#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ncu n ASN 805 N 0.00 2.99 -4.16 1.62 5.15 -1.26 -4.95 115.26 114.65 3ncu n ASN 805 Ca 0.00 1.20 -0.14 0.00 -0.60 0.00 0.00 54.58 55.05 3ncu n ASN 805 Cb 0.00 -1.51 -0.11 0.00 -0.53 0.00 0.00 39.78 37.63 3ncu n ASN 805 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3ncu s LYS 806 N -1.76 0.79 0.17 1.20 1.02 -1.26 -3.12 119.74 116.77 3ncu s LYS 806 Ca 0.56 -1.11 0.07 0.00 0.02 0.00 0.00 55.97 55.52 3ncu s LYS 806 Cb -0.56 -0.45 -0.04 0.00 -0.52 0.00 0.00 37.83 36.26 3ncu s LYS 806 CO 0.61 0.06 -0.01 -1.59 -0.92 0.00 0.00 175.35 173.50 3ncu s LYS 807 N -2.71 2.37 -0.17 1.68 -2.85 -0.51 -0.47 119.74 117.08 3ncu s LYS 807 Ca 0.03 -1.10 -0.05 0.00 -1.00 0.00 0.00 55.97 53.86 3ncu s LYS 807 Cb -0.03 -2.35 -0.03 0.00 -2.06 0.00 0.00 37.83 33.36 3ncu s LYS 807 CO -0.01 0.46 -0.00 -0.51 0.10 0.00 0.00 175.35 175.39 3ncu s LEU 808 N -2.86 3.41 0.07 2.77 1.02 0.22 -0.78 118.68 122.53 3ncu s LEU 808 Ca 0.27 -0.08 0.07 0.00 0.02 0.00 0.00 54.13 54.41 3ncu s LEU 808 Cb -0.09 -1.84 -0.04 0.00 0.02 0.00 0.00 46.19 44.24 3ncu s LEU 808 CO 0.18 0.15 -0.15 -0.76 0.02 0.00 0.00 176.35 175.79 3ncu s LEU 809 N 0.48 2.80 0.15 1.79 1.43 0.59 -0.10 118.68 125.82 3ncu s LEU 809 Ca -0.01 -0.42 -0.33 0.00 -1.03 0.00 0.00 54.13 52.34 3ncu s LEU 809 Cb -0.14 -1.64 -0.12 0.00 0.03 0.00 0.00 46.19 44.32 3ncu s LEU 809 CO 0.02 0.22 1.72 0.00 0.23 0.00 0.00 176.35 178.54 3ncu h ARG 811 N 7.16 0.08 0.00 0.00 9.65 -1.43 0.33 114.38 130.18 3ncu h ARG 811 Ca -0.45 -0.01 -0.09 0.00 -1.10 0.00 0.00 59.98 58.33 3ncu h ARG 811 Cb 1.23 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.78 3ncu h ARG 811 CO 0.93 0.10 -0.55 -0.22 2.80 0.00 0.00 179.97 183.04 3ncu h LYS 812 N 0.08 0.00 -0.01 0.20 3.64 -1.89 -3.41 116.57 115.19 3ncu h LYS 812 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3ncu h LYS 812 Cb 0.08 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 3ncu h LYS 812 CO 0.00 0.75 -0.31 0.00 -2.27 0.00 0.00 179.45 177.63 3ncu n LYS 814 N -0.42 -1.04 -2.04 0.00 4.76 0.11 -4.95 118.16 114.58 3ncu n LYS 814 Ca 0.04 0.48 -0.38 0.00 -2.87 0.00 0.00 58.31 55.59 3ncu n LYS 814 Cb 0.24 -4.38 0.01 0.00 -1.84 0.00 0.00 35.03 29.06 3ncu n LYS 814 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3ncu s ALA 815 N -1.74 2.92 0.24 7.82 0.00 -1.26 -4.52 121.76 125.22 3ncu s ALA 815 Ca 0.00 1.12 -0.30 0.00 0.00 0.00 0.00 51.96 52.77 3ncu s ALA 815 Cb 0.00 -3.47 -0.10 0.00 0.00 0.00 0.00 23.12 19.55 3ncu s ALA 815 CO 0.00 -0.97 1.52 -1.17 0.00 0.00 0.00 175.76 175.14 3ncu s LEU 816 N -3.22 4.37 -0.13 0.00 2.96 -1.26 -0.58 118.68 120.82 3ncu s LEU 816 Ca 0.67 2.74 -0.09 0.00 -0.22 0.00 0.00 54.13 57.23 3ncu s LEU 816 Cb -0.34 -3.62 -0.06 0.00 0.50 0.00 0.00 46.19 42.67 3ncu s LEU 816 CO 0.41 -0.79 -0.20 0.00 -1.32 0.00 0.00 176.35 174.44 3ncu n ALA 817 N 2.72 1.93 -3.44 5.97 0.00 0.85 -4.85 120.51 123.69 3ncu n ALA 817 Ca 0.09 -0.58 0.05 0.00 0.00 0.00 0.00 53.44 53.01 3ncu n ALA 817 Cb 0.39 0.24 0.01 0.00 0.00 0.00 0.00 19.45 20.09 3ncu n ALA 817 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ncu s TYR 819 N -3.68 2.38 0.55 0.00 1.51 -1.26 -0.61 117.35 116.24 3ncu s TYR 819 Ca 0.12 -0.35 0.26 0.00 -1.01 0.00 0.00 57.07 56.09 3ncu s TYR 819 Cb -0.01 -1.29 1.47 0.00 -0.11 0.00 0.00 41.96 42.01 3ncu s TYR 819 CO 0.02 0.34 2.02 1.79 -1.11 0.00 0.00 175.55 178.60 3ncu h THR 820 N 3.81 0.63 -0.06 -0.71 1.35 -1.13 0.19 112.91 116.98 3ncu h THR 820 Ca -0.50 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 65.38 3ncu h THR 820 Cb 1.17 0.76 -0.00 0.00 -1.73 0.00 0.00 68.15 68.35 3ncu h THR 820 CO 0.41 0.00 0.05 0.00 -0.25 0.00 0.00 175.52 175.73 3ncu h ALA 821 N 1.72 1.95 -0.00 6.62 0.00 -1.95 -1.53 119.26 126.07 3ncu h ALA 821 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3ncu h ALA 821 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3ncu