#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n1g n ARG 711 N 0.00 2.63 -2.41 3.44 1.85 -1.26 -4.83 116.66 116.08 3n1g n ARG 711 Ca 0.00 0.94 -0.41 0.00 -1.00 0.00 0.00 57.85 57.38 3n1g n ARG 711 Cb 0.00 -2.75 -0.04 0.00 -1.05 0.00 0.00 32.46 28.62 3n1g n ARG 711 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 3n1g s PRO 712 N 0.57 4.52 -0.13 2.89 0.04 -1.26 -4.96 135.00 136.67 3n1g s PRO 712 Ca 0.72 1.83 -0.13 0.00 0.04 0.00 0.00 61.00 63.46 3n1g s PRO 712 Cb -0.53 -3.25 -0.05 0.00 0.04 0.00 0.00 34.50 30.71 3n1g s PRO 712 CO 0.39 -0.04 -0.27 1.55 0.04 0.00 0.00 177.00 178.67 3n1g n VAL 713 N 2.43 1.40 -2.01 -0.36 3.14 -1.26 -3.18 118.33 118.48 3n1g n VAL 713 Ca 0.04 0.14 -0.42 0.00 -2.96 0.00 0.00 64.34 61.14 3n1g n VAL 713 Cb 0.45 -2.11 -0.02 0.00 -1.06 0.00 0.00 33.84 31.09 3n1g n VAL 713 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3n1g s ALA 714 N -2.65 3.65 0.50 1.55 0.00 -1.26 -1.50 121.76 122.06 3n1g s ALA 714 Ca -0.23 1.32 0.09 0.00 0.00 0.00 0.00 51.96 53.13 3n1g s ALA 714 Cb 0.04 -3.56 0.05 0.00 0.00 0.00 0.00 23.12 19.65 3n1g s ALA 714 CO 0.33 -0.74 0.69 0.20 0.00 0.00 0.00 175.76 176.25 3n1g s GLY 715 N 0.53 1.83 0.92 0.00 0.00 -1.26 -4.77 107.32 104.57 3n1g s GLY 715 Ca 0.61 -1.92 -0.11 0.00 0.00 0.00 0.00 44.72 43.30 3n1g s GLY 715 CO 0.40 -1.58 1.09 -4.14 0.00 0.00 0.00 173.10 168.87 3n1g s PRO 716 N -4.53 1.08 -0.11 2.90 0.02 -1.26 -4.94 135.00 128.16 3n1g s PRO 716 Ca 0.59 0.96 0.03 0.00 0.02 0.00 0.00 61.00 62.60 3n1g s PRO 716 Cb -0.08 -1.78 0.01 0.00 0.02 0.00 0.00 34.50 32.67 3n1g s PRO 716 CO 0.36 -2.40 -0.21 -0.47 -0.33 0.00 0.00 177.00 173.95 3n1g s TYR 717 N -2.84 2.37 -0.24 6.54 5.04 -0.24 -4.18 117.35 123.81 3n1g s TYR 717 Ca 0.64 -1.05 -0.27 0.00 -2.44 0.00 0.00 57.07 53.95 3n1g s TYR 717 Cb -0.19 -1.62 0.00 0.00 0.35 0.00 0.00 41.96 40.50 3n1g s TYR 717 CO 0.58 -0.46 0.96 0.42 -1.34 0.00 0.00 175.55 175.71 3n1g s ILE 718 N 0.60 4.73 -0.53 3.14 1.01 -1.26 -1.02 121.20 127.87 3n1g s ILE 718 Ca -0.14 1.84 0.22 0.00 0.00 0.00 0.00 60.65 62.57 3n1g s ILE 718 Cb -0.17 -4.24 -0.21 0.00 0.01 0.00 0.00 42.46 37.86 3n1g s ILE 718 CO 0.04 -0.15 0.84 0.35 0.00 0.00 0.00 174.94 176.01 3n1g n THR 719 N 5.32 0.09 -3.64 2.92 -2.24 0.11 -4.95 114.28 111.90 3n1g n THR 719 Ca 0.10 -0.27 -0.09 0.00 -2.27 0.00 0.00 64.05 61.52 3n1g n THR 719 Cb 0.47 0.33 -0.07 0.00 -2.10 0.00 0.00 70.33 68.96 3n1g n THR 719 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3n1g s PHE 720 N -3.25 -0.98 -0.01 4.78 5.36 -1.16 -4.97 117.98 117.75 3n1g s PHE 720 Ca 0.01 2.05 0.01 0.00 -0.96 0.00 0.00 56.93 58.05 3n1g s PHE 720 Cb 0.15 0.54 0.00 0.00 -0.34 0.00 0.00 43.02 43.37 3n1g s PHE 720 CO 0.85 -0.49 -0.04 0.95 -1.46 0.00 0.00 175.22 175.04 3n1g s THR 721 N 1.34 0.34 -0.14 0.12 -4.23 -1.26 -0.83 115.64 110.97 3n1g s THR 721 Ca -0.08 -0.14 -0.21 0.00 -1.18 0.00 0.00 61.69 60.08 3n1g s THR 721 Cb -0.05 -0.32 0.05 0.00 1.34 0.00 0.00 72.50 73.53 3n1g s THR 721 CO -0.15 0.12 0.54 -0.62 -0.54 0.00 0.00 174.62 173.97 3n1g s ASP 722 N 0.16 -0.53 0.41 3.99 2.15 -0.72 -5.02 116.67 117.10 3n1g s ASP 722 Ca -0.01 0.86 -0.27 0.00 0.43 0.00 0.00 52.55 53.56 3n1g s ASP 722 Cb -0.05 0.87 -0.09 0.00 -0.30 0.00 0.00 42.92 43.35 3n1g s ASP 722 CO -0.00 -0.32 1.40 0.00 -0.17 0.00 0.00 175.17 176.07 3n1g s ALA 723 N -0.29 3.36 -0.11 3.66 0.00 -1.26 -1.03 121.76 126.09 3n1g s ALA 723 Ca -0.05 1.41 0.12 0.00 0.00 0.00 0.00 51.96 53.44 3n1g s ALA 