#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kh0 s LEU 788 N 0.00 4.16 -0.05 3.41 1.43 -1.26 -5.09 118.68 121.28 3kh0 s LEU 788 Ca 0.00 0.91 -0.02 0.00 -1.03 0.00 0.00 54.13 53.99 3kh0 s LEU 788 Cb 0.00 -3.68 -0.04 0.00 0.03 0.00 0.00 46.19 42.50 3kh0 s LEU 788 CO 0.00 -0.08 0.06 -0.31 0.23 0.00 0.00 176.35 176.25 3kh0 s TYR 789 N -1.84 3.29 0.19 0.29 1.51 -1.26 -5.11 117.35 114.42 3kh0 s TYR 789 Ca 0.47 0.25 -0.01 0.00 -1.01 0.00 0.00 57.07 56.77 3kh0 s TYR 789 Cb -0.11 -1.78 -0.04 0.00 -0.11 0.00 0.00 41.96 39.91 3kh0 s TYR 789 CO 0.22 0.55 0.11 -0.06 -1.11 0.00 0.00 175.55 175.26 3kh0 s PHE 790 N -1.06 1.15 0.02 2.71 0.40 -1.26 -5.01 117.98 114.93 3kh0 s PHE 790 Ca 0.18 -1.32 0.00 0.00 -0.60 0.00 0.00 56.93 55.19 3kh0 s PHE 790 Cb -0.12 -0.59 -0.01 0.00 0.51 0.00 0.00 43.02 42.81 3kh0 s PHE 790 CO 0.08 -0.57 -0.03 1.14 0.70 0.00 0.00 175.22 176.54 3kh0 s GLN 791 N -4.12 0.25 -0.14 0.44 -2.07 -1.26 -5.08 119.66 107.69 3kh0 s GLN 791 Ca 0.36 -0.46 -0.29 0.00 -1.82 0.00 0.00 55.36 53.15 3kh0 s GLN 791 Cb 0.07 0.04 0.09 0.00 -1.09 0.00 0.00 33.01 32.12 3kh0 s GLN 791 CO 0.10 -0.03 0.79 0.20 -1.32 0.00 0.00 175.29 175.04 3kh0 s GLY 792 N -1.08 -0.46 -0.81 2.60 0.00 -1.26 -4.61 107.32 101.70 3kh0 s GLY 792 Ca -0.11 1.73 0.01 0.00 0.00 0.00 0.00 44.72 46.35 3kh0 s GLY 792 CO -0.01 1.19 1.56 -2.01 0.00 0.00 0.00 173.10 173.84 3kh0 n ASN 793 N 1.30 6.36 -3.71 1.64 4.05 -1.26 -4.92 115.26 118.72 3kh0 n ASN 793 Ca -0.15 -3.72 -0.11 0.00 0.45 0.00 0.00 54.58 51.04 3kh0 n ASN 793 Cb 0.57 -0.91 -0.11 0.00 1.23 0.00 0.00 39.78 40.55 3kh0 n ASN 793 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 177.26 172.63 3kh0 s GLN 794 N -3.98 0.34 0.09 1.20 0.74 -1.26 -5.03 119.66 111.76 3kh0 s GLN 794 Ca 0.45 0.70 0.06 0.00 0.05 0.00 0.00 55.36 56.62 3kh0 s GLN 794 Cb 0.28 -0.04 -0.22 0.00 1.10 0.00 0.00 33.01 34.13 3kh0 s GLN 794 CO -0.19 -0.15 1.17 1.96 -0.55 0.00 0.00 175.29 177.52 3kh0 h GLN 795 N 7.05 0.04 -2.47 1.67 4.20 -2.03 -3.48 115.11 120.10 3kh0 h GLN 795 Ca -0.37 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.23 3kh0 h GLN 795 Cb 1.18 0.03 -0.16 0.00 0.30 0.00 0.00 27.48 28.82 3kh0 h GLN 795 CO 0.32 0.96 0.22 0.54 -0.67 0.00 0.00 178.83 180.20 3kh0 s VAL 796 N -2.69 0.00 0.00 -0.54 0.11 -1.26 -5.18 120.40 110.84 3kh0 s VAL 796 Ca -0.01 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.04 3kh0 s VAL 796 Cb 0.09 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.94 3kh0 s VAL 796 CO 0.83 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 173.21 3kh0 n GLY 797 N 0.27 0.18 3.80 6.54 0.00 -1.26 -5.05 105.19 109.68 3kh0 n GLY 797 Ca -0.18 -2.30 -0.34 0.00 0.00 0.00 0.00 46.02 43.20 3kh0 n GLY 797 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kh0 s ASP 798 N -3.52 6.69 0.29 1.61 1.01 -1.26 -4.98 116.67 116.51 3kh0 s ASP 798 Ca 0.00 1.86 -0.20 0.00 0.71 0.00 0.00 52.55 54.92 3kh0 s ASP 798 Cb 0.00 -2.56 0.04 0.00 1.01 0.00 0.00 42.92 41.41 3kh0 s ASP 798 CO 0.00 -0.54 0.78 0.00 0.21 0.00 0.00 175.17 175.63 3kh0 s ILE 801 N -3.75 4.08 0.44 0.00 1.01 -1.26 -0.14 121.20 121.58 3kh0 s ILE 801 Ca 0.04 -0.27 0.06 0.00 0.00 0.00 0.00 60.65 60.48 3kh0 s ILE 801 Cb 0.04 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.63 3kh0 s ILE 801 CO -0.10 0.43 0.13 0.27 0.00 0.00 0.00 174.94 175.67 3kh0 s ILE 802 N 0.87 1.96 -0.16 2.92 -4.36 0.19 -4.92 121.20 117.70 3kh0 s ILE 802 Ca 0.01 -1.81 0.01 0.00 -0.26 0.00 0.00 60.65 58.61 3kh0 s ILE 802 Cb -0.14 -2.77 0.01 0.00 1.25 0.00 0.00 42.46 40.81 3kh0 s ILE 802 CO 