120CO 0.40 -0.28 1.06 0.00 0.02 0.00 0.00 175.30 176.50 3hng n ALA 1121N -1.97 0.32 -1.42 2.13 0.00 -1.26 -4.96 120.51 113.35 3hng n ALA 1121Ca 0.04 0.28 -0.29 0.00 0.00 0.00 0.00 53.44 53.46 3hng n ALA 1121Cb 0.54 -2.10 0.19 0.00 0.00 0.00 0.00 19.45 18.08 3hng n ALA 1121CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hng s PRO 1122N -1.93 0.13 0.17 0.00 0.04 -1.26 -4.99 135.00 127.16 3hng s PRO 1122Ca 0.61 0.04 -0.03 0.00 0.04 0.00 0.00 61.00 61.66 3hng s PRO 1122Cb -0.58 -1.74 0.04 0.00 0.04 0.00 0.00 34.50 32.25 3hng s PRO 1122CO 0.58 -2.83 1.43 1.49 0.04 0.00 0.00 177.00 177.71 3hng h GLU 1123N -1.95 0.48 -0.57 4.56 4.81 -1.92 -3.13 114.58 116.86 3hng h GLU 1123Ca -0.48 -0.38 0.00 0.00 -0.13 0.00 0.00 59.36 58.37 3hng h GLU 1123Cb 1.30 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.75 3hng h GLU 1123CO 0.47 1.01 0.00 0.66 -0.73 0.00 0.00 179.01 180.42 3hng n TYR 1124N -3.87 1.27 -2.31 0.92 4.02 -0.34 -4.97 117.16 111.89 3hng n TYR 1124Ca -0.05 -0.62 -0.25 0.00 -0.01 0.00 0.00 57.90 56.97 3hng n TYR 1124Cb 0.70 -0.21 0.08 0.00 -0.02 0.00 0.00 39.34 39.88 3hng n TYR 1124CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 3hng s SER 1125N -1.04 4.68 0.16 7.72 1.04 -1.18 -4.98 113.70 120.10 3hng s SER 1125Ca 0.47 0.24 0.08 0.00 0.48 0.00 0.00 55.95 57.22 3hng s SER 1125Cb 0.30 -0.84 -0.04 0.00 0.10 0.00 0.00 66.02 65.54 3hng s SER 1125CO 0.22 -1.65 -0.09 -0.89 0.98 0.00 0.00 173.24 171.81 3hng s THR 1126N -3.20 3.28 0.28 2.02 2.01 -1.26 -4.98 115.64 113.79 3hng s THR 1126Ca 0.62 -1.52 0.01 0.00 0.31 0.00 0.00 61.69 61.10 3hng s THR 1126Cb -0.09 -2.60 0.28 0.00 0.01 0.00 0.00 72.50 70.09 3hng s THR 1126CO 0.44 -0.05 1.69 -0.65 -0.69 0.00 0.00 174.62 175.37 3hng h PRO 1127N 3.09 0.35 -0.49 4.92 0.11 -1.99 0.46 132.00 138.47 3hng h PRO 1127Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3hng h PRO 1127Cb 1.19 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3hng h PRO 1127CO 0.54 0.23 0.32 1.49 -0.21 0.00 0.00 178.00 180.37 3hng h GLU 1128N 0.36 0.65 -0.21 1.05 4.81 -2.00 -1.16 114.58 118.09 3hng h GLU 1128Ca 0.52 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.53 3hng h GLU 1128Cb 0.96 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.19 3hng h GLU 1128CO -0.53 0.44 -0.60 0.82 -0.73 0.00 0.00 179.01 178.41 3hng h ILE 1129N 0.66 1.30 -0.66 2.32 2.04 -1.73 -2.94 117.51 118.51 3hng h ILE 1129Ca 0.18 -1.83 0.07 0.00 1.00 0.00 0.00 64.86 64.27 3hng h ILE 1129Cb -0.06 1.79 -0.06 0.00 -0.74 0.00 0.00 36.82 37.74 3hng h ILE 1129CO -0.04 0.58 0.34 0.22 0.00 0.00 0.00 178.15 179.25 3hng h TYR 1130N 0.51 0.62 -0.99 1.37 3.20 -0.79 -1.84 116.97 119.04 3hng h TYR 1130Ca -0.00 0.03 0.20 0.00 3.14 0.00 0.00 58.73 62.10 3hng h TYR 1130Cb 1.18 -0.18 -0.10 0.00 1.54 0.00 0.00 36.73 39.17 3hng h TYR 1130CO 0.06 0.26 0.62 0.37 -1.64 0.00 0.00 178.16 177.83 3hng h GLN 1131N 0.61 0.64 -0.31 1.82 5.75 -1.03 -0.53 115.11 122.07 3hng h GLN 1131Ca 0.31 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.69 3hng h GLN 1131Cb 0.26 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.65 3hng h GLN 1131CO -0.22 0.42 -0.10 0.82 -2.65 0.00 0.00 178.83 177.10 3hng h ILE 1132N 0.66 1.29 -0.20 2.39 2.04 -1.25 -2.20 117.51 120.23 3hng h ILE 1132Ca 0.57 -1.17 0.02 0.00 1.00 0.00 0.00 64.86 65.28 3hng h ILE 1132Cb 1.03 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 3hng h ILE 1132CO -0.35 0.38 0.05 0.24 0.00 0.00 0.00 178.15 