#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nqb s LYS 815 N 0.00 3.25 0.52 0.00 1.02 -1.26 -5.10 119.74 118.18 2nqb s LYS 815 Ca 0.00 -0.50 -0.19 0.00 0.02 0.00 0.00 55.97 55.30 2nqb s LYS 815 Cb 0.00 -2.95 -0.07 0.00 -0.52 0.00 0.00 37.83 34.29 2nqb s LYS 815 CO 0.00 0.61 1.04 -1.54 -0.92 0.00 0.00 175.35 174.54 2nqb s SER 816 N -2.34 6.18 0.38 2.83 1.04 -1.26 -4.90 113.70 115.62 2nqb s SER 816 Ca 0.31 1.89 0.11 0.00 0.48 0.00 0.00 55.95 58.74 2nqb s SER 816 Cb -0.13 -2.55 0.75 0.00 0.10 0.00 0.00 66.02 64.19 2nqb s SER 816 CO 0.24 -0.89 1.87 0.03 0.98 0.00 0.00 173.24 175.47 2nqb h ARG 817 N 1.20 0.14 -0.45 4.02 3.08 -1.98 -1.36 114.38 119.03 2nqb h ARG 817 Ca -0.49 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 59.48 2nqb h ARG 817 Cb 1.22 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.24 2nqb h ARG 817 CO 0.59 0.38 0.10 0.77 -1.07 0.00 0.00 179.97 180.74 2nqb h SER 818 N 0.13 0.70 -0.12 7.04 0.02 -1.87 -1.07 113.55 118.38 2nqb h SER 818 Ca 0.02 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.73 2nqb h SER 818 Cb 0.51 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 2nqb h SER 818 CO 0.04 0.76 0.07 -1.13 -1.14 0.00 0.00 176.83 175.42 2nqb h ASN 819 N 0.61 0.15 -0.24 3.07 -1.24 -1.63 0.72 115.58 117.02 2nqb h ASN 819 Ca 0.14 -0.08 0.03 0.00 0.71 0.00 0.00 56.30 57.11 2nqb h ASN 819 Cb 0.34 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.34 2nqb h ASN 819 CO 0.00 0.18 0.16 0.03 -1.29 0.00 0.00 177.43 176.52 2nqb h ARG 820 N 0.10 0.18 0.00 6.67 3.08 -1.11 -0.00 114.38 123.30 2nqb h ARG 820 Ca 0.04 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2nqb h ARG 820 Cb 0.07 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2nqb h ARG 820 CO -0.01 0.12 -0.31 0.00 -1.07 0.00 0.00 179.97 178.71 2nqb h ALA 821 N 1.87 0.81 -1.38 0.04 0.00 -0.43 -3.47 119.26 116.69 2nqb h ALA 821 Ca 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2nqb h ALA 821 Cb 0.18 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.98 2nqb h ALA 821 CO -0.02 0.00 -0.08 0.41 0.00 0.00 0.00 179.25 179.56 2nqb n GLY 822 N 1.27 0.69 3.34 0.00 0.00 0.00 -5.06 105.19 105.44 2nqb n GLY 822 Ca 0.04 -0.60 -0.22 0.00 0.00 0.00 0.00 46.02 45.24 2nqb n GLY 822 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nqb s LEU 823 N -1.59 2.46 -0.14 0.99 1.43 0.04 -5.02 118.68 116.84 2nqb s LEU 823 Ca 0.06 -0.89 -0.05 0.00 -1.03 0.00 0.00 54.13 52.23 2nqb s LEU 823 Cb -0.03 -0.82 -0.25 0.00 0.03 0.00 0.00 46.19 45.12 2nqb s LEU 823 CO 0.07 -0.05 0.28 0.00 0.23 0.00 0.00 176.35 176.89 2nqb n GLN 824 N 0.18 0.74 -2.07 1.70 1.13 -1.26 -4.30 117.38 113.50 2nqb n GLN 824 Ca -0.12 0.24 -0.41 0.00 -1.94 0.00 0.00 57.00 54.77 2nqb n GLN 824 Cb 0.57 -1.68 -0.02 0.00 0.11 0.00 0.00 30.24 29.22 2nqb n GLN 824 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 2nqb s PHE 825 N -2.55 3.01 -0.76 1.08 0.40 -1.26 -4.92 117.98 112.98 2nqb s PHE 825 Ca -0.24 1.27 -0.26 0.00 -0.60 0.00 0.00 56.93 57.11 2nqb s PHE 825 Cb 0.07 -3.74 -0.09 0.00 0.51 0.00 0.00 43.02 39.77 2nqb s PHE 825 CO 0.74 -2.19 2.21 -1.25 0.70 0.00 0.00 175.22 175.44 2nqb s PRO 826 N -1.30 2.07 0.18 0.24 0.04 -1.26 -4.79 135.00 130.19 2nqb s PRO 826 Ca 0.53 0.41 -0.13 0.00 0.04 0.00 0.00 61.00 61.85 2nqb s PRO 826 Cb -0.41 -4.80 0.16 0.00 0.04 0.00 0.00 34.50 29.49 2nqb s PRO 826 CO 0.50 -3.77 1.78 0.28 0.04 0.00 0.00 177.00 175.83 2nqb h VAL 827 N 7.47 0.93 -0.70 -0.36 2.07 -1.90 -1.65 116.25 122.10 2nqb h VAL 827 Ca -0.03 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.35 2nqb h VAL 827 Cb 1.06 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 2nqb h VAL 827 CO 1.11 0.09 0.44 1.23 0.02 0.00 0.00 