h ALA 821 CO -0.00 -0.08 -0.29 -0.25 0.00 0.00 0.00 179.25 178.62 3ncu n ASP 822 N -4.35 0.74 -4.77 0.00 8.00 0.65 -4.92 116.55 111.89 3ncu n ASP 822 Ca -0.01 -0.59 -0.40 0.00 0.71 0.00 0.00 54.79 54.50 3ncu n ASP 822 Cb 0.15 0.10 -0.06 0.00 -0.02 0.00 0.00 41.12 41.30 3ncu n ASP 822 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3ncu s VAL 823 N -2.66 4.40 0.05 2.53 1.01 -0.58 -1.21 120.40 123.95 3ncu s VAL 823 Ca 0.21 1.72 0.04 0.00 0.00 0.00 0.00 61.98 63.95 3ncu s VAL 823 Cb 0.19 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.40 3ncu s VAL 823 CO 0.56 0.50 -0.11 -0.13 0.00 0.00 0.00 175.10 175.92 3ncu s ARG 824 N -1.00 0.71 -0.12 2.72 1.81 -0.55 -4.48 118.95 118.04 3ncu s ARG 824 Ca 0.36 -0.82 -0.01 0.00 -1.72 0.00 0.00 55.73 53.54 3ncu s ARG 824 Cb -0.23 -0.63 -0.02 0.00 -0.45 0.00 0.00 34.95 33.62 3ncu s ARG 824 CO 0.26 0.14 -0.08 0.08 -0.68 0.00 0.00 175.30 175.02 3ncu s VAL 825 N -1.20 3.52 -0.20 3.52 1.01 0.35 -1.50 120.40 125.89 3ncu s VAL 825 Ca -0.04 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 3ncu s VAL 825 Cb -0.09 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 33.80 3ncu s VAL 825 CO 0.01 0.53 -0.10 -0.63 0.00 0.00 0.00 175.10 174.92 3ncu s ILE 826 N 0.04 2.92 -1.55 2.22 1.01 0.65 -0.29 121.20 126.20 3ncu s ILE 826 Ca -0.02 -0.65 -0.04 0.00 0.00 0.00 0.00 60.65 59.93 3ncu s ILE 826 Cb -0.14 -2.30 0.00 0.00 0.01 0.00 0.00 42.46 40.04 3ncu s ILE 826 CO 0.03 0.47 0.59 -0.62 0.00 0.00 0.00 174.94 175.41 3ncu n GLU 827 N 4.66 -4.78 -2.10 2.79 1.02 -1.26 -1.56 120.64 119.42 3ncu n GLU 827 Ca -0.19 0.91 -0.11 0.00 -0.02 0.00 0.00 57.16 57.75 3ncu n GLU 827 Cb 0.51 -5.74 -0.02 0.00 -0.02 0.00 0.00 31.44 26.17 3ncu n GLU 827 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3ncu n GLU 828 N -3.97 -1.99 0.00 3.49 1.02 -1.26 -4.63 120.64 113.30 3ncu n GLU 828 Ca -0.12 0.56 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 3ncu n GLU 828 Cb 0.62 -5.02 0.00 0.00 -0.02 0.00 0.00 31.44 27.02 3ncu n GLU 828 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ncu s HIS 830 N -1.00 2.44 -0.13 0.00 3.76 -0.60 -4.95 115.29 114.81 3ncu s HIS 830 Ca 0.00 -0.34 0.02 0.00 -0.15 0.00 0.00 55.06 54.59 3ncu s HIS 830 Cb 0.00 -1.47 0.00 0.00 1.11 0.00 0.00 32.58 32.22 3ncu s HIS 830 CO 0.00 0.13 -0.21 0.71 -0.85 0.00 0.00 174.74 174.52 3ncu s TYR 831 N -0.78 2.66 0.39 1.40 1.51 -1.26 -0.25 117.35 121.02 3ncu s TYR 831 Ca 0.12 -1.12 0.04 0.00 -1.01 0.00 0.00 57.07 55.10 3ncu s TYR 831 Cb -0.10 -1.79 -0.05 0.00 -0.11 0.00 0.00 41.96 39.90 3ncu s TYR 831 CO 0.02 -0.48 0.05 -0.08 -1.11 0.00 0.00 175.55 173.95 3ncu s THR 832 N 0.60 1.25 -0.01 -0.71 -1.32 -0.56 -0.81 115.64 114.08 3ncu s THR 832 Ca -0.11 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.39 3ncu s THR 832 Cb -0.16 -2.64 -0.00 0.00 -1.51 0.00 0.00 72.50 68.18 3ncu s THR 832 CO 0.03 0.00 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.66 3ncu s VAL 833 N -3.07 0.75 0.52 5.08 1.01 -1.26 -1.48 120.40 121.95 3ncu s VAL 833 Ca 0.28 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 61.89 3ncu s VAL 833 Cb 0.07 -0.64 0.02 0.00 0.00 0.00 0.00 36.38 35.82 3ncu s VAL 833 CO 0.14 0.22 0.74 -0.76 0.00 0.00 0.00 175.10 175.43 3ncu s LEU 834 N -0.10 3.39 0.00 3.92 1.43 -0.35 -4.86 118.68 122.12 3ncu s LEU 834 Ca 0.02 0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.15 3ncu s LEU 834 Cb -0.05 -2.93 0.00 0.00 0.03 0.00 0.00 46.19 43.24 3ncu s LEU 834 CO -0.00 -1.01 0.00 0.61 0.23 0.00 0.00 176.35 176.18 3ncu n GLY 835 N -2.25 -0.12 0.19 -3.19 0.00 -1.26 -4.59 105.19 93.97 3ncu n GLY 835 Ca 0.06 -1.56 0.07 0.00 0.00 0.00 0.00 46.02 44.58 3ncu n GLY 835 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ncu h ASP 836 N 0.00 0.00 -0.45 1.61 3.32 -2.01 -3.29 116.42 115.60 3ncu h ASP 836 Ca 0.00 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.08 3ncu h ASP 836 