#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oax h VAL 739 N 0.00 0.14 -0.82 -1.45 2.07 -2.00 -1.65 116.25 112.54 2oax h VAL 739 Ca 0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 2oax h VAL 739 Cb 0.00 0.14 -0.09 0.00 -1.52 0.00 0.00 31.29 29.82 2oax h VAL 739 CO 0.00 0.00 0.40 -0.03 0.02 0.00 0.00 177.57 177.96 2oax h MET 740 N -0.76 0.56 -0.31 1.57 1.85 -2.02 -1.67 114.93 114.14 2oax h MET 740 Ca -0.01 -0.03 -0.04 0.00 -0.61 0.00 0.00 59.70 59.01 2oax h MET 740 Cb 0.73 -0.13 -0.01 0.00 0.43 0.00 0.00 31.60 32.62 2oax h MET 740 CO -0.16 0.37 0.05 0.28 -0.40 0.00 0.00 176.91 177.05 2oax h VAL 741 N 0.58 1.23 0.44 -5.77 2.07 -1.93 -2.23 116.25 110.65 2oax h VAL 741 Ca 0.45 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 2oax h VAL 741 Cb 0.65 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 2oax h VAL 741 CO -0.37 0.27 -0.21 -0.07 0.02 0.00 0.00 177.57 177.20 2oax h LEU 742 N 0.34 -0.51 -1.98 2.57 3.38 -0.75 -1.33 115.31 117.04 2oax h LEU 742 Ca 0.09 0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.20 2oax h LEU 742 Cb 0.34 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2oax h LEU 742 CO 0.01 -0.36 0.30 -0.33 0.09 0.00 0.00 178.44 178.14 2oax h GLU 743 N -0.60 0.02 0.00 1.13 5.08 -1.34 -2.21 114.58 116.66 2oax h GLU 743 Ca -0.06 -0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.15 2oax h GLU 743 Cb 0.46 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2oax h GLU 743 CO 0.10 0.02 -0.73 -0.97 -1.00 0.00 0.00 179.01 176.43 2oax h ASN 744 N 0.03 0.00 -0.36 1.42 -0.73 -0.80 -3.26 115.58 111.87 2oax h ASN 744 Ca 0.20 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.37 2oax h ASN 744 Cb 0.77 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.36 2oax h ASN 744 CO -0.01 0.73 0.00 2.30 -0.37 0.00 0.00 177.43 180.08 2oax n ILE 745 N -3.36 0.50 -1.62 2.57 -5.35 -0.56 -4.97 119.36 106.59 2oax n ILE 745 Ca 0.01 -0.75 -0.50 0.00 -0.27 0.00 0.00 62.75 61.24 2oax n ILE 745 Cb 0.80 0.98 -0.05 0.00 -1.74 0.00 0.00 39.64 39.63 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 1.39 1.49 -0.77 6.28 4.07 -0.91 -4.77 120.64 127.42 2oax n GLU 746 Ca 0.18 0.54 -0.33 0.00 -0.06 0.00 0.00 57.16 57.49 2oax n GLU 746 Cb 0.58 -2.21 0.13 0.00 -0.06 0.00 0.00 31.44 29.88 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 2.74 -0.61 -4.07 5.31 -0.04 -1.26 -4.99 135.00 132.08 2oax n PRO 747 Ca 0.17 -0.14 -0.23 0.00 -0.04 0.00 0.00 63.50 63.26 2oax n PRO 747 Cb 0.23 -1.82 -0.04 0.00 -0.04 0.00 0.00 33.50 31.83 2oax n PRO 747 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2oax s GLU 748 N -3.60 3.06 0.30 0.54 -1.05 -1.26 -5.05 118.70 111.64 2oax s GLU 748 Ca 0.57 -0.91 -0.25 0.00 -0.15 0.00 0.00 54.97 54.22 2oax s GLU 748 Cb -0.19 -2.68 -0.16 0.00 -0.44 0.00 0.00 34.13 30.66 2oax s GLU 748 CO 0.67 0.44 0.38 0.44 0.95 0.00 0.00 175.26 178.14 2oax n ILE 749 N -0.94 1.47 -4.41 1.83 -5.35 -1.26 -4.99 119.36 105.70 2oax