#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oax h MET 740 N 0.00 0.04 -0.18 1.45 1.85 -2.01 -1.84 114.93 114.24 2oax h MET 740 Ca 0.00 -0.02 -0.21 0.00 -0.61 0.00 0.00 59.70 58.86 2oax h MET 740 Cb 0.00 0.00 0.01 0.00 0.43 0.00 0.00 31.60 32.04 2oax h MET 740 CO 0.00 0.52 -0.71 0.28 -0.40 0.00 0.00 176.91 176.60 2oax h VAL 741 N 0.03 1.29 -0.15 -5.77 2.07 -2.02 -1.27 116.25 110.44 2oax h VAL 741 Ca -0.00 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.58 2oax h VAL 741 Cb 0.88 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.54 2oax h VAL 741 CO 0.07 0.61 0.06 -0.07 0.02 0.00 0.00 177.57 178.26 2oax h LEU 742 N 0.53 0.20 -1.45 2.57 3.38 -1.93 -0.24 115.31 118.37 2oax h LEU 742 Ca -0.03 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 2oax h LEU 742 Cb 1.32 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 2oax h LEU 742 CO 0.14 0.30 0.17 -0.33 0.09 0.00 0.00 178.44 178.81 2oax h GLU 743 N 0.09 0.53 -0.35 1.13 5.08 -1.32 -2.21 114.58 117.53 2oax h GLU 743 Ca 0.05 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 2oax h GLU 743 Cb 0.16 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2oax h GLU 743 CO -0.00 0.43 -0.11 -0.97 -1.00 0.00 0.00 179.01 177.36 2oax h ASN 744 N 0.53 0.70 -0.03 1.42 -1.24 -0.74 -3.21 115.58 113.02 2oax h ASN 744 Ca 0.13 -0.38 0.00 0.00 0.71 0.00 0.00 56.30 56.77 2oax h ASN 744 Cb 0.09 -0.19 0.00 0.00 0.73 0.00 0.00 38.32 38.95 2oax h ASN 744 CO -0.02 0.92 0.00 2.30 -1.29 0.00 0.00 177.43 179.34 2oax n ILE 745 N -4.38 0.03 -1.65 2.57 -5.35 -0.14 -4.93 119.36 105.51 2oax n ILE 745 Ca -0.02 -0.15 -0.45 0.00 -0.27 0.00 0.00 62.75 61.86 2oax n ILE 745 Cb 0.36 0.03 -0.03 0.00 -1.74 0.00 0.00 39.64 38.26 2oax n ILE 745 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 2oax n GLU 746 N -0.33 1.82 -0.59 6.28 4.07 -0.87 -4.80 120.64 126.21 2oax n GLU 746 Ca 0.19 0.65 -0.30 0.00 -0.06 0.00 0.00 57.16 57.64 2oax n GLU 746 Cb 0.23 -2.25 0.21 0.00 -0.06 0.00 0.00 31.44 29.57 2oax n GLU 746 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 2oax n PRO 747 N 1.77 -1.74 -3.36 5.31 -0.04 -1.26 -5.03 135.00 130.65 2oax n PRO 747 Ca 0.12 -0.47 -0.21 0.00 -0.04 0.00 0.00 63.50 62.89 2oax n PRO 747 Cb 0.30 -2.02 -0.00 0.00 -0.04 0.00 0.00 33.50 31.74 2oax n PRO 747 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2oax n GLU 748 N -3.66 0.86 -1.58 0.54 0.28 -1.26 -5.08 120.64 110.75 2oax n GLU 748 Ca 0.04 -2.70 -0.46 0.00 -0.16 0.00 0.00 57.16 53.88 2oax n GLU 748 Cb 0.56 0.31 -0.02 0.00 1.43 0.00 0.00 31.44 33.72 2oax n GLU 748 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2oax n ILE 749 N -1.48 1.71 -4.08 3.84 5.41 -1.26 -5.00 119.36 118.50 2oax n ILE 749 Ca -0.02 -0.43 -0.19 0.00 1.00 0.00 0.00 62.75 63.10 2oax n ILE 749 Cb 0.49 -0.93 -0.16 0.00 -0.71 0.00 0.00 39.64 38.33 2oax n ILE 749 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2oax s VAL 750 N -0.82 0.44 -0.01 1.39 1.01 -1.26 -5.15 120.40 116.00 2oax s VAL 750 Ca 0.62 -0.06 -0.14 0.00 0.00 0.00 0.00 61.98 62.40 2oax s VAL 750 Cb -0.75 -0.49 -0.06 0.00 0.00 0.00 0.00 36.38 35.09 2oax s VAL 750 CO 0.58 0.21 0.39 -0.31 0.00 0.00 0.00 175.10 175.97 2oax s TYR 751 N 1.02 3.71 -0.58 5.22 1.51 -1.26 -4.40 117.35 122.57 2oax s TYR 751 Ca -0.10 0.96 0.25 0.00 -1.01 0.00 0.00 57.07 57.17 2oax s TYR 751 Cb -0.14 -2.28 0.54 0.00 -0.11 0.00 0.00 41.96 39.97 2oax s TYR 751 CO -0.01 0.62 1.64 0.00 -1.11 0.00 0.00 175.55 176.70 2oax h ALA 752 N 4.83 0.95 -2.50 3.71 0.00 -1.93 -3.46 119.26 120.86 2oax h ALA 752 Ca -0.51 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.22 2oax h ALA 752 Cb 1.22 0.00 0.04 0.00 0.00 0.00 0.00 17.79 19.05 2oax h ALA 752 CO 0.62 0.00 -0.27 0.41 0.00 0.00 0.00 179.25 180.01 2oax n GLY 753 N 1.22 0.21 3.74 0.00 0.00 -1.26 -4.70 105.19 104.40 2oax n GLY 753 Ca 0.04 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 2oax n GLY 753 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2oax s TYR 754 N -2.92 2.89 -0.24 1.61 5.04 -1.26 -5.00 117.35 117.48 2oax s TYR 754 Ca 0.17 0.86 0.02 0.00 -2.44 0.00 0.00 57.07 55.69 2oax s TYR 754 Cb -0.08 -3.95 0.05 0.00 0.35 0.00 0.00 41.96 38.33 2oax s TYR 754 CO 0.21 -3.20 -0.13 0.34 -1.34 0.00 0.00 175.55 171.43 2oax s ASP 755 N 0.50 4.09 0.00 4.32 3.68 -1.26 -5.00 116.67 123.00 2oax s ASP 755 Ca 0.62 -1.20 0.12 0.00 2.13 0.00 0.00 52.55 54.22 2oax s ASP 755 Cb -0.45 -1.51 0.71 0.00 -1.45 0.00 0.00 42.92 40.23 2oax s ASP 755 CO 0.44 -0.15 1.24 -1.20 0.13 0.00 0.00 175.17 175.64 2oax n SER 756 N 4.49 0.00 0.10 -0.34 7.64 -1.26 -3.04 113.62 121.20 2oax n SER 756 Ca -0.16 -1.04 0.04 0.00 1.01 0.00 0.00 58.87 58.73 2oax n SER 756 Cb 0.44 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.63 2oax n SER 756 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2oax h SER 757 N 0.00 0.00 -3.38 6.43 4.64 -2.03 -3.46 113.55 115.75 2oax h SER 757 Ca 0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 2oax h SER 757 Cb 0.00 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.14 2oax h SER 757 CO 0.00 0.38 0.10 -0.54 -0.87 0.00 0.00 176.83 175.90 2oax s LYS 758 N -3.05 2.93 0.19 4.77 3.01 -1.17 -5.06 119.74 121.36 2oax s LYS 758 Ca 0.01 -0.16 -0.26 0.00 -1.01 0.00 0.00 55.97 54.54 2oax s LYS 758 Cb 0.08 -2.35 -0.08 0.00 -1.01 0.00 0.00 37.83 34.47 2oax s LYS 758 CO 0.77 -0.60 0.82 -1.25 0.51 0.00 0.00 175.35 175.60 2oax s PRO 759 N -4.87 4.63 -1.09 -1.68 0.04 -1.26 -4.93 135.00 125.83 2oax s PRO 759 Ca 0.53 1.23 -0.10 0.00 0.04 0.00 0.00 61.00 62.70 2oax s PRO 759 Cb -0.10 -3.24 -0.07 0.00 0.04 0.00 0.00 34.50 31.13 2oax s PRO 759 CO 0.43 0.54 2.27 -0.25 0.04 0.00 0.00 177.00 180.04 2oax n ASP 760 N 1.50 5.24 -4.87 6.66 8.00 -1.26 -4.81 116.55 127.01 2oax n ASP 760 Ca -0.04 -2.48 -0.31 0.00 0.71 0.00 0.00 54.79 52.66 2oax n ASP 760 Cb 0.48 -1.25 -0.04 0.00 -0.02 0.00 0.00 41.12 40.29 2oax n ASP 760 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2oax s THR 761 N 3.40 4.79 0.36 -3.53 -1.32 -1.26 -4.88 115.64 113.20 2oax s THR 761 Ca 0.50 0.64 0.13 0.00 -1.21 0.00 0.00 61.69 61.75 2oax s THR 761 Cb 0.13 -3.69 0.35 0.00 -1.51 0.00 0.00 72.50 67.77 2oax s THR 761 CO -0.02 -0.39 1.78 0.00 -2.21 0.00 0.00 174.62 173.78 2oax h ALA 762 N 1.63 1.99 0.17 11.08 0.00 -1.89 -1.76 119.26 130.46 2oax h ALA 762 Ca -0.47 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2oax h ALA 762 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2oax h ALA 762 CO 0.65 -0.38 -0.08 0.93 0.00 0.00 0.00 179.25 180.37 2oax h GLU 763 N 0.54 -0.22 0.50 0.00 3.07 -1.88 -2.88 114.58 113.71 2oax h GLU 763 Ca 0.58 0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 59.43 2oax h GLU 763 Cb 1.23 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 2oax h GLU 763 CO -0.34 0.00 -0.24 -0.91 -1.40 0.00 0.00 179.01 176.13 2oax h ASN 764 N -0.41 -0.57 -0.58 1.42 -0.26 -1.66 -2.67 115.58 110.85 2oax h ASN 764 Ca -0.02 0.01 0.12 0.00 -0.56 0.00 0.00 56.30 55.85 2oax h ASN 764 Cb 0.32 0.15 -0.10 0.00 -1.06 0.00 0.00 38.32 37.62 2oax h ASN 764 CO 0.04 -0.40 -0.08 -0.07 -1.06 0.00 0.00 177.43 175.86 2oax h LEU 765 N -0.68 -0.41 -0.44 1.61 4.07 -1.44 -0.03 115.31 117.99 2oax h LEU 765 Ca -0.07 0.16 -0.11 0.00 0.08 0.00 0.00 57.88 57.94 2oax h LEU 765 Cb 0.52 0.31 -0.01 0.00 1.08 0.00 0.00 40.66 42.56 2oax h LEU 765 CO 0.11 -0.15 -0.17 -0.07 -1.08 0.00 0.00 178.44 177.08 2oax h LEU 766 N 0.05 0.91 -1.17 1.67 3.38 -1.53 -0.97 115.31 117.65 2oax h LEU 766 Ca 0.29 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2oax h LEU 766 Cb 0.46 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 2oax h LEU 766 CO -0.55 1.10 0.53 0.28 0.09 0.00 0.00 178.44 179.89 2oax h SER 767 N 0.72 0.95 -0.25 -0.43 0.02 -1.03 -0.18 113.55 113.34 2oax h SER 767 Ca 0.10 -0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 2oax h SER 767 Cb 0.73 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2oax h SER 767 CO 0.06 0.70 0.01 0.74 -1.14 0.00 0.00 176.83 177.20 2oax h THR 768 N 1.12 1.25 -0.81 -2.27 2.02 -0.69 -1.96 112.91 111.57 2oax h THR 768 Ca 0.30 -0.86 0.03 0.00 0.77 0.00 0.00 66.41 66.64 2oax h THR 768 Cb -0.11 1.32 -0.04 0.00 -1.74 0.00 0.00 68.15 