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3ncu h ASP 836 CO 0.00 0.34 0.24 0.00 -1.72 0.00 0.00 179.24 178.09 3ncu h ALA 837 N 1.66 0.57 -0.65 3.45 0.00 -2.00 -2.20 119.26 120.10 3ncu h ALA 837 Ca -0.00 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3ncu h ALA 837 Cb 1.03 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 3ncu h ALA 837 CO 0.04 -0.11 0.30 0.35 0.00 0.00 0.00 179.25 179.84 3ncu h PHE 838 N 0.47 0.92 -0.37 0.00 3.57 -1.81 -2.28 116.94 117.44 3ncu h PHE 838 Ca 0.19 -0.04 0.09 0.00 3.53 0.00 0.00 57.97 61.74 3ncu h PHE 838 Cb 0.08 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.51 3ncu h PHE 838 CO -0.09 0.68 0.26 0.87 -2.23 0.00 0.00 178.31 177.80 3ncu h LYS 839 N 0.92 0.10 0.00 1.11 1.57 -1.52 0.26 116.57 119.01 3ncu h LYS 839 Ca 0.22 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.99 3ncu h LYS 839 Cb 0.11 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 3ncu h LYS 839 CO -0.03 0.07 -0.05 0.93 -0.57 0.00 0.00 179.45 179.80 3ncu h GLU 840 N 0.10 0.00 -0.00 3.15 4.39 -1.34 -3.27 114.58 117.61 3ncu h GLU 840 Ca 0.17 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.87 3ncu h GLU 840 Cb 0.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 3ncu h GLU 840 CO -0.02 0.05 -0.28 0.00 -1.16 0.00 0.00 179.01 177.60 3ncu s PHE 842 N -2.77 0.78 0.24 0.00 -0.71 -1.23 -1.06 117.98 113.21 3ncu s PHE 842 Ca 0.18 -0.74 0.10 0.00 -1.04 0.00 0.00 56.93 55.43 3ncu s PHE 842 Cb 0.19 -0.46 -0.04 0.00 -1.21 0.00 0.00 43.02 41.49 3ncu s PHE 842 CO 0.59 -0.13 -0.10 0.14 -1.34 0.00 0.00 175.22 174.38 3ncu s VAL 843 N -2.65 3.07 0.32 -2.49 -7.23 0.16 -4.74 120.40 106.84 3ncu s VAL 843 Ca 0.02 -1.95 0.10 0.00 -1.81 0.00 0.00 61.98 58.34 3ncu s VAL 843 Cb -0.01 -2.58 -0.05 0.00 0.56 0.00 0.00 36.38 34.29 3ncu s VAL 843 CO -0.03 -0.27 -0.07 -0.44 -0.31 0.00 0.00 175.10 173.98 3ncu s SER 844 N -3.28 3.96 -0.25 4.85 0.01 -1.26 -1.12 113.70 116.60 3ncu s SER 844 Ca 0.28 -1.02 -0.13 0.00 1.31 0.00 0.00 55.95 56.39 3ncu s SER 844 Cb -0.07 -0.46 0.08 0.00 0.21 0.00 0.00 66.02 65.78 3ncu s SER 844 CO 0.16 -0.13 0.61 -0.60 0.41 0.00 0.00 173.24 173.69 3ncu s ARG 845 N -3.63 0.60 -0.14 12.44 3.52 -0.37 -4.98 118.95 126.39 3ncu s ARG 845 Ca 0.33 1.15 -0.40 0.00 -0.13 0.00 0.00 55.73 56.67 3ncu s ARG 845 Cb -0.01 0.20 -0.18 0.00 -1.56 0.00 0.00 34.95 33.40 3ncu s ARG 845 CO 0.18 -0.16 1.41 -2.30 -0.81 0.00 0.00 175.30 173.62 3ncu n PRO 846 N 4.49 0.62 -1.78 5.12 -0.02 -1.26 -0.41 135.00 141.77 3ncu n PRO 846 Ca -0.19 0.22 -0.42 0.00 -2.02 0.00 0.00 63.50 61.10 3ncu n PRO 846 Cb 0.56 -1.81 -0.02 0.00 -0.02 0.00 0.00 33.50 32.21 3ncu n PRO 846 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3ncu s HIS 847 N 1.57 2.81 0.08 6.00 2.46 0.23 -4.65 115.29 123.79 3ncu s HIS 847 Ca 0.94 0.67 0.27 0.00 0.47 0.00 0.00 55.06 57.40 3ncu s HIS 847 Cb -1.17 -4.08 1.02 0.00 -0.13 0.00 0.00 32.58 28.22 3ncu s HIS 847 CO 0.61 -3.76 1.86 -1.00 -2.47 0.00 0.00 174.74 169.98 3ncu h PRO 848 N 5.42 0.00 -2.08 2.88 0.13 -1.88 -3.29 132.00 133.18 3ncu h PRO 848 Ca -0.46 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.16 3ncu h PRO 848 Cb 1.21 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.94 3ncu h PRO 848 CO 0.84 0.14 -1.02 1.17 -0.23 0.00 0.00 178.00 178.90 3ncu n LYS 849 N -3.27 1.70 -1.53 0.86 4.81 -1.26 -5.11 118.16 114.36 3ncu n LYS 849 Ca 0.01 -3.86 -0.35 0.00 -0.87 0.00 0.00 58.31 53.24 3ncu n LYS 849 Cb 0.40 -1.88 0.08 0.00 0.02 0.00 0.00 35.03 33.65 3ncu n LYS 849 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 3ncu s PRO 850 N -2.77 2.29 0.04 1.64 0.04 -1.24 -5.02 135.00 129.98 3ncu s PRO 850 Ca 0.43 1.77 -0.28 0.00 0.04 0.00 0.00 61.00 62.95 3ncu s PRO 850 Cb 0.33 -1.85 0.10 0.00 0.04 0.00 0.00 34.50 33.11 3ncu s PRO 850 CO -0.10 -1.72 1.08 -1.59 0.04 0.00 0.00 177.00 174.72 3ncu s LYS 851 N -3.82 0.78 -0.04 4.56 -2.85 -1.15 -5.01 