n ILE 749 Ca -0.08 -0.50 -0.22 0.00 -0.27 0.00 0.00 62.75 61.68 2oax n ILE 749 Cb 0.57 -0.09 -0.16 0.00 -1.74 0.00 0.00 39.64 38.22 2oax n ILE 749 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2oax s VAL 750 N -1.30 0.86 0.43 7.28 1.01 -1.26 -5.14 120.40 122.29 2oax s VAL 750 Ca 0.62 -0.34 -0.03 0.00 0.00 0.00 0.00 61.98 62.23 2oax s VAL 750 Cb -0.78 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 2oax s VAL 750 CO 0.59 0.29 0.70 -0.31 0.00 0.00 0.00 175.10 176.36 2oax s TYR 751 N 0.62 3.52 -0.25 5.22 1.51 -1.26 -4.51 117.35 122.21 2oax s TYR 751 Ca -0.11 0.62 -0.11 0.00 -1.01 0.00 0.00 57.07 56.46 2oax s TYR 751 Cb -0.14 -2.16 -0.16 0.00 -0.11 0.00 0.00 41.96 39.40 2oax s TYR 751 CO 0.02 -0.14 -0.15 0.00 -1.11 0.00 0.00 175.55 174.17 2oax n ALA 752 N -2.09 1.15 0.00 3.71 0.00 -1.26 -4.91 120.51 117.11 2oax n ALA 752 Ca -0.01 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.49 2oax n ALA 752 Cb 0.56 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2oax n ALA 752 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oax n GLY 753 N 1.59 0.88 3.68 0.00 0.00 -1.26 -4.79 105.19 105.30 2oax n GLY 753 Ca -0.46 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.07 2oax n GLY 753 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2oax n TYR 754 N 0.00 2.30 -4.93 1.61 9.36 -1.26 -4.97 117.16 119.26 2oax n TYR 754 Ca 0.00 0.07 -0.27 0.00 3.32 0.00 0.00 57.90 61.02 2oax n TYR 754 Cb 0.00 -2.64 -0.15 0.00 -0.63 0.00 0.00 39.34 35.92 2oax n TYR 754 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2oax s ASP 755 N 3.78 2.51 0.15 2.98 3.68 -1.26 -5.13 116.67 123.37 2oax s ASP 755 Ca 0.92 -0.43 -0.25 0.00 2.13 0.00 0.00 52.55 54.93 2oax s ASP 755 Cb -0.73 -0.26 0.06 0.00 -1.45 0.00 0.00 42.92 40.55 2oax s ASP 755 CO 0.52 0.23 0.91 -0.94 0.13 0.00 0.00 175.17 176.02 2oax s SER 756 N -0.70 -0.23 -0.48 -0.34 1.04 -1.26 -5.17 113.70 106.57 2oax s SER 756 Ca 0.08 -0.36 0.05 0.00 0.48 0.00 0.00 55.95 56.20 2oax s SER 756 Cb -0.08 0.51 0.23 0.00 0.10 0.00 0.00 66.02 66.78 2oax s SER 756 CO -0.00 -0.92 0.90 0.47 0.98 0.00 0.00 173.24 174.67 2oax n ASP 760 N -0.44 -2.82 -4.86 7.02 8.00 -1.26 -5.37 116.55 116.83 2oax n ASP 760 Ca -0.07 -3.02 -0.21 0.00 0.71 0.00 0.00 54.79 52.21 2oax n ASP 760 Cb 0.61 1.68 -0.03 0.00 -0.02 0.00 0.00 41.12 43.35 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 0.68 2.90 0.18 -3.53 -1.32 -1.26 -4.98 115.64 108.31 2oax s THR 761 Ca 0.31 -1.37 -0.12 0.00 -1.21 0.00 0.00 61.69 59.30 2oax s THR 761 Cb 0.18 -3.05 0.08 0.00 -1.51 0.00 0.00 72.50 68.20 2oax s THR 761 CO -0.19 -0.05 1.78 0.00 -2.21 0.00 0.00 174.62 173.94 2oax h ALA 762 N 1.11 0.77 -0.63 11.08 0.00 -1.93 -2.09 119.26 127.58 2oax h ALA 762 Ca -0.42 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 54.49 2oax h ALA 762 Cb 1.26 -0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.73 2oax h ALA 762 CO 0.58 0.30 0.18 0.93 0.00 0.00 0.00 179.25 