67.58 2oax h THR 768 CO -0.06 0.27 0.53 -0.07 0.37 0.00 0.00 175.52 176.56 2oax h LEU 769 N 0.22 0.87 -0.26 2.58 4.07 -0.58 0.17 115.31 122.39 2oax h LEU 769 Ca 0.07 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.97 2oax h LEU 769 Cb 0.39 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.91 2oax h LEU 769 CO 0.01 0.61 -0.03 0.78 -1.08 0.00 0.00 178.44 178.73 2oax h ASN 770 N 1.02 0.48 -0.42 -0.43 2.35 -0.76 -0.95 115.58 116.88 2oax h ASN 770 Ca 0.31 -0.34 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2oax h ASN 770 Cb -0.01 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 2oax h ASN 770 CO -0.09 0.71 0.26 0.03 -1.65 0.00 0.00 177.43 176.69 2oax h ARG 771 N 0.25 0.57 -0.99 0.81 3.08 -0.88 -1.00 114.38 116.22 2oax h ARG 771 Ca 0.07 -0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.15 2oax h ARG 771 Cb 0.48 -0.12 -0.07 0.00 0.08 0.00 0.00 29.97 30.34 2oax h ARG 771 CO 0.02 0.41 0.64 1.25 -1.07 0.00 0.00 179.97 181.21 2oax h LEU 772 N 0.56 0.99 -0.18 3.04 5.85 -0.87 -1.29 115.31 123.41 2oax h LEU 772 Ca 0.15 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.90 2oax h LEU 772 Cb -0.02 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 2oax h LEU 772 CO -0.03 0.61 0.07 0.00 -0.34 0.00 0.00 178.44 178.75 2oax h ALA 773 N 1.48 0.20 -0.59 1.25 0.00 -0.11 -0.16 119.26 121.34 2oax h ALA 773 Ca 0.44 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.38 2oax h ALA 773 Cb 0.24 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2oax h ALA 773 CO -0.19 -0.36 0.37 0.78 0.00 0.00 0.00 179.25 179.86 2oax h GLY 774 N 0.16 0.84 0.63 0.00 0.00 -0.55 -0.27 103.07 103.89 2oax h GLY 774 Ca 0.08 -0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.16 2oax h GLY 774 CO -0.07 0.25 -0.07 0.50 0.00 0.00 0.00 176.54 177.15 2oax h LYS 775 N 0.74 -0.06 -0.52 4.80 6.56 -0.85 -2.03 116.57 125.21 2oax h LYS 775 Ca 0.23 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.80 2oax h LYS 775 Cb -0.02 0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 31.63 2oax h LYS 775 CO -0.08 -0.04 0.24 1.96 -2.06 0.00 0.00 179.45 179.47 2oax h GLN 776 N -0.06 0.73 -0.11 3.15 4.20 -0.63 -2.25 115.11 120.13 2oax h GLN 776 Ca 0.08 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 2oax h GLN 776 Cb 0.18 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 2oax h GLN 776 CO -0.18 0.58 -0.08 0.52 -0.67 0.00 0.00 178.83 179.00 2oax h MET 777 N 0.73 0.17 -0.30 1.46 2.86 -0.34 0.37 114.93 119.87 2oax h MET 777 Ca 0.18 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.77 2oax h MET 777 Cb 0.09 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 2oax h MET 777 CO -0.02 0.27 0.08 0.82 1.06 0.00 0.00 176.91 179.12 2oax h ILE 778 N 0.16 1.21 -0.64 -1.22 2.04 -0.98 -0.76 117.51 117.32 2oax h ILE 778 Ca 0.04 -0.69 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 2oax h ILE 778 Cb 0.26 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 2oax h ILE 778 CO 0.01 0.23 0.24 1.56 0.00 0.00 0.00 178.15 180.19 2oax h GLN 779 N 0.33 0.97 -0.93 2.37 1.08 -1.10 -2.28 115.11 115.54 2oax h GLN 779 Ca 0.10 -0.19 0.07 0.00 -1.45 0.00 0.00 58.65 57.19 2oax h GLN 779 Cb 0.27 -0.15 -0.07 0.00 -0.05 0.00 0.00 27.48 27.48 2oax h GLN 779 CO -0.00 0.83 0.59 0.28 -0.95 0.00 0.00 178.83 179.57 2oax h VAL 780 N 0.91 1.03 -0.51 -0.54 2.07 0.22 0.13 116.25 119.55 2oax h VAL 780 Ca 0.21 -0.36 -0.12 0.00 0.82 0.00 0.00 66.70 67.25 2oax h VAL 780 Cb 0.23 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 2oax h VAL 780 CO -0.01 0.19 -0.17 0.58 0.02 0.00 0.00 177.57 178.18 2oax h VAL 781 N 1.04 1.27 -0.26 2.57 2.07 -0.92 0.45 116.25 122.47 2oax h VAL 781 Ca 0.42 -1.33 -0.08 0.00 0.82 0.00 0.00 66.70 66.53 2oax h VAL 781 Cb 0.23 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 2oax h VAL 781 CO -0.19 0.46 -0.19 0.50 0.02 0.00 0.00 177.57 178.17 2oax h LYS 782 N 0.88 0.46 -0.09 1.57 3.64 -0.76 -1.38 116.57 120.89 2oax h LYS 782 Ca 0.12 -0.15 -0.06 0.00 -1.27 0.00 0.00 60.65 59.30 2oax h LYS 782 Cb 0.74 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 2oax h LYS 782 CO 0.06 0.63 -0.18 2.35 -2.27 0.00 0.00 179.45 180.03 2oax h TRP 783 N 0.42 0.35 -0.85 1.91 7.01 -0.44 -3.21 115.95 121.13 2oax h TRP 783 Ca 0.07 -0.13 0.02 0.00 2.11 0.00 0.00 58.89 60.96 2oax h TRP 783 Cb 0.56 -0.06 -0.05 0.00 -2.10 0.00 0.00 29.16 27.51 2oax h TRP 783 CO 0.02 0.79 0.55 0.00 -2.79 0.00 0.00 178.44 177.01 2oax h ALA 784 N 0.50 1.09 -0.97 2.65 0.00 -0.80 -2.93 119.26 118.80 2oax h ALA 784 Ca 0.00 -0.05 0.20 0.00 0.00 0.00 0.00 54.91 55.07 2oax h ALA 784 Cb 0.77 -0.32 -0.09 0.00 0.00 0.00 0.00 17.79 18.16 2oax h ALA 784 CO 0.04 0.43 0.62 -0.22 0.00 0.00 0.00 179.25 180.12 2oax h LYS 785 N 1.11 0.58 -0.38 0.00 3.64 -1.25 -1.48 116.57 118.79 2oax h LYS 785 Ca 0.32 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.54 2oax h LYS 785 Cb -0.07 -0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 31.55 2oax h LYS 785 CO -0.09 0.38 0.03 1.33 -2.27 0.00 0.00 179.45 178.83 2oax n VAL 786 N -4.65 2.50 -2.69 2.00 0.24 -1.15 -4.68 118.33 109.91 2oax n VAL 786 Ca 0.22 -2.24 -0.42 0.00 -2.04 0.00 0.00 64.34 59.85 2oax n VAL 786 Cb 0.65 -0.30 -0.03 0.00 -1.47 0.00 0.00 33.84 32.69 2oax n VAL 786 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2oax s LEU 787 N -3.05 4.28 0.13 1.34 2.96 -0.56 -4.98 118.68 118.80 2oax s LEU 787 Ca 0.45 1.57 -0.34 0.00 -0.22 0.00 0.00 54.13 55.59 2oax s LEU 787 Cb 0.38 -3.56 -0.13 0.00 0.50 0.00 0.00 46.19 43.38 2oax s LEU 787 CO 0.05 -0.41 1.64 -2.65 -1.32 0.00 0.00 176.35 173.67 2oax n PRO 788 N 4.74 2.24 0.00 0.98 -0.02 -1.26 -2.22 135.00 139.46 2oax n PRO 788 Ca 0.08 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 2oax n PRO 788 Cb 0.49 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 2oax n PRO 788 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oax n GLY 789 N 3.62 1.91 0.26 -1.23 0.00 -1.26 -4.67 105.19 103.82 2oax n GLY 789 Ca 0.18 -0.22 0.02 0.00 0.00 0.00 0.00 46.02 46.00 2oax n GLY 789 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2oax h PHE 790 N 0.00 0.50 0.00 1.61 3.57 -1.89 -1.91 116.94 118.82 2oax h PHE 790 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2oax h PHE 790 Cb 0.00 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.62 2oax h PHE 790 CO 0.00 0.12 0.00 0.36 -2.23 0.00 0.00 178.31 176.56 2oax n LYS 791 N -4.97 0.05 -0.02 1.11 2.85 -0.94 -1.82 118.16 114.42 2oax n LYS 791 Ca 0.12 0.12 0.03 0.00 -1.05 0.00 0.00 58.31 57.53 2oax n LYS 791 Cb 0.33 -1.50 -0.11 0.00 -0.65 0.00 0.00 35.03 33.10 2oax n LYS 791 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2oax n ASN 792 N -1.13 1.72 -4.67 -5.58 3.02 -0.72 -5.00 115.26 102.90 2oax n ASN 792 Ca 0.01 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.25 2oax n ASN 792 Cb 0.01 1.43 0.17 0.00 -0.61 0.00 0.00 39.78 40.78 2oax n ASN 792 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2oax s LEU 793 N -4.27 2.85 0.19 3.41 1.43 -0.76 -4.85 118.68 116.69 2oax s LEU 793 Ca -0.06 2.19 -0.32 0.00 -1.03 0.00 0.00 54.13 54.92 2oax s LEU 793 Cb 0.08 -4.57 -0.12 0.00 0.03 0.00 0.00 46.19 41.61 2oax s LEU 793 CO 0.58 -3.10 1.73 -0.81 0.23 0.00 0.00 176.35 174.98 2oax n PRO 794 N -4.23 2.72 -0.30 1.29 -0.04 -1.26 -4.76 135.00 128.43 2oax n PRO 794 Ca 0.12 0.98 0.20 0.00 -0.04 0.00 0.00 63.50 64.76 2oax n PRO 794 Cb 0.52 -2.83 0.38 0.00 -0.04 0.00 0.00 33.50 31.54 2oax n PRO 794 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2oax n LEU 795 N 4.14 0.09 -0.14 1.53 7.94 -1.26 0.11 117.00 129.41 2oax n LEU 795 Ca 0.16 1.50 -0.03 0.00 -1.11 0.00 0.00 56.01 56.53 2oax n LEU 795 Cb 0.35 -0.63 0.05 0.00 0.53 0.00 0.00 43.42 43.72 2oax n LEU 795 CO 0.64 -1.59 0.87 -0.33 -1.11 0.00 0.00 177.39 175.87 2oax h GLU 796 N 0.00 0.15 -0.44 1.96 3.07 -2.00 -1.10 114.58 116.22 2oax h GLU 796 Ca 0.64 -0.01 -0.13 0.00 -0.50 0.00 0.00 59.36 59.36 2oax h GLU 796 Cb 1.52 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 29.39 2oax h GLU 796 CO -0.77 0.10 -0.23 -0.44 -1.40 0.00 0.00 179.01 176.27 2oax h ASP 797 N 0.15 0.92 -0.25 1.42 3.32 0.50 -2.33 116.42 120.15 2oax h ASP 797 Ca 0.23 -0.35 0.05 0.00 0.02 