178.47 3hng h MET 1133N 0.37 0.13 -0.86 2.37 2.86 -0.79 -2.12 114.93 116.90 3hng h MET 1133Ca 0.07 -0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.79 3hng h MET 1133Cb 0.61 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 32.17 3hng h MET 1133CO 0.04 0.09 0.51 -0.07 1.06 0.00 0.00 176.91 178.53 3hng h LEU 1134N 0.14 0.76 -0.26 1.22 3.38 -1.30 0.05 115.31 119.30 3hng h LEU 1134Ca 0.09 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.16 3hng h LEU 1134Cb 0.08 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.65 3hng h LEU 1134CO -0.11 0.45 -0.12 0.44 0.09 0.00 0.00 178.44 179.19 3hng h ASP 1135N 0.88 -0.41 -0.14 -0.43 5.19 -1.05 -1.36 116.42 119.10 3hng h ASP 1135Ca 0.40 0.10 0.04 0.00 -0.62 0.00 0.00 57.03 56.95 3hng h ASP 1135Cb 0.31 0.23 -0.01 0.00 0.18 0.00 0.00 39.33 40.04 3hng h ASP 1135CO -0.22 -0.15 0.14 0.00 -3.12 0.00 0.00 179.24 175.88 3hng n TRP 1137N -3.91 2.49 -2.04 0.00 8.01 -0.27 -3.66 117.44 118.06 3hng n TRP 1137Ca 0.00 -1.52 -0.41 0.00 -1.31 0.00 0.00 57.50 54.26 3hng n TRP 1137Cb 0.25 -0.76 -0.02 0.00 -2.01 0.00 0.00 31.31 28.77 3hng n TRP 1137CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 3hng s HIS 1138N -3.15 3.00 0.23 -5.99 2.46 -1.05 -4.91 115.29 105.88 3hng s HIS 1138Ca 0.54 1.17 -0.06 0.00 0.47 0.00 0.00 55.06 57.19 3hng s HIS 1138Cb 0.45 -3.78 0.41 0.00 -0.13 0.00 0.00 32.58 29.53 3hng s HIS 1138CO 0.10 -2.40 1.73 0.07 -2.47 0.00 0.00 174.74 171.77 3hng h ARG 1139N 4.33 0.40 -5.84 2.88 -0.00 -1.93 -3.38 114.38 110.84 3hng h ARG 1139Ca -0.47 -0.02 -0.58 0.00 -0.00 0.00 0.00 59.98 58.90 3hng h ARG 1139Cb 1.22 -0.09 -0.08 0.00 -0.00 0.00 0.00 29.97 31.02 3hng h ARG 1139CO 0.73 0.26 0.29 0.34 -0.00 0.00 0.00 179.97 181.59 3hng s ASP 1140N -5.34 6.86 0.27 0.08 -1.08 -1.26 -4.93 116.67 111.26 3hng s ASP 1140Ca -0.13 1.05 0.08 0.00 -0.52 0.00 0.00 52.55 53.03 3hng s ASP 1140Cb 0.20 -2.42 0.34 0.00 -1.46 0.00 0.00 42.92 39.58 3hng s ASP 1140CO 0.76 -0.35 1.61 1.55 0.52 0.00 0.00 175.17 179.25 3hng h PRO 1141N 7.38 0.12 0.00 4.34 0.13 -1.95 -2.70 132.00 139.33 3hng h PRO 1141Ca -0.30 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 3hng h PRO 1141Cb 1.14 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3hng h PRO 1141CO 0.81 0.67 0.06 -0.22 -0.23 0.00 0.00 178.00 179.09 3hng h LYS 1142N 0.09 0.00 0.00 0.86 3.64 -1.93 -2.39 116.57 116.83 3hng h LYS 1142Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3hng h LYS 1142Cb 1.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 3hng h LYS 1142CO 0.08 0.00 0.00 -1.91 -2.27 0.00 0.00 179.45 175.35 3hng n GLU 1143N -2.36 1.92 -2.51 1.90 4.07 -1.02 -4.96 120.64 117.69 3hng n GLU 1143Ca -0.02 -1.23 -0.32 0.00 -0.06 0.00 0.00 57.16 55.54 3hng n GLU 1143Cb 0.10 -1.00 -0.03 0.00 -0.06 0.00 0.00 31.44 30.45 3hng n GLU 1143CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 3hng s ARG 1144N -0.73 3.89 0.57 5.31 0.52 -0.90 -4.93 118.95 122.69 3hng s ARG 1144Ca 0.00 0.81 -0.19 0.00 -0.52 0.00 0.00 55.73 55.83 3hng s ARG 1144Cb 0.00 -2.20 -0.04 0.00 0.52 0.00 0.00 34.95 33.22 3hng s ARG 1144CO 0.00 -0.21 1.20 -1.25 0.02 0.00 0.00 175.30 175.06 3hng s PRO 1145N -4.04 3.10 0.72 3.54 0.04 -1.26 -5.03 135.00 132.07 3hng s PRO 1145Ca 0.57 1.82 -0.11 0.00 0.04 0.00 0.00 61.00 63.32 3hng s PRO 1145Cb -0.10 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.47 3hng s PRO 1145CO 0.32 -1.10 1.07 1.03 0.04 0.00 0.00 177.00 178.36 3hng s ARG 