0.02 0.00 -0.20 -0.13 0.24 0.00 0.00 174.94 174.87 3kh0 s ARG 803 N -3.89 3.06 -0.22 0.37 0.52 -0.23 0.04 118.95 118.60 3kh0 s ARG 803 Ca 0.33 -0.82 -0.02 0.00 -0.52 0.00 0.00 55.73 54.69 3kh0 s ARG 803 Cb 0.05 -2.52 0.01 0.00 0.52 0.00 0.00 34.95 33.00 3kh0 s ARG 803 CO 0.18 -0.07 -0.07 0.08 0.02 0.00 0.00 175.30 175.44 3kh0 s VAL 804 N 0.96 3.01 0.25 3.52 1.01 0.13 -0.08 120.40 129.21 3kh0 s VAL 804 Ca -0.03 -0.72 -0.07 0.00 0.00 0.00 0.00 61.98 61.16 3kh0 s VAL 804 Cb -0.15 -2.40 -0.06 0.00 0.00 0.00 0.00 36.38 33.77 3kh0 s VAL 804 CO -0.05 0.38 0.54 -0.55 0.00 0.00 0.00 175.10 175.42 3kh0 s SER 805 N 1.41 6.53 -0.10 3.32 0.15 0.11 -1.42 113.70 123.69 3kh0 s SER 805 Ca 0.04 0.79 -0.06 0.00 0.70 0.00 0.00 55.95 57.42 3kh0 s SER 805 Cb -0.15 -2.18 0.04 0.00 -1.71 0.00 0.00 66.02 62.03 3kh0 s SER 805 CO -0.05 -0.12 0.25 -0.22 1.20 0.00 0.00 173.24 174.29 3kh0 s LEU 806 N -3.15 0.60 -0.46 3.45 2.96 -1.03 -0.28 118.68 120.78 3kh0 s LEU 806 Ca 0.45 0.52 -0.29 0.00 -0.22 0.00 0.00 54.13 54.59 3kh0 s LEU 806 Cb -0.11 0.77 0.02 0.00 0.50 0.00 0.00 46.19 47.37 3kh0 s LEU 806 CO 0.26 -0.14 1.29 -0.62 -1.32 0.00 0.00 176.35 175.81 3kh0 s ASP 807 N 0.94 6.46 -0.16 3.68 2.15 -1.26 -2.25 116.67 126.22 3kh0 s ASP 807 Ca -0.07 0.62 -0.15 0.00 0.43 0.00 0.00 52.55 53.38 3kh0 s ASP 807 Cb -0.08 -2.55 0.04 0.00 -0.30 0.00 0.00 42.92 40.04 3kh0 s ASP 807 CO -0.06 -1.37 0.43 0.68 -0.17 0.00 0.00 175.17 174.68 3kh0 s VAL 808 N 5.03 -0.00 -1.24 1.11 -7.23 -1.03 -4.97 120.40 112.07 3kh0 s VAL 808 Ca 0.54 0.01 -0.02 0.00 -1.81 0.00 0.00 61.98 60.70 3kh0 s VAL 808 Cb -0.10 -0.61 -0.01 0.00 0.56 0.00 0.00 36.38 36.22 3kh0 s VAL 808 CO 0.32 0.00 0.81 -0.90 -0.31 0.00 0.00 175.10 175.02 3kh0 n ASP 809 N 2.93 -2.25 -3.87 4.85 5.75 -1.26 -3.27 116.55 119.42 3kh0 n ASP 809 Ca -0.14 -0.76 -0.25 0.00 -0.01 0.00 0.00 54.79 53.63 3kh0 n ASP 809 Cb 0.57 -4.44 0.00 0.00 -1.03 0.00 0.00 41.12 36.22 3kh0 n ASP 809 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3kh0 n ASN 810 N -3.07 -1.04 0.00 -1.12 4.13 -1.26 -4.89 115.26 108.01 3kh0 n ASN 810 Ca -0.26 -0.93 0.00 0.00 1.68 0.00 0.00 54.58 55.07 3kh0 n ASN 810 Cb 0.66 -3.45 0.00 0.00 -1.54 0.00 0.00 39.78 35.46 3kh0 n ASN 810 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3kh0 n GLY 811 N -1.79 1.10 2.66 7.41 0.00 -1.20 -5.15 105.19 108.21 3kh0 n GLY 811 Ca -0.27 -0.48 -0.24 0.00 0.00 0.00 0.00 46.02 45.03 3kh0 n GLY 811 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kh0 s ASN 812 N 2.00 2.02 -0.23 1.61 0.01 -1.26 -2.46 114.94 116.63 3kh0 s ASN 812 Ca 0.00 -0.40 -0.17 0.00 -0.71 0.00 0.00 52.86 51.58 3kh0 s ASN 812 Cb 0.00 -0.27 -0.03 0.00 0.41 0.00 0.00 41.25 41.35 3kh0 s ASN 812 CO 0.00 -0.30 0.45 -0.32 -1.51 0.00 0.00 177.10 175.41 3kh0 s MET 813 N 2.10 4.12 -0.13 -0.60 -2.45 -0.96 -4.91 119.30 116.47 3kh0 s MET 813 Ca 0.03 0.24 -0.07 0.00 -1.25 0.00 0.00 55.69 54.65 3kh0 s MET 813 Cb -0.15 -3.59 -0.04 0.00 1.25 0.00 0.00 34.83 32.30 3kh0 s MET 813 CO -0.07 -0.19 0.11 0.71 1.05 0.00 0.00 175.02 176.63 3kh0 s TYR 814 N 1.77 3.46 0.02 4.11 2.02 -1.26 -2.46 117.35 125.01 3kh0 s TYR 814 Ca 0.20 0.39 0.07 0.00 -0.37 0.00 0.00 57.07 57.36 3kh0 s TYR 814 Cb -0.15 -1.96 -0.02 0.00 -0.40 0.00 0.00 41.96 39.43 3kh0 s TYR 814 CO 0.09 0.56 -0.22 0.15 -1.57 0.00 0.00 175.55 174.56 3kh0 s LYS 815 N -0.65 1.61 0.05 -0.62 -0.14 -0.51 -4.90 119.74 114.57 3kh0 s LYS 815 Ca 0.12 -0.90 -0.27 0.00 -1.36 0.00 0.00 55.97 53.57 3kh0 s LYS 815 Cb -0.12 -1.66 -0.05 0.00 -1.68 0.00 0.00 37.83 34.32 3kh0 s LYS 815 CO 