119.74 112.21 3ncu s LYS 851 Ca 0.75 -0.40 0.03 0.00 -1.00 0.00 0.00 55.97 55.35 3ncu s LYS 851 Cb -0.29 0.29 -0.03 0.00 -2.06 0.00 0.00 37.83 35.73 3ncu s LYS 851 CO 0.43 -0.36 -0.12 -1.14 0.10 0.00 0.00 175.35 174.27 3ncu s GLN 852 N -2.89 2.53 -0.02 1.78 -0.44 -1.26 -0.37 119.66 118.99 3ncu s GLN 852 Ca 0.11 -0.68 -0.29 0.00 -2.50 0.00 0.00 55.36 52.00 3ncu s GLN 852 Cb 0.01 -2.42 0.09 0.00 -1.64 0.00 0.00 33.01 29.05 3ncu s GLN 852 CO -0.02 0.63 0.77 -0.59 0.50 0.00 0.00 175.29 176.58 3ncu s PHE 853 N -0.78 -0.51 0.00 1.67 -0.71 -1.18 -5.01 117.98 111.46 3ncu s PHE 853 Ca 0.12 0.68 0.00 0.00 -1.04 0.00 0.00 56.93 56.69 3ncu s PHE 853 Cb -0.11 0.47 0.00 0.00 -1.21 0.00 0.00 43.02 42.18 3ncu s PHE 853 CO 0.02 -0.59 0.00 0.43 -1.34 0.00 0.00 175.22 173.74 3ncu n SER 854 N 0.38 0.00 -1.17 1.98 7.64 -1.26 -2.08 113.62 119.12 3ncu n SER 854 Ca -0.15 0.00 0.10 0.00 1.01 0.00 0.00 58.87 59.83 3ncu n SER 854 Cb 0.60 0.00 0.28 0.00 -1.01 0.00 0.00 64.21 64.07 3ncu n SER 854 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3ncu n SER 855 N 3.46 3.78 -3.71 6.43 2.88 -1.26 -4.96 113.62 120.24 3ncu n SER 855 Ca 0.00 -2.10 -0.14 0.00 -1.33 0.00 0.00 58.87 55.30 3ncu n SER 855 Cb 0.00 -0.43 -0.08 0.00 -0.75 0.00 0.00 64.21 62.95 3ncu n SER 855 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 3ncu s PHE 856 N -1.18 -0.32 -0.12 0.66 -0.00 -0.89 -3.88 117.98 112.25 3ncu s PHE 856 Ca 0.42 0.58 -0.08 0.00 -0.00 0.00 0.00 56.93 57.84 3ncu s PHE 856 Cb 0.23 0.17 -0.04 0.00 -0.00 0.00 0.00 43.02 43.37 3ncu s PHE 856 CO 0.26 -0.40 0.17 -1.83 -0.00 0.00 0.00 175.22 173.42 3ncu s GLU 857 N -1.03 3.63 -0.37 1.99 -1.05 -0.65 -3.07 118.70 118.14 3ncu s GLU 857 Ca -0.11 -0.09 -0.20 0.00 -0.15 0.00 0.00 54.97 54.42 3ncu s GLU 857 Cb -0.04 -3.24 0.01 0.00 -0.44 0.00 0.00 34.13 30.42 3ncu s GLU 857 CO 0.05 0.68 0.63 0.21 0.95 0.00 0.00 175.26 177.78 3ncu s LYS 858 N -0.77 3.59 -0.14 -4.83 2.20 0.50 -1.15 119.74 119.15 3ncu s LYS 858 Ca 0.15 -0.05 0.00 0.00 -0.36 0.00 0.00 55.97 55.71 3ncu s LYS 858 Cb -0.12 -3.84 -0.09 0.00 -1.51 0.00 0.00 37.83 32.27 3ncu s LYS 858 CO 0.04 -0.79 -0.13 0.54 -0.36 0.00 0.00 175.35 174.65 3ncu n ARG 859 N 6.08 0.33 -4.14 4.03 1.74 -0.79 -2.95 116.66 120.96 3ncu n ARG 859 Ca -0.02 0.08 -0.14 0.00 -0.77 0.00 0.00 57.85 57.01 3ncu n ARG 859 Cb 0.48 -1.24 -0.11 0.00 -1.02 0.00 0.00 32.46 30.57 3ncu n ARG 859 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ncu s ALA 860 N -2.27 0.94 0.08 7.54 0.00 -0.95 0.78 121.76 127.88 3ncu s ALA 860 Ca -0.18 -1.04 -0.12 0.00 0.00 0.00 0.00 51.96 50.61 3ncu s ALA 860 Cb 0.05 0.03 -0.06 0.00 0.00 0.00 0.00 23.12 23.14 3ncu s ALA 860 CO 0.30 -0.02 0.44 0.15 0.00 0.00 0.00 175.76 176.64 3ncu s LYS 861 N -2.34 3.86 0.10 0.00 -0.14 0.46 -0.02 119.74 121.66 3ncu s LYS 861 Ca -0.00 0.32 0.10 0.00 -1.36 0.00 0.00 55.97 55.03 3ncu s LYS 861 Cb -0.05 -3.03 -0.04 0.00 -1.68 0.00 0.00 37.83 33.03 3ncu s LYS 861 CO 0.00 0.57 -0.26 0.96 -0.76 0.00 0.00 175.35 175.86 3ncu s ILE 862 N -1.34 2.18 0.05 2.17 -4.36 -0.24 -1.24 121.20 118.42 3ncu s ILE 862 Ca 0.32 -1.63 -0.03 0.00 -0.26 0.00 0.00 60.65 59.05 3ncu s ILE 862 Cb -0.15 -1.91 -0.03 0.00 1.25 0.00 0.00 42.46 41.62 3ncu s ILE 862 CO 0.17 0.16 0.03 -0.36 0.24 0.00 0.00 174.94 175.18 3ncu s PHE 863 N -0.99 0.38 0.15 1.37 0.40 -0.27 -1.07 117.98 117.95 3ncu s PHE 863 Ca 0.13 -0.84 -0.34 0.00 -0.60 0.00 0.00 56.93 55.27 3ncu s PHE 863 Cb -0.10 -0.27 -0.15 0.00 0.51 0.00 0.00 43.02 43.01 3ncu s PHE 863 CO 0.05 -0.39 1.46 0.00 0.70 0.00 0.00 175.22 177.04 3ncu h ALA 865 N 5.17 1.23 -1.43 0.00 0.00 -1.39 -3.21 119.26 119.64 3ncu h ALA 865 Ca -0.46 -0.30 -0.69 0.00 0.00 0.00 0.00 54.91 53.47 3ncu h ALA 865 Cb 1.