723 Cb -0.03 -3.56 -0.17 0.00 0.00 0.00 0.00 23.12 19.36 3n1g s ALA 723 CO 0.03 -1.00 0.10 1.33 0.00 0.00 0.00 175.76 176.22 3n1g n VAL 724 N 0.16 0.71 -2.22 0.00 0.24 -0.30 -4.82 118.33 112.10 3n1g n VAL 724 Ca 0.03 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.83 3n1g n VAL 724 Cb 0.42 -0.49 0.00 0.00 -1.47 0.00 0.00 33.84 32.30 3n1g n VAL 724 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 3n1g n ASN 725 N -2.38 0.00 0.05 -1.34 0.23 -1.15 -4.99 115.26 105.68 3n1g n ASN 725 Ca -0.17 -0.09 0.10 0.00 -0.53 0.00 0.00 54.58 53.89 3n1g n ASN 725 Cb 0.81 0.00 0.43 0.00 -2.08 0.00 0.00 39.78 38.94 3n1g n ASN 725 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 3n1g n GLU 726 N 0.00 0.09 0.00 -3.83 0.00 -1.26 -1.80 120.64 113.84 3n1g n GLU 726 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 57.16 57.41 3n1g n GLU 726 Cb 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 31.44 29.79 3n1g n GLU 726 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 3n1g n THR 727 N -1.81 0.43 -3.87 3.84 -2.24 -1.26 -2.22 114.28 107.15 3n1g n THR 727 Ca 0.04 -0.51 -0.14 0.00 -2.27 0.00 0.00 64.05 61.17 3n1g n THR 727 Cb 0.25 0.89 -0.15 0.00 -2.10 0.00 0.00 70.33 69.23 3n1g n THR 727 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3n1g s THR 728 N -0.43 0.04 -0.05 4.28 2.01 -1.23 -0.56 115.64 119.70 3n1g s THR 728 Ca 0.00 0.06 0.03 0.00 0.31 0.00 0.00 61.69 62.09 3n1g s THR 728 Cb 0.00 -0.09 0.00 0.00 0.01 0.00 0.00 72.50 72.42 3n1g s THR 728 CO 0.00 0.06 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.21 3n1g s ILE 729 N 0.46 1.24 -0.10 1.82 1.01 -0.29 -1.14 121.20 124.19 3n1g s ILE 729 Ca -0.04 -0.58 -0.08 0.00 0.00 0.00 0.00 60.65 59.95 3n1g s ILE 729 Cb -0.06 -1.09 -0.04 0.00 0.01 0.00 0.00 42.46 41.28 3n1g s ILE 729 CO -0.01 0.37 0.17 -0.32 0.00 0.00 0.00 174.94 175.15 3n1g s MET 730 N 0.29 3.49 0.14 2.79 1.75 -0.20 -0.00 119.30 127.56 3n1g s MET 730 Ca -0.08 -0.09 0.05 0.00 -1.25 0.00 0.00 55.69 54.33 3n1g s MET 730 Cb -0.13 -3.19 -0.04 0.00 2.84 0.00 0.00 34.83 34.32 3n1g s MET 730 CO 0.03 0.76 -0.12 -0.48 -0.65 0.00 0.00 175.02 174.56 3n1g s LEU 731 N -1.10 2.47 0.05 4.11 2.34 -0.02 -1.76 118.68 124.77 3n1g s LEU 731 Ca 0.17 -0.92 0.03 0.00 0.06 0.00 0.00 54.13 53.47 3n1g s LEU 731 Cb -0.13 -0.44 -0.02 0.00 -0.56 0.00 0.00 46.19 45.04 3n1g s LEU 731 CO 0.06 -0.24 -0.10 -0.54 -1.06 0.00 0.00 176.35 174.47 3n1g s LYS 732 N -3.25 0.62 0.06 1.48 1.02 -0.01 -1.75 119.74 117.92 3n1g s LYS 732 Ca 0.13 -0.77 -0.05 0.00 0.02 0.00 0.00 55.97 55.30 3n1g s LYS 732 Cb -0.01 -0.47 -0.02 0.00 -0.52 0.00 0.00 37.83 36.81 3n1g s LYS 732 CO 0.02 0.10 0.09 1.67 -0.92 0.00 0.00 175.35 176.30 3n1g s TRP 733 N -1.24 0.29 -0.11 3.18 -2.14 -0.34 -0.71 118.94 117.87 3n1g s TRP 733 Ca -0.07 -0.74 -0.01 0.00 2.66 0.00 0.00 56.10 57.95 3n1g s TRP 733 Cb -0.09 -0.20 -0.02 0.00 -3.10 0.00 0.00 33.47 30.06 3n1g s TRP 733 CO 0.01 -0.44 -0.09 -1.64 -2.66 0.00 0.00 176.95 172.13 3n1g s MET 734 N -3.59 3.19 -0.07 3.25 -1.94 -0.19 -4.80 119.30 115.16 3n1g s MET 734 Ca 0.03 -0.60 -0.03 0.00 -1.71 0.00 0.00 55.69 53.39 3n1g s MET 734 Cb 0.05 -2.68 0.04 0.00 2.01 0.00 0.00 34.83 34.25 3n1g s MET 734 CO -0.09 0.40 0.15 -0.47 -0.01 0.00 0.00 175.02 175.00 3n1g s TYR 735 N -0.10 -0.18 -0.35 -0.03 5.04 -1.26 -1.08 117.35 119.39 3n1g s TYR 735 Ca 0.00 0.53 -0.07 0.00 -2.44 0.00 0.00 57.07 55.09 3n1g s TYR 735 Cb -0.13 -0.12 0.04 0.00 0.35 0.00 0.00 41.96 42.10 