0.02 0.44 0.83 -1.12 -0.76 0.00 0.00 175.35 174.76 3kh0 s SER 816 N -0.91 7.28 -0.03 2.83 0.01 -1.26 0.21 113.70 121.83 3kh0 s SER 816 Ca 0.08 1.53 0.03 0.00 1.31 0.00 0.00 55.95 58.91 3kh0 s SER 816 Cb -0.09 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.64 3kh0 s SER 816 CO 0.01 -0.05 -0.10 -0.63 0.41 0.00 0.00 173.24 172.88 3kh0 s ILE 817 N 0.15 0.89 -0.05 1.44 -1.09 0.11 -4.93 121.20 117.71 3kh0 s ILE 817 Ca 0.42 -0.42 -0.30 0.00 -2.23 0.00 0.00 60.65 58.12 3kh0 s ILE 817 Cb -0.21 -0.79 -0.02 0.00 -1.58 0.00 0.00 42.46 39.86 3kh0 s ILE 817 CO 0.25 0.27 1.03 -0.22 -1.23 0.00 0.00 174.94 175.04 3kh0 s LEU 818 N 0.17 4.30 -0.25 2.97 2.96 -1.26 -0.64 118.68 126.93 3kh0 s LEU 818 Ca -0.03 1.63 0.01 0.00 -0.22 0.00 0.00 54.13 55.52 3kh0 s LEU 818 Cb -0.09 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 43.08 3kh0 s LEU 818 CO 0.01 -0.40 -0.10 -0.69 -1.32 0.00 0.00 176.35 173.85 3kh0 s VAL 819 N 1.62 2.39 0.55 1.68 1.01 0.80 -4.91 120.40 123.55 3kh0 s VAL 819 Ca 0.51 -1.35 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 3kh0 s VAL 819 Cb -0.20 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 3kh0 s VAL 819 CO 0.23 0.12 0.93 0.42 0.00 0.00 0.00 175.10 176.79 3kh0 s THR 820 N 1.20 4.77 0.56 3.92 -4.23 -1.26 -0.81 115.64 119.79 3kh0 s THR 820 Ca -0.04 0.64 0.24 0.00 -1.18 0.00 0.00 61.69 61.36 3kh0 s THR 820 Cb -0.18 -3.85 0.33 0.00 1.34 0.00 0.00 72.50 70.14 3kh0 s THR 820 CO -0.06 -0.98 2.16 0.77 -0.54 0.00 0.00 174.62 175.97 3kh0 h SER 821 N 0.03 0.00 1.14 3.99 4.64 -1.75 -2.24 113.55 119.36 3kh0 h SER 821 Ca -0.45 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.83 3kh0 h SER 821 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 3kh0 h SER 821 CO 0.62 0.00 -0.88 1.56 -0.87 0.00 0.00 176.83 177.26 3kh0 h GLN 822 N 0.00 0.00 -6.36 4.77 4.20 -1.93 -3.44 115.11 112.36 3kh0 h GLN 822 Ca 0.04 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 58.15 3kh0 h GLN 822 Cb 0.20 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.02 3kh0 h GLN 822 CO -0.00 0.08 1.00 -0.25 -0.67 0.00 0.00 178.83 178.99 3kh0 n ASP 823 N -2.82 3.36 -4.95 1.46 8.00 -0.84 -4.91 116.55 115.85 3kh0 n ASP 823 Ca -0.01 1.01 -0.23 0.00 0.71 0.00 0.00 54.79 56.27 3kh0 n ASP 823 Cb 0.61 -1.40 -0.01 0.00 -0.02 0.00 0.00 41.12 40.30 3kh0 n ASP 823 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3kh0 s LYS 824 N 3.00 3.39 0.29 -1.24 1.02 -1.26 -1.01 119.74 123.92 3kh0 s LYS 824 Ca 0.88 -0.46 -0.03 0.00 0.02 0.00 0.00 55.97 56.38 3kh0 s LYS 824 Cb -0.68 -2.69 0.61 0.00 -0.52 0.00 0.00 37.83 34.56 3kh0 s LYS 824 CO 0.46 0.11 1.58 0.00 -0.92 0.00 0.00 175.35 176.59 3kh0 h ALA 825 N 0.76 0.95 -0.50 5.17 0.00 -1.29 -2.45 119.26 121.89 3kh0 h ALA 825 Ca -0.49 0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 3kh0 h ALA 825 Cb 1.23 0.61 -0.02 0.00 0.00 0.00 0.00 17.79 19.61 3kh0 h ALA 825 CO 0.60 -0.49 0.17 -1.35 0.00 0.00 0.00 179.25 178.18 3kh0 h PRO 826 N 0.02 0.74 -0.41 0.00 0.11 -1.89 -0.53 132.00 130.03 3kh0 h PRO 826 Ca 0.53 -0.12 -0.09 0.00 0.11 0.00 0.00 66.00 66.44 3kh0 h PRO 826 Cb 0.99 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 3kh0 h PRO 826 CO -0.91 0.63 -0.09 0.00 -0.21 0.00 0.00 178.00 177.42 3kh0 h ALA 827 N 1.46 1.06 -0.16 -0.75 0.00 -1.84 -1.81 119.26 117.23 3kh0 h ALA 827 Ca 0.17 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 3kh0 h ALA 827 Cb 0.20 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3kh0 h ALA 827 CO -0.01 0.58 -0.50 0.28 0.00 0.00 0.00 179.25 179.60 3kh0 h VAL 828 N 0.66 1.33 -0.70 0.00 2.07 -1.34 -2.88 116.25 115.40 3kh0 h VAL 828 Ca 0.12 -1.75 0.03 0.00 0.82 0.00 0.00 66.70 65.91 3kh0 h VAL 828 Cb 0.54 1.98 -0.04 0.00 -1.52 0.00 0.00 31.29 32.25 3kh0 h VAL 828 CO 0.03 0.54 0.44 0.40 0.02 0.00 0.00 177.57 179.00 3kh0 h ILE 829 N 0.30 1.10 -0.71 4.57 2.04 -1.00 -1.50 117.51 122.31 3kh0 h ILE 829 Ca -0.02 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 3kh0 h ILE 829 Cb 1.12 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 3kh0 h ILE 829 CO 0.11 0.16 0.37 0.03 0.00 0.00 0.00 178.15 178.82 3kh0 h ARG 830 N 0.87 1.00 -0.35 2.37 3.08 -1.33 0.44 114.38 120.46 3kh0 h ARG 830 Ca 0.28 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 3kh0 h ARG 830 Cb 0.00 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 3kh0 h ARG 830 CO -0.10 0.76 0.16 0.87 -1.07 0.00 0.00 179.97 180.59 3kh0 h LYS 831 N 0.98 0.50 -0.56 0.04 1.57 -1.25 -1.39 116.57 116.47 3kh0 h LYS 831 Ca 0.25 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 3kh0 h LYS 831 Cb 0.06 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 3kh0 h LYS 831 CO -0.04 0.47 0.29 0.00 -0.57 0.00 0.00 179.45 179.60 3kh0 h ALA 832 N 1.01 0.71 -0.76 3.86 0.00 -0.89 -2.46 119.26 120.75 3kh0 h ALA 832 Ca 0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3kh0 h ALA 832 Cb 0.13 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 3kh0 h ALA 832 CO -0.01 0.25 0.42 0.52 0.00 0.00 0.00 179.25 180.42 3kh0 h MET 833 N 0.75 1.06 -0.38 0.00 2.86 -0.80 -0.72 114.93 117.70 3kh0 h MET 833 Ca 0.19 -0.12 0.02 0.00 -2.06 0.00 0.00 59.70 57.73 3kh0 h MET 833 Cb 0.07 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.49 3kh0 h MET 833 CO -0.03 0.78 0.21 -0.44 1.06 0.00 0.00 176.91 178.49 3kh0 h ASP 834 N 1.05 0.33 0.10 1.22 3.32 -1.02 0.58 116.42 122.01 3kh0 h ASP 834 Ca 0.27 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.21 3kh0 h ASP 834 Cb 0.03 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3kh0 h ASP 834 CO -0.04 0.24 -0.39 0.11 -1.72 0.00 0.00 179.24 177.44 3kh0 h LYS 835 N 0.43 0.38 -0.27 3.56 1.57 -1.02 -2.79 116.57 118.44 3kh0 h LYS 835 Ca 0.15 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3kh0 h LYS 835 Cb 0.02 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3kh0 h LYS 835 CO -0.08 0.72 0.00 0.72 -0.57 0.00 0.00 179.45 180.24 3kh0 n HIS 836 N -4.03 0.36 -3.59 -1.35 8.25 -0.31 -4.94 115.22 109.60 3kh0 n HIS 836 Ca -0.01 -0.18 -0.26 0.00 -0.26 0.00 0.00 57.72 57.01 3kh0 n HIS 836 Cb 0.49 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.65 3kh0 n HIS 836 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3kh0 n ASN 837 N 0.29 -5.75 -2.32 0.41 3.02 -0.75 -4.93 115.26 105.24 3kh0 n ASN 837 Ca 0.09 -0.56 -0.34 0.00 -0.03 0.00 0.00 54.58 53.74 3kh0 n ASN 837 Cb 0.23 -4.57 0.08 0.00 -0.61 0.00 0.00 39.78 34.92 3kh0 n ASN 837 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3kh0 n LEU 838 N -4.69 7.62 -0.30 3.41 4.77 0.12 -4.77 117.00 123.17 3kh0 n LEU 838 Ca -0.00 -4.28 0.07 0.00 -0.03 0.00 0.00 56.01 51.77 3kh0 n LEU 838 Cb 0.56 -0.96 0.29 0.00 -2.33 0.00 0.00 43.42 40.97 3kh0 n LEU 838 CO 0.65 1.47 1.24 -0.33 -1.33 0.00 0.00 177.39 179.08 3kh0 h GLU 839 N 1.98 0.88 -0.00 3.23 3.07 -1.91 -1.84 114.58 119.99 3kh0 h GLU 839 Ca 0.60 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.41 3kh0 h GLU 839 Cb 0.88 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 3kh0 h GLU 839 CO 1.57 0.58 0.00 0.39 -1.40 0.00 0.00 179.01 180.15 3kh0 n GLU 840 N -4.54 1.01 -3.69 2.33 4.71 -1.26 -4.86 120.64 114.35 3kh0 n GLU 840 Ca 