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3ncu h ALA 865 CO 0.83 0.41 1.17 0.54 0.00 0.00 0.00 179.25 182.20 3ncu n ARG 866 N -3.82 1.31 -1.80 0.00 5.12 -1.26 -4.86 116.66 111.36 3ncu n ARG 866 Ca -0.01 0.44 -0.39 0.00 -1.93 0.00 0.00 57.85 55.95 3ncu n ARG 866 Cb 0.41 -2.36 0.02 0.00 -1.16 0.00 0.00 32.46 29.37 3ncu n ARG 866 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 3ncu s GLN 867 N 4.85 3.51 0.00 5.56 0.74 -1.26 -1.30 119.66 131.75 3ncu s GLN 867 Ca 1.02 2.36 0.00 0.00 0.05 0.00 0.00 55.36 58.79 3ncu s GLN 867 Cb -0.91 -2.53 0.00 0.00 1.10 0.00 0.00 33.01 30.67 3ncu s GLN 867 CO 0.56 -0.94 0.00 0.09 -0.55 0.00 0.00 175.29 174.45 3ncu n ASN 868 N -0.46 0.00 0.00 6.67 3.02 -1.26 -4.82 115.26 118.41 3ncu n ASN 868 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 3ncu n ASN 868 Cb 0.43 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 3ncu n ASN 868 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ncu n SER 870 N -1.99 -5.11 -4.73 0.00 7.64 -0.97 -4.89 113.62 103.57 3ncu n SER 870 Ca 0.00 0.18 -0.42 0.00 1.01 0.00 0.00 58.87 59.65 3ncu n SER 870 Cb 0.00 -4.37 -0.02 0.00 -1.01 0.00 0.00 64.21 58.81 3ncu n SER 870 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3ncu s HIS 871 N -2.78 2.86 -0.04 1.43 2.46 -1.26 -4.47 115.29 113.49 3ncu s HIS 871 Ca 0.00 0.58 -0.30 0.00 0.47 0.00 0.00 55.06 55.82 3ncu s HIS 871 Cb 0.00 -4.07 -0.07 0.00 -0.13 0.00 0.00 32.58 28.31 3ncu s HIS 871 CO 0.00 -3.85 1.85 0.34 -2.47 0.00 0.00 174.74 170.61 3ncu s ASP 872 N 0.86 6.42 -0.00 9.88 3.68 -1.26 -0.75 116.67 135.49 3ncu s ASP 872 Ca 0.69 2.35 0.14 0.00 2.13 0.00 0.00 52.55 57.85 3ncu s ASP 872 Cb -0.48 -2.53 -0.15 0.00 -1.45 0.00 0.00 42.92 38.31 3ncu s ASP 872 CO 0.39 -1.12 0.58 0.79 0.13 0.00 0.00 175.17 175.94 3ncu n TRP 873 N 7.89 0.00 0.00 -5.34 7.02 -0.23 -4.78 117.44 122.00 3ncu n TRP 873 Ca 0.20 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.68 3ncu n TRP 873 Cb 0.42 -0.01 0.00 0.00 -2.42 0.00 0.00 31.31 29.31 3ncu n TRP 873 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3ncu n GLY 874 N 1.33 0.44 3.25 6.99 0.00 -1.18 -2.37 105.19 113.65 3ncu n GLY 874 Ca 0.03 -1.21 -0.15 0.00 0.00 0.00 0.00 46.02 44.69 3ncu n GLY 874 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3ncu s ILE 875 N -0.97 0.10 -0.02 -0.61 -4.36 -0.39 -1.07 121.20 113.88 3ncu s ILE 875 Ca 0.00 -2.00 0.05 0.00 -0.26 0.00 0.00 60.65 58.44 3ncu s ILE 875 Cb 0.00 -2.51 -0.01 0.00 1.25 0.00 0.00 42.46 41.18 3ncu s ILE 875 CO 0.00 0.00 -0.18 -2.28 0.24 0.00 0.00 174.94 172.72 3ncu s HIS 876 N -3.89 1.60 0.12 1.37 2.46 0.98 -0.08 115.29 117.84 3ncu s HIS 876 Ca 0.39 -0.33 0.02 0.00 0.47 0.00 0.00 55.06 55.61 3ncu s HIS 876 Cb 0.06 -1.04 -0.04 0.00 -0.13 0.00 0.00 32.58 31.43 3ncu s HIS 876 CO 0.16 -0.05 -0.04 0.14 -2.47 0.00 0.00 174.74 172.48 3ncu s VAL 877 N -0.34 0.67 -0.35 0.89 -7.23 0.16 -1.88 120.40 112.31 3ncu s VAL 877 Ca 0.05 -1.95 -0.16 0.00 -1.81 0.00 0.00 61.98 58.11 3ncu s VAL 877 Cb -0.08 -1.84 -0.01 0.00 0.56 0.00 0.00 36.38 35.02 3ncu s VAL 877 CO -0.00 -0.73 0.40 -0.75 -0.31 0.00 0.00 175.10 173.71 3ncu s LYS 878 N -3.87 3.51 -0.21 4.82 2.47 -0.30 -0.36 119.74 125.80 3ncu s LYS 878 Ca 0.16 -0.41 0.01 0.00 -1.56 0.00 0.00 55.97 54.17 3ncu s LYS 878 Cb 0.06 -3.83 0.05 0.00 -1.46 0.00 0.00 37.83 32.65 3ncu s LYS 878 CO -0.02 -0.59 -0.09 -0.47 0.16 0.00 0.00 175.35 174.34 3ncu s TYR 879 N 2.11 2.47 0.00 4.03 5.04 0.20 -1.64 117.35 129.56 3ncu s TYR 879 Ca 0.13 -1.69 0.00 0.00 -2.44 0.00 0.00 57.07 53.07 3ncu s TYR 879 Cb -0.16 -1.64 0.00 0.00 0.35 0.00 0.00 41.96 40.51 3ncu s TYR 879 CO 0.12 -0.76 0.00 1.63 -1.34 0.00 0.00 175.55 175.20 3ncu n LYS 880 N 4.66 0.00 -1.02 4.97 5.02 -1.25 -0.91 118.16 129.63 3ncu n LYS 880 Ca -0.14 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.10 3ncu n LYS 880 Cb 0.45 0.00 0.31 0.00 -0.02 0.00 0.00 35.03 35.77 3ncu n LYS 880 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3ncu n THR 881 N 0.00 2.94 -4.27 -0.18 -2.24 -1.26 -4.95 114.28 104.32 3ncu n THR 881 Ca 0.00 -1.65 -0.21 