181.24 2oax h GLU 763 N 0.81 0.31 0.42 0.00 5.08 -1.87 -2.90 114.58 116.44 2oax h GLU 763 Ca 0.21 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 2oax h GLU 763 Cb 0.08 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2oax h GLU 763 CO -0.03 0.21 -0.20 -0.97 -1.00 0.00 0.00 179.01 177.01 2oax h ASN 764 N 0.32 -0.48 -0.62 1.42 -0.73 -1.75 -3.04 115.58 110.70 2oax h ASN 764 Ca 0.33 0.02 0.11 0.00 1.87 0.00 0.00 56.30 58.62 2oax h ASN 764 Cb 0.47 0.12 -0.12 0.00 0.27 0.00 0.00 38.32 39.07 2oax h ASN 764 CO -0.38 -0.28 -0.33 -0.07 -0.37 0.00 0.00 177.43 176.00 2oax h LEU 765 N -0.70 -1.15 -0.47 0.34 -0.00 -1.37 -0.35 115.31 111.61 2oax h LEU 765 Ca -0.06 0.23 0.00 0.00 -0.00 0.00 0.00 57.88 58.05 2oax h LEU 765 Cb 0.44 0.58 -0.02 0.00 -0.00 0.00 0.00 40.66 41.65 2oax h LEU 765 CO 0.10 -0.30 0.30 -0.07 -0.00 0.00 0.00 178.44 178.46 2oax h LEU 766 N -0.15 0.55 -0.59 1.67 3.38 -1.65 -0.03 115.31 118.49 2oax h LEU 766 Ca 0.24 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2oax h LEU 766 Cb 0.55 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 2oax h LEU 766 CO -0.70 0.42 0.37 0.28 0.09 0.00 0.00 178.44 178.90 2oax h SER 767 N 0.63 0.69 0.16 -0.43 0.02 -1.26 0.29 113.55 113.65 2oax h SER 767 Ca 0.17 -0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.02 2oax h SER 767 Cb -0.04 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.31 2oax h SER 767 CO -0.03 0.52 -0.25 0.71 -1.14 0.00 0.00 176.83 176.64 2oax h THR 768 N 0.79 1.22 -0.23 -2.27 1.35 -0.71 -0.69 112.91 112.36 2oax h THR 768 Ca 0.21 -1.02 -0.13 0.00 -0.55 0.00 0.00 66.41 64.93 2oax h THR 768 Cb -0.06 1.43 -0.00 0.00 -1.73 0.00 0.00 68.15 67.79 2oax h THR 768 CO -0.04 0.30 -0.35 -0.07 -0.25 0.00 0.00 175.52 175.12 2oax h LEU 769 N 0.14 0.71 -1.17 3.87 3.38 0.29 -0.04 115.31 122.49 2oax h LEU 769 Ca 0.02 -0.51 -0.04 0.00 0.09 0.00 0.00 57.88 57.43 2oax h LEU 769 Cb 0.52 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2oax h LEU 769 CO 0.04 1.09 0.08 0.78 0.09 0.00 0.00 178.44 180.52 2oax h ASN 770 N 0.35 0.61 -0.34 -0.43 2.35 -0.10 0.17 115.58 118.19 2oax h ASN 770 Ca 0.02 -0.10 -0.17 0.00 -0.55 0.00 0.00 56.30 55.50 2oax h ASN 770 Cb 0.93 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 39.14 2oax h ASN 770 CO 0.08 0.63 -0.44 -0.09 -1.65 0.00 0.00 177.43 175.96 2oax h ARG 771 N 0.64 0.90 -0.81 0.81 2.43 -1.04 -2.16 114.38 115.16 2oax h ARG 771 Ca 0.14 -0.51 -0.02 0.00 -0.81 0.00 0.00 59.98 58.78 2oax h ARG 771 Cb 0.28 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.83 2oax h ARG 771 CO 0.00 1.16 0.43 1.25 -1.51 0.00 0.00 179.97 181.30 2oax h LEU 772 N 0.70 1.01 -0.42 3.80 6.46 -0.31 -2.42 115.31 124.13 2oax h LEU 772 Ca 0.04 -0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.71 2oax h LEU 772 Cb 1.04 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 40.69 2oax h LEU 772 CO 0.10 0.83 0.27 0.00 -0.62 0.00 0.00 178.44 179.02 2oax h ALA 773 N 1.34 