177.57 180.46 2nqb h GLY 828 N 0.48 1.02 0.95 2.17 0.00 -1.94 0.13 103.07 105.88 2nqb h GLY 828 Ca 0.23 -0.33 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 2nqb h GLY 828 CO -0.18 0.28 0.03 -0.09 0.00 0.00 0.00 176.54 176.58 2nqb h ARG 829 N 0.86 0.72 -0.41 4.80 2.43 -1.90 -1.84 114.38 119.03 2nqb h ARG 829 Ca 0.28 -0.22 -0.08 0.00 -0.81 0.00 0.00 59.98 59.15 2nqb h ARG 829 Cb 0.02 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2nqb h ARG 829 CO -0.11 0.78 -0.09 0.82 -1.51 0.00 0.00 179.97 179.87 2nqb h ILE 830 N 0.56 1.25 -0.64 1.20 2.04 -0.86 0.29 117.51 121.34 2nqb h ILE 830 Ca 0.12 -1.10 -0.02 0.00 1.00 0.00 0.00 64.86 64.86 2nqb h ILE 830 Cb 0.44 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 2nqb h ILE 830 CO 0.02 0.37 0.31 -0.74 0.00 0.00 0.00 178.15 178.11 2nqb h HIS 831 N 0.66 0.91 -0.35 1.37 2.76 -0.56 -1.12 115.15 118.83 2nqb h HIS 831 Ca 0.12 -0.04 -0.10 0.00 -2.20 0.00 0.00 60.37 58.15 2nqb h HIS 831 Cb 0.53 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 29.19 2nqb h HIS 831 CO 0.03 0.68 -0.19 -0.09 -1.30 0.00 0.00 177.93 177.06 2nqb h ARG 832 N 0.88 0.64 -0.19 5.26 2.43 -0.79 -1.92 114.38 120.70 2nqb h ARG 832 Ca 0.22 -0.23 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 2nqb h ARG 832 Cb 0.11 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2nqb h ARG 832 CO -0.03 0.79 -0.42 -0.07 -1.51 0.00 0.00 179.97 178.74 2nqb h LEU 833 N 0.58 0.47 -0.37 3.80 3.38 -0.51 -2.10 115.31 120.55 2nqb h LEU 833 Ca 0.09 -0.21 -0.13 0.00 0.09 0.00 0.00 57.88 57.73 2nqb h LEU 833 Cb 0.64 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2nqb h LEU 833 CO 0.05 0.83 -0.27 -0.07 0.09 0.00 0.00 178.44 179.07 2nqb h LEU 834 N 0.36 0.87 -0.84 1.67 3.38 -0.95 -1.70 115.31 118.10 2nqb h LEU 834 Ca 0.03 -0.44 -0.07 0.00 0.09 0.00 0.00 57.88 57.49 2nqb h LEU 834 Cb 0.89 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 2nqb h LEU 834 CO 0.07 1.12 0.05 0.03 0.09 0.00 0.00 178.44 179.81 2nqb h ARG 835 N 0.62 0.92 0.00 1.13 3.08 -1.23 -3.12 114.38 115.78 2nqb h ARG 835 Ca 0.07 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.88 2nqb h ARG 835 Cb 0.84 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.78 2nqb h ARG 835 CO 0.07 0.88 -0.49 1.57 -1.07 0.00 0.00 179.97 180.93 2nqb h LYS 836 N 0.86 0.00 -0.11 0.04 2.10 -1.37 -3.37 116.57 114.72 2nqb h LYS 836 Ca 0.17 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.82 2nqb h LYS 836 Cb 0.44 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.77 2nqb h LYS 836 CO 0.02 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 177.88 2nqb n GLY 837 N 1.24 -0.57 3.58 0.07 0.00 -0.64 -4.92 105.19 103.94 2nqb n GLY 837 Ca 0.03 -0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.74 2nqb n GLY 837 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2nqb n ASN 838 N -0.28 -4.00 -0.09 1.61 4.13 -1.26 -4.92 115.26 110.45 2nqb n ASN 838 Ca 0.02 -0.87 -0.09 0.00 1.68 0.00 0.00 54.58 55.32 2nqb n ASN 838 Cb 0.07 -4.09 -0.12 0.00 -1.54 0.00 0.00 39.78 34.10 2nqb n ASN 838 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2nqb n TYR 839 N -3.99 0.00 -3.58 3.10 4.02 -1.26 -5.06 117.16 110.40 2nqb n TYR 839 Ca -0.17 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.64 2nqb n TYR 839 Cb 0.63 -0.80 -0.02 0.00 -0.02 0.00 0.00 39.34 39.14 2nqb n TYR 839 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2nqb s ALA 840 N -2.40 -1.62 0.32 -0.72 0.00 -1.26 -5.02 121.76 111.06 2nqb s ALA 840 Ca -0.13 0.46 0.06 0.00 0.00 0.00 0.00 51.96 52.35 2nqb s ALA 840 Cb 0.05 0.69 0.54 0.00 0.00 0.00 0.00 23.12 24.40 2nqb s ALA 840 CO 0.62 -0.84 1.77 0.93 0.00 0.00 0.00 175.76 178.24 2nqb h GLU 841 N 2.00 