0.00 -2.27 0.00 0.00 64.05 59.91 3ncu n THR 881 Cb 0.00 -0.36 -0.12 0.00 -2.10 0.00 0.00 70.33 67.75 3ncu n THR 881 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3ncu s PHE 882 N -3.00 1.63 -0.25 4.78 0.08 -0.08 -5.12 117.98 116.01 3ncu s PHE 882 Ca 0.55 -0.46 -0.00 0.00 0.12 0.00 0.00 56.93 57.14 3ncu s PHE 882 Cb 0.44 -0.87 0.04 0.00 -0.57 0.00 0.00 43.02 42.06 3ncu s PHE 882 CO 0.13 0.19 -0.07 -1.21 -0.10 0.00 0.00 175.22 174.17 3ncu s GLU 883 N -2.20 2.62 0.10 0.44 2.02 -1.26 0.60 118.70 121.03 3ncu s GLU 883 Ca 0.07 -1.11 0.03 0.00 0.02 0.00 0.00 54.97 53.98 3ncu s GLU 883 Cb -0.08 -2.96 -0.04 0.00 0.10 0.00 0.00 34.13 31.15 3ncu s GLU 883 CO 0.04 -0.47 -0.09 0.96 0.02 0.00 0.00 175.26 175.72 3ncu s ILE 884 N 1.25 0.88 0.29 -1.63 -4.36 0.51 -4.91 121.20 113.23 3ncu s ILE 884 Ca -0.03 -1.74 -0.28 0.00 -0.26 0.00 0.00 60.65 58.35 3ncu s ILE 884 Cb -0.18 -1.46 -0.10 0.00 1.25 0.00 0.00 42.46 41.98 3ncu s ILE 884 CO -0.05 -0.66 0.95 -2.16 0.24 0.00 0.00 174.94 173.26 3ncu s PRO 885 N -3.12 4.69 -0.14 0.37 0.04 -1.26 0.36 135.00 135.94 3ncu s PRO 885 Ca 0.08 1.40 0.01 0.00 0.04 0.00 0.00 61.00 62.53 3ncu s PRO 885 Cb -0.00 -2.99 0.02 0.00 0.04 0.00 0.00 34.50 31.56 3ncu s PRO 885 CO -0.01 0.37 -0.16 0.08 0.04 0.00 0.00 177.00 177.31 3ncu s VAL 886 N -1.44 1.69 0.15 -0.36 1.01 0.88 -4.26 120.40 118.08 3ncu s VAL 886 Ca 0.47 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 61.79 3ncu s VAL 886 Cb -0.22 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 3ncu s VAL 886 CO 0.27 0.48 0.01 0.27 0.00 0.00 0.00 175.10 176.13 3ncu s ILE 887 N 1.26 3.87 -0.20 2.22 -4.36 0.01 -1.27 121.20 122.73 3ncu s ILE 887 Ca 0.01 -1.28 -0.04 0.00 -0.26 0.00 0.00 60.65 59.08 3ncu s ILE 887 Cb -0.14 -2.92 -0.01 0.00 1.25 0.00 0.00 42.46 40.64 3ncu s ILE 887 CO -0.08 -0.05 -0.04 -1.59 0.24 0.00 0.00 174.94 173.42 3ncu s LYS 888 N -2.80 3.45 0.58 0.37 -2.85 -1.00 -4.46 119.74 113.03 3ncu s LYS 888 Ca 0.27 -0.60 0.28 0.00 -1.00 0.00 0.00 55.97 54.92 3ncu s LYS 888 Cb -0.10 -2.97 1.59 0.00 -2.06 0.00 0.00 37.83 34.28 3ncu s LYS 888 CO 0.19 -0.07 2.07 0.97 0.10 0.00 0.00 175.35 178.61 3ncu h ILE 889 N 5.56 0.52 0.00 3.79 6.09 -1.91 -0.69 117.51 130.88 3ncu h ILE 889 Ca -0.38 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.11 3ncu h ILE 889 Cb 1.17 0.81 0.00 0.00 0.47 0.00 0.00 36.82 39.28 3ncu h ILE 889 CO 0.60 0.00 0.00 -1.84 -3.07 0.00 0.00 178.15 173.84 3ncu n GLU 890 N -3.90 0.13 -0.10 2.19 0.28 -1.26 -1.33 120.64 116.66 3ncu n GLU 890 Ca 0.03 0.58 0.11 0.00 -0.16 0.00 0.00 57.16 57.71 3ncu n GLU 890 Cb 0.38 -1.89 0.34 0.00 1.43 0.00 0.00 31.44 31.70 3ncu n GLU 890 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 3ncu n SER 891 N -2.16 2.00 -4.21 -1.84 7.64 -0.26 -4.93 113.62 109.85 3ncu n SER 891 Ca -0.01 -1.77 -0.12 0.00 1.01 0.00 0.00 58.87 57.98 3ncu n SER 891 Cb 0.07 -0.13 -0.10 0.00 -1.01 0.00 0.00 64.21 63.04 3ncu n SER 891 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3ncu s PHE 892 N -1.74 1.09 -0.17 1.43 0.08 -0.44 -1.22 117.98 117.02 3ncu s PHE 892 Ca 0.33 -0.93 -0.06 0.00 0.12 0.00 0.00 56.93 56.39 3ncu s PHE 892 Cb 0.18 -0.61 -0.04 0.00 -0.57 0.00 0.00 43.02 41.98 3ncu s PHE 892 CO 0.27 -0.13 0.04 0.08 -0.10 0.00 0.00 175.22 175.38 3ncu s VAL 893 N -3.58 4.61 -0.19 -0.44 1.01 0.20 -4.64 120.40 117.37 3ncu s VAL 893 Ca 0.18 -0.10 -0.19 0.00 0.00 0.00 0.00 61.98 61.87 3ncu s VAL 893 Cb 0.05 -3.06 -0.03 0.00 0.00 0.00 0.00 36.38 33.34 3ncu s VAL 893 CO -0.00 0.48 0.54 -0.69 0.00 0.00 0.00 175.10 175.43 3ncu s VAL 894 N 0.25 5.09 -0.16 2.92 1.01 -0.70 -0.30 120.40 128.52 3ncu s VAL 894 Ca 0.03 1.01 0.01 0.00 0.00 0.00 0.00 61.98 63.03 3ncu s VAL 894 Cb -0.13 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.39 3ncu s VAL 894 CO 0.01 0.17 -0.18 -0.70 0.00 0.00 0.00 175.10 174.40 3ncu s GLU 895 N 1.61 3.11 0.01 2.72 2.12 0.04 0.32 118.70 128.62 