0.54 0.06 1.25 0.00 -0.44 -0.38 119.26 121.62 2oax h ALA 773 Ca 0.28 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.17 2oax h ALA 773 Cb 0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2oax h ALA 773 CO -0.04 0.00 -0.15 0.78 0.00 0.00 0.00 179.25 179.84 2oax h GLY 774 N 0.57 -0.25 1.29 0.00 0.00 -0.95 -1.21 103.07 102.51 2oax h GLY 774 Ca 0.15 0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.67 2oax h GLY 774 CO -0.03 -0.15 0.47 0.50 0.00 0.00 0.00 176.54 177.33 2oax h LYS 775 N -0.28 0.91 -0.04 4.80 6.56 -1.22 -2.08 116.57 125.22 2oax h LYS 775 Ca 0.03 -0.05 -0.10 0.00 -1.06 0.00 0.00 60.65 59.46 2oax h LYS 775 Cb 0.31 -0.21 -0.01 0.00 -0.57 0.00 0.00 32.23 31.76 2oax h LYS 775 CO -0.10 0.60 -0.46 1.96 -2.06 0.00 0.00 179.45 179.39 2oax h GLN 776 N 0.94 0.09 0.00 3.15 4.20 -0.62 -2.80 115.11 120.06 2oax h GLN 776 Ca 0.26 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.88 2oax h GLN 776 Cb -0.08 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 2oax h GLN 776 CO -0.06 0.53 -0.24 0.52 -0.67 0.00 0.00 178.83 178.91 2oax h MET 777 N 0.07 0.00 -0.43 1.46 2.86 -0.51 -1.04 114.93 117.35 2oax h MET 777 Ca 0.00 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 2oax h MET 777 Cb 0.85 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.49 2oax h MET 777 CO 0.06 0.24 -0.08 0.82 1.06 0.00 0.00 176.91 179.02 2oax h ILE 778 N 0.00 1.25 -0.16 -1.22 2.04 -1.36 -2.00 117.51 116.06 2oax h ILE 778 Ca -0.00 -1.09 -0.17 0.00 1.00 0.00 0.00 64.86 64.59 2oax h ILE 778 Cb 0.47 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.55 2oax h ILE 778 CO 0.03 0.37 -0.62 1.56 0.00 0.00 0.00 178.15 179.50 2oax h GLN 779 N 0.68 0.55 -0.96 2.37 1.08 -1.39 -2.92 115.11 114.52 2oax h GLN 779 Ca 0.12 -0.38 0.00 0.00 -1.45 0.00 0.00 58.65 56.95 2oax h GLN 779 Cb 0.53 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.97 2oax h GLN 779 CO 0.03 0.99 0.60 0.28 -0.95 0.00 0.00 178.83 179.79 2oax h VAL 780 N 0.40 1.26 0.14 -0.54 2.07 -0.72 0.98 116.25 119.84 2oax h VAL 780 Ca -0.01 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 2oax h VAL 780 Cb 1.18 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2oax h VAL 780 CO 0.11 0.26 -0.07 0.58 0.02 0.00 0.00 177.57 178.47 2oax h VAL 781 N 1.31 0.92 -0.65 2.57 2.07 -1.28 0.17 116.25 121.37 2oax h VAL 781 Ca 0.35 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.62 2oax h VAL 781 Cb -0.10 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 2oax h VAL 781 CO -0.07 0.06 0.42 0.50 0.02 0.00 0.00 177.57 178.50 2oax h LYS 782 N -0.31 0.86 0.23 1.57 3.64 -1.35 -0.20 116.57 121.00 2oax h LYS 782 Ca -0.02 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2oax h LYS 782 Cb 0.25 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2oax h LYS 782 CO 0.03 0.58 -0.11 2.35 -2.27 0.00 0.00 179.45 180.03 2oax h TRP 783 N 0.87 -0.28 0.00 1.91 7.01 -0.64 -2.88 115.95 121.94 2oax h TRP 783 Ca 0.23 