0.31 -4.84 0.00 4.39 -1.98 -3.44 114.58 111.03 2nqb h GLU 841 Ca -0.26 -0.11 -0.36 0.00 0.34 0.00 0.00 59.36 58.97 2nqb h GLU 841 Cb 1.26 -0.02 -0.24 0.00 -0.10 0.00 0.00 28.75 29.65 2nqb h GLU 841 CO 0.31 0.57 -0.76 1.03 -1.16 0.00 0.00 179.01 178.99 2nqb s ARG 842 N -4.43 0.68 -0.14 2.33 0.52 -1.26 -5.13 118.95 111.52 2nqb s ARG 842 Ca -0.05 -0.63 -0.00 0.00 -0.52 0.00 0.00 55.73 54.52 2nqb s ARG 842 Cb 0.14 -0.60 0.03 0.00 0.52 0.00 0.00 34.95 35.04 2nqb s ARG 842 CO 0.77 0.14 -0.09 0.08 0.02 0.00 0.00 175.30 176.22 2nqb s VAL 843 N -0.87 1.27 0.77 3.52 1.01 -1.26 -5.10 120.40 119.74 2nqb s VAL 843 Ca -0.02 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.31 2nqb s VAL 843 Cb -0.07 -1.29 0.05 0.00 0.00 0.00 0.00 36.38 35.07 2nqb s VAL 843 CO 0.01 0.32 1.08 -0.83 0.00 0.00 0.00 175.10 175.68 2nqb s GLY 844 N 1.60 1.66 0.42 4.51 0.00 -1.26 -4.96 107.32 109.29 2nqb s GLY 844 Ca 0.03 0.13 0.09 0.00 0.00 0.00 0.00 44.72 44.97 2nqb s GLY 844 CO -0.09 0.49 2.02 0.00 0.00 0.00 0.00 173.10 175.53 2nqb h ALA 845 N -1.07 1.68 0.00 3.20 0.00 -2.03 -2.80 119.26 118.24 2nqb h ALA 845 Ca -0.45 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.28 2nqb h ALA 845 Cb 1.24 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2nqb h ALA 845 CO 0.54 0.26 -0.50 0.78 0.00 0.00 0.00 179.25 180.34 2nqb h GLY 846 N 0.53 0.00 0.42 0.00 0.00 -2.01 -3.36 103.07 98.65 2nqb h GLY 846 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.47 2nqb h GLY 846 CO -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 176.54 176.35 2nqb h ALA 847 N 1.50 -0.11 0.00 3.60 0.00 -1.87 -1.33 119.26 121.05 2nqb h ALA 847 Ca -0.00 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2nqb h ALA 847 Cb 1.24 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 2nqb h ALA 847 CO 0.06 -0.63 -0.21 -1.00 0.00 0.00 0.00 179.25 177.47 2nqb h PRO 848 N -0.22 0.00 -0.03 0.00 0.13 -1.72 -1.07 132.00 129.09 2nqb h PRO 848 Ca 0.10 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.21 2nqb h PRO 848 Cb 0.36 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.49 2nqb h PRO 848 CO -0.26 0.21 -0.03 0.28 -0.23 0.00 0.00 178.00 177.98 2nqb h VAL 849 N 0.00 1.37 -0.35 1.56 2.07 -1.58 -1.16 116.25 118.16 2nqb h VAL 849 Ca -0.00 -1.15 -0.02 0.00 0.82 0.00 0.00 66.70 66.35 2nqb h VAL 849 Cb 0.48 2.09 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 2nqb h VAL 849 CO 0.03 0.31 0.16 0.22 0.02 0.00 0.00 177.57 178.31 2nqb h TYR 850 N -0.38 0.52 -0.60 1.57 3.20 -1.09 -2.11 116.97 118.09 2nqb h TYR 850 Ca 0.01 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 2nqb h TYR 850 Cb 0.51 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 2nqb h TYR 850 CO 0.09 0.46 0.26 1.25 -1.64 0.00 0.00 178.16 178.58 2nqb h LEU 851 N 0.43 0.80 -0.95 2.82 5.85 -1.20 -1.48 115.31 121.59 2nqb h LEU 851 Ca 0.12 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 2nqb h LEU 851 Cb 0.14 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2nqb h LEU 851 CO -0.01 0.74 0.16 0.00 -0.34 0.00 0.00 178.44 178.98 2nqb h ALA 852 N 1.10 1.15 -0.49 1.25 0.00 -1.12 -0.39 119.26 120.75 2nqb h ALA 852 Ca 0.20 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2nqb h ALA 852 Cb 0.17 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2nqb h ALA 852 CO -0.02 0.58 0.04 0.00 0.00 0.00 0.00 179.25 179.84 2nqb h ALA 853 N 1.28 0.66 -0.36 0.00 0.00 -1.03 0.40 119.26 120.21 2nqb h ALA 853 Ca 0.19 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2nqb h ALA 853 Cb 0.30 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2nqb h ALA 853 CO -0.00 0.43 -0.02 0.28 0.00 0.00 0.00 179.25 179.94 2nqb h VAL 854 N 0.71 1.26 -0.56 0.00 2.07 -0.97 -0.14 