3ncu s GLU 895 Ca 0.25 -0.80 -0.30 0.00 0.36 0.00 0.00 54.97 54.48 3ncu s GLU 895 Cb -0.16 -2.56 -0.06 0.00 0.26 0.00 0.00 34.13 31.61 3ncu s GLU 895 CO 0.10 -0.05 1.55 0.34 -0.54 0.00 0.00 175.26 176.66 3ncu s ASP 896 N 0.93 6.72 0.26 -1.70 -1.08 -0.39 -1.43 116.67 119.98 3ncu s ASP 896 Ca -0.04 2.26 -0.01 0.00 -0.52 0.00 0.00 52.55 54.24 3ncu s ASP 896 Cb -0.15 -2.55 0.34 0.00 -1.46 0.00 0.00 42.92 39.10 3ncu s ASP 896 CO -0.03 -0.83 1.74 0.40 0.52 0.00 0.00 175.17 176.97 3ncu h ILE 897 N 5.06 1.25 -0.22 4.11 2.04 -1.89 0.30 117.51 128.16 3ncu h ILE 897 Ca -0.39 -1.09 -0.19 0.00 1.00 0.00 0.00 64.86 64.19 3ncu h ILE 897 Cb 1.18 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 3ncu h ILE 897 CO 0.93 0.37 -0.62 0.00 0.00 0.00 0.00 178.15 178.83 3ncu h ALA 898 N 1.25 0.49 0.00 1.87 0.00 -1.91 -3.37 119.26 117.59 3ncu h ALA 898 Ca 0.12 -0.54 -0.17 0.00 0.00 0.00 0.00 54.91 54.32 3ncu h ALA 898 Cb 0.53 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 3ncu h ALA 898 CO 0.03 0.69 -1.77 0.25 0.00 0.00 0.00 179.25 178.45 3ncu n THR 899 N -3.97 0.63 -0.14 0.00 -2.24 -1.19 -5.01 114.28 102.36 3ncu n THR 899 Ca -0.05 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 3ncu n THR 899 Cb 0.66 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 3ncu n THR 899 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ncu n GLY 900 N 2.14 1.36 3.66 3.38 0.00 0.11 -5.02 105.19 110.81 3ncu n GLY 900 Ca -0.15 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.39 3ncu n GLY 900 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ncu n VAL 901 N -2.00 0.06 -4.30 1.61 0.31 -1.26 -4.62 118.33 108.14 3ncu n VAL 901 Ca 0.00 -0.01 -0.35 0.00 -0.01 0.00 0.00 64.34 63.97 3ncu n VAL 901 Cb 0.00 -1.43 -0.09 0.00 -0.91 0.00 0.00 33.84 31.41 3ncu n VAL 901 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3ncu s GLN 902 N 1.19 3.13 -0.05 5.55 -0.21 -1.26 -1.26 119.66 126.74 3ncu s GLN 902 Ca 0.82 -0.38 0.04 0.00 0.02 0.00 0.00 55.36 55.86 3ncu s GLN 902 Cb -0.74 -2.87 -0.00 0.00 1.00 0.00 0.00 33.01 30.40 3ncu s GLN 902 CO 0.41 0.66 -0.18 0.99 -2.12 0.00 0.00 175.29 175.06 3ncu s THR 903 N -0.75 1.51 -0.47 -0.19 2.01 0.15 -4.97 115.64 112.93 3ncu s THR 903 Ca 0.12 -0.74 -0.11 0.00 0.31 0.00 0.00 61.69 61.26 3ncu s THR 903 Cb -0.12 -1.30 0.10 0.00 0.01 0.00 0.00 72.50 71.19 3ncu s THR 903 CO 0.02 0.43 0.35 -0.76 -0.69 0.00 0.00 174.62 173.98 3ncu s LEU 904 N 0.16 5.60 0.31 4.42 1.43 -1.26 -1.73 118.68 127.61 3ncu s LEU 904 Ca -0.07 -1.68 -0.01 0.00 -1.03 0.00 0.00 54.13 51.34 3ncu s LEU 904 Cb -0.13 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 3ncu s LEU 904 CO 0.03 -0.67 0.52 -0.31 0.23 0.00 0.00 176.35 176.16 3ncu s TYR 905 N 1.46 3.49 -0.04 0.29 2.02 -1.26 -5.01 117.35 118.30 3ncu s TYR 905 Ca 0.04 0.39 0.05 0.00 -0.37 0.00 0.00 57.07 57.19 3ncu s TYR 905 Cb -0.26 -1.92 -0.08 0.00 -0.40 0.00 0.00 41.96 39.31 3ncu s TYR 905 CO 0.02 0.18 0.05 0.45 -1.57 0.00 0.00 175.55 174.68 3ncu n SER 906 N -1.45 3.58 -4.04 2.29 2.88 -1.26 -4.00 113.62 111.62 3ncu n SER 906 Ca -0.04 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.32 3ncu n SER 906 Cb 0.55 0.82 -0.14 0.00 -0.75 0.00 0.00 64.21 64.69 3ncu n SER 906 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 3ncu s LYS 907 N -2.22 0.66 0.43 -1.46 -0.14 -1.26 -4.30 119.74 111.46 3ncu s LYS 907 Ca -0.03 -0.44 0.11 0.00 -1.36 0.00 0.00 55.97 54.24 3ncu s LYS 907 Cb 0.02 -0.61 0.95 0.00 -1.68 0.00 0.00 37.83 36.52 3ncu s LYS 907 CO 0.24 0.16 2.04 -1.49 -0.76 0.00 0.00 175.35 175.53 3ncu h TRP 908 N 5.52 0.27 -0.70 3.18 4.06 -1.96 -2.53 115.95 123.79 3ncu h TRP 908 Ca -0.32 -0.01 0.17 0.00 2.06 0.00 0.00 58.89 60.79 3ncu h TRP 908 Cb 1.19 -0.09 -0.04 0.00 -1.00 0.00 0.00 29.16 29.22 3ncu h TRP 908 CO 0.47 0.25 0.49 1.57 -3.56 0.00 0.00 178.44 177.65 3ncu h LYS 909 N 0.28 0.19 0.00 0.49 2.10 -1.98 -1.46 116.57 116.18 