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.23 2oax h TRP 783 Cb -0.08 0.09 -0.00 0.00 -2.10 0.00 0.00 29.16 27.07 2oax h TRP 783 CO -0.03 -0.12 -0.00 0.00 -2.79 0.00 0.00 178.44 175.50 2oax h ALA 784 N 0.38 1.96 0.00 2.65 0.00 -0.41 -2.53 119.26 121.31 2oax h ALA 784 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2oax h ALA 784 Cb 0.29 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2oax h ALA 784 CO 0.05 0.01 -0.06 -0.22 0.00 0.00 0.00 179.25 179.02 2oax h LYS 785 N 0.00 0.00 -0.30 0.00 3.64 -0.80 -2.74 116.57 116.36 2oax h LYS 785 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2oax h LYS 785 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 2oax h LYS 785 CO 0.00 0.06 0.00 1.33 -2.27 0.00 0.00 179.45 178.57 2oax n VAL 786 N -4.22 1.68 -2.21 2.00 0.24 -0.96 -4.75 118.33 110.11 2oax n VAL 786 Ca -0.03 -1.46 -0.42 0.00 -2.04 0.00 0.00 64.34 60.39 2oax n VAL 786 Cb 0.15 0.10 -0.03 0.00 -1.47 0.00 0.00 33.84 32.59 2oax n VAL 786 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2oax s LEU 787 N -1.96 4.29 0.22 1.34 1.43 -1.03 -4.94 118.68 118.03 2oax s LEU 787 Ca 0.33 2.05 -0.32 0.00 -1.03 0.00 0.00 54.13 55.16 2oax s LEU 787 Cb 0.24 -3.55 -0.13 0.00 0.03 0.00 0.00 46.19 42.77 2oax s LEU 787 CO 0.12 -0.78 1.48 -2.65 0.23 0.00 0.00 176.35 174.76 2oax n PRO 788 N 6.07 2.14 0.00 1.29 -0.02 -1.26 -0.85 135.00 142.36 2oax n PRO 788 Ca 0.14 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2oax n PRO 788 Cb 0.44 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 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 2.57 1.59 0.25 -1.23 0.00 -1.26 -4.56 105.19 102.54 2oax n GLY 789 Ca 0.13 -0.06 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.55 -0.01 1.61 3.57 -1.87 -1.23 116.94 118.47 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 0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.01 2oax h PHE 790 CO 0.00 -0.29 0.29 1.57 -2.23 0.00 0.00 178.31 177.65 2oax h LYS 791 N -0.23 0.00 -0.61 1.11 2.10 -1.21 -0.75 116.57 116.98 2oax h LYS 791 Ca 0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.77 2oax h LYS 791 Cb 0.42 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 2oax h LYS 791 CO -0.34 0.00 0.00 0.27 -2.00 0.00 0.00 179.45 177.38 2oax n ASN 792 N -2.93 3.67 -4.94 7.07 2.04 -0.46 -4.89 115.26 114.82 2oax n ASN 792 Ca -0.02 -2.26 -0.24 0.00 -0.44 0.00 0.00 54.58 51.62 2oax n ASN 792 Cb 0.34 -0.48 0.01 0.00 -2.53 0.00 0.00 39.78 37.12 2oax n ASN 792 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 2oax s LEU 793 N -1.41 3.67 0.17 -4.53 1.43 -0.29 -5.02 118.68 112.70 2oax s LEU 793 Ca 0.40 0.46 -0.32 0.00 -1.03 0.00 0.00 54.13 53.65 2oax s LEU 793 Cb 0.25 -3.34 -0.11 0.00 0.03 0.00 0.00 46.19 43.02 2oax s LEU 793 CO 0.21 -0.64 1.65 -2.16 0.23 0.00 0.00 176.35 175.63 2oax s PRO 794 N -4.59 4.18 0.19 1.29 0.04 -1.26 -4.80 135.00 130.05 2oax s PRO 794 Ca 0.47 2.47 -0.21 0.00 0.04 0.00 0.00 61.00 63.77 