0.00 0.00 57.03 56.98 2oax h ASP 797 Cb 0.33 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.58 2oax h ASP 797 CO -0.35 1.11 -0.03 1.56 -1.72 0.00 0.00 179.24 179.80 2oax h GLN 798 N 0.78 0.04 -0.51 3.56 4.20 -0.56 0.10 115.11 122.72 2oax h GLN 798 Ca 0.10 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 2oax h GLN 798 Cb 0.78 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 2oax h GLN 798 CO 0.06 0.02 0.19 0.82 -0.67 0.00 0.00 178.83 179.26 2oax h ILE 799 N 0.04 1.22 -0.85 2.54 5.03 -1.20 -2.40 117.51 121.90 2oax h ILE 799 Ca 0.12 -0.70 -0.02 0.00 -0.12 0.00 0.00 64.86 64.14 2oax h ILE 799 Cb 0.17 0.72 -0.04 0.00 -3.03 0.00 0.00 36.82 34.64 2oax h ILE 799 CO -0.23 0.26 0.45 0.74 -0.68 0.00 0.00 178.15 178.69 2oax h THR 800 N 0.69 1.25 -0.41 -0.27 2.02 -0.85 -1.72 112.91 113.62 2oax h THR 800 Ca 0.17 -0.65 -0.11 0.00 0.77 0.00 0.00 66.41 66.58 2oax h THR 800 Cb 0.22 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 2oax h THR 800 CO -0.01 0.29 -0.20 -0.07 0.37 0.00 0.00 175.52 175.90 2oax h LEU 801 N 1.19 0.80 -0.45 2.58 -0.00 -0.66 -2.29 115.31 116.47 2oax h LEU 801 Ca 0.30 -0.28 -0.07 0.00 -0.00 0.00 0.00 57.88 57.82 2oax h LEU 801 Cb 0.06 -0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 40.48 2oax h LEU 801 CO -0.04 0.99 -0.00 0.40 -0.00 0.00 0.00 178.44 179.78 2oax h ILE 802 N 0.70 1.26 -0.06 1.22 2.04 -1.14 -2.52 117.51 119.02 2oax h ILE 802 Ca 0.10 -1.05 -0.10 0.00 1.00 0.00 0.00 64.86 64.81 2oax h ILE 802 Cb 0.71 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 2oax h ILE 802 CO 0.05 0.36 -0.42 1.56 0.00 0.00 0.00 178.15 179.71 2oax h GLN 803 N 0.64 0.12 0.00 2.37 4.20 -1.27 -0.96 115.11 120.21 2oax h GLN 803 Ca 0.13 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.78 2oax h GLN 803 Cb 0.50 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 2oax h GLN 803 CO 0.02 0.52 -0.26 1.88 -0.67 0.00 0.00 178.83 180.32 2oax h TYR 804 N 0.10 0.00 0.00 2.96 0.05 -1.34 -3.37 116.97 115.37 2oax h TYR 804 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2oax h TYR 804 Cb 0.79 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.53 2oax h TYR 804 CO 0.01 0.00 0.00 -1.13 -1.05 0.00 0.00 178.16 175.99 2oax n SER 805 N -2.38 1.18 -0.19 3.88 3.41 -0.96 -4.81 113.62 113.76 2oax n SER 805 Ca 0.04 -1.51 0.19 0.00 -0.26 0.00 0.00 58.87 57.33 2oax n SER 805 Cb 0.46 0.00 0.55 0.00 -0.26 0.00 0.00 64.21 64.96 2oax n SER 805 CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 2oax h TRP 806 N 0.00 0.41 -0.03 7.33 5.08 -1.35 0.33 115.95 127.73 2oax h TRP 806 Ca 0.00 0.01 -0.20 0.00 1.08 0.00 0.00 58.89 59.78 2oax h TRP 806 Cb 0.55 -0.13 -0.00 0.00 -3.00 0.00 0.00 29.16 26.58 2oax h TRP 806 CO 0.00 0.13 -0.84 1.98 -1.28 0.00 0.00 178.44 178.43 2oax h MET 807 N 0.33 0.34 -0.42 0.12 4.05 -1.87 -2.16 114.93 115.31 2oax h MET 807 Ca 0.41 -0.33 -0.04 0.00 -0.28 0.00 0.00 59.70 59.46 2oax h MET 807 Cb 1.11 0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.98 2oax h MET 807 CO -0.12 1.00 0.10 0.00 0.23 0.00 0.00 176.91 178.12 2oax h LEU 809 N 0.55 -0.56 -0.78 0.00 3.38 -1.16 -1.66 115.31 115.09 2oax h LEU 809 Ca 0.13 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 2oax h LEU 809 Cb 0.32 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2oax h LEU 809 CO 0.00 -0.32 0.06 -0.07 0.09 0.00 0.00 178.44 178.21 2oax h LEU 810 N -0.77 0.95 -0.37 1.67 3.38 -1.43 -0.95 115.31 117.79 2oax h LEU 810 Ca -0.07 -0.23 -0.13 0.00 0.09 0.00 0.00 57.88 57.54 2oax h LEU 810 Cb 0.56 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2oax h LEU 810 CO 0.11 0.97 -0.28 0.77 0.09 0.00 0.00 178.44 180.11 2oax h SER 811 N 0.92 0.88 -0.52 -0.43 4.64 -1.28 0.16 113.55 117.92 2oax h SER 811 Ca 0.18 -0.44 -0.05 0.00 -0.47 0.00 0.00 61.79 61.01 2oax h SER 811 Cb 0.45 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.27 2oax h SER 811 CO 0.02 1.13 0.16 0.15 -0.87 0.00 0.00 176.83 177.42 2oax h PHE 812 N 0.63 0.88 -0.44 4.77 3.57 -1.19 -1.47 116.94 123.69 2oax h PHE 812 Ca 0.07 -0.08 -0.14 0.00 3.53 0.00 0.00 57.97 61.35 2oax h PHE 812 Cb 0.85 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 2oax h PHE 812 CO 0.06 0.73 -0.28 0.00 -2.23 0.00 0.00 178.31 176.59 2oax h ALA 813 N 1.34 0.62 0.00 2.41 0.00 -0.90 -1.96 119.26 120.78 2oax h ALA 813 Ca 0.19 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.70 2oax h ALA 813 Cb 0.27 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2oax h ALA 813 CO -0.01 0.65 -0.11 1.25 0.00 0.00 0.00 179.25 181.04 2oax h LEU 814 N 0.80 -0.32 -0.31 0.00 5.85 -0.43 0.04 115.31 120.94 2oax h LEU 814 Ca 0.09 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.92 2oax h LEU 814 Cb 0.86 0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.97 2oax h LEU 814 CO 0.08 -0.16 -0.07 -1.28 -0.34 0.00 0.00 178.44 176.67 2oax h SER 815 N -0.19 -0.27 -0.18 1.25 0.87 -1.20 0.91 113.55 114.74 2oax h SER 815 Ca 0.04 0.09 0.04 0.00 -1.23 0.00 0.00 61.79 60.73 2oax h SER 815 Cb 0.24 0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.35 2oax h SER 815 CO -0.11 -0.10 -0.04 -0.25 -0.53 0.00 0.00 176.83 175.80 2oax h TRP 816 N 0.01 -0.09 -0.62 2.24 2.91 -0.87 -0.62 115.95 118.90 2oax h TRP 816 Ca 0.15 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.17 2oax h TRP 816 Cb 0.23 0.07 -0.03 0.00 -0.51 0.00 0.00 29.16 28.91 2oax h TRP 816 CO -0.29 -0.07 0.32 0.00 -1.03 0.00 0.00 178.44 177.36 2oax h ARG 817 N 0.00 0.87 0.00 2.65 3.08 -0.54 -0.75 114.38 119.69 2oax h ARG 817 Ca 0.08 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 2oax h ARG 817 Cb 0.13 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2oax h ARG 817 CO -0.18 0.65 -0.34 0.77 -1.07 0.00 0.00 179.97 179.81 2oax h SER 818 N 0.87 0.00 -0.03 7.04 0.02 -0.23 -2.17 113.55 119.05 2oax h SER 818 Ca 0.22 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.10 2oax h SER 818 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 2oax h SER 818 CO -0.03 0.34 -0.25 0.22 -1.14 0.00 0.00 176.83 175.97 2oax h TYR 819 N 0.00 0.31 0.00 3.45 3.20 0.24 0.97 116.97 125.14 2oax h TYR 819 Ca -0.00 -0.15 -0.16 0.00 3.14 0.00 0.00 58.73 61.56 2oax h TYR 819 Cb 0.65 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.85 2oax h TYR 819 CO 0.00 0.89 -0.75 0.87 -1.64 0.00 0.00 178.16 177.53 2oax h LYS 820 N -0.36 0.00 0.00 1.82 1.79 -1.17 -2.40 116.57 116.25 2oax h LYS 820 Ca -0.02 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.35 2oax h LYS 820 Cb 0.93 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.56 2oax h LYS 820 CO 0.05 0.75 -2.07 0.72 -1.08 0.00 0.00 179.45 177.82 2oax n HIS 821 N -3.50 0.00 -1.17 -1.35 8.25 -0.82 -4.59 115.22 112.03 2oax n HIS 821 Ca -0.00 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.47 2oax n HIS 821 Cb 0.76 -0.62 0.02 0.00 1.12 0.00 0.00 29.99 31.27 2oax n HIS 821 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2oax n THR 822 N -2.37 0.42 -3.43 1.59 -2.24 -1.03 -4.99 114.28 102.23 2oax n THR 822 Ca -0.12 -0.48 -0.25 0.00 -2.27 0.00 0.00 64.05 60.94 2oax n THR 822 Cb 0.72 0.58 0.02 0.00 -2.10 0.00 0.00 70.33 69.55 2oax n THR 822 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2oax n ASN 823 N -0.28 -4.69 -2.22 3.42 5.15 -0.90 -1.63 115.26 114.10 2oax n ASN 823 Ca 0.02 -0.47 -0.16 0.00 -0.60 0.00 0.00 54.58 53.37 2oax n ASN 823 Cb 0.54 -3.81 0.03 0.00 -0.53 0.00 0.00 39.78 36.01 2oax n ASN 823 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2oax n SER 824 N -2.51 -4.81 -0.13 1.20 7.64 0.31 -4.91 113.62 110.40 2oax n SER 824 Ca -0.02 -0.21 -0.19 0.00 1.01 0.00 0.00 58.87 59.45 2oax n SER 824 Cb 0.56 -3.66 -0.12 0.00 -1.01 0.00 0.00 64.21 59.99 2oax n SER 824 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2oax n GLN 825 N -3.10 0.64 -4.65 1.43 7.27 -0.65 -4.71 117.38 113.60 2oax n GLN 825 Ca -0.08 0.16 -0.29 0.00 0.07 0.00 0.00 57.00 56.86 2oax n GLN 825 Cb 0.58 -1.51 -0.09 0.00 2.41 0.00 0.00 30.24 31.63 2oax n GLN 825 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 2oax s PHE 826 N -2.51 2.01 -0.37 3.69 0.08 -1.26 -4.99 117.98 114.62 2oax s PHE 826 Ca -0.35 -0.95 -0.11 0.00 0.12 0.00 0.00 56.93 55.63 2oax s PHE 826 Cb 0.10 -1.53 0.02 0.00 -0.57 0.00 0.00 43.02 41.04 2oax s PHE 826 CO 0.58 0.16 0.21 -0.51 -0.10 0.00 0.00 175.22 175.57 2oax s LEU 827 N -3.75 4.70 -1.24 -0.37 1.43 -1.04 -4.72 118.68 113.69 2oax s LEU 827 Ca 0.19 -0.92 -0.14 0.00 -1.03 0.00 0.00 54.13 52.24 2oax s LEU 827 Cb 0.04 -2.04 0.16 0.00 0.03 0.00 0.00 46.19 44.38 2oax s LEU 827 CO 0.10 -0.37 1.55 0.00 0.23 0.00 0.00 176.35 177.86 2oax n TYR 828 N 5.02 4.62 -0.08 0.29 4.19 -1.26 0.07 117.16 130.00 2oax n TYR 828 Ca -0.12 -3.21 -0.03 0.00 3.31 0.00 0.00 57.90 57.85 2oax n TYR 828 Cb 0.47 -2.22 0.19 0.00 0.49 0.00 0.00 39.34 38.27 2oax n TYR 828 CO 0.00 0.00 0.00 0.74 0.91 0.00 0.00 176.86 178.51 2oax h PHE 829 N 6.96 0.77 -1.99 2.98 -1.00 -1.80 -3.41 116.94 119.46 2oax h PHE 829 Ca 0.35 -0.10 0.22 0.00 2.81 0.00 0.00 57.97 61.24 2oax h PHE 829 Cb 0.83 -0.21 -0.11 0.00 3.61 0.00 0.00 35.95 40.06 2oax h PHE 829 CO 1.17 0.73 0.62 0.00 -1.61 0.00 0.00 178.31 179.22 2oax s ALA 830 N -4.97 -1.89 0.22 2.45 0.00 -0.79 -4.96 121.76 111.82 2oax s ALA 830 Ca -0.09 0.59 -0.07 0.00 0.00 0.00 0.00 51.96 52.38 2oax s ALA 830 Cb 0.15 0.45 0.34 0.00 0.00 0.00 0.00 23.12 24.06 2oax s ALA 830 CO 0.80 -0.94 1.74 -1.35 0.00 0.00 0.00 175.76 176.01 2oax h PRO 831 N 2.00 0.42 -0.57 0.00 0.11 -1.91 -1.30 132.00 130.75 2oax h PRO 831 Ca -0.24 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2oax h PRO 831 Cb 1.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2oax h PRO 831 CO 0.27 0.28 0.00 -0.40 -0.21 0.00 0.00 178.00 177.94 2oax n ASP 832 N -4.99 2.69 -3.25 -2.05 3.85 -1.26 -4.65 116.55 106.89 2oax n ASP 832 Ca 0.11 -2.23 -0.04 0.00 -0.71 0.00 0.00 54.79 51.93 2oax n ASP 832 Cb 0.32 -0.42 -0.03 0.00 -1.35 0.00 0.00 41.12 39.65 2oax n ASP 832 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 2oax s LEU 833 N -1.19 -1.15 -0.18 -2.12 2.96 -0.49 -4.52 118.68 111.98 2oax s LEU 833 Ca 0.27 -0.86 -0.03 0.00 -0.22 0.00 0.00 54.13 53.29 2oax s LEU 833 Cb 0.17 1.59 -0.02 0.00 0.50 0.00 0.00 46.19 48.44 2oax s LEU 833 CO 0.13 -0.21 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.20 2oax s VAL 834 N 1.88 3.53 -0.25 1.68 1.01 -1.25 -1.88 120.40 125.12 2oax s VAL 834 Ca 0.15 -0.47 -0.27 0.00 0.00 0.00 0.00 61.98 61.40 2oax s VAL 834 Cb -0.08 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.75 2oax s VAL 834 CO -0.09 0.46 0.93 -0.36 0.00 0.00 0.00 175.10 176.05 2oax s PHE 835 N 0.85 3.30 0.50 5.22 0.40 0.11 -4.92 117.98 123.45 2oax s PHE 835 Ca -0.01 1.26 -0.02 0.00 -0.60 0.00 0.00 56.93 57.56 2oax s PHE 835 Cb -0.15 -3.20 0.10 0.00 0.51 0.00 0.00 43.02 40.28 2oax s PHE 835 CO 0.01 -0.47 0.69 -1.71 0.70 0.00 0.00 175.22 174.44 2oax n ASN 836 N 6.22 0.78 -0.06 1.36 5.15 -1.26 -2.49 115.26 124.95 2oax n ASN 836 Ca 0.09 -1.69 -0.08 0.00 -0.60 0.00 0.00 54.58 52.30 2oax n ASN 836 Cb 0.47 -0.46 0.09 0.00 -0.53 0.00 0.00 39.78 39.35 2oax n ASN 836 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 2oax h GLU 837 N 0.00 0.71 -0.36 1.20 4.39 -1.96 -2.28 114.58 116.29 2oax h GLU 837 Ca -0.23 -0.32 -0.15 0.00 0.34 0.00 0.00 59.36 59.01 2oax h GLU 837 Cb 0.80 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.43 2oax h GLU 837 CO 0.23 0.92 -0.36 1.05 -1.16 0.00 0.00 179.01 179.69 2oax h GLU 838 N 0.61 0.87 -0.75 2.33 4.11 -1.99 -2.56 114.58 117.20 2oax h GLU 838 Ca 0.07 -0.46 0.00 0.00 0.07 0.00 0.00 59.36 59.04 2oax h GLU 838 Cb 0.81 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.04 2oax h GLU 838 CO 0.07 1.11 0.47 0.87 0.07 0.00 0.00 179.01 181.59 2oax h LYS 839 N 0.67 1.00 -0.84 1.06 1.79 -1.91 0.34 116.57 118.69 2oax h LYS 839 Ca 0.06 -0.07 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 2oax h LYS 839 Cb 0.95 -0.22 -0.04 0.00 -1.58 0.00 0.00 32.23 31.34 2oax h LYS 839 CO 0.09 0.68 0.42 0.52 -1.08 0.00 0.00 179.45 180.08 2oax h MET 840 N 1.02 1.19 -0.10 3.15 2.86 -1.22 -2.36 114.93 119.47 2oax h MET 840 Ca 0.27 -0.16 -0.08 0.00 -2.06 0.00 0.00 59.70 57.67 2oax h MET 840 Cb -0.08 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.36 2oax h MET 840 CO -0.05 0.90 -0.26 0.45 1.06 0.00 0.00 176.91 179.00 2oax h HIS 841 N 1.18 0.44 0.00 -0.22 3.86 -0.72 -2.78 115.15 116.92 2oax h HIS 841 Ca 0.29 -0.17 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 2oax h HIS 841 Cb 0.08 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 28.48 2oax h HIS 841 CO 0.01 0.87 -0.03 1.96 0.86 0.00 0.00 177.93 181.61 2oax h GLN 842 N -0.11 0.00 -0.19 2.45 4.20 -0.28 -2.07 115.11 119.10 2oax h GLN 842 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2oax h GLN 842 Cb 0.87 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.65 2oax h GLN 842 CO 0.06 0.03 0.00 -1.13 -0.67 0.00 0.00 178.83 177.11 2oax n SER 843 N -3.27 1.79 -2.11 1.46 3.41 -0.90 -3.12 113.62 110.88 2oax n SER 843 Ca -0.02 -1.75 -0.17 0.00 -0.26 0.00 0.00 58.87 56.67 2oax n SER 843 Cb 0.17 -0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 63.96 2oax n SER 843 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2oax n ALA 844 N 0.41 -0.55 -1.68 7.33 0.00 -0.78 -4.82 120.51 120.42 2oax n ALA 844 Ca 0.16 0.18 0.06 0.00 0.00 0.00 0.00 53.44 53.84 2oax n ALA 844 Cb 0.34 -1.84 0.13 0.00 0.00 0.00 0.00 19.45 18.09 2oax n ALA 844 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2oax n MET 845 N -2.66 0.99 -0.86 0.00 0.00 -1.18 -5.02 117.12 108.39 2oax n MET 845 Ca -0.19 -2.56 -0.29 0.00 0.00 0.00 0.00 57.70 54.66 2oax n MET 845 Cb 0.62 -1.13 0.22 0.00 0.00 0.00 0.00 33.22 32.94 2oax n MET 845 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 175.97 175.50 2oax s TYR 846 N -2.09 1.49 0.00 1.12 6.14 -1.06 -0.97 117.35 121.98 2oax s TYR 846 Ca 0.31 0.97 0.00 0.00 0.64 0.00 0.00 57.07 58.99 2oax s TYR 846 Cb 0.30 -3.19 0.00 0.00 0.42 0.00 0.00 41.96 39.49 2oax s TYR 846 CO -0.05 -3.56 0.00 0.39 0.64 0.00 0.00 175.55 172.97 2oax n GLU 847 N -4.65 0.00 -0.22 4.97 -0.58 -1.26 -4.19 120.64 114.71 2oax n GLU 847 Ca 0.05 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.70 2oax n GLU 847 Cb 0.57 0.00 0.03 0.00 -0.57 0.00 0.00 31.44 31.46 2oax n GLU 847 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2oax h LEU 848 N 0.00 1.03 -0.84 -4.62 5.85 -1.90 -2.08 115.31 112.75 2oax h LEU 848 Ca 0.00 -0.29 -0.12 0.00 0.84 0.00 0.00 57.88 58.32 2oax h LEU 848 Cb 0.00 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 2oax h LEU 848 CO 0.00 1.06 -0.41 0.00 -0.34 0.00 0.00 178.44 178.75 2oax h GLN 850 N 0.30 0.00 0.56 0.00 1.08 -1.71 -1.49 115.11 113.84 2oax h GLN 850 Ca 0.03 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 2oax h GLN 850 Cb 0.85 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.27 2oax h GLN 850 CO 0.07 0.16 -0.42 0.78 -0.95 0.00 0.00 178.83 178.46 2oax h GLY 851 N 0.75 -1.09 1.99 3.46 0.00 -0.87 -0.94 103.07 106.36 2oax h GLY 851 Ca -0.00 0.48 -0.17 0.00 0.00 0.00 0.00 47.33 47.64 2oax h GLY 851 CO 0.02 -0.37 -0.82 -0.33 0.00 0.00 0.00 176.54 175.04 2oax h MET 852 N -0.96 0.01 -0.10 4.80 2.86 -1.65 -2.96 114.93 116.94 2oax h MET 852 Ca -0.06 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.58 2oax h MET 852 Cb 0.81 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.47 2oax h MET 852 CO 0.01 0.83 0.07 1.25 1.06 0.00 0.00 176.91 180.13 2oax h HIS 853 N 0.01 0.05 0.00 -0.22 6.17 -1.15 0.15 115.15 120.16 2oax h HIS 853 Ca -0.01 0.00 -0.14 0.00 0.71 0.00 0.00 60.37 60.94 2oax h HIS 853 Cb 1.45 -0.02 -0.02 0.00 2.52 0.00 0.00 27.41 31.35 2oax h HIS 853 CO 0.00 0.03 -0.65 1.96 0.71 0.00 0.00 177.93 179.99 2oax h GLN 854 N 0.05 0.00 -0.24 5.26 1.08 -1.02 -2.65 115.11 117.61 2oax h GLN 854 Ca 0.04 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.14 2oax h GLN 854 Cb 0.10 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.53 2oax h GLN 854 CO -0.00 0.65 -0.23 0.82 -0.95 0.00 0.00 178.83 179.11 2oax h ILE 855 N 0.00 1.32 -0.81 2.54 1.08 -0.69 -2.81 117.51 118.13 2oax h ILE 855 Ca -0.01 -1.40 0.09 0.00 -0.39 0.00 0.00 64.86 63.15 2oax h ILE 855 Cb 1.48 1.69 -0.07 0.00 -3.07 0.00 0.00 36.82 36.84 2oax h ILE 855 CO 0.08 0.44 0.47 0.28 -0.69 0.00 0.00 178.15 178.73 2oax h SER 856 N 0.28 0.67 -0.58 1.72 0.02 -0.90 -1.24 113.55 113.52 2oax h SER 856 