3ncu h LYS 909 Ca 0.07 -0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 58.69 3ncu h LYS 909 Cb 0.11 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.39 3ncu h LYS 909 CO -0.00 0.12 -0.77 -0.44 -2.00 0.00 0.00 179.45 176.36 3ncu h ASP 910 N 0.19 0.00 -3.37 7.07 3.32 -1.88 -3.44 116.42 118.31 3ncu h ASP 910 Ca 0.34 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.76 3ncu h ASP 910 Cb 1.07 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.48 3ncu h ASP 910 CO -0.06 0.06 0.38 0.12 -1.72 0.00 0.00 179.24 178.01 3ncu s PHE 911 N -3.28 2.92 -0.33 4.55 5.36 -0.55 -5.02 117.98 121.62 3ncu s PHE 911 Ca 0.01 -0.06 -0.12 0.00 -0.96 0.00 0.00 56.93 55.81 3ncu s PHE 911 Cb 0.08 -3.80 -0.01 0.00 -0.34 0.00 0.00 43.02 38.95 3ncu s PHE 911 CO 0.76 -1.15 0.21 -1.01 -1.46 0.00 0.00 175.22 172.57 3ncu s HIS 912 N 3.43 3.21 0.33 10.12 3.76 -1.26 -4.96 115.29 129.92 3ncu s HIS 912 Ca 0.27 -0.39 -0.09 0.00 -0.15 0.00 0.00 55.06 54.69 3ncu s HIS 912 Cb -0.14 -2.43 0.02 0.00 1.11 0.00 0.00 32.58 31.14 3ncu s HIS 912 CO 0.19 -0.41 0.58 -0.59 -0.85 0.00 0.00 174.74 173.65 3ncu s PHE 913 N 1.67 0.58 -0.61 1.40 -0.71 -1.26 -5.04 117.98 114.01 3ncu s PHE 913 Ca 0.05 -0.98 -0.26 0.00 -1.04 0.00 0.00 56.93 54.71 3ncu s PHE 913 Cb -0.17 0.28 -0.06 0.00 -1.21 0.00 0.00 43.02 41.85 3ncu s PHE 913 CO 0.09 -1.23 2.21 -2.00 -1.34 0.00 0.00 175.22 172.94 3ncu s GLU 914 N -3.10 2.21 -1.06 1.99 2.12 -1.26 -4.87 118.70 114.73 3ncu s GLU 914 Ca 0.23 0.88 -0.17 0.00 0.36 0.00 0.00 54.97 56.28 3ncu s GLU 914 Cb -0.02 -4.60 0.14 0.00 0.26 0.00 0.00 34.13 29.91 3ncu s GLU 914 CO 0.15 -3.31 1.29 0.15 -0.54 0.00 0.00 175.26 172.99 3ncu s LYS 915 N 7.89 3.81 0.02 4.30 1.02 -1.26 -4.99 119.74 130.54 3ncu s LYS 915 Ca 0.85 -2.08 -0.30 0.00 0.02 0.00 0.00 55.97 54.46 3ncu s LYS 915 Cb -0.14 -5.02 -0.07 0.00 -0.52 0.00 0.00 37.83 32.08 3ncu s LYS 915 CO 0.19 -1.81 1.59 0.42 -0.92 0.00 0.00 175.35 174.82 3ncu s ILE 916 N 2.39 3.33 0.42 2.17 1.01 -1.26 -4.82 121.20 124.44 3ncu s ILE 916 Ca 0.38 0.69 -0.25 0.00 0.00 0.00 0.00 60.65 61.47 3ncu s ILE 916 Cb -0.03 -3.44 -0.08 0.00 0.01 0.00 0.00 42.46 38.91 3ncu s ILE 916 CO -0.05 -0.02 1.21 -2.84 0.00 0.00 0.00 174.94 173.24 3ncu s PRO 917 N 2.89 3.94 0.34 2.79 0.02 -1.26 -0.50 135.00 143.21 3ncu s PRO 917 Ca 0.71 1.91 -0.29 0.00 0.02 0.00 0.00 61.00 63.36 3ncu s PRO 917 Cb -0.36 -2.62 -0.12 0.00 0.02 0.00 0.00 34.50 31.42 3ncu s PRO 917 CO 0.30 -0.44 1.44 0.34 -0.33 0.00 0.00 177.00 178.31 3ncu n PHE 918 N -0.07 2.69 -3.82 6.54 7.35 0.60 -4.65 117.46 126.10 3ncu n PHE 918 Ca 0.05 0.44 -0.26 0.00 -0.76 0.00 0.00 57.45 56.92 3ncu n PHE 918 Cb 0.46 -2.50 -0.17 0.00 0.35 0.00 0.00 39.48 37.62 3ncu n PHE 918 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3ncu s ASP 919 N -0.04 2.43 0.60 -2.13 2.15 -1.26 -4.99 116.67 113.43 3ncu s ASP 919 Ca 0.57 -0.50 0.29 0.00 0.43 0.00 0.00 52.55 53.34 3ncu s ASP 919 Cb -0.52 -0.69 1.58 0.00 -0.30 0.00 0.00 42.92 42.98 3ncu s ASP 919 CO 0.60 -0.21 1.98 -0.65 -0.17 0.00 0.00 175.17 176.72 3ncu h PRO 920 N 8.21 0.00 0.00 4.34 0.11 -1.95 -0.45 132.00 142.26 3ncu h PRO 920 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 3ncu h PRO 920 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3ncu h PRO 920 CO 0.35 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.14 3ncu n ALA 921 N -2.28 2.39 0.66 -0.75 0.00 -1.26 -1.76 120.51 117.51 3ncu n ALA 921 Ca 0.04 -0.15 0.12 0.00 0.00 0.00 0.00 53.44 53.45 3ncu n ALA 921 Cb 0.50 -1.41 0.21 0.00 0.00 0.00 0.00 19.45 18.75 3ncu n ALA 921 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3ncu n GLU 922 N -1.08 2.35 -0.97 0.00 1.02 -0.18 -5.32 120.64 116.46 3ncu n GLU 922 Ca 0.17 -2.01 0.00 0.00 -0.02 0.00 0.00 57.16 55.30 3ncu n GLU 922 Cb 0.12 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 3ncu n GLU 922 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98