0.16 -0.02 -0.21 0.00 -0.01 0.00 0.00 57.16 57.07 3kh0 n GLU 840 Cb 0.31 -1.36 -0.04 0.00 -1.01 0.00 0.00 31.44 29.35 3kh0 n GLU 840 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 3kh0 s GLU 841 N -2.00 2.53 0.02 3.49 2.02 -0.69 -5.15 118.70 118.92 3kh0 s GLU 841 Ca 0.34 -1.52 0.06 0.00 0.02 0.00 0.00 54.97 53.86 3kh0 s GLU 841 Cb 0.16 -2.35 -0.03 0.00 0.10 0.00 0.00 34.13 32.01 3kh0 s GLU 841 CO 0.26 -0.12 -0.15 -1.21 0.02 0.00 0.00 175.26 174.07 3kh0 s GLU 842 N -4.07 2.25 0.53 1.61 0.41 -1.26 -5.03 118.70 113.14 3kh0 s GLU 842 Ca 0.46 -0.87 0.26 0.00 -0.41 0.00 0.00 54.97 54.40 3kh0 s GLU 842 Cb -0.03 -2.29 1.46 0.00 -1.78 0.00 0.00 34.13 31.49 3kh0 s GLU 842 CO 0.27 0.57 2.09 -1.00 -0.49 0.00 0.00 175.26 176.70 3kh0 h PRO 843 N 4.66 0.00 0.00 0.39 0.13 -1.94 -2.28 132.00 132.96 3kh0 h PRO 843 Ca -0.48 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 3kh0 h PRO 843 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 3kh0 h PRO 843 CO 0.50 0.11 -0.08 0.93 -0.23 0.00 0.00 178.00 179.22 3kh0 h GLU 844 N 0.00 0.00 -0.14 0.86 3.07 -1.97 -2.55 114.58 113.86 3kh0 h GLU 844 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3kh0 h GLU 844 Cb 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 3kh0 h GLU 844 CO 0.01 0.08 0.00 -0.25 -1.40 0.00 0.00 179.01 177.46 3kh0 n ASP 845 N -3.61 1.35 -4.26 1.42 8.00 -0.86 -4.91 116.55 113.68 3kh0 n ASP 845 Ca -0.02 -1.67 -0.17 0.00 0.71 0.00 0.00 54.79 53.64 3kh0 n ASP 845 Cb 0.20 -0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 41.11 3kh0 n ASP 845 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3kh0 s TYR 846 N -1.82 1.41 0.08 1.24 2.02 -0.96 -1.28 117.35 118.05 3kh0 s TYR 846 Ca 0.31 -0.62 0.05 0.00 -0.37 0.00 0.00 57.07 56.43 3kh0 s TYR 846 Cb 0.16 -0.71 -0.03 0.00 -0.40 0.00 0.00 41.96 40.97 3kh0 s TYR 846 CO 0.24 0.17 -0.13 -1.83 -1.57 0.00 0.00 175.55 172.43 3kh0 s GLU 847 N -3.18 0.83 -0.22 -0.62 -1.05 0.96 -4.86 118.70 110.57 3kh0 s GLU 847 Ca 0.14 -1.02 -0.06 0.00 -0.15 0.00 0.00 54.97 53.87 3kh0 s GLU 847 Cb -0.02 -0.72 -0.02 0.00 -0.44 0.00 0.00 34.13 32.93 3kh0 s GLU 847 CO 0.03 0.15 0.02 -1.17 0.95 0.00 0.00 175.26 175.24 3kh0 s LEU 848 N -1.99 3.31 -0.10 1.83 2.96 -1.26 -1.03 118.68 122.39 3kh0 s LEU 848 Ca 0.01 -0.21 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 3kh0 s LEU 848 Cb -0.08 -1.86 0.02 0.00 0.50 0.00 0.00 46.19 44.77 3kh0 s LEU 848 CO 0.02 0.02 -0.12 -0.76 -1.32 0.00 0.00 176.35 174.19 3kh0 s LEU 849 N 1.25 1.51 0.01 -0.68 1.02 -0.72 -1.24 118.68 119.84 3kh0 s LEU 849 Ca 0.04 -0.36 -0.30 0.00 0.02 0.00 0.00 54.13 53.53 3kh0 s LEU 849 Cb -0.15 -0.95 -0.04 0.00 0.02 0.00 0.00 46.19 45.08 3kh0 s LEU 849 CO 0.02 -0.04 1.06 -1.58 0.02 0.00 0.00 176.35 175.83 3kh0 s GLN 850 N 1.22 4.50 -0.59 1.70 0.74 0.73 -0.45 119.66 127.52 3kh0 s GLN 850 Ca -0.03 1.54 -0.27 0.00 0.05 0.00 0.00 55.36 56.65 3kh0 s GLN 850 Cb -0.14 -3.44 0.03 0.00 1.10 0.00 0.00 33.01 30.57 3kh0 s GLN 850 CO -0.04 -0.15 1.11 0.42 -0.55 0.00 0.00 175.29 176.08 3kh0 s ILE 851 N 1.17 4.12 -0.02 -2.34 1.01 0.73 -0.08 121.20 125.79 3kh0 s ILE 851 Ca 0.54 0.62 -0.19 0.00 0.00 0.00 0.00 60.65 61.62 3kh0 s ILE 851 Cb -0.24 -4.68 -0.33 0.00 0.01 0.00 0.00 42.46 37.23 3kh0 s ILE 851 CO 0.27 -1.32 0.89 -0.07 0.00 0.00 0.00 174.94 174.72 3kh0 h LEU 852 N 11.69 0.62 0.00 2.97 3.38 -1.69 -3.42 115.31 128.86 3kh0 h LEU 852 Ca -0.26 -0.93 -0.10 0.00 0.09 0.00 0.00 57.88 56.68 3kh0 h LEU 852 Cb 1.06 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 3kh0 h LEU 852 CO 1.16 1.56 