116.25 118.63 2nqb h VAL 854 Ca 0.14 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.65 2nqb h VAL 854 Cb 0.46 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 2nqb h VAL 854 CO 0.02 0.34 0.36 0.24 0.02 0.00 0.00 177.57 178.55 2nqb h MET 855 N 0.46 0.74 -0.58 1.57 2.86 -0.93 -0.20 114.93 118.86 2nqb h MET 855 Ca 0.10 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.64 2nqb h MET 855 Cb 0.49 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 2nqb h MET 855 CO 0.02 0.51 0.16 1.49 1.06 0.00 0.00 176.91 180.15 2nqb h GLU 856 N 0.76 0.91 -0.72 1.72 4.81 -0.76 -1.29 114.58 120.00 2nqb h GLU 856 Ca 0.20 -0.21 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2nqb h GLU 856 Cb -0.07 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.16 2nqb h GLU 856 CO -0.04 0.83 0.22 -0.92 -0.73 0.00 0.00 179.01 178.37 2nqb h TYR 857 N 0.82 1.17 -0.26 0.92 3.20 -0.52 -0.90 116.97 121.39 2nqb h TYR 857 Ca 0.18 -0.12 -0.14 0.00 3.14 0.00 0.00 58.73 61.79 2nqb h TYR 857 Cb 0.32 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 2nqb h TYR 857 CO 0.02 0.93 -0.42 -0.07 -1.64 0.00 0.00 178.16 176.98 2nqb h LEU 858 N 1.07 0.68 -0.52 2.82 3.38 -0.89 -1.82 115.31 120.03 2nqb h LEU 858 Ca 0.23 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 2nqb h LEU 858 Cb 0.31 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2nqb h LEU 858 CO -0.01 1.01 -0.02 0.00 0.09 0.00 0.00 178.44 179.52 2nqb h ALA 859 N 1.02 0.70 -0.49 1.53 0.00 -0.99 -2.20 119.26 118.83 2nqb h ALA 859 Ca 0.04 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.66 2nqb h ALA 859 Cb 0.94 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2nqb h ALA 859 CO 0.08 0.53 0.32 0.00 0.00 0.00 0.00 179.25 180.19 2nqb h ALA 860 N 0.94 0.62 -0.68 0.00 0.00 -0.99 0.10 119.26 119.25 2nqb h ALA 860 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2nqb h ALA 860 Cb 0.55 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2nqb h ALA 860 CO 0.03 0.06 0.39 1.49 0.00 0.00 0.00 179.25 181.22 2nqb h GLU 861 N 0.66 0.94 -0.25 0.00 4.57 -1.21 0.84 114.58 120.13 2nqb h GLU 861 Ca 0.18 -0.10 -0.09 0.00 -1.18 0.00 0.00 59.36 58.18 2nqb h GLU 861 Cb -0.07 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.32 2nqb h GLU 861 CO -0.04 0.68 -0.18 0.28 -1.18 0.00 0.00 179.01 178.57 2nqb h VAL 862 N 0.93 1.31 -0.16 0.32 2.07 -1.12 -2.64 116.25 116.96 2nqb h VAL 862 Ca 0.24 -1.31 -0.07 0.00 0.82 0.00 0.00 66.70 66.38 2nqb h VAL 862 Cb 0.00 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2nqb h VAL 862 CO -0.04 0.41 -0.23 -0.07 0.02 0.00 0.00 177.57 177.66 2nqb h LEU 863 N 0.28 0.28 -0.03 2.57 3.38 -0.76 0.63 115.31 121.66 2nqb h LEU 863 Ca 0.05 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2nqb h LEU 863 Cb 0.71 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 2nqb h LEU 863 CO 0.05 0.52 0.01 -0.08 0.09 0.00 0.00 178.44 179.03 2nqb h GLU 864 N 0.26 0.04 -0.56 1.13 4.57 -0.79 -0.82 114.58 118.41 2nqb h GLU 864 Ca 0.04 -0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.12 2nqb h GLU 864 Cb 0.55 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 2nqb h GLU 864 CO 0.04 0.25 -0.04 -0.07 -1.18 0.00 0.00 179.01 178.01 2nqb h LEU 865 N -0.17 0.97 -0.47 1.64 3.38 -1.17 -2.36 115.31 117.14 2nqb h LEU 865 Ca 0.01 -0.28 -0.11 0.00 0.09 0.00 0.00 57.88 57.58 2nqb h LEU 865 Cb 0.22 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2nqb h LEU 865 CO -0.00 1.05 -0.15 0.00 0.09 0.00 0.00 178.44 179.43 2nqb h ALA 866 N 1.05 0.65 -0.70 1.53 0.00 -0.82 -1.44 119.26 119.52 2nqb h ALA 866 Ca 0.16 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2nqb h ALA 866 Cb 0.58 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2nqb