2oax s PRO 794 Cb -0.10 -3.17 0.13 0.00 0.04 0.00 0.00 34.50 31.39 2oax s PRO 794 CO 0.39 -0.68 1.45 -0.11 0.04 0.00 0.00 177.00 178.09 2oax n LEU 795 N 4.17 -0.74 -0.34 -3.56 7.94 -1.26 0.15 117.00 123.36 2oax n LEU 795 Ca 0.15 1.65 0.19 0.00 -1.11 0.00 0.00 56.01 56.88 2oax n LEU 795 Cb 0.37 -0.32 0.42 0.00 0.53 0.00 0.00 43.42 44.42 2oax n LEU 795 CO 0.63 -1.43 1.19 -0.33 -1.11 0.00 0.00 177.39 176.33 2oax h GLU 796 N 0.00 0.53 -0.19 1.96 3.07 -2.00 0.55 114.58 118.50 2oax h GLU 796 Ca 0.27 -0.03 -0.17 0.00 -0.50 0.00 0.00 59.36 58.92 2oax h GLU 796 Cb 0.50 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 2oax h GLU 796 CO -0.91 0.35 -0.56 -0.44 -1.40 0.00 0.00 179.01 176.05 2oax h ASP 797 N 0.54 0.82 -0.37 1.42 3.32 -0.66 -2.13 116.42 119.37 2oax h ASP 797 Ca 0.62 -0.58 0.07 0.00 0.02 0.00 0.00 57.03 57.15 2oax h ASP 797 Cb 1.27 -0.24 -0.07 0.00 0.22 0.00 0.00 39.33 40.51 2oax h ASP 797 CO -0.40 1.26 -0.09 1.56 -1.72 0.00 0.00 179.24 179.85 2oax h GLN 798 N 0.42 -0.00 -0.61 3.56 4.20 -0.33 0.16 115.11 122.52 2oax h GLN 798 Ca -0.02 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 2oax h GLN 798 Cb 1.18 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.93 2oax h GLN 798 CO 0.12 -0.00 0.24 0.82 -0.67 0.00 0.00 178.83 179.34 2oax h ILE 799 N -0.00 1.23 -0.39 2.54 5.03 -1.36 -1.67 117.51 122.89 2oax h ILE 799 Ca 0.18 -0.71 -0.01 0.00 -0.12 0.00 0.00 64.86 64.19 2oax h ILE 799 Cb 0.27 0.57 -0.02 0.00 -3.03 0.00 0.00 36.82 34.61 2oax h ILE 799 CO -0.38 0.28 0.20 0.74 -0.68 0.00 0.00 178.15 178.30 2oax h THR 800 N 0.84 1.16 -0.37 -0.27 2.02 -0.64 -0.23 112.91 115.42 2oax h THR 800 Ca 0.20 -0.45 -0.04 0.00 0.77 0.00 0.00 66.41 66.89 2oax h THR 800 Cb 0.20 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 2oax h THR 800 CO -0.02 0.17 0.07 -0.07 0.37 0.00 0.00 175.52 176.05 2oax h LEU 801 N 0.49 0.51 -0.31 2.58 3.38 -0.50 -0.66 115.31 120.80 2oax h LEU 801 Ca 0.13 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2oax h LEU 801 Cb 0.10 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2oax h LEU 801 CO -0.02 0.53 -0.26 0.40 0.09 0.00 0.00 178.44 179.17 2oax h ILE 802 N 0.54 1.30 -0.03 1.22 2.04 -0.97 -2.65 117.51 118.96 2oax h ILE 802 Ca 0.12 -1.42 -0.00 0.00 1.00 0.00 0.00 64.86 64.56 2oax h ILE 802 Cb 0.23 1.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.82 2oax h ILE 802 CO -0.00 0.46 0.01 1.56 0.00 0.00 0.00 178.15 180.18 2oax h GLN 803 N 0.49 0.05 -0.38 2.37 4.20 -0.51 -1.92 115.11 119.41 2oax h GLN 803 Ca 0.06 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.70 2oax h GLN 803 Cb 0.83 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.58 2oax h GLN 803 CO 0.07 0.22 -0.01 1.88 -0.67 0.00 0.00 178.83 180.32 2oax h TYR 804 N -0.14 0.63 -0.11 2.96 0.99 -1.19 -3.22 116.97 116.90 2oax h TYR 804 Ca 0.01 -0.07 0.00 0.00 2.00 0.00 0.00 58.73 60.67 2oax h TYR 804 Cb 0.19 -0.18 0.00 0.00 1.00 0.00 0.00 36.73 37.74 2oax