Ca 0.04 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2oax h SER 856 Cb 0.79 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.22 2oax h SER 856 CO 0.06 0.39 0.38 -0.07 -1.14 0.00 0.00 176.83 176.45 2oax h LEU 857 N 0.79 0.68 -1.04 5.07 3.38 -1.38 -1.74 115.31 121.07 2oax h LEU 857 Ca 0.39 -0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.42 2oax h LEU 857 Cb 0.34 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.85 2oax h LEU 857 CO -0.24 0.50 0.63 1.56 0.09 0.00 0.00 178.44 180.98 2oax h GLN 858 N 0.79 1.05 -0.91 1.13 4.20 -0.99 0.25 115.11 120.64 2oax h GLN 858 Ca 0.21 -0.06 0.07 0.00 0.06 0.00 0.00 58.65 58.93 2oax h GLN 858 Cb -0.08 -0.24 -0.06 0.00 0.30 0.00 0.00 27.48 27.40 2oax h GLN 858 CO -0.05 0.70 0.59 0.74 -0.67 0.00 0.00 178.83 180.14 2oax h PHE 859 N 1.08 1.04 -0.17 2.96 0.04 -0.62 0.24 116.94 121.51 2oax h PHE 859 Ca 0.45 0.03 -0.14 0.00 2.80 0.00 0.00 57.97 61.11 2oax h PHE 859 Cb 0.30 -0.34 0.00 0.00 2.20 0.00 0.00 35.95 38.11 2oax h PHE 859 CO -0.00 0.52 -0.43 0.28 -0.60 0.00 0.00 178.31 178.09 2oax h VAL 860 N 1.00 1.34 0.00 -0.55 2.07 -0.12 0.20 116.25 120.19 2oax h VAL 860 Ca 0.40 -1.68 -0.03 0.00 0.82 0.00 0.00 66.70 66.22 2oax h VAL 860 Cb 0.25 1.95 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 2oax h VAL 860 CO -0.16 0.52 -0.12 0.03 0.02 0.00 0.00 177.57 177.86 2oax h ARG 861 N 0.26 0.00 -0.01 1.57 3.08 -0.58 -2.82 114.38 115.88 2oax h ARG 861 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2oax h ARG 861 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.09 2oax h ARG 861 CO 0.09 0.12 -0.78 1.28 -1.07 0.00 0.00 179.97 179.62 2oax n LEU 862 N -3.21 1.33 -3.66 3.04 4.77 0.81 -4.98 117.00 115.09 2oax n LEU 862 Ca 0.01 -0.55 -0.21 0.00 -0.03 0.00 0.00 56.01 55.23 2oax n LEU 862 Cb 0.43 -0.02 0.04 0.00 -2.33 0.00 0.00 43.42 41.54 2oax n LEU 862 CO 0.32 0.29 -0.05 0.00 -1.33 0.00 0.00 177.39 176.61 2oax n GLN 863 N -0.97 -4.77 -1.77 3.23 1.13 -0.02 -4.87 117.38 109.34 2oax n GLN 863 Ca 0.06 0.64 -0.41 0.00 -1.94 0.00 0.00 57.00 55.35 2oax n GLN 863 Cb 0.38 -5.20 -0.00 0.00 0.11 0.00 0.00 30.24 25.52 2oax n GLN 863 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 2oax n LEU 864 N -4.22 4.63 -4.97 1.08 7.94 -0.74 -5.01 117.00 115.71 2oax n LEU 864 Ca -0.28 1.22 -0.21 0.00 -1.11 0.00 0.00 56.01 55.63 2oax n LEU 864 Cb 0.67 -1.61 -0.01 0.00 0.53 0.00 0.00 43.42 43.01 2oax n LEU 864 CO 0.67 0.10 0.05 0.42 -1.11 0.00 0.00 177.39 177.53 2oax s THR 865 N -0.99 4.67 0.39 1.96 -4.23 -1.26 -4.97 115.64 111.21 2oax s THR 865 Ca 0.55 -0.88 0.16 0.00 -1.18 0.00 0.00 61.69 60.34 2oax s THR 865 Cb -0.49 -3.65 0.16 0.00 1.34 0.00 0.00 72.50 69.86 2oax s THR 865 CO 0.62 -0.29 1.92 0.15 -0.54 0.00 0.00 174.62 176.48 2oax h PHE 866 N 0.94 0.00 0.00 3.99 3.57 -1.99 0.35 116.94 123.80 2oax h PHE 866 Ca -0.49 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 60.92 2oax h PHE 866 Cb 1.24 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.97 2oax h PHE 866 CO 0.45 0.27 -0.42 1.05 -2.23 0.00 0.00 178.31 177.42 2oax h GLU 867 N 0.00 0.00 0.09 1.11 4.11 -1.96 -1.92 114.58 116.00 2oax h GLU 867 Ca -0.00 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.13 2oax h GLU 867 Cb 0.50 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2oax h GLU 867 CO 0.03 0.42 -1.55 0.93 0.07 0.00 0.00 179.01 178.92 2oax h GLU 868 N 0.00 0.19 -0.33 1.06 5.08 -1.73 -3.17 114.58 115.68 2oax h GLU 868 Ca -0.00 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 58.02 2oax h GLU 868 Cb 1.15 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 2oax h GLU 868 CO 0.06 1.01 0.13 -0.92 -1.00 0.00 0.00 179.01 178.28 2oax h TYR 869 N 0.05 0.51 -0.49 4.33 3.20 -0.89 -1.70 116.97 121.99 2oax h TYR 869 Ca -0.24 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.55 2oax h TYR 869 Cb 1.99 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 40.09 2oax h TYR 869 CO 0.05 0.48 0.17 0.00 -1.64 0.00 0.00 178.16 177.22 2oax h THR 870 N 0.39 1.19 0.05 1.81 1.03 -1.46 -0.54 112.91 115.38 2oax h THR 870 Ca 0.11 -0.63 -0.17 0.00 -0.01 0.00 0.00 66.41 65.71 2oax h THR 870 Cb 0.19 0.64 0.02 0.00 -1.07 0.00 0.00 68.15 67.93 2oax h THR 870 CO -0.01 0.24 -0.69 0.40 -0.01 0.00 0.00 175.52 175.45 2oax h ILE 871 N 0.70 1.45 -0.49 0.00 1.08 -1.50 -3.24 117.51 115.51 2oax h ILE 871 Ca 0.16 -2.24 0.02 0.00 -0.39 0.00 0.00 64.86 62.42 2oax h ILE 871 Cb 0.18 2.79 -0.03 0.00 -3.07 0.00 0.00 36.82 36.70 2oax h ILE 871 CO -0.01 0.65 0.32 0.24 -0.69 0.00 0.00 178.15 178.66 2oax h MET 872 N -0.17 0.56 -0.43 2.37 2.86 -1.14 -2.07 114.93 116.92 2oax h MET 872 Ca -0.10 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.48 2oax h MET 872 Cb 1.44 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.95 2oax h MET 872 CO 0.13 0.37 0.16 -0.22 1.06 0.00 0.00 176.91 178.41 2oax h LYS 873 N 0.58 0.65 -0.71 1.72 3.64 -1.15 -1.98 116.57 119.33 2oax h LYS 873 Ca 0.19 -0.13 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2oax h LYS 873 Cb 0.05 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 2oax h LYS 873 CO -0.05 0.62 0.47 0.28 -2.27 0.00 0.00 179.45 178.50 2oax h VAL 874 N 0.55 1.17 -0.72 2.00 2.07 -1.42 -2.06 116.25 117.85 2oax h VAL 874 Ca 0.14 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.36 2oax h VAL 874 Cb 0.22 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.10 2oax h VAL 874 CO -0.01 0.17 0.47 -0.07 0.02 0.00 0.00 177.57 178.16 2oax h LEU 875 N 0.95 0.79 -1.18 2.57 3.38 -1.06 -0.40 115.31 120.35 2oax h LEU 875 Ca 0.26 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.13 2oax h LEU 875 Cb -0.10 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 2oax h LEU 875 CO -0.06 0.56 -0.37 -0.07 0.09 0.00 0.00 178.44 178.58 2oax h LEU 876 N 0.92 0.06 -1.28 1.67 3.38 -0.71 -0.21 115.31 119.15 2oax h LEU 876 Ca 0.27 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2oax h LEU 876 Cb -0.03 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2oax h LEU 876 CO -0.07 0.44 0.00 0.25 0.09 0.00 0.00 178.44 179.15 2oax h LEU 877 N 0.06 0.00 -3.07 1.67 5.85 -0.48 -2.89 115.31 116.45 2oax h LEU 877 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2oax h LEU 877 Cb 0.69 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.72 2oax h LEU 877 CO 0.05 0.00 0.00 0.18 -0.34 0.00 0.00 178.44 178.33 2oax n LEU 878 N -2.63 2.86 -1.00 2.25 4.77 -0.18 -4.71 117.00 118.36 2oax n LEU 878 Ca 0.01 -2.73 0.08 0.00 -0.03 0.00 0.00 56.01 53.34 2oax n LEU 878 Cb 0.22 -0.36 0.24 0.00 -2.33 0.00 0.00 43.42 41.19 2oax n LEU 878 CO 0.21 0.67 0.70 -1.20 -1.33 0.00 0.00 177.39 176.44 2oax n SER 879 N -0.71 3.59 -3.44 -1.43 7.64 -0.68 -4.84 113.62 113.75 2oax n SER 879 Ca 0.14 -2.19 -0.18 0.00 1.01 0.00 0.00 58.87 57.65 2oax n SER 879 Cb 0.62 -0.39 -0.11 0.00 -1.01 0.00 0.00 64.21 63.32 2oax n SER 879 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2oax s THR 880 N -1.36 -0.36 0.37 0.44 2.01 -1.26 -0.31 115.64 115.17 2oax s THR 880 Ca 0.36 -0.35 0.08 0.00 0.31 0.00 0.00 61.69 62.10 2oax s THR 880 Cb 0.21 -0.86 -0.05 0.00 0.01 0.00 0.00 72.50 71.81 2oax s THR 880 CO 0.21 -0.37 0.07 0.27 -0.69 0.00 0.00 174.62 174.11 2oax s ILE 881 N 2.34 2.52 0.14 1.82 -4.36 -0.87 -4.75 121.20 118.04 2oax s ILE 881 Ca 0.09 -1.87 -0.31 0.00 -0.26 0.00 0.00 60.65 58.30 2oax s ILE 881 Cb -0.15 -2.89 -0.08 0.00 1.25 0.00 0.00 42.46 40.59 2oax s ILE 881 CO -0.25 -0.12 1.42 -2.84 0.24 0.00 0.00 174.94 173.39 2oax s PRO 882 N -3.78 4.31 0.36 0.37 0.02 -1.26 -1.27 135.00 133.74 2oax s PRO 882 Ca 0.37 2.13 0.24 0.00 0.02 0.00 0.00 61.00 63.76 2oax s PRO 882 Cb 0.02 -3.22 1.32 0.00 0.02 0.00 0.00 34.50 32.64 2oax s PRO 882 CO 0.20 -0.45 1.74 1.57 -0.33 0.00 0.00 177.00 179.74 2oax h LYS 883 N 6.60 0.00 0.00 5.54 2.10 -0.96 0.31 116.57 130.15 2oax h LYS 883 Ca -0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.22 2oax h LYS 883 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 2oax h LYS 883 CO 0.86 0.00 -0.26 -0.25 -2.00 0.00 0.00 179.45 177.80 2oax n ASP 884 N -2.35 0.45 0.00 7.07 8.00 -1.26 -5.04 116.55 123.41 2oax n ASP 884 Ca -0.02 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.73 2oax n ASP 