0.03 -1.54 0.09 0.00 0.00 178.44 179.74 3kh0 n SER 853 N -3.93 -1.10 0.28 -0.43 3.41 -0.91 -4.81 113.62 106.14 3kh0 n SER 853 Ca -0.17 -2.07 0.16 0.00 -0.26 0.00 0.00 58.87 56.53 3kh0 n SER 853 Cb 0.95 1.92 0.82 0.00 -0.26 0.00 0.00 64.21 67.63 3kh0 n SER 853 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3kh0 h ASP 854 N 1.20 0.00 -0.00 4.04 3.32 -2.03 -3.16 116.42 119.79 3kh0 h ASP 854 Ca -0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.87 3kh0 h ASP 854 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3kh0 h ASP 854 CO 0.24 0.07 -0.01 0.47 -1.72 0.00 0.00 179.24 178.30 3kh0 n ASP 855 N -3.42 0.68 -4.19 6.45 8.00 -1.26 -5.04 116.55 117.76 3kh0 n ASP 855 Ca -0.02 -0.84 -0.30 0.00 0.71 0.00 0.00 54.79 54.35 3kh0 n ASP 855 Cb 0.22 0.36 -0.17 0.00 -0.02 0.00 0.00 41.12 41.51 3kh0 n ASP 855 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3kh0 s ARG 856 N -0.40 2.45 0.01 -1.24 0.52 -1.20 -5.12 118.95 113.98 3kh0 s ARG 856 Ca 0.00 -0.77 0.04 0.00 -0.52 0.00 0.00 55.73 54.48 3kh0 s ARG 856 Cb 0.00 -1.98 -0.01 0.00 0.52 0.00 0.00 34.95 33.48 3kh0 s ARG 856 CO 0.01 0.24 -0.12 0.15 0.02 0.00 0.00 175.30 175.60 3kh0 s LYS 857 N 0.16 0.86 -0.26 3.54 1.02 -1.26 -1.95 119.74 121.85 3kh0 s LYS 857 Ca -0.10 -0.55 -0.03 0.00 0.02 0.00 0.00 55.97 55.31 3kh0 s LYS 857 Cb -0.15 -0.83 0.03 0.00 -0.52 0.00 0.00 37.83 36.36 3kh0 s LYS 857 CO 0.05 0.21 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.50 3kh0 s LEU 858 N -0.69 3.39 0.02 3.17 2.96 0.88 -4.93 118.68 123.48 3kh0 s LEU 858 Ca 0.02 -0.89 -0.30 0.00 -0.22 0.00 0.00 54.13 52.74 3kh0 s LEU 858 Cb -0.06 -1.71 -0.06 0.00 0.50 0.00 0.00 46.19 44.87 3kh0 s LEU 858 CO 0.00 -0.15 1.32 -0.75 -1.32 0.00 0.00 176.35 175.45 3kh0 s LYS 859 N 1.35 4.33 -0.26 1.98 2.47 -1.26 -0.19 119.74 128.15 3kh0 s LYS 859 Ca -0.00 1.89 -0.20 0.00 -1.56 0.00 0.00 55.97 56.10 3kh0 s LYS 859 Cb -0.17 -3.46 -0.02 0.00 -1.46 0.00 0.00 37.83 32.72 3kh0 s LYS 859 CO -0.03 -0.46 0.60 0.42 0.16 0.00 0.00 175.35 176.05 3kh0 s ILE 860 N 1.84 5.00 0.48 5.43 -1.09 -0.37 -4.95 121.20 127.54 3kh0 s ILE 860 Ca 0.61 1.03 -0.22 0.00 -2.23 0.00 0.00 60.65 59.85 3kh0 s ILE 860 Cb -0.31 -3.92 -0.09 0.00 -1.58 0.00 0.00 42.46 36.56 3kh0 s ILE 860 CO 0.27 0.01 0.89 -2.65 -1.23 0.00 0.00 174.94 172.23 3kh0 n PRO 861 N 5.70 1.05 -0.49 2.79 -0.02 -1.26 -4.60 135.00 138.18 3kh0 n PRO 861 Ca -0.01 0.39 0.41 0.00 -2.02 0.00 0.00 63.50 62.26 3kh0 n PRO 861 Cb 0.49 -1.97 0.72 0.00 -0.02 0.00 0.00 33.50 32.72 3kh0 n PRO 861 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3kh0 h GLU 862 N 1.05 0.06 -0.96 -0.52 9.09 -1.96 -2.25 114.58 119.10 3kh0 h GLU 862 Ca -0.45 -0.00 -0.36 0.00 0.05 0.00 0.00 59.36 58.59 3kh0 h GLU 862 Cb 1.36 -0.01 -0.40 0.00 -1.65 0.00 0.00 28.75 28.04 3kh0 h GLU 862 CO 0.54 0.04 -1.15 -1.71 0.05 0.00 0.00 179.01 176.78 3kh0 n ASN 863 N -4.32 1.77 -4.89 3.06 5.15 -1.26 -4.12 115.26 110.65 3kh0 n ASN 863 Ca 0.36 -2.71 -0.27 0.00 -0.60 0.00 0.00 54.58 51.36 3kh0 n ASN 863 Cb 1.52 -0.51 -0.04 0.00 -0.53 0.00 0.00 39.78 40.22 3kh0 n ASN 863 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3kh0 s ALA 864 N -3.26 3.83 -0.22 5.20 0.00 -0.85 -4.85 121.76 121.61 3kh0 s ALA 864 Ca 0.29 -1.07 -0.29 0.00 0.00 0.00 0.00 51.96 50.89 3kh0 s ALA 864 Cb 0.43 -1.64 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 3kh0 s ALA 864 CO 0.01 0.57 1.39 1.21 0.00 0.00 0.00 175.76 178.94 3kh0 s ASN 865 N -3.09 6.68 0.07 0.00 3.84 -1.26 -0.95 114.94 120.23 3kh0 s ASN 865 Ca 0.33 1.52 -0.25 0.00 0.21 0.00 0.00 52.86 