1146N -3.25 2.72 0.55 4.56 0.52 -1.26 -4.94 118.95 117.86 3hng s ARG 1146Ca 0.75 0.91 0.33 0.00 -0.52 0.00 0.00 55.73 57.21 3hng s ARG 1146Cb -0.30 -1.97 1.54 0.00 0.52 0.00 0.00 34.95 34.74 3hng s ARG 1146CO 0.33 -1.24 2.06 0.74 0.02 0.00 0.00 175.30 177.21 3hng h PHE 1147N -0.82 0.00 -0.63 -0.53 0.04 -1.94 -2.65 116.94 110.41 3hng h PHE 1147Ca -0.44 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.29 3hng h PHE 1147Cb 1.22 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.35 3hng h PHE 1147CO 0.59 0.05 0.24 0.00 -0.60 0.00 0.00 178.31 178.59 3hng h ALA 1148N 1.95 0.82 -0.02 2.45 0.00 -1.92 -2.17 119.26 120.37 3hng h ALA 1148Ca -0.00 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 3hng h ALA 1148Cb 0.41 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3hng h ALA 1148CO 0.01 0.46 -0.71 0.93 0.00 0.00 0.00 179.25 179.93 3hng h GLU 1149N 0.89 0.13 -0.28 0.00 5.08 -1.86 -2.75 114.58 115.80 3hng h GLU 1149Ca 0.21 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 3hng h GLU 1149Cb 0.23 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 3hng h GLU 1149CO -0.01 0.79 0.14 -0.07 -1.00 0.00 0.00 179.01 178.85 3hng h LEU 1150N 0.09 0.36 -0.87 1.33 3.38 -1.39 -0.30 115.31 117.91 3hng h LEU 1150Ca -0.02 -0.12 0.11 0.00 0.09 0.00 0.00 57.88 57.95 3hng h LEU 1150Cb 1.26 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.84 3hng h LEU 1150CO 0.10 0.38 0.50 0.58 0.09 0.00 0.00 178.44 180.08 3hng h VAL 1151N 0.32 0.87 0.11 1.22 2.07 -1.36 -2.17 116.25 117.32 3hng h VAL 1151Ca 0.10 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 3hng h VAL 1151Cb 0.11 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.89 3hng h VAL 1151CO -0.01 0.14 -0.05 -0.33 0.02 0.00 0.00 177.57 177.34 3hng h GLU 1152N 0.79 -0.15 -0.48 1.57 5.08 -1.12 0.12 114.58 120.40 3hng h GLU 1152Ca 0.43 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.87 3hng h GLU 1152Cb 0.46 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.65 3hng h GLU 1152CO -0.28 0.29 -0.48 0.87 -1.00 0.00 0.00 179.01 178.42 3hng h LYS 1153N -0.66 -0.30 -0.40 2.33 1.57 -1.02 0.89 116.57 118.98 3hng h LYS 1153Ca -0.02 0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 3hng h LYS 1153Cb 0.51 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 3hng h LYS 1153CO 0.03 -0.20 -0.04 -0.07 -0.57 0.00 0.00 179.45 178.60 3hng h LEU 1154N -0.31 0.73 -0.90 2.94 3.38 -1.46 -0.88 115.31 118.81 3hng h LEU 1154Ca 0.13 -0.33 0.23 0.00 0.09 0.00 0.00 57.88 58.00 3hng h LEU 1154Cb 0.58 -0.20 -0.16 0.00 0.09 0.00 0.00 40.66 40.97 3hng h LEU 1154CO -0.63 0.89 0.02 1.23 0.09 0.00 0.00 178.44 180.04 3hng h GLY 1155N 0.56 1.08 2.00 0.83 0.00 -0.29 0.53 103.07 107.78 3hng h GLY 1155Ca 0.11 0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.57 3hng h GLY 1155CO 0.03 -0.42 -0.04 -0.55 0.00 0.00 0.00 176.54 175.57 3hng h ASP 1156N 0.06 0.00 0.54 0.19 5.19 0.61 -2.29 116.42 120.72 3hng h ASP 1156Ca 0.52 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.93 3hng h ASP 1156Cb 1.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.52 3hng h ASP 1156CO -0.82 0.04 -1.40 0.18 -3.12 0.00 0.00 179.24 174.11 3hng n LEU 1157N -3.41 0.49 0.00 1.55 4.77 0.17 -5.09 117.00 115.47 3hng n LEU 1157Ca -0.02 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3hng n LEU 1157Cb 0.15 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 3hng n LEU 1157CO 0.26 -0.09 0.08 -0.11 -1.33 0.00 0.00 177.39 176.19