h ALA 866 CO 0.03 0.58 0.35 0.78 0.00 0.00 0.00 179.25 180.99 2nqb h GLY 867 N 0.77 1.05 1.23 0.00 0.00 -1.05 0.12 103.07 105.19 2nqb h GLY 867 Ca 0.11 -0.49 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 2nqb h GLY 867 CO 0.05 0.47 -0.07 3.43 0.00 0.00 0.00 176.54 180.43 2nqb h ASN 868 N 0.98 0.90 -0.39 0.19 2.35 -1.12 -0.75 115.58 117.75 2nqb h ASN 868 Ca 0.24 -0.27 -0.07 0.00 -0.55 0.00 0.00 56.30 55.65 2nqb h ASN 868 Cb 0.08 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 2nqb h ASN 868 CO -0.03 1.00 -0.00 0.00 -1.65 0.00 0.00 177.43 176.74 2nqb h ALA 869 N 1.08 1.11 -0.38 -0.83 0.00 -0.33 -0.60 119.26 119.31 2nqb h ALA 869 Ca 0.14 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2nqb h ALA 869 Cb 0.59 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2nqb h ALA 869 CO 0.04 0.57 -0.08 0.00 0.00 0.00 0.00 179.25 179.78 2nqb h ALA 870 N 1.27 0.53 -0.57 0.00 0.00 -0.41 -2.55 119.26 117.53 2nqb h ALA 870 Ca 0.14 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2nqb h ALA 870 Cb 0.45 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2nqb h ALA 870 CO 0.02 0.38 0.35 -0.09 0.00 0.00 0.00 179.25 179.90 2nqb h ARG 871 N 0.54 0.77 -0.12 0.00 2.43 -0.79 0.57 114.38 117.77 2nqb h ARG 871 Ca 0.10 -0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.24 2nqb h ARG 871 Cb 0.59 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2nqb h ARG 871 CO 0.03 0.55 0.11 -0.44 -1.51 0.00 0.00 179.97 178.71 2nqb h ASP 872 N 0.76 0.00 -0.57 -3.80 3.32 -0.92 0.22 116.42 115.43 2nqb h ASP 872 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2nqb h ASP 872 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 2nqb h ASP 872 CO -0.04 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.07 2nqb n ASN 873 N -4.17 3.70 -3.67 6.45 3.02 -0.61 -4.92 115.26 115.05 2nqb n ASN 873 Ca -0.00 -2.21 -0.26 0.00 -0.03 0.00 0.00 54.58 52.08 2nqb n ASN 873 Cb 0.22 -0.47 0.06 0.00 -0.61 0.00 0.00 39.78 38.98 2nqb n ASN 873 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2nqb n LYS 874 N 1.06 -7.14 -4.36 3.52 5.02 0.78 -4.99 118.16 112.05 2nqb n LYS 874 Ca 0.21 0.76 -0.28 0.00 -2.02 0.00 0.00 58.31 56.98 2nqb n LYS 874 Cb 0.66 -5.76 -0.11 0.00 -0.02 0.00 0.00 35.03 29.79 2nqb n LYS 874 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2nqb s LYS 875 N -6.39 1.70 -0.10 1.97 -0.14 0.09 -5.01 119.74 111.87 2nqb s LYS 875 Ca 0.60 -1.35 0.19 0.00 -1.36 0.00 0.00 55.97 54.05 2nqb s LYS 875 Cb -0.28 -2.00 -0.28 0.00 -1.68 0.00 0.00 37.83 33.60 2nqb s LYS 875 CO 0.74 0.44 0.27 2.41 -0.76 0.00 0.00 175.35 178.45 2nqb n THR 876 N 0.44 0.61 -3.91 2.17 -1.04 -1.26 -3.80 114.28 107.49 2nqb n THR 876 Ca -0.14 -0.62 -0.36 0.00 -2.04 0.00 0.00 64.05 60.89 2nqb n THR 876 Cb 0.55 -0.22 -0.12 0.00 -1.82 0.00 0.00 70.33 68.72 2nqb n THR 876 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 2nqb s ARG 877 N -2.96 3.75 0.12 -2.82 3.52 -1.26 -5.04 118.95 114.26 2nqb s ARG 877 Ca -0.08 -0.44 -0.31 0.00 -0.13 0.00 0.00 55.73 54.76 2nqb s ARG 877 Cb 0.09 -3.25 -0.08 0.00 -1.56 0.00 0.00 34.95 30.16 2nqb s ARG 877 CO 0.81 -0.00 1.40 0.42 -0.81 0.00 0.00 175.30 177.12 2nqb s ILE 878 N 1.11 3.26 0.37 4.11 1.01 -1.26 -4.99 121.20 124.81 2nqb s ILE 878 Ca 0.04 0.90 0.06 0.00 0.00 0.00 0.00 60.65 61.66 2nqb s ILE 878 Cb -0.14 -3.58 -0.07 0.00 0.01 0.00 0.00 42.46 38.68 2nqb s ILE 878 CO 0.03 0.07 0.00 0.27 0.00 0.00 0.00 174.94 175.31 2nqb s ILE 879 N 1.13 1.79 0.29 2.92 -4.36 -1.26 -5.02 121.20 116.69 2nqb s ILE 879 Ca 0.65 -2.03 0.04 0.00 -0.26 0.00 0.00 60.65 59.04 2nqb s ILE 879 Cb -0.37 -2.86 0.29 0.00 1.25 0.00 0.00 42.46 40.77 2nqb s ILE 879 CO 0.30 -0.05 1.69 -0.65 