3n1g s TYR 735 CO 0.03 -0.20 0.13 0.42 -1.34 0.00 0.00 175.55 174.59 3n1g s ILE 736 N 1.46 3.85 0.39 3.14 1.01 -1.26 -4.98 121.20 124.81 3n1g s ILE 736 Ca -0.06 -1.17 0.11 0.00 0.00 0.00 0.00 60.65 59.53 3n1g s ILE 736 Cb -0.12 -3.21 0.33 0.00 0.01 0.00 0.00 42.46 39.48 3n1g s ILE 736 CO -0.06 -0.23 1.90 -0.65 0.00 0.00 0.00 174.94 175.90 3n1g h PRO 737 N 8.24 0.56 -0.03 2.79 0.11 -1.98 0.44 132.00 142.14 3n1g h PRO 737 Ca -0.23 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.86 3n1g h PRO 737 Cb 1.08 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 3n1g h PRO 737 CO 0.62 0.37 0.11 0.00 -0.21 0.00 0.00 178.00 178.90 3n1g h ALA 738 N 1.62 1.26 0.00 -0.75 0.00 -1.93 -0.38 119.26 119.08 3n1g h ALA 738 Ca 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3n1g h ALA 738 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3n1g h ALA 738 CO -0.15 -0.13 0.00 -1.13 0.00 0.00 0.00 179.25 177.84 3n1g n SER 739 N -3.23 0.00 -0.15 0.00 3.41 0.15 -2.68 113.62 111.12 3n1g n SER 739 Ca -0.02 0.40 0.07 0.00 -0.26 0.00 0.00 58.87 59.06 3n1g n SER 739 Cb 0.19 -0.46 0.09 0.00 -0.26 0.00 0.00 64.21 63.77 3n1g n SER 739 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3n1g n ASN 740 N -1.46 1.76 -1.81 4.04 3.02 -0.23 -4.70 115.26 115.88 3n1g n ASN 740 Ca 0.06 -2.68 -0.11 0.00 -0.03 0.00 0.00 54.58 51.81 3n1g n ASN 740 Cb 0.22 -0.32 0.03 0.00 -0.61 0.00 0.00 39.78 39.10 3n1g n ASN 740 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3n1g n ASN 741 N -1.00 -3.99 -1.82 6.41 3.02 -1.09 -3.26 115.26 113.53 3n1g n ASN 741 Ca 0.11 -0.20 -0.21 0.00 -0.03 0.00 0.00 54.58 54.25 3n1g n ASN 741 Cb 0.61 -2.73 -0.07 0.00 -0.61 0.00 0.00 39.78 36.98 3n1g n ASN 741 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3n1g n ASN 742 N -0.54 -5.62 -4.71 6.41 3.02 -0.71 -4.93 115.26 108.17 3n1g n ASN 742 Ca -0.03 0.37 -0.43 0.00 -0.03 0.00 0.00 54.58 54.46 3n1g n ASN 742 Cb 0.55 -4.87 -0.03 0.00 -0.61 0.00 0.00 39.78 34.82 3n1g n ASN 742 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 3n1g n THR 743 N -2.85 0.16 -1.69 3.41 5.66 -1.20 -4.95 114.28 112.82 3n1g n THR 743 Ca -0.22 -0.04 -0.37 0.00 -3.05 0.00 0.00 64.05 60.37 3n1g n THR 743 Cb 0.69 -1.86 0.07 0.00 -1.55 0.00 0.00 70.33 67.68 3n1g n THR 743 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 3n1g n PRO 744 N 3.54 1.04 -4.53 1.09 -0.04 -1.26 -4.99 135.00 129.85 3n1g n PRO 744 Ca 0.15 0.41 -0.28 0.00 -0.04 0.00 0.00 63.50 63.75 3n1g n PRO 744 Cb 0.33 -2.48 -0.17 0.00 -0.04 0.00 0.00 33.50 31.15 3n1g n PRO 744 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3n1g s ILE 745 N -1.43 1.44 0.10 0.52 -1.09 -1.26 -4.61 121.20 114.87 3n1g s ILE 745 Ca 0.82 -0.62 0.13 0.00 -2.23 0.00 0.00 60.65 58.74 3n1g s ILE 745 Cb -0.38 -1.31 -0.01 0.00 -1.58 0.00 0.00 42.46 39.17 3n1g s ILE 745 CO 0.41 0.43 1.51 0.45 -1.23 0.00 0.00 174.94 176.52 3n1g h HIS 746 N 7.27 0.00 0.00 3.97 3.86 -1.36 -3.40 115.15 125.50 3n1g h HIS 746 Ca -0.30 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.91 3n1g h HIS 746 Cb 1.18 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.65 3n1g h HIS 746 CO 0.48 0.63 0.00 0.41 0.86 0.00 0.00 177.93 180.31 3n1g n GLY 747 N 0.77 -1.02 3.34 2.45 0.00 -1.24 -3.18 105.19 106.31 3n1g n GLY 747 Ca 0.00 -1.02 -0.27 0.00 0.00 0.00 0.00 46.02 44.73 3n1g n GLY 747 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n1g s PHE 748 N -3.00 2.11 -0.20 1.61 0.40 -0.14 -2.52 117.98 116.24 3n1g