884 Cb 0.04 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 40.91 2oax n ASP 884 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oax n GLY 885 N 1.43 0.23 3.89 0.44 0.00 0.11 -5.04 105.19 106.25 2oax n GLY 885 Ca 0.06 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 2oax n GLY 885 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oax s LEU 886 N -1.07 2.79 0.29 0.99 1.43 -1.26 -4.82 118.68 117.03 2oax s LEU 886 Ca 0.00 1.04 0.23 0.00 -1.03 0.00 0.00 54.13 54.37 2oax s LEU 886 Cb 0.00 -3.76 1.07 0.00 0.03 0.00 0.00 46.19 43.53 2oax s LEU 886 CO 0.00 -1.49 1.69 0.29 0.23 0.00 0.00 176.35 177.07 2oax n LYS 887 N -3.09 0.17 -2.99 1.70 5.02 -1.26 -3.69 118.16 114.02 2oax n LYS 887 Ca 0.07 0.53 -0.15 0.00 -2.02 0.00 0.00 58.31 56.74 2oax n LYS 887 Cb 0.58 -1.92 -0.02 0.00 -0.02 0.00 0.00 35.03 33.66 2oax n LYS 887 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2oax n SER 888 N -2.26 -1.64 -0.15 4.39 2.88 -1.26 -4.99 113.62 110.59 2oax n SER 888 Ca 0.00 -2.91 0.13 0.00 -1.33 0.00 0.00 58.87 54.76 2oax n SER 888 Cb 0.14 0.67 0.47 0.00 -0.75 0.00 0.00 64.21 64.74 2oax n SER 888 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2oax h GLN 889 N 4.38 0.47 0.77 -1.46 5.75 -1.96 -2.94 115.11 120.13 2oax h GLN 889 Ca 0.01 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.45 2oax h GLN 889 Cb 0.98 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 29.41 2oax h GLN 889 CO 0.33 0.31 -0.48 0.00 -2.65 0.00 0.00 178.83 176.34 2oax h ALA 890 N 1.65 -1.27 -0.19 3.38 0.00 -1.94 -1.49 119.26 119.41 2oax h ALA 890 Ca 0.34 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 55.06 2oax h ALA 890 Cb 0.66 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2oax h ALA 890 CO -0.11 -1.22 0.24 0.00 0.00 0.00 0.00 179.25 178.15 2oax h ALA 891 N -1.19 1.77 0.07 0.00 0.00 -1.96 -1.55 119.26 116.40 2oax h ALA 891 Ca -0.10 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.54 2oax h ALA 891 Cb 0.94 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2oax h ALA 891 CO 0.10 -0.34 -1.22 0.35 0.00 0.00 0.00 179.25 178.14 2oax h PHE 892 N 0.00 0.28 -0.10 0.00 3.57 -1.32 -2.71 116.94 116.66 2oax h PHE 892 Ca 0.09 -0.20 -0.03 0.00 3.53 0.00 0.00 57.97 61.36 2oax h PHE 892 Cb 0.57 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.29 2oax h PHE 892 CO 0.00 1.18 -0.06 0.93 -2.23 0.00 0.00 178.31 178.12 2oax h GLU 893 N 0.04 0.21 0.11 1.11 4.39 -0.28 -1.63 114.58 118.53 2oax h GLU 893 Ca -0.11 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.49 2oax h GLU 893 Cb 1.91 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.54 2oax h GLU 893 CO 0.16 0.59 -0.20 0.93 -1.16 0.00 0.00 179.01 179.34 2oax h GLU 894 N -0.17 -0.32 -0.71 2.33 4.39 -1.55 0.30 114.58 118.86 2oax h GLU 894 Ca 0.02 0.02 0.14 0.00 0.34 0.00 0.00 59.36 59.88 2oax h GLU 894 Cb 0.54 0.07 -0.13 0.00 -0.10 0.00 0.00 28.75 29.13 2oax h GLU 894 CO 0.02 -0.21 -0.16 1.98 -1.16 0.00 0.00 179.01 179.48 2oax h MET 895 N -0.33 0.01 0.00 2.33 4.05 -1.54 0.24 114.93 119.69 2oax h MET 895 Ca -0.01 -0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 59.33 2oax h MET 895 Cb 0.31 -0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.09 2oax h MET 895 CO -0.07 0.01 -0.36 -0.09 0.23 0.00 0.00 176.91 176.62 2oax h ARG 896 N 0.01 0.00 0.01 0.39 2.43 -1.13 -2.12 114.38 113.97 2oax h ARG 896 Ca 0.34 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 59.29 2oax h ARG 896 Cb 0.54 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.08 2oax h ARG 896 CO -0.72 0.36 -0.95 1.15 -1.51 0.00 0.00 179.97 178.31 2oax h THR 897 N 0.00 1.44 0.86 0.20 2.02 0.13 -2.22 112.91 115.34 2oax h THR 897 Ca -0.00 -2.57 -0.04 0.00 0.77 0.00 0.00 66.41 64.57 2oax h THR 897 Cb 0.68 2.48 0.01 0.00 -1.74 0.00 0.00 68.15 69.58 2oax h THR 897 CO 0.05 0.76 -0.43 0.78 0.37 0.00 0.00 175.52 177.05 2oax h ASN 898 N 0.17 -1.02 -0.65 4.18 2.35 -0.24 -1.44 115.58 118.93 2oax h ASN 898 Ca -0.07 0.04 0.07 0.00 -0.55 0.00 0.00 56.30 55.79 2oax h ASN 898 Cb 1.59 0.27 -0.04 0.00 0.05 0.00 0.00 38.32 40.19 2oax h ASN 898 CO 0.16 -0.72 0.43 1.88 -1.65 0.00 0.00 177.43 177.53 2oax h TYR 899 N -1.17 0.63 -0.90 1.19 0.05 -1.44 0.16 116.97 115.48 2oax h TYR 899 Ca -0.12 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.68 2oax h TYR 899 Cb 0.91 -0.21 -0.04 0.00 1.01 0.00 0.00 36.73 38.40 2oax h TYR 899 CO -0.02 0.33 0.56 0.82 -1.05 0.00 0.00 178.16 178.79 2oax h ILE 900 N 0.62 1.25 -0.15 -2.88 2.04 -1.13 -0.81 117.51 116.45 2oax h ILE 900 Ca 0.29 -0.52 -0.13 0.00 1.00 0.00 0.00 64.86 65.50 2oax h ILE 900 Cb 0.33 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 2oax h ILE 900 CO -0.09 0.25 -0.49 0.11 0.00 0.00 0.00 178.15 177.94 2oax h LYS 901 N 1.24 0.38 -0.04 2.37 1.57 0.11 0.18 116.57 122.37 2oax h LYS 901 Ca 0.32 -0.21 -0.06 0.00 -1.87 0.00 0.00 60.65 58.83 2oax h LYS 901 Cb -0.07 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 2oax h LYS 901 CO -0.06 0.78 -0.25 1.49 -0.57 0.00 0.00 179.45 180.84 2oax h GLU 902 N 0.30 0.07 0.07 3.15 4.57 0.14 0.24 114.58 123.13 2oax h GLU 902 Ca 0.02 -0.02 -0.28 0.00 -1.18 0.00 0.00 59.36 57.89 2oax h GLU 902 Cb 0.97 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.53 2oax h GLU 902 CO 0.08 0.32 -1.48 1.25 -1.18 0.00 0.00 179.01 178.01 2oax h LEU 903 N 0.07 0.22 0.00 1.64 5.85 -0.83 -2.94 115.31 119.31 2oax h LEU 903 Ca 0.01 -0.32 -0.00 0.00 0.84 0.00 0.00 57.88 58.41 2oax h LEU 903 Cb 0.48 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2oax h LEU 903 CO 0.03 1.27 -0.00 -0.09 -0.34 0.00 0.00 178.44 179.31 2oax h ARG 904 N 0.04 -0.01 -0.60 1.25 2.43 0.03 0.26 114.38 117.78 2oax h ARG 904 Ca -0.21 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 58.89 2oax h ARG 904 Cb 1.96 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 31.49 2oax h ARG 904 CO 0.13 0.25 0.10 -0.22 -1.51 0.00 0.00 179.97 178.73 2oax h LYS 905 N -0.26 0.96 -0.31 0.20 3.64 -0.68 -2.94 116.57 117.17 2oax h LYS 905 Ca -0.00 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 59.10 2oax h LYS 905 Cb 0.26 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2oax h LYS 905 CO 0.00 0.89 0.03 1.98 -2.27 0.00 0.00 179.45 180.08 2oax h MET 906 N 0.91 0.53 0.00 1.90 4.05 -1.32 -3.51 114.93 117.49 2oax h MET 906 Ca 0.19 -0.15 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 2oax h MET 906 Cb 0.39 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.13 2oax h MET 906 CO 0.01 0.64 0.00 0.28 0.23 0.00 0.00 176.91 178.07 2oax n VAL 907 N -4.59 0.00 0.00 -5.77 0.31 0.90 -5.08 118.33 104.10 2oax n VAL 907 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2oax n VAL 907 Cb 0.23 -0.53 0.00 0.00 -0.91 0.00 0.00 33.84 32.64 2oax n VAL 907 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2oax n GLN 919 N -0.38 0.00 0.09 5.55 10.64 -1.26 -4.85 117.38 127.17 2oax n GLN 919 Ca 0.00 0.00 -0.07 0.00 -1.83 0.00 0.00 57.00 55.10 2oax n GLN 919 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2oax n GLN 919 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.06 175.14 2oax h ARG 920 N 0.00 0.10 -0.93 2.61 2.43 -2.03 -3.15 114.38 113.42 2oax h ARG 920 Ca 0.00 -0.11 0.04 0.00 -0.81 0.00 0.00 59.98 59.10 2oax h ARG 920 Cb 0.00 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.53 2oax h ARG 920 CO 0.00 0.89 0.60 0.35 -1.51 0.00 0.00 179.97 180.31 2oax h PHE 921 N 0.05 1.13 -0.84 2.20 3.57 -1.95 -1.11 116.94 119.99 2oax h PHE 921 Ca -0.03 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2oax h PHE 921 Cb 1.49 -0.37 -0.04 0.00 2.79 0.00 0.00 35.95 39.82 2oax h PHE 921 CO 0.02 0.64 0.47 -0.92 -2.23 0.00 0.00 178.31 176.29 2oax h TYR 922 N 1.16 1.14 -0.01 0.41 3.20 -1.98 -1.60 116.97 119.27 2oax h TYR 922 Ca 0.38 -0.02 -0.16 0.00 3.14 0.00 0.00 58.73 62.07 2oax h TYR 922 Cb 0.03 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 37.92 2oax h TYR 922 CO -0.01 0.78 -0.71 1.96 -1.64 0.00 0.00 178.16 178.53 2oax h GLN 923 N 1.17 0.09 0.28 1.82 4.20 -1.32 -2.45 115.11 118.89 2oax h GLN 923 Ca 0.30 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 2oax h GLN 923 Cb 0.01 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.81 2oax h