0.24 0.00 0.00 174.94 176.47 2nqb h PRO 880 N 1.93 0.37 -0.87 0.37 0.11 -1.88 0.73 132.00 132.76 2nqb h PRO 880 Ca -0.43 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.75 2nqb h PRO 880 Cb 1.24 -0.08 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 2nqb h PRO 880 CO 0.76 0.24 0.57 -0.09 -0.21 0.00 0.00 178.00 179.26 2nqb h ARG 881 N 0.38 0.86 -0.47 1.05 9.65 -1.78 -0.57 114.38 123.50 2nqb h ARG 881 Ca 0.56 -0.05 -0.11 0.00 -1.10 0.00 0.00 59.98 59.28 2nqb h ARG 881 Cb 1.07 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 29.44 2nqb h ARG 881 CO -0.54 0.57 -0.13 0.45 2.80 0.00 0.00 179.97 183.12 2nqb h HIS 882 N 0.89 0.98 -0.63 2.20 3.86 -1.20 -0.74 115.15 120.50 2nqb h HIS 882 Ca 0.40 -0.20 -0.09 0.00 -1.16 0.00 0.00 60.37 59.32 2nqb h HIS 882 Cb 0.36 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 2nqb h HIS 882 CO -0.00 0.95 0.05 -0.07 0.86 0.00 0.00 177.93 179.72 2nqb h LEU 883 N 0.79 1.05 -0.41 2.43 3.38 -1.07 -1.37 115.31 120.11 2nqb h LEU 883 Ca 0.12 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 2nqb h LEU 883 Cb 0.66 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2nqb h LEU 883 CO 0.05 1.07 0.10 -0.61 0.09 0.00 0.00 178.44 179.14 2nqb h GLN 884 N 0.99 0.65 -0.63 1.13 5.75 -0.80 -1.54 115.11 120.66 2nqb h GLN 884 Ca 0.19 -0.15 -0.09 0.00 -0.15 0.00 0.00 58.65 58.44 2nqb h GLN 884 Cb 0.50 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.94 2nqb h GLN 884 CO 0.02 0.67 0.04 -0.07 -2.65 0.00 0.00 178.83 176.84 2nqb h LEU 885 N 0.52 1.04 -0.25 -2.39 3.38 -1.02 -0.65 115.31 115.94 2nqb h LEU 885 Ca 0.13 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2nqb h LEU 885 Cb 0.31 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2nqb h LEU 885 CO 0.00 1.07 0.15 0.00 0.09 0.00 0.00 178.44 179.75 2nqb h ALA 886 N 1.04 0.32 -0.10 1.53 0.00 -1.08 -1.69 119.26 119.28 2nqb h ALA 886 Ca 0.18 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2nqb h ALA 886 Cb 0.51 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2nqb h ALA 886 CO 0.02 -0.17 -0.06 0.82 0.00 0.00 0.00 179.25 179.86 2nqb h ILE 887 N 0.30 1.33 0.00 0.00 2.04 -1.16 -3.03 117.51 117.00 2nqb h ILE 887 Ca 0.09 -1.12 -0.05 0.00 1.00 0.00 0.00 64.86 64.78 2nqb h ILE 887 Cb 0.03 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 2nqb h ILE 887 CO -0.02 0.32 -0.22 0.03 0.00 0.00 0.00 178.15 178.27 2nqb h ARG 888 N -0.15 0.00 -0.01 2.37 2.47 -1.12 -2.56 114.38 115.39 2nqb h ARG 888 Ca 0.02 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 2nqb h ARG 888 Cb 0.54 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 2nqb h ARG 888 CO 0.02 0.22 -0.12 0.09 0.56 0.00 0.00 179.97 180.74 2nqb n ASN 889 N -3.36 0.79 -4.32 7.04 3.02 -0.64 -4.71 115.26 113.09 2nqb n ASN 889 Ca 0.00 -0.89 -0.37 0.00 -0.03 0.00 0.00 54.58 53.29 2nqb n ASN 889 Cb 0.43 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.48 2nqb n ASN 889 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2nqb s ASP 890 N -2.34 5.10 0.19 6.41 2.15 -0.98 -5.01 116.67 122.20 2nqb s ASP 890 Ca 0.31 -0.78 -0.19 0.00 0.43 0.00 0.00 52.55 52.32 2nqb s ASP 890 Cb 0.20 -1.87 0.14 0.00 -0.30 0.00 0.00 42.92 41.10 2nqb s ASP 890 CO 0.45 -0.21 1.60 -0.08 -0.17 0.00 0.00 175.17 176.76 2nqb h GLU 891 N 8.22 -0.13 -0.30 4.34 4.81 -1.84 0.41 114.58 130.08 2nqb h GLU 891 Ca -0.30 0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 58.80 2nqb h GLU 891 Cb 1.12 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.53 2nqb h GLU 891 CO 0.60 -0.09 -0.36 0.93 -0.73 0.00 0.00 179.01 179.36 2nqb h GLU 892 N -0.14 0.78 -0.39 1.92 5.08 -1.95 -1.93 114.58 117.95 2nqb h GLU 892 Ca 0.24 -0.43 -0.10 0.00 -1.00 0.00 0.00 59.36 