s PHE 748 Ca 0.00 -0.39 -0.08 0.00 -0.60 0.00 0.00 56.93 55.86 3n1g s PHE 748 Cb 0.00 -1.16 -0.04 0.00 0.51 0.00 0.00 43.02 42.33 3n1g s PHE 748 CO 0.00 0.27 0.08 0.71 0.70 0.00 0.00 175.22 176.98 3n1g s TYR 749 N -1.06 3.23 -0.27 0.36 4.12 0.47 -2.05 117.35 122.15 3n1g s TYR 749 Ca 0.11 0.02 -0.05 0.00 0.02 0.00 0.00 57.07 57.16 3n1g s TYR 749 Cb -0.10 -2.14 0.01 0.00 -1.52 0.00 0.00 41.96 38.21 3n1g s TYR 749 CO 0.05 0.05 0.03 0.42 0.02 0.00 0.00 175.55 176.12 3n1g s ILE 750 N 0.70 3.63 -0.07 2.71 1.09 -0.85 -1.18 121.20 127.23 3n1g s ILE 750 Ca 0.04 -0.75 -0.08 0.00 -1.10 0.00 0.00 60.65 58.76 3n1g s ILE 750 Cb -0.13 -2.84 -0.04 0.00 -1.06 0.00 0.00 42.46 38.38 3n1g s ILE 750 CO 0.02 0.15 0.21 -0.31 -0.10 0.00 0.00 174.94 174.90 3n1g s TYR 751 N 1.45 3.62 -0.07 3.97 2.02 0.13 -0.43 117.35 128.03 3n1g s TYR 751 Ca 0.02 0.61 -0.07 0.00 -0.37 0.00 0.00 57.07 57.26 3n1g s TYR 751 Cb -0.17 -2.00 0.02 0.00 -0.40 0.00 0.00 41.96 39.41 3n1g s TYR 751 CO 0.00 0.70 0.21 1.52 -1.57 0.00 0.00 175.55 176.41 3n1g s TYR 752 N -1.09 -0.21 -0.03 2.71 -0.85 0.06 -1.97 117.35 115.97 3n1g s TYR 752 Ca 0.19 0.51 -0.03 0.00 -0.52 0.00 0.00 57.07 57.22 3n1g s TYR 752 Cb -0.13 0.07 0.01 0.00 0.38 0.00 0.00 41.96 42.29 3n1g s TYR 752 CO 0.08 -0.13 0.09 0.50 -1.52 0.00 0.00 175.55 174.58 3n1g s ARG 753 N -0.02 0.13 0.34 -3.49 3.52 -0.60 -0.65 118.95 118.18 3n1g s ARG 753 Ca -0.01 0.09 -0.29 0.00 -0.13 0.00 0.00 55.73 55.39 3n1g s ARG 753 Cb -0.02 0.06 -0.12 0.00 -1.56 0.00 0.00 34.95 33.31 3n1g s ARG 753 CO 0.00 -0.02 1.45 -2.30 -0.81 0.00 0.00 175.30 173.63 3n1g n PRO 754 N 2.92 2.48 0.26 5.12 -0.02 -1.26 -0.19 135.00 144.31 3n1g n PRO 754 Ca -0.13 0.87 0.11 0.00 -2.02 0.00 0.00 63.50 62.34 3n1g n PRO 754 Cb 0.59 -2.57 0.69 0.00 -0.02 0.00 0.00 33.50 32.20 3n1g n PRO 754 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3n1g h THR 755 N 2.94 0.67 0.00 3.45 2.02 -1.14 -1.86 112.91 118.98 3n1g h THR 755 Ca -0.48 -0.53 -0.01 0.00 0.77 0.00 0.00 66.41 66.16 3n1g h THR 755 Cb 1.25 1.33 -0.00 0.00 -1.74 0.00 0.00 68.15 68.99 3n1g h THR 755 CO 0.68 0.12 -0.03 0.44 0.37 0.00 0.00 175.52 177.10 3n1g h ASP 756 N 0.00 0.00 -3.23 4.18 5.19 -1.89 -3.42 116.42 117.25 3n1g h ASP 756 Ca -0.00 0.00 -0.58 0.00 -0.62 0.00 0.00 57.03 55.83 3n1g h ASP 756 Cb 0.32 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.76 3n1g h ASP 756 CO 0.02 0.03 -0.12 -0.55 -3.12 0.00 0.00 179.24 175.49 3n1g s SER 757 N -5.86 6.81 -0.05 6.45 0.15 -0.70 -4.95 113.70 115.55 3n1g s SER 757 Ca -0.04 0.96 0.14 0.00 0.70 0.00 0.00 55.95 57.71 3n1g s SER 757 Cb 0.14 -2.30 0.42 0.00 -1.71 0.00 0.00 66.02 62.57 3n1g s SER 757 CO 0.52 0.14 1.35 0.47 1.20 0.00 0.00 173.24 176.92 3n1g n ASP 758 N 2.78 3.41 -4.59 5.45 10.43 -1.26 -4.90 116.55 127.87 3n1g n ASP 758 Ca -0.09 -2.29 -0.40 0.00 2.57 0.00 0.00 54.79 54.58 3n1g n ASP 758 Cb 0.52 -0.36 -0.08 0.00 1.84 0.00 0.00 41.12 43.04 3n1g n ASP 758 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 3n1g s ASN 759 N -1.21 6.35 0.00 -2.24 3.84 -1.26 -4.95 114.94 115.47 3n1g s ASN 759 Ca 0.32 0.22 0.13 0.00 0.21 0.00 0.00 52.86 53.75 3n1g s ASN 759 Cb 0.20 -2.27 0.66 0.00 -0.55 0.00 0.00 41.25 39.30 3n1g s ASN 759 CO 0.16 -0.37 1.35 0.47 -2.79 0.00 0.00 177.10 175.92 3n1g n ASP 760 N 5.62 0.00 -0.03 -4.21 8.00 -1.26 -1.54 116.55 123.13 3n1g n ASP 760 Ca -0.05 0.13 0.13 0.00 0.71 0.00 0.00 54.79 55.71 3n1g n ASP 760 Cb 0.49 -0.30 0.48 0.00 -0.02 0.00 0.00 41.12 