GLN 923 CO -0.05 0.76 -0.13 -0.07 -0.67 0.00 0.00 178.83 178.67 2oax h LEU 924 N 0.06 -0.32 -2.03 1.46 4.07 -0.92 -2.23 115.31 115.39 2oax h LEU 924 Ca -0.01 -0.10 0.11 0.00 0.08 0.00 0.00 57.88 57.95 2oax h LEU 924 Cb 1.26 0.08 -0.01 0.00 1.08 0.00 0.00 40.66 43.06 2oax h LEU 924 CO 0.10 0.17 0.28 0.71 -1.08 0.00 0.00 178.44 178.62 2oax h THR 925 N -1.04 0.73 0.00 0.22 1.35 -1.42 0.23 112.91 112.98 2oax h THR 925 Ca -0.04 0.00 -0.09 0.00 -0.55 0.00 0.00 66.41 65.74 2oax h THR 925 Cb 0.40 0.80 -0.01 0.00 -1.73 0.00 0.00 68.15 67.61 2oax h THR 925 CO 0.06 0.00 -0.41 0.50 -0.25 0.00 0.00 175.52 175.42 2oax h LYS 926 N 0.00 0.00 0.02 4.72 1.63 -1.47 -0.25 116.57 121.22 2oax h LYS 926 Ca 0.18 0.00 -0.22 0.00 -0.85 0.00 0.00 60.65 59.75 2oax h LYS 926 Cb 0.74 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.34 2oax h LYS 926 CO -0.00 0.41 -1.07 1.25 -3.45 0.00 0.00 179.45 176.59 2oax h LEU 927 N 0.00 0.06 -0.18 5.20 6.46 -0.01 -2.86 115.31 123.98 2oax h LEU 927 Ca -0.00 -0.07 -0.05 0.00 -0.12 0.00 0.00 57.88 57.64 2oax h LEU 927 Cb 1.20 -0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 41.11 2oax h LEU 927 CO 0.05 1.05 -0.08 -0.07 -0.62 0.00 0.00 178.44 178.78 2oax h LEU 928 N 0.01 0.38 -0.50 2.25 3.38 -0.75 -3.09 115.31 116.99 2oax h LEU 928 Ca -0.04 -0.40 0.10 0.00 0.09 0.00 0.00 57.88 57.63 2oax h LEU 928 Cb 1.81 -0.11 -0.09 0.00 0.09 0.00 0.00 40.66 42.36 2oax h LEU 928 CO 0.14 0.70 -0.09 0.44 0.09 0.00 0.00 178.44 179.72 2oax h ASP 929 N 0.07 -0.40 0.04 -0.43 5.19 -1.04 -2.10 116.42 117.75 2oax h ASP 929 Ca 0.04 0.14 -0.00 0.00 -0.62 0.00 0.00 57.03 56.59 2oax h ASP 929 Cb 0.55 0.28 -0.00 0.00 0.18 0.00 0.00 39.33 40.34 2oax h ASP 929 CO 0.02 -0.14 -0.00 0.77 -3.12 0.00 0.00 179.24 176.77 2oax h SER 930 N 0.03 0.00 -0.93 6.45 4.64 -1.43 -2.96 113.55 119.35 2oax h SER 930 Ca 0.24 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.63 2oax h SER 930 Cb 0.37 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.40 2oax h SER 930 CO -0.49 0.00 0.61 0.24 -0.87 0.00 0.00 176.83 176.32 2oax h MET 931 N 0.00 1.04 -0.59 4.77 2.86 -1.36 -3.10 114.93 118.55 2oax h MET 931 Ca -0.00 -0.06 0.10 0.00 -2.06 0.00 0.00 59.70 57.68 2oax h MET 931 Cb 0.03 -0.24 -0.11 0.00 0.06 0.00 0.00 31.60 31.34 2oax h MET 931 CO 0.00 0.69 -0.33 0.45 1.06 0.00 0.00 176.91 178.78 2oax h HIS 932 N 1.07 -0.93 -0.41 -0.22 3.86 -1.69 0.54 115.15 117.38 2oax h HIS 932 Ca 0.40 0.07 -0.08 0.00 -1.16 0.00 0.00 60.37 59.61 2oax h HIS 932 Cb 0.18 0.49 -0.02 0.00 1.06 0.00 0.00 27.41 29.12 2oax h HIS 932 CO -0.00 -0.38 -0.06 -0.44 0.86 0.00 0.00 177.93 177.91 2oax h ASP 933 N -0.16 0.67 0.18 2.45 3.32 -1.79 -0.52 116.42 120.58 2oax h ASP 933 Ca 0.23 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 2oax h ASP 933 Cb 0.55 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.92 2oax h ASP 933 CO -0.68 0.78 -0.09 -0.07 -1.72 0.00 0.00 179.24 177.46 2oax h LEU 934 N 0.64 -0.20 -1.39 1.55 4.07 -1.06 -2.66 115.31 116.26 2oax h LEU 934 Ca 0.12 -0.11 0.01 0.00 0.08 0.00 0.00 57.88 57.99 2oax h LEU 934 Cb 0.48 0.05 -0.03 0.00 1.08 0.00 0.00 40.66 42.24 2oax h LEU 934 CO 0.03 -0.02 0.42 0.58 -1.08 0.00 0.00 178.44 178.37 2oax h VAL 935 N -0.38 1.14 -0.17 1.22 2.07 0.25 -2.02 116.25 118.35 2oax h VAL 935 Ca -0.02 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2oax h VAL 935 Cb 0.30 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 2oax h VAL 935 CO 0.04 0.15 0.11 0.28 0.02 0.00 0.00 177.57 178.17 2oax h SER 936 N 0.84 0.20 -0.76 0.57 0.02 -0.93 0.15 113.55 113.63 2oax h SER 936 Ca 0.24 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.15 2oax h SER 936 Cb -0.05 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.40 2oax h SER 936 CO -0.06 0.16 0.39 0.44 -1.14 0.00 0.00 176.83 176.63 2oax h ASP 937 N 0.22 0.97 -0.56 3.07 3.32 -1.12 -0.91 116.42 121.40 2oax h ASP 937 Ca 0.06 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 2oax h ASP 937 Cb -0.01 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 2oax h ASP 937 CO -0.01 0.81 0.25 -0.07 -1.72 0.00 0.00 179.24 178.49 2oax h LEU 938 N 1.05 0.75 -0.89 1.55 3.38 -1.03 -2.10 115.31 118.02 2oax h LEU 938 Ca 0.26 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 2oax h LEU 938 Cb 0.08 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2oax h LEU 938 CO -0.04 0.70 -0.05 -0.07 0.09 0.00 0.00 178.44 179.07 2oax h LEU 939 N 0.76 0.74 -0.82 1.67 3.38 -0.32 -1.59 115.31 119.12 2oax h LEU 939 Ca 0.19 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 2oax h LEU 939 Cb 0.16 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2oax h LEU 939 CO -0.02 0.84 -0.31 -0.33 0.09 0.00 0.00 178.44 178.71 2oax h GLU 940 N 0.70 0.52 -0.14 1.13 5.08 -0.91 0.85 114.58 121.80 2oax h GLU 940 Ca 0.13 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2oax h GLU 940 Cb 0.51 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2oax h GLU 940 CO 0.03 0.77 0.07 0.35 -1.00 0.00 0.00 179.01 179.23 2oax h PHE 941 N 0.44 0.20 -0.07 4.33 3.57 -1.19 -2.28 116.94 121.95 2oax h PHE 941 Ca 0.05 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.56 2oax h PHE 941 Cb 0.77 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 2oax h PHE 941 CO 0.03 0.22 -0.02 0.00 -2.23 0.00 0.00 178.31 176.31 2oax h PHE 943 N -0.01 1.23 0.39 0.00 0.04 0.77 -1.13 116.94 118.23 2oax h PHE 943 Ca 0.03 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.79 2oax h PHE 943 Cb 0.06 -0.41 0.00 0.00 2.20 0.00 0.00 35.95 37.80 2oax h PHE 943 CO -0.13 0.80 -0.19 -0.92 -0.60 0.00 0.00 178.31 177.27 2oax h TYR 944 N 1.31 -0.49 -0.61 -0.55 5.03 -1.27 -1.46 116.97 118.92 2oax h TYR 944 Ca 0.34 -0.01 0.18 0.00 2.58 0.00 0.00 58.73 61.82 2oax h TYR 944 Cb -0.09 0.16 -0.02 0.00 1.55 0.00 0.00 36.73 38.33 2oax h TYR 944 CO 0.00 -0.17 0.46 1.15 -1.32 0.00 0.00 178.16 178.29 2oax h THR 945 N -0.87 0.62 -0.01 1.81 2.02 -1.22 0.33 112.91 115.59 2oax h THR 945 Ca -0.05 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 2oax h THR 945 Cb 0.55 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2oax h THR 945 CO 0.09 0.00 -0.00 0.15 0.37 0.00 0.00 175.52 176.12 2oax h PHE 946 N 0.00 0.02 0.08 3.16 3.57 -0.93 0.14 116.94 122.98 2oax h PHE 946 Ca 0.29 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.79 2oax h PHE 946 Cb 1.22 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.93 2oax h PHE 946 CO 0.00 0.44 -0.12 0.00 -2.23 0.00 0.00 178.31 176.39 2oax h ARG 947 N -0.40 -0.24 -0.22 1.11 -0.00 0.09 -2.43 114.38 112.29 2oax h ARG 947 Ca 0.00 0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.50 2oax h ARG 947 Cb 0.43 0.05 0.00 0.00 0.00 0.00 0.00 29.97 30.46 2oax h ARG 947 CO 0.00 -0.16 0.00 0.39 0.00 0.00 0.00 179.97 180.20 2oax n GLU 948 N -5.25 1.52 -0.33 0.04 -0.58 -0.39 -4.52 120.64 111.13 2oax n GLU 948 Ca -0.07 -0.81 0.24 0.00 -0.42 0.00 0.00 57.16 56.10 2oax n GLU 948 Cb 0.17 -1.19 0.45 0.00 -0.57 0.00 0.00 31.44 30.30 2oax n GLU 948 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2oax h SER 949 N 1.34 -0.05 0.19 1.62 0.87 -0.19 0.22 113.55 117.54 2oax h SER 949 Ca 0.00 0.27 -0.13 0.00 -1.23 0.00 0.00 61.79 60.70 2oax h SER 949 Cb 0.30 0.37 -0.01 0.00 -0.44 0.00 0.00 62.40 62.62 2oax h SER 949 CO 0.00 -0.39 -0.49 1.12 -0.53 0.00 0.00 176.83 176.54 2oax h HIS 950 N 0.02 0.43 0.06 2.24 2.07 -1.83 -1.85 115.15 116.28 2oax h HIS 950 Ca 0.73 -0.14 -0.27 0.00 -2.85 0.00 0.00 60.37 57.84 2oax h HIS 950 Cb 1.75 -0.09 -0.02 0.00 2.57 0.00 0.00 27.41 31.63 2oax h HIS 950 CO -0.24 0.77 -1.35 0.00 -3.07 0.00 0.00 177.93 174.04 2oax h ALA 951 N 1.21 0.36 0.00 6.11 0.00 -1.05 -3.31 119.26 122.58 2oax h ALA 951 Ca 0.01 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.85 2oax h ALA 951 Cb 0.96 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2oax h ALA 951 CO 0.08 1.23 -0.15 1.28 0.00 0.00 0.00 179.25 181.68 2oax n LEU 952 N -3.36 0.40 -2.56 0.00 4.77 0.29 -4.93 117.00 111.60 2oax n LEU 952 Ca -0.10 0.41 -0.20 0.00 -0.03 0.00 0.00 56.01 56.09 2oax n LEU 952 Cb 1.01 -0.37 0.02 0.00 -2.33 0.00 0.00 43.42 41.74 2oax n LEU 952 CO 0.49 -0.04 -0.10 0.29 -1.33 0.00 0.00 177.39 176.70 2oax n LYS 953 