58.06 2nqb h GLU 892 Cb 0.52 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2nqb h GLU 892 CO -0.64 1.06 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.19 2nqb h LEU 893 N 0.54 0.75 -0.92 1.33 3.38 -1.74 0.80 115.31 119.45 2nqb h LEU 893 Ca 0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 2nqb h LEU 893 Cb 0.95 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.45 2nqb h LEU 893 CO 0.09 0.92 0.53 -1.13 0.09 0.00 0.00 178.44 178.94 2nqb h ASN 894 N 0.66 1.12 -0.07 -0.43 -1.24 -0.01 0.60 115.58 116.21 2nqb h ASN 894 Ca 0.10 -0.08 -0.06 0.00 0.71 0.00 0.00 56.30 56.97 2nqb h ASN 894 Cb 0.67 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.43 2nqb h ASN 894 CO 0.05 0.87 -0.19 0.50 -1.29 0.00 0.00 177.43 177.37 2nqb h LYS 895 N 1.27 0.25 -0.97 6.67 3.64 -0.95 -1.76 116.57 124.73 2nqb h LYS 895 Ca 0.33 -0.18 0.10 0.00 -1.27 0.00 0.00 60.65 59.63 2nqb h LYS 895 Cb -0.02 0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 31.75 2nqb h LYS 895 CO -0.06 0.79 0.62 1.25 -2.27 0.00 0.00 179.45 179.78 2nqb h LEU 896 N -0.25 0.90 -3.76 5.20 5.85 -0.56 -2.34 115.31 120.36 2nqb h LEU 896 Ca -0.00 0.03 -0.43 0.00 0.84 0.00 0.00 57.88 58.32 2nqb h LEU 896 Cb 0.81 -0.15 -0.24 0.00 0.37 0.00 0.00 40.66 41.44 2nqb h LEU 896 CO 0.04 0.51 0.34 0.18 -0.34 0.00 0.00 178.44 179.17 2nqb n LEU 897 N -4.56 5.88 0.23 2.25 4.77 0.18 -4.70 117.00 121.04 2nqb n LEU 897 Ca 0.17 -3.86 0.06 0.00 -0.03 0.00 0.00 56.01 52.35 2nqb n LEU 897 Cb 0.31 -0.76 0.54 0.00 -2.33 0.00 0.00 43.42 41.18 2nqb n LEU 897 CO 0.29 1.27 0.92 0.77 -1.33 0.00 0.00 177.39 179.31 2nqb h SER 898 N 1.24 0.00 -0.46 -1.43 4.64 -0.74 -1.87 113.55 114.93 2nqb h SER 898 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 2nqb h SER 898 Cb 2.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.13 2nqb h SER 898 CO 0.92 0.17 0.00 0.61 -0.87 0.00 0.00 176.83 177.65 2nqb n GLY 899 N -1.00 1.46 3.83 -0.77 0.00 -1.26 -4.93 105.19 102.51 2nqb n GLY 899 Ca -0.02 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 2nqb n GLY 899 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nqb s VAL 900 N -1.51 5.07 -0.13 1.61 1.01 -0.71 -5.09 120.40 120.65 2nqb s VAL 900 Ca 0.32 -0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.16 2nqb s VAL 900 Cb 0.19 -3.29 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2nqb s VAL 900 CO 0.19 0.44 -0.20 -0.89 0.00 0.00 0.00 175.10 174.64 2nqb s THR 901 N -1.16 2.27 -0.32 3.92 2.01 -1.26 -5.08 115.64 116.02 2nqb s THR 901 Ca 0.21 -0.92 -0.11 0.00 0.31 0.00 0.00 61.69 61.18 2nqb s THR 901 Cb -0.12 -1.91 -0.01 0.00 0.01 0.00 0.00 72.50 70.47 2nqb s THR 901 CO 0.12 0.54 0.18 -0.63 -0.69 0.00 0.00 174.62 174.14 2nqb s ILE 902 N 0.62 4.86 0.31 1.82 1.01 -1.26 -5.06 121.20 123.51 2nqb s ILE 902 Ca -0.11 -0.33 -0.29 0.00 0.00 0.00 0.00 60.65 59.91 2nqb s ILE 902 Cb -0.16 -3.48 -0.12 0.00 0.01 0.00 0.00 42.46 38.71 2nqb s ILE 902 CO 0.03 0.04 1.52 0.00 0.00 0.00 0.00 174.94 176.53 2nqb n ALA 903 N 5.03 2.25 -2.28 9.38 0.00 -1.26 -1.91 120.51 131.72 2nqb n ALA 903 Ca -0.13 0.37 -0.21 0.00 0.00 0.00 0.00 53.44 53.47 2nqb n ALA 903 Cb 0.49 -2.41 -0.02 0.00 0.00 0.00 0.00 19.45 17.51 2nqb n ALA 903 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2nqb n GLN 904 N 1.56 -1.63 -0.02 0.00 1.13 -1.26 -4.82 117.38 112.34 2nqb n GLN 904 Ca 0.07 1.04 0.02 0.00 -1.94 0.00 0.00 57.00 56.19 2nqb n GLN 904 Cb 0.37 -5.66 -0.13 0.00 0.11 0.00 0.00 30.24 24.92 2nqb n GLN 904 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2nqb n GLY 905 N -0.93 -1.08 7.00 1.08 0.00 -0.80 -3.18 105.19 107.28 2nqb n GLY 905 Ca -0.24 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2nqb n GLY 905 