41.77 3n1g n ASP 760 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3n1g n SER 761 N -1.30 0.32 -0.83 -2.24 3.41 -1.26 -4.01 113.62 107.71 3n1g n SER 761 Ca 0.06 -0.07 0.08 0.00 -0.26 0.00 0.00 58.87 58.68 3n1g n SER 761 Cb 0.11 -0.11 0.21 0.00 -0.26 0.00 0.00 64.21 64.16 3n1g n SER 761 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3n1g n ASP 762 N -1.34 2.41 -4.71 4.04 8.00 -0.59 -4.90 116.55 119.46 3n1g n ASP 762 Ca 0.08 -1.99 -0.42 0.00 0.71 0.00 0.00 54.79 53.18 3n1g n ASP 762 Cb 0.32 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 41.10 3n1g n ASP 762 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3n1g s TYR 763 N -1.41 3.62 0.47 1.24 1.51 -1.26 -4.61 117.35 116.91 3n1g s TYR 763 Ca 0.31 1.63 -0.06 0.00 -1.01 0.00 0.00 57.07 57.94 3n1g s TYR 763 Cb 0.16 -3.10 -0.04 0.00 -0.11 0.00 0.00 41.96 38.87 3n1g s TYR 763 CO 0.21 -0.05 0.78 0.15 -1.11 0.00 0.00 175.55 175.53 3n1g s LYS 764 N 1.21 3.57 -0.05 -0.62 1.02 0.17 -4.84 119.74 120.21 3n1g s LYS 764 Ca 0.50 0.22 0.03 0.00 0.02 0.00 0.00 55.97 56.74 3n1g s LYS 764 Cb -0.20 -2.39 0.00 0.00 -0.52 0.00 0.00 37.83 34.73 3n1g s LYS 764 CO 0.25 -0.17 -0.14 0.21 -0.92 0.00 0.00 175.35 174.58 3n1g s LYS 765 N -4.60 1.62 0.25 1.68 2.20 -1.26 -0.76 119.74 118.87 3n1g s LYS 765 Ca 0.48 -0.48 0.08 0.00 -0.36 0.00 0.00 55.97 55.69 3n1g s LYS 765 Cb -0.10 -1.38 -0.04 0.00 -1.51 0.00 0.00 37.83 34.79 3n1g s LYS 765 CO 0.43 0.13 0.08 -0.51 -0.36 0.00 0.00 175.35 175.12 3n1g s ASP 766 N 0.33 5.00 -0.08 1.43 1.11 0.42 -4.94 116.67 119.94 3n1g s ASP 766 Ca -0.08 -0.44 0.03 0.00 0.18 0.00 0.00 52.55 52.23 3n1g s ASP 766 Cb -0.13 -1.11 0.01 0.00 1.07 0.00 0.00 42.92 42.76 3n1g s ASP 766 CO 0.03 -0.00 -0.16 -0.32 1.18 0.00 0.00 175.17 175.89 3n1g s MET 767 N -3.65 2.13 0.12 8.23 1.75 -1.26 -2.01 119.30 124.61 3n1g s MET 767 Ca 0.32 -0.56 0.06 0.00 -1.25 0.00 0.00 55.69 54.26 3n1g s MET 767 Cb -0.07 -1.71 -0.04 0.00 2.84 0.00 0.00 34.83 35.85 3n1g s MET 767 CO 0.22 0.06 -0.15 0.14 -0.65 0.00 0.00 175.02 174.64 3n1g s VAL 768 N 0.61 1.41 0.78 10.11 -7.23 -0.87 -4.99 120.40 120.22 3n1g s VAL 768 Ca -0.15 -1.68 -0.11 0.00 -1.81 0.00 0.00 61.98 58.23 3n1g s VAL 768 Cb -0.16 -1.52 0.06 0.00 0.56 0.00 0.00 36.38 35.31 3n1g s VAL 768 CO 0.05 -0.34 1.08 -1.61 -0.31 0.00 0.00 175.10 173.97 3n1g s GLU 769 N -2.49 2.24 0.29 4.82 0.41 -1.26 -0.96 118.70 121.74 3n1g s GLU 769 Ca 0.08 0.87 0.23 0.00 -0.41 0.00 0.00 54.97 55.74 3n1g s GLU 769 Cb -0.06 -1.92 1.07 0.00 -1.78 0.00 0.00 34.13 31.44 3n1g s GLU 769 CO 0.04 -1.57 1.69 0.41 -0.49 0.00 0.00 175.26 175.34 3n1g n GLY 770 N -1.73 -1.09 0.64 -1.39 0.00 -1.19 -2.38 105.19 98.05 3n1g n GLY 770 Ca 0.08 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.36 3n1g n GLY 770 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3n1g n ASP 771 N -2.25 2.14 -4.79 1.61 5.68 -1.26 -4.91 116.55 112.76 3n1g n ASP 771 Ca 0.00 -1.62 -0.36 0.00 -0.50 0.00 0.00 54.79 52.32 3n1g n ASP 771 Cb 0.14 0.12 -0.06 0.00 -1.14 0.00 0.00 41.12 40.18 3n1g n ASP 771 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3n1g s LYS 772 N -2.17 4.46 0.00 0.11 -0.14 -1.00 -4.97 119.74 116.02 3n1g s LYS 772 Ca 0.28 1.17 0.00 0.00 -1.36 0.00 0.00 55.97 56.06 3n1g s LYS 772 Cb 0.20 -2.78 0.00 0.00 -1.68 0.00 0.00 37.83 33.57 3n1g s LYS 772 CO 0.40 0.29 0.67 2.48 -0.76 0.00 0.00 175.35 178.43 3n1g n TYR 773 N 0.51 0.00 -3.53 3.18 0.18 -1.26 -5.01 117.16 111.24 3n1g n TYR 773 Ca 0.01 -0.21 -0.12 0.00 1.88 0.00 0.00 57.90 59.46 3n1g n TYR 773 Cb 0.51 -0.02 -0.04 0.00 -0.38 0.00 0.00 39.34 39.41 3n1g n TYR 773 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 3n1g s TRP 774 N -0.42 -0.40 0.07 -3.48 1.48 -1.26 -1.20 118.94 113.73 3n1g s TRP 774 Ca 0.00 0.24 -0.20 0.00 -1.06 0.00 0.00 56.10 55.08 3n1g s TRP 774 Cb 0.00 0.40 0.05 0.00 -1.16 0.00 0.00 33.47 32.76 3n1g s TRP 774 CO 0.00 -0.74 0.48 -1.58 -4.06 0.00 0.00 176.95 171.05 3n1g s HIS 775 N -3.36 -0.36 -0.18 1.66 2.46 -0.71 -5.01 115.29 109.79 3n1g s HIS 775 Ca -0.00 0.29 0.01 0.00 0.47 0.00 0.00 55.06 55.83 3n1g s HIS 775 Cb 0.00 0.32 0.02 0.00 -0.13 0.00 0.00 32.58 32.78 3n1g s HIS 775 CO -0.09 -0.65 -0.19 -1.12 -2.47 0.00 0.00 174.74 170.21 3n1g s SER 776 N -2.20 3.20 -0.21 9.88 0.01 -1.26 -0.84 113.70 122.28 3n1g s SER 776 Ca -0.03 -0.63 -0.22 0.00 1.31 0.00 0.00 55.95 56.38 3n1g s SER 776 Cb -0.00 -1.49 -0.02 0.00 0.21 0.00 0.00 66.02 64.72 3n1g s SER 776 CO -0.05 0.01 0.70 -0.63 0.41 0.00 0.00 173.24 173.68 3n1g s ILE 777 N 1.25 4.96 0.50 1.44 1.01 1.00 -4.92 121.20 126.44 3n1g s ILE 777 Ca 0.04 1.31 0.06 0.00 0.00 0.00 0.00 60.65 62.06 3n1g s ILE 777 Cb -0.13 -4.00 0.01 0.00 0.01 0.00 0.00 42.46 38.34 3n1g s ILE 777 CO -0.11 0.05 0.32 -0.44 0.00 0.00 0.00 174.94 174.76 3n1g s SER 778 N 1.28 4.60 -1.43 3.58 0.01 -1.26 -1.14 113.70 119.33 3n1g s SER 778 Ca 0.31 -1.20 -0.10 0.00 1.31 0.00 0.00 55.95 56.27 3n1g s SER 778 Cb -0.16 0.15 0.05 0.00 0.21 0.00 0.00 66.02 66.27 3n1g s SER 778 CO 0.10 -0.93 1.05 1.41 0.41 0.00 0.00 173.24 175.27 3n1g n HIS 779 N -1.60 -2.50 -2.65 2.43 8.25 -0.72 -4.92 115.22 113.51 3n1g n HIS 779 Ca -0.03 0.95 -0.23 0.00 -0.26 0.00 0.00 57.72 58.15 3n1g n HIS 779 Cb 0.64 -4.48 0.10 0.00 1.12 0.00 0.00 29.99 27.38 3n1g n HIS 779 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3n1g s LEU 780 N -7.21 2.99 0.13 2.41 1.43 0.28 -5.05 118.68 113.67 3n1g s LEU 780 Ca 0.56 -0.44 -0.09 0.00 -1.03 0.00 0.00 54.13 53.12 3n1g s LEU 780 Cb -0.26 -1.92 -0.06 0.00 0.03 0.00 0.00 46.19 43.98 3n1g s LEU 780 CO 0.79 -1.80 0.45 -1.10 0.23 0.00 0.00 176.35 174.91 3n1g s GLN 781 N -5.08 3.77 0.56 1.70 -1.52 -1.26 -4.47 119.66 113.37 3n1g s GLN 781 Ca 0.66 0.18 -0.21 0.00 -1.95 0.00 0.00 55.36 54.05 3n1g s GLN 781 Cb -0.05 -2.88 -0.04 0.00 -0.22 0.00 0.00 33.01 29.82 3n1g s GLN 781 CO 0.44 0.48 1.30 -2.14 -0.25 0.00 0.00 175.29 175.12 3n1g s PRO 782 N -2.27 3.06 -1.58 2.91 0.02 -0.94 -3.48 135.00 132.73 3n1g s PRO 782 Ca 0.38 2.10 -0.15 0.00 0.02 0.00 0.00 61.00 63.35 3n1g s PRO 782 Cb -0.13 -2.14 0.11 0.00 0.02 0.00 0.00 34.50 32.36 3n1g s PRO 782 CO 0.20 -1.21 0.87 -1.91 -0.33 0.00 0.00 177.00 174.62 3n1g n GLU 783 N -1.22 -4.48 -5.08 5.54 2.13 -0.14 -4.90 120.64 112.49 3n1g n GLU 783 Ca 0.12 0.51 -0.29 0.00 0.66 0.00 0.00 57.16 58.16 3n1g n GLU 783 Cb 0.47 -5.33 -0.16 0.00 0.27 0.00 0.00 31.44 26.68 3n1g n GLU 783 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 3n1g s THR 784 N -3.25 1.77 0.06 6.31 2.01 -1.23 -4.88 115.64 116.43 3n1g s THR 784 Ca 0.67 -0.92 -0.21 0.00 0.31 0.00 0.00 61.69 61.54 3n1g s THR 784 Cb -0.35 -1.50 -0.06 0.00 0.01 0.00 0.00 72.50 70.60 3n1g s THR 784 CO 0.83 0.50 0.64 -0.55 -0.69 0.00 0.00 174.62 175.34 3n1g s SER 785 N -0.20 7.11 0.01 3.53 0.15 -1.26 -1.31 113.70 121.73 3n1g s SER 785 Ca -0.00 1.31 0.07 0.00 0.70 0.00 0.00 55.95 58.03 3n1g s SER 785 Cb -0.12 -2.40 -0.02 0.00 -1.71 0.00 0.00 66.02 61.78 3n1g s SER 785 