N -1.79 -3.32 -4.00 3.23 4.76 -0.72 -4.84 118.16 111.48 2oax n LYS 953 Ca 0.06 0.89 -0.35 0.00 -2.87 0.00 0.00 58.31 56.03 2oax n LYS 953 Cb 0.38 -5.55 -0.12 0.00 -1.84 0.00 0.00 35.03 27.90 2oax n LYS 953 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2oax s VAL 954 N -3.07 4.33 0.20 -0.18 1.01 -1.08 -4.84 120.40 116.77 2oax s VAL 954 Ca 0.17 -0.18 -0.04 0.00 0.00 0.00 0.00 61.98 61.93 2oax s VAL 954 Cb -0.07 -2.97 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 2oax s VAL 954 CO 0.20 0.42 0.43 -1.61 0.00 0.00 0.00 175.10 174.54 2oax s GLU 955 N 0.90 3.60 -0.06 2.72 8.01 -1.26 -4.72 118.70 127.89 2oax s GLU 955 Ca 0.03 -0.14 0.02 0.00 0.01 0.00 0.00 54.97 54.89 2oax s GLU 955 Cb -0.14 -2.79 0.01 0.00 -4.31 0.00 0.00 34.13 26.90 2oax s GLU 955 CO 0.02 0.39 -0.10 -0.06 0.01 0.00 0.00 175.26 175.52 2oax s PHE 956 N -1.82 1.27 1.04 1.61 0.40 -1.26 -4.58 117.98 114.63 2oax s PHE 956 Ca 0.41 -0.44 -0.11 0.00 -0.60 0.00 0.00 56.93 56.18 2oax s PHE 956 Cb -0.11 -0.96 0.22 0.00 0.51 0.00 0.00 43.02 42.68 2oax s PHE 956 CO 0.27 -0.25 1.09 -2.14 0.70 0.00 0.00 175.22 174.89 2oax s PRO 957 N 0.70 0.02 0.12 0.24 0.02 -1.26 -4.70 135.00 130.14 2oax s PRO 957 Ca -0.14 1.24 -0.26 0.00 0.02 0.00 0.00 61.00 61.87 2oax s PRO 957 Cb -0.15 -1.63 -0.07 0.00 0.02 0.00 0.00 34.50 32.66 2oax s PRO 957 CO 0.03 -3.21 1.64 0.00 -0.33 0.00 0.00 177.00 175.13 2oax h ALA 958 N -2.27 -0.38 -0.50 -1.55 0.00 -1.99 -1.52 119.26 111.04 2oax h ALA 958 Ca -0.52 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.46 2oax h ALA 958 Cb 1.30 0.41 -0.08 0.00 0.00 0.00 0.00 17.79 19.43 2oax h ALA 958 CO 0.45 -0.76 0.05 0.52 0.00 0.00 0.00 179.25 179.51 2oax h MET 959 N -0.42 0.17 -0.74 0.00 2.07 -1.97 -0.34 114.93 113.70 2oax h MET 959 Ca 0.04 -0.01 0.00 0.00 -2.07 0.00 0.00 59.70 57.66 2oax h MET 959 Cb 0.47 -0.04 -0.04 0.00 -1.87 0.00 0.00 31.60 30.13 2oax h MET 959 CO -0.18 0.11 0.46 1.25 1.07 0.00 0.00 176.91 179.63 2oax h LEU 960 N 0.17 0.87 -1.00 1.22 5.85 -1.84 0.07 115.31 120.65 2oax h LEU 960 Ca 0.26 -0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.97 2oax h LEU 960 Cb 0.37 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 2oax h LEU 960 CO -0.38 0.66 0.65 0.58 -0.34 0.00 0.00 178.44 179.61 2oax h VAL 961 N 1.01 1.15 0.27 1.05 2.07 -0.20 0.15 116.25 121.75 2oax h VAL 961 Ca 0.27 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2oax h VAL 961 Cb -0.07 -0.20 0.00 0.00 -1.52 0.00 0.00 31.29 29.51 2oax h VAL 961 CO -0.05 0.23 -0.13 -0.08 0.02 0.00 0.00 177.57 177.55 2oax h GLU 962 N 1.23 -0.35 -0.52 1.57 4.57 -0.09 -1.43 114.58 119.57 2oax h GLU 962 Ca 0.41 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.60 2oax h GLU 962 Cb 0.05 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 2oax h GLU 962 CO -0.14 -0.08 0.28 0.82 -1.18 0.00 0.00 179.01 178.71 2oax h ILE 963 N -0.59 1.18 -0.15 2.32 2.04 -0.54 -3.06 117.51 118.71 2oax h ILE 963 Ca -0.04 -0.45 -0.05 0.00 1.00 0.00 0.00 64.86 65.32 2oax h ILE 963 Cb 0.43 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 37.04 2oax h ILE 963 CO 0.06 0.19 -0.12 0.40 0.00 0.00 0.00 178.15 178.68 2oax h ILE 964 N 0.69 1.33 0.00 -0.67 2.04 -0.75 -0.44 117.51 119.71 2oax h ILE 964 Ca 0.18 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 64.81 2oax h ILE 964 Cb 0.05 1.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 2oax h ILE 964 CO -0.03 0.36 0.00 -0.24 0.00 0.00 0.00 178.15 178.24 2oax n SER 965 N -4.58 0.00 -0.07 1.72 2.88 -0.54 -0.09 113.62 112.94 2oax n SER 965 Ca -0.06 0.48 -0.11 0.00 -1.33 0.00 0.00 58.87 57.85 2oax n SER 965 Cb 0.34 -0.48 -0.06 0.00 -0.75 0.00 0.00 64.21 63.26 2oax n SER 965 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2oax n ASP 966 N -1.48 2.30 -0.00 -3.46 -0.08 -1.14 -4.36 116.55 108.33 2oax n ASP 966 Ca 0.00 0.01 -0.06 0.00 -1.51 0.00 0.00 54.79 53.23 2oax n ASP 966 Cb 0.00 -0.28 0.12 0.00 2.34 0.00 0.00 41.12 43.31 2oax n ASP 966 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 2oax h GLN 967 N -0.17 0.54 0.02 -0.67 5.75 -0.66 -3.34 115.11 116.57 2oax h GLN 967 Ca -0.31 -0.26 -0.00 0.00 -0.15 0.00 0.00 58.65 57.92 2oax h GLN 967 Cb 1.41 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.95 2oax h GLN 967 CO -0.10 0.83 -0.01 1.25 -2.65 0.00 0.00 178.83 178.15 2oax h LEU 968 N 0.45 -0.03 0.00 -2.39 5.85 -0.72 -3.36 115.31 115.10 2oax h LEU 968 Ca 0.04 -0.64 0.00 0.00 0.84 0.00 0.00 57.88 58.13 2oax h LEU 968 Cb 0.86 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.90 2oax h LEU 968 CO 0.07 0.64 0.00 -0.81 -0.34 0.00 0.00 178.44 178.01 2oax n PRO 969 N -4.78 0.00 0.00 5.25 -0.04 -1.25 -2.58 135.00 131.59 2oax n PRO 969 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2oax n PRO 969 Cb 0.33 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.79 2oax n PRO 969 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2oax n LYS 970 N 0.00 0.13 0.00 0.54 4.81 -1.26 -1.18 118.16 121.20 2oax n LYS 970 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2oax n LYS 970 Cb 0.00 -1.33 0.00 0.00 0.02 0.00 0.00 35.03 33.72 2oax n LYS 970 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2oax n VAL 971 N 0.79 0.08 1.05 3.15 0.31 -1.25 -4.65 118.33 117.80 2oax n VAL 971 Ca 0.00 -0.11 0.12 0.00 -0.01 0.00 0.00 64.34 64.33 2oax n VAL 971 Cb 0.06 1.38 0.08 0.00 -0.91 0.00 0.00 33.84 34.45 2oax n VAL 971 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2oax n GLU 972 N -0.04 1.41 -2.20 5.55 2.13 -0.33 -4.06 120.64 123.11 2oax n GLU 972 Ca 0.00 -1.13 -0.40 0.00 0.66 0.00 0.00 57.16 56.29 2oax n GLU 972 Cb 0.34 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.57 2oax n GLU 972 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2oax n SER 973 N 0.19 7.82 -4.07 4.31 3.41 -1.26 -4.82 113.62 119.21 2oax n SER 973 Ca 0.11 -3.32 -0.45 0.00 -0.26 0.00 0.00 58.87 54.95 2oax n SER 973 Cb 0.48 -1.30 0.02 0.00 -0.26 0.00 0.00 64.21 63.15 2oax n SER 973 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2oax n GLY 974 N 1.12 -0.82 0.00 5.00 0.00 -1.26 -4.88 105.19 104.35 2oax n GLY 974 Ca 0.57 0.33 0.01 0.00 0.00 0.00 0.00 46.02 46.94 2oax n GLY 974 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2oax n ASN 975 N -2.03 3.96 -4.49 1.61 5.15 -1.26 -4.89 115.26 113.31 2oax n ASN 975 Ca -0.12 -0.06 -0.43 0.00 -0.60 0.00 0.00 54.58 53.38 2oax n ASN 975 Cb 0.55 1.11 -0.03 0.00 -0.53 0.00 0.00 39.78 40.88 2oax n ASN 975 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2oax s ALA 976 N -2.09 3.10 -0.37 5.20 0.00 -1.26 -0.22 121.76 126.12 2oax s ALA 976 Ca -0.01 -2.48 -0.29 0.00 0.00 0.00 0.00 51.96 49.18 2oax s ALA 976 Cb 0.02 -4.21 -0.00 0.00 0.00 0.00 0.00 23.12 18.93 2oax s ALA 976 CO 0.11 -3.20 1.52 0.21 0.00 0.00 0.00 175.76 174.40 2oax s LYS 977 N 3.67 3.56 -0.10 0.00 2.20 -0.40 -4.89 119.74 123.78 2oax s LYS 977 Ca 0.37 1.14 -0.30 0.00 -0.36 0.00 0.00 55.97 56.83 2oax s LYS 977 Cb -0.04 -4.06 -0.02 0.00 -1.51 0.00 0.00 37.83 32.20 2oax s LYS 977 CO -0.08 -1.58 1.13 -2.14 -0.36 0.00 0.00 175.35 172.32 2oax s PRO 978 N 5.03 4.35 -0.13 4.03 0.02 -1.26 -2.05 135.00 145.00 2oax s PRO 978 Ca 0.66 1.54 -0.20 0.00 0.02 0.00 0.00 61.00 63.03 2oax s PRO 978 Cb -0.17 -3.58 -0.04 0.00 0.02 0.00 0.00 34.50 30.73 2oax s PRO 978 CO 0.32 -0.45 0.58 -0.51 -0.33 0.00 0.00 177.00 176.61 2oax s LEU 979 N 2.39 4.25 0.09 -5.54 1.43 0.57 -5.00 118.68 116.88 2oax s LEU 979 Ca 0.52 0.92 0.08 0.00 -1.03 0.00 0.00 54.13 54.61 2oax s LEU 979 Cb -0.21 -2.85 -0.04 0.00 0.03 0.00 0.00 46.19 43.12 2oax s LEU 979 CO 0.18 -0.11 -0.15 -0.31 0.23 0.00 0.00 176.35 176.19 2oax s TYR 980 N 1.05 2.62 0.02 0.29 2.02 -1.26 -4.90 117.35 117.19 2oax s TYR 980 Ca 0.30 -0.22 0.03 0.00 -0.37 0.00 0.00 57.07 56.81 2oax s TYR 980 Cb -0.16 -1.41 -0.25 0.00 -0.40 0.00 0.00 41.96 39.74 2oax s TYR 980 CO 0.12 0.38 0.92 0.74 -1.57 0.00 0.00 175.55 176.14 2oax h PHE 981 N 3.87 0.24 -0.01 2.71 0.04 -1.97 -3.52 116.94 118.31 2oax h PHE 981 Ca -0.49 -0.18 0.00 0.00 2.80 0.00 0.00 57.97 60.10 2oax h PHE 981 Cb 1.17 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.31 2oax h PHE 981 CO 0.59 1.21 0.00 0.72 -0.60 0.00 0.00 178.31 180.23