54.67 3kh0 s ASN 865 Cb -0.11 -2.54 -0.16 0.00 -0.55 0.00 0.00 41.25 37.89 3kh0 s ASN 865 CO 0.27 -1.02 1.63 0.58 -2.79 0.00 0.00 177.10 175.77 3kh0 h VAL 866 N 5.84 0.94 -1.09 -5.21 2.07 -1.37 -0.90 116.25 116.53 3kh0 h VAL 866 Ca -0.29 -0.18 0.30 0.00 0.82 0.00 0.00 66.70 67.35 3kh0 h VAL 866 Cb 1.12 1.05 -0.09 0.00 -1.52 0.00 0.00 31.29 31.85 3kh0 h VAL 866 CO 1.00 0.04 0.72 0.15 0.02 0.00 0.00 177.57 179.50 3kh0 h PHE 867 N -0.23 0.54 0.00 1.57 3.57 -1.80 -0.84 116.94 119.74 3kh0 h PHE 867 Ca -0.02 0.02 -0.33 0.00 3.53 0.00 0.00 57.97 61.17 3kh0 h PHE 867 Cb 0.19 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 38.71 3kh0 h PHE 867 CO -0.04 0.02 -2.24 0.66 -2.23 0.00 0.00 178.31 174.48 3kh0 n TYR 868 N -4.56 0.00 0.17 0.41 4.01 -1.20 -4.50 117.16 111.49 3kh0 n TYR 868 Ca 0.27 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 58.04 3kh0 n TYR 868 Cb 0.99 -0.89 0.27 0.00 -0.31 0.00 0.00 39.34 39.40 3kh0 n TYR 868 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3kh0 h ALA 869 N 0.87 0.98 -2.34 -0.72 0.00 -0.77 -3.46 119.26 113.81 3kh0 h ALA 869 Ca -0.49 -0.42 -0.51 0.00 0.00 0.00 0.00 54.91 53.49 3kh0 h ALA 869 Cb 2.10 -0.07 0.12 0.00 0.00 0.00 0.00 17.79 19.93 3kh0 h ALA 869 CO 0.02 0.58 0.34 0.00 0.00 0.00 0.00 179.25 180.20 3kh0 s MET 870 N -3.59 2.53 -0.74 0.00 0.23 -0.35 -4.97 119.30 112.40 3kh0 s MET 870 Ca -0.00 1.16 -0.24 0.00 -1.03 0.00 0.00 55.69 55.57 3kh0 s MET 870 Cb 0.11 -1.93 0.06 0.00 -1.53 0.00 0.00 34.83 31.54 3kh0 s MET 870 CO 0.72 -1.43 1.15 1.21 -2.03 0.00 0.00 175.02 174.63 3kh0 s ASN 871 N -3.32 6.22 0.57 -1.18 3.84 -1.26 -4.89 114.94 114.91 3kh0 s ASN 871 Ca 0.61 -0.86 0.37 0.00 0.21 0.00 0.00 52.86 53.19 3kh0 s ASN 871 Cb -0.17 -2.49 1.73 0.00 -0.55 0.00 0.00 41.25 39.77 3kh0 s ASN 871 CO 0.53 -1.59 2.10 0.28 -2.79 0.00 0.00 177.10 175.62 3kh0 h SER 872 N 9.74 0.00 0.08 -4.21 0.02 -1.92 -2.79 113.55 114.46 3kh0 h SER 872 Ca -0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 3kh0 h SER 872 Cb 1.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.59 3kh0 h SER 872 CO 1.24 0.00 -0.77 0.35 -1.14 0.00 0.00 176.83 176.51 3kh0 n THR 873 N -3.00 0.00 -2.59 -2.27 -2.24 -1.26 -4.97 114.28 97.95 3kh0 n THR 873 Ca -0.01 -0.07 -0.23 0.00 -2.27 0.00 0.00 64.05 61.48 3kh0 n THR 873 Cb 0.20 0.92 0.08 0.00 -2.10 0.00 0.00 70.33 69.44 3kh0 n THR 873 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kh0 s ALA 874 N -2.85 3.75 0.14 6.98 0.00 -1.05 -5.03 121.76 123.70 3kh0 s ALA 874 Ca 0.12 -1.57 -0.32 0.00 0.00 0.00 0.00 51.96 50.19 3kh0 s ALA 874 Cb 0.17 -2.05 -0.11 0.00 0.00 0.00 0.00 23.12 21.13 3kh0 s ALA 874 CO 0.76 -1.22 1.81 0.09 0.00 0.00 0.00 175.76 177.19 3kh0 n ASN 875 N -2.68 4.01 -1.66 0.00 3.02 -1.26 -4.87 115.26 111.82 3kh0 n ASN 875 Ca 0.12 1.01 -0.02 0.00 -0.03 0.00 0.00 54.58 55.66 3kh0 n ASN 875 Cb 0.60 -1.55 -0.02 0.00 -0.61 0.00 0.00 39.78 38.20 3kh0 n ASN 875 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3kh0 n TYR 876 N 5.21 0.00 -4.11 3.10 0.53 -1.26 -4.69 117.16 115.94 3kh0 n TYR 876 Ca 0.18 -0.91 -0.35 0.00 -1.02 0.00 0.00 57.90 55.80 3kh0 n TYR 876 Cb 0.36 -0.61 -0.11 0.00 -1.03 0.00 0.00 39.34 37.95 3kh0 n TYR 876 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 3kh0 s ASP 877 N 2.02 5.18 0.14 7.72 1.11 -1.26 -1.06 116.67 130.52 3kh0 s ASP 877 Ca 0.09 -0.07 0.06 0.00 0.18 0.00 0.00 52.55 52.81 3kh0 s ASP 877 Cb 0.04 -1.88 -0.04 0.00 1.07 0.00 0.00 42.92 42.11 3kh0 s ASP 877 CO 0.00 0.13 -0.15 -0.36 1.18 0.00 0.00 175.17 175.97 3kh0 s PHE 878 N 0.63 1.49 -0.11 4.23 0.40 0.89 -0.19 117.98 125.33 3kh0 s PHE 878 Ca 0.01 -0.55 0.01 0.00 -0.60 0.00 0.00 56.93 55.80 3kh0 s PHE 878 Cb -0.14 -0.76 -0.01 0.00 0.51 0.00 0.00 43.02 42.62 3kh0 s PHE 878 CO 0.02 0.19 -0.16 0.54 0.70 0.00 0.00 175.22 176.51 3kh0 s VAL 879 N -2.26 2.85 -0.44 -0.44 0.11 0.41 0.06 120.40 120.70 3kh0 s VAL 879 Ca 0.12 -0.75 -0.18 0.00 -2.93 0.00 0.00 61.98 58.24 3kh0 s VAL 879 Cb -0.04 -2.16 0.03 0.00 -1.53 0.00 0.00 36.38 32.67 3kh0 s VAL 879 CO 0.04 0.54 0.51 -0.22 -3.33 0.00 0.00 175.10 172.64 3kh0 s LEU 880 N 0.14 4.81 -0.07 2.54 2.96 0.62 -1.75 118.68 127.92 3kh0 s LEU 880 Ca -0.08 -0.64 0.04 0.00 -0.22 0.00 0.00 54.13 53.23 3kh0 s LEU 880 Cb -0.15 -2.47 -0.02 0.00 0.50 0.00 0.00 46.19 44.05 3kh0 s LEU 880 CO 0.05 -0.66 -0.18 -0.75 -1.32 0.00 0.00 176.35 173.48 3kh0 s LYS 881 N 2.34 2.75 -0.04 1.98 2.20 -0.20 -4.64 119.74 124.13 3kh0 s LYS 881 Ca 0.15 -0.78 -0.30 0.00 -0.36 0.00 0.00 55.97 54.68 3kh0 s LYS 881 Cb -0.17 -2.35 -0.03 0.00 -1.51 0.00 0.00 37.83 33.77 3kh0 s LYS 881 CO 0.15 0.42 1.09 0.21 -0.36 0.00 0.00 175.35 176.85 3kh0 s LYS 882 N -0.22 4.43 0.59 4.03 2.20 -1.26 -0.03 119.74 129.49 3kh0 s LYS 882 Ca -0.01 1.54 -0.18 0.00 -0.36 0.00 0.00 55.97 56.96 3kh0 s LYS 882 Cb -0.13 -3.50 -0.03 0.00 -1.51 0.00 0.00 37.83 32.65 3kh0 s LYS 882 CO 0.03 -0.29 1.18 1.03 -0.36 0.00 0.00 175.35 176.94 3kh0 s ARG 883 N 1.73 3.00 -0.81 4.03 0.52 -0.40 -4.93 118.95 122.09 3kh0 s ARG 883 Ca 0.53 1.75 -0.00 0.00 -0.52 0.00 0.00 55.73 57.48 3kh0 s ARG 883 Cb -0.22 -1.94 0.35 0.00 0.52 0.00 0.00 34.95 33.66 3kh0 s ARG 883 CO 0.23 -1.16 1.80 2.41 0.02 0.00 0.00 175.30 178.60 3kh0 n THR 884 N -1.64 3.90 -0.31 0.02 -1.04 -1.26 -4.98 114.28 108.97 3kh0 n THR 884 Ca 0.13 -4.80 0.00 0.00 -2.04 0.00 0.00 64.05 57.34 3kh0 n THR 884 Cb 0.50 -1.31 0.00 0.00 -1.82 0.00 0.00 70.33 67.70 3kh0 n THR 884 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 3kh0 n PHE 885 N -0.42 -1.61 -0.18 -1.42 -1.74 -1.26 -5.21 117.46 105.62 3kh0 n PHE 885 Ca 0.49 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.38 3kh0 n PHE 885 Cb 0.31 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.31 3kh0 n PHE 885 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3kh0 n GLY 888 N 3.75 0.93 3.22 4.97 0.00 -1.26 -5.13 105.19 111.67 3kh0 n GLY 888 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3kh0 n GLY 888 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kh0 s VAL 889 N 3.16 1.85 -0.35 1.61 -7.23 -1.26 -5.12 120.40 113.06 3kh0 s VAL 889 Ca 0.00 -0.95 -0.19 0.00 -1.81 0.00 0.00 61.98 59.03 3kh0 s VAL 889 Cb 0.00 -1.57 -0.00 0.00 0.56 0.00 0.00 36.38 35.37 3kh0 s VAL 889 CO 0.00 0.52 0.57 -0.75 -0.31 0.00 0.00 175.10 175.13 3kh0 s LYS 890 N -0.04 3.65 -0.29 4.82 2.20 -1.26 -5.06 119.74 123.76 3kh0 s LYS 890 Ca -0.05 -0.05 -0.10 0.00 -0.36 0.00 0.00 55.97 55.41 3kh0 s LYS 890 Cb -0.14 -3.81 -0.02 0.00 -1.51 0.00 0.00 37.83 32.35 3kh0 s LYS 890 CO 0.04 -0.69 0.15 0.08 -0.36 0.00 0.00 175.35 174.57 3kh0 s VAL 891 N 2.54 4.76 -0.60 4.02 1.01 -1.26 -5.07 120.40 125.81 3kh0 s VAL 891 Ca 0.21 -0.21 -0.26 0.00 0.00 0.00 0.00 61.98 61.72 3kh0 s VAL 891 Cb -0.15 -3.35 0.04 0.00 0.00 0.00 0.00 36.38 32.92 3kh0 s VAL 891 CO 0.14 0.16 1.11 -0.75 0.00 0.00 0.00 175.10 175.76 3kh0 s LYS 892 N 1.66 3.37 0.00 2.72 2.20 -1.26 -5.34 119.74 123.09 3kh0 s LYS 892 Ca 0.06 -0.08 0.28 0.00 -0.36 0.00 0.00 55.97 55.86 3kh0 s LYS 892 Cb -0.16 -4.07 1.65 0.00 -1.51 0.00 0.00 37.83 33.73 3kh0 s LYS 892 CO 0.07 -1.71 1.99 -2.39 -0.36 0.00 0.00 175.35 172.96