CO 0.02 0.18 -0.21 -0.31 1.20 0.00 0.00 173.24 174.11 3n1g s TYR 786 N -0.68 1.89 -0.06 3.44 1.51 0.13 -0.57 117.35 123.01 3n1g s TYR 786 Ca 0.32 -0.37 -0.22 0.00 -1.01 0.00 0.00 57.07 55.79 3n1g s TYR 786 Cb -0.20 -1.17 -0.04 0.00 -0.11 0.00 0.00 41.96 40.44 3n1g s TYR 786 CO 0.20 0.03 0.65 -0.51 -1.11 0.00 0.00 175.55 174.81 3n1g s ASP 787 N -0.81 6.95 -0.08 2.29 1.01 0.74 -1.32 116.67 125.45 3n1g s ASP 787 Ca 0.08 1.14 0.01 0.00 0.71 0.00 0.00 52.55 54.50 3n1g s ASP 787 Cb -0.08 -2.39 0.02 0.00 1.01 0.00 0.00 42.92 41.47 3n1g s ASP 787 CO 0.00 -0.06 -0.10 -0.63 0.21 0.00 0.00 175.17 174.59 3n1g s ILE 788 N 0.56 1.06 0.22 0.77 1.01 0.12 -1.56 121.20 123.38 3n1g s ILE 788 Ca 0.35 -0.40 -0.05 0.00 0.00 0.00 0.00 60.65 60.54 3n1g s ILE 788 Cb -0.18 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 3n1g s ILE 788 CO 0.17 0.35 0.26 -1.59 0.00 0.00 0.00 174.94 174.12 3n1g s LYS 789 N 0.96 1.33 0.27 2.79 -2.85 -0.83 -0.04 119.74 121.36 3n1g s LYS 789 Ca -0.09 -1.50 -0.12 0.00 -1.00 0.00 0.00 55.97 53.26 3n1g s LYS 789 Cb -0.15 0.34 0.00 0.00 -2.06 0.00 0.00 37.83 35.96 3n1g s LYS 789 CO 0.00 -0.48 0.51 0.00 0.10 0.00 0.00 175.35 175.48 3n1g s MET 790 N -4.11 1.64 0.24 1.78 0.23 -1.26 0.18 119.30 118.00 3n1g s MET 790 Ca 0.33 -1.31 -0.13 0.00 -1.03 0.00 0.00 55.69 53.56 3n1g s MET 790 Cb 0.04 0.48 -0.00 0.00 -1.53 0.00 0.00 34.83 33.82 3n1g s MET 790 CO 0.11 -0.69 0.47 1.14 -2.03 0.00 0.00 175.02 174.02 3n1g s GLN 791 N -3.81 1.53 0.32 3.16 -2.07 -0.33 -0.46 119.66 118.00 3n1g s GLN 791 Ca 0.22 -1.24 0.08 0.00 -1.82 0.00 0.00 55.36 52.60 3n1g s GLN 791 Cb -0.01 0.47 -0.04 0.00 -1.09 0.00 0.00 33.01 32.34 3n1g s GLN 791 CO 0.10 -0.64 0.19 0.00 -1.32 0.00 0.00 175.29 173.63 3n1g s PHE 793 N -2.33 -0.25 0.00 0.00 -0.12 -1.05 -0.58 117.98 113.65 3n1g s PHE 793 Ca 0.37 0.06 0.00 0.00 -0.05 0.00 0.00 56.93 57.31 3n1g s PHE 793 Cb -0.05 0.27 0.00 0.00 -0.63 0.00 0.00 43.02 42.61 3n1g s PHE 793 CO 0.24 -0.66 0.00 0.27 -0.05 0.00 0.00 175.22 175.02 3n1g n ASN 794 N 0.04 0.00 0.12 1.98 0.23 -0.94 -0.86 115.26 115.82 3n1g n ASN 794 Ca -0.17 0.00 0.10 0.00 -0.53 0.00 0.00 54.58 53.98 3n1g n ASN 794 Cb 0.62 0.00 0.47 0.00 -2.08 0.00 0.00 39.78 38.80 3n1g n ASN 794 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 3n1g n GLU 795 N 0.00 0.15 -0.10 -3.83 0.00 -1.26 -3.14 120.64 112.46 3n1g n GLU 795 Ca 0.00 0.48 -0.10 0.00 0.00 0.00 0.00 57.16 57.54 3n1g n GLU 795 Cb 0.00 -1.84 -0.15 0.00 0.00 0.00 0.00 31.44 29.45 3n1g n GLU 795 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3n1g n GLY 796 N -0.51 -0.92 0.00 -1.84 0.00 -1.26 -5.05 105.19 95.61 3n1g n GLY 796 Ca 0.01 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.71 3n1g n GLY 796 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n1g n GLY 797 N 1.84 -0.73 3.86 -0.02 0.00 -1.19 -4.82 105.19 104.13 3n1g n GLY 797 Ca -0.32 -1.38 -0.33 0.00 0.00 0.00 0.00 46.02 43.98 3n1g n GLY 797 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3n1g s GLU 798 N -2.00 3.29 1.13 1.61 8.01 -1.26 -2.22 118.70 127.25 3n1g s GLU 798 Ca 0.00 -0.39 -0.16 0.00 0.01 0.00 0.00 54.97 54.43 3n1g s GLU 798 Cb 0.00 -3.00 0.25 0.00 -4.31 0.00 0.00 34.13 27.07 3n1g s GLU 798 CO 0.00 0.66 1.09 -1.54 0.01 0.00 0.00 175.26 175.48 3n1g s SER 799 N -1.86 1.53 0.80 -0.19 1.04 0.25 -4.81 113.70 110.47 3n1g s SER 799 Ca 0.25 0.94 -0.11 0.00 0.48 0.00 0.00 55.95 57.52 3n1g s SER 799 Cb -0.12 -1.42 0.07 0.00 0.10 0.00 0.00 66.02 