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nqb n GLY 906 N 1.43 0.29 3.36 -0.02 0.00 -1.26 -4.55 105.19 104.44 2nqb n GLY 906 Ca -0.14 -0.91 -0.19 0.00 0.00 0.00 0.00 46.02 44.79 2nqb n GLY 906 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2nqb s VAL 907 N 0.00 0.57 0.23 1.61 -7.23 -1.26 -5.02 120.40 109.30 2nqb s VAL 907 Ca 0.00 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.87 2nqb s VAL 907 Cb 0.00 -2.59 -0.09 0.00 0.56 0.00 0.00 36.38 34.26 2nqb s VAL 907 CO 0.00 0.00 0.97 -0.76 -0.31 0.00 0.00 175.10 175.00 2nqb s LEU 908 N -3.38 4.61 0.16 1.32 1.43 -1.26 -4.97 118.68 116.59 2nqb s LEU 908 Ca 0.36 1.98 -0.31 0.00 -1.03 0.00 0.00 54.13 55.13 2nqb s LEU 908 Cb 0.07 -3.61 -0.10 0.00 0.03 0.00 0.00 46.19 42.57 2nqb s LEU 908 CO 0.15 0.08 1.67 -2.84 0.23 0.00 0.00 176.35 175.64 2nqb s PRO 909 N -1.05 4.17 -0.30 1.29 0.02 -1.26 -4.93 135.00 132.94 2nqb s PRO 909 Ca 0.42 2.48 -0.08 0.00 0.02 0.00 0.00 61.00 63.84 2nqb s PRO 909 Cb -0.27 -3.26 0.17 0.00 0.02 0.00 0.00 34.50 31.16 2nqb s PRO 909 CO 0.33 -0.71 0.77 1.21 -0.33 0.00 0.00 177.00 178.27 2nqb s ASN 910 N 1.58 -1.01 -0.18 2.53 2.47 -1.26 -5.14 114.94 113.94 2nqb s ASN 910 Ca 0.74 0.90 0.01 0.00 0.42 0.00 0.00 52.86 54.93 2nqb s ASN 910 Cb -0.46 1.95 0.02 0.00 -1.45 0.00 0.00 41.25 41.32 2nqb s ASN 910 CO 0.32 -0.19 -0.20 -0.63 -3.72 0.00 0.00 177.10 172.69 2nqb s ILE 911 N 2.81 2.06 0.17 -5.21 1.01 -1.26 -5.09 121.20 115.69 2nqb s ILE 911 Ca 0.06 -0.94 -0.33 0.00 0.00 0.00 0.00 60.65 59.44 2nqb s ILE 911 Cb -0.12 -1.86 -0.15 0.00 0.01 0.00 0.00 42.46 40.35 2nqb s ILE 911 CO -0.18 0.54 1.36 0.00 0.00 0.00 0.00 174.94 176.66 2nqb n GLN 912 N 4.62 1.62 -0.24 2.79 1.13 -1.26 -4.86 117.38 121.18 2nqb n GLN 912 Ca -0.21 0.58 0.04 0.00 -1.94 0.00 0.00 57.00 55.47 2nqb n GLN 912 Cb 0.50 -2.21 0.17 0.00 0.11 0.00 0.00 30.24 28.81 2nqb n GLN 912 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2nqb h ALA 913 N 4.40 0.95 -0.02 -1.58 0.00 -1.99 -1.35 119.26 119.67 2nqb h ALA 913 Ca -0.45 0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.60 2nqb h ALA 913 Cb 1.30 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 2nqb h ALA 913 CO 0.77 -0.26 0.11 -0.39 0.00 0.00 0.00 179.25 179.48 2nqb h VAL 914 N 0.36 0.07 0.00 0.00 -1.51 -2.02 -2.04 116.25 111.11 2nqb h VAL 914 Ca 0.39 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 65.82 2nqb h VAL 914 Cb 0.61 0.89 -0.01 0.00 -2.13 0.00 0.00 31.29 30.65 2nqb h VAL 914 CO -0.43 0.00 -0.20 -0.07 -1.23 0.00 0.00 177.57 175.64 2nqb h LEU 915 N 0.00 0.00-10.07 4.19 3.38 -1.59 -3.46 115.31 107.75 2nqb h LEU 915 Ca 0.01 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.46 2nqb h LEU 915 Cb 0.24 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.08 2nqb h LEU 915 CO -0.00 0.20 0.47 -0.76 0.09 0.00 0.00 178.44 178.44 2nqb s LEU 916 N -6.42 3.77 0.00 1.67 1.43 -0.77 -5.04 118.68 113.32 2nqb s LEU 916 Ca 0.04 2.32 -0.08 0.00 -1.03 0.00 0.00 54.13 55.38 2nqb s LEU 916 Cb 0.07 -4.51 0.12 0.00 0.03 0.00 0.00 46.19 41.90 2nqb s LEU 916 CO 0.67 -1.34 0.45 -0.81 0.23 0.00 0.00 176.35 175.55 2nqb n PRO 917 N -1.26 -1.75 0.00 1.29 -0.04 -1.26 -4.94 135.00 127.04 2nqb n PRO 917 Ca 0.12 -0.71 0.00 0.00 -0.04 0.00 0.00 63.50 62.86 2nqb n PRO 917 Cb 0.50 -0.65 0.00 0.00 -0.04 0.00 0.00 33.50 33.31 2nqb n PRO 917 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2nqb n LYS 918 N -2.78 0.00 0.00 0.54 2.85 -1.26 -5.16 118.16 112.35 2nqb n LYS 918 Ca 0.06 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.32 2nqb n LYS 918 Cb 0.24 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.62 2nqb n LYS 918 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71