64.65 3n1g s SER 799 CO 0.17 -3.78 1.10 -1.83 0.98 0.00 0.00 173.24 169.87 3n1g s GLU 800 N -5.12 2.01 0.54 4.02 -1.05 -0.56 -4.80 118.70 113.73 3n1g s GLU 800 Ca 0.68 1.18 -0.20 0.00 -0.15 0.00 0.00 54.97 56.48 3n1g s GLU 800 Cb -0.15 -1.87 -0.06 0.00 -0.44 0.00 0.00 34.13 31.61 3n1g s GLU 800 CO 0.57 -1.82 1.14 -0.06 0.95 0.00 0.00 175.26 176.04 3n1g s PHE 801 N -2.88 2.67 1.28 4.83 0.40 -1.26 -4.15 117.98 118.86 3n1g s PHE 801 Ca 0.62 1.54 -0.20 0.00 -0.60 0.00 0.00 56.93 58.29 3n1g s PHE 801 Cb -0.18 -3.31 0.31 0.00 0.51 0.00 0.00 43.02 40.35 3n1g s PHE 801 CO 0.56 -1.61 1.05 -1.54 0.70 0.00 0.00 175.22 174.38 3n1g s SER 802 N -1.72 0.24 0.84 1.36 1.04 0.39 -4.83 113.70 111.02 3n1g s SER 802 Ca 0.72 0.74 -0.14 0.00 0.48 0.00 0.00 55.95 57.75 3n1g s SER 802 Cb -0.25 -1.05 0.01 0.00 0.10 0.00 0.00 66.02 64.84 3n1g s SER 802 CO 0.28 -4.55 0.55 -0.46 0.98 0.00 0.00 173.24 170.04 3n1g n ASN 803 N -5.07 -1.35 -4.35 7.02 6.94 -1.26 -4.73 115.26 112.46 3n1g n ASN 803 Ca 0.13 0.47 -0.35 0.00 -0.02 0.00 0.00 54.58 54.81 3n1g n ASN 803 Cb 0.59 -1.24 -0.14 0.00 -2.36 0.00 0.00 39.78 36.63 3n1g n ASN 803 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3n1g s VAL 804 N -2.15 3.49 0.10 3.53 1.01 -1.26 -4.57 120.40 120.55 3n1g s VAL 804 Ca 0.62 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 62.12 3n1g s VAL 804 Cb -0.28 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.48 3n1g s VAL 804 CO 0.61 0.43 0.29 -0.04 0.00 0.00 0.00 175.10 176.40 3n1g s MET 805 N 1.25 3.53 -0.13 2.72 -1.94 0.94 -4.88 119.30 120.78 3n1g s MET 805 Ca 0.03 -0.27 0.01 0.00 -1.71 0.00 0.00 55.69 53.75 3n1g s MET 805 Cb -0.14 -2.95 -0.01 0.00 2.01 0.00 0.00 34.83 33.74 3n1g s MET 805 CO -0.01 0.54 -0.15 0.42 -0.01 0.00 0.00 175.02 175.81 3n1g s ILE 806 N -1.58 2.86 -0.09 2.53 1.01 -1.26 0.11 121.20 124.78 3n1g s ILE 806 Ca 0.38 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 60.23 3n1g s ILE 806 Cb -0.13 -2.19 0.03 0.00 0.01 0.00 0.00 42.46 40.19 3n1g s ILE 806 CO 0.26 0.53 0.24 0.00 0.00 0.00 0.00 174.94 175.97 3n1g s GLU 808 N 0.52 3.27 0.63 0.00 2.12 -1.26 -0.70 118.70 123.28 3n1g s GLU 808 Ca -0.03 -0.35 -0.11 0.00 0.36 0.00 0.00 54.97 54.84 3n1g s GLU 808 Cb -0.05 -3.01 -0.03 0.00 0.26 0.00 0.00 34.13 31.30 3n1g s GLU 808 CO -0.03 0.69 1.04 0.95 -0.54 0.00 0.00 175.26 177.37 3n1g s THR 809 N -1.18 4.56 0.92 -1.70 -4.23 -0.42 -4.16 115.64 109.42 3n1g s THR 809 Ca 0.22 0.83 -0.11 0.00 -1.18 0.00 0.00 61.69 61.45 3n1g s THR 809 Cb -0.12 -3.78 0.14 0.00 1.34 0.00 0.00 72.50 70.08 3n1g s THR 809 CO 0.13 -1.09 1.09 -0.54 -0.54 0.00 0.00 174.62 173.67 3n1g s LYS 810 N -5.16 1.08 0.04 3.99 1.02 -0.75 -3.23 119.74 116.72 3n1g s LYS 810 Ca 0.56 1.06 -0.30 0.00 0.02 0.00 0.00 55.97 57.30 3n1g s LYS 810 Cb -0.11 -1.77 -0.05 0.00 -0.52 0.00 0.00 37.83 35.37 3n1g s LYS 810 CO 0.54 -2.43 1.21 0.00 -0.92 0.00 0.00 175.35 173.74 3n1g s ALA 811 N -2.80 3.41 -0.67 5.17 0.00 -1.26 -0.96 121.76 124.66 3n1g s ALA 811 Ca 0.64 0.81 -0.28 0.00 0.00 0.00 0.00 51.96 53.13 3n1g s ALA 811 Cb -0.20 -3.46 -0.17 0.00 0.00 0.00 0.00 23.12 19.29 3n1g s ALA 811 CO 0.58 -0.51 2.01 -2.13 0.00 0.00 0.00 175.76 175.71 3n1g n ARG 812 N 4.21 0.00 0.00 0.00 0.63 -1.26 -4.79 116.66 115.45 3n1g n ARG 812 Ca 0.09 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 3n1g n ARG 812 Cb 0.46 -1.20 0.00 0.00 0.45 0.00 0.00 32.46 32.17 3n1g n ARG 812 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29