h TYR 804 CO -0.01 0.61 0.00 -1.13 -0.00 0.00 0.00 178.16 177.63 2oax n SER 805 N -4.25 2.33 -0.32 3.88 3.41 -1.00 -4.60 113.62 113.07 2oax n SER 805 Ca 0.02 -1.78 0.19 0.00 -0.26 0.00 0.00 58.87 57.04 2oax n SER 805 Cb 0.27 -0.06 0.39 0.00 -0.26 0.00 0.00 64.21 64.55 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 3.44 0.66 -0.01 7.33 5.08 -1.35 0.29 115.95 131.39 2oax h TRP 806 Ca 0.00 0.04 -0.10 0.00 1.08 0.00 0.00 58.89 59.92 2oax h TRP 806 Cb 0.74 -0.14 -0.01 0.00 -3.00 0.00 0.00 29.16 26.75 2oax h TRP 806 CO 0.06 -0.20 -0.45 1.98 -1.28 0.00 0.00 178.44 178.55 2oax h MET 807 N 0.27 0.01 0.08 0.12 4.05 -1.87 -1.33 114.93 116.27 2oax h MET 807 Ca 0.66 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 60.06 2oax h MET 807 Cb 1.43 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.23 2oax h MET 807 CO -0.64 0.46 -0.04 0.00 0.23 0.00 0.00 176.91 176.93 2oax h LEU 809 N -0.68 -0.54 -1.32 0.00 3.38 -1.30 0.29 115.31 115.14 2oax h LEU 809 Ca -0.01 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2oax h LEU 809 Cb 0.55 0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.42 2oax h LEU 809 CO 0.02 -0.35 0.29 -0.07 0.09 0.00 0.00 178.44 178.42 2oax h LEU 810 N -0.56 0.68 -0.07 1.67 3.38 -1.35 -1.76 115.31 117.29 2oax h LEU 810 Ca -0.04 -0.05 -0.25 0.00 0.09 0.00 0.00 57.88 57.63 2oax h LEU 810 Cb 0.46 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.05 2oax h LEU 810 CO 0.05 0.55 -1.03 0.77 0.09 0.00 0.00 178.44 178.88 2oax h SER 811 N 0.77 0.67 0.18 -0.43 4.64 -1.26 -2.32 113.55 115.79 2oax h SER 811 Ca 0.20 -0.56 -0.12 0.00 -0.47 0.00 0.00 61.79 60.84 2oax h SER 811 Cb 0.03 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 2oax h SER 811 CO -0.03 1.36 -0.45 0.15 -0.87 0.00 0.00 176.83 176.99 2oax h PHE 812 N 0.27 0.40 -0.18 4.77 3.57 -0.77 -2.80 116.94 122.20 2oax h PHE 812 Ca -0.11 -0.12 -0.14 0.00 3.53 0.00 0.00 57.97 61.13 2oax h PHE 812 Cb 1.68 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 40.32 2oax h PHE 812 CO 0.08 0.73 -0.48 0.00 -2.23 0.00 0.00 178.31 176.41 2oax h ALA 813 N 1.25 0.82 -0.77 2.41 0.00 -1.31 -2.12 119.26 119.55 2oax h ALA 813 Ca 0.02 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 2oax h ALA 813 Cb 0.90 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 2oax h ALA 813 CO 0.07 0.66 0.32 1.25 0.00 0.00 0.00 179.25 181.56 2oax h LEU 814 N 0.39 1.04 -0.54 0.00 5.85 -1.26 -1.65 115.31 119.14 2oax h LEU 814 Ca 0.02 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 2oax h LEU 814 Cb 0.99 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 2oax h LEU 814 CO 0.09 0.91 -0.02 0.28 -0.34 0.00 0.00 178.44 179.36 2oax h SER 815 N 1.11 0.94 -0.28 1.25 0.02 -1.24 -1.85 113.55 113.51 2oax h SER 815 Ca 0.26 -0.31 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 2oax h SER 815 Cb 0.19 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 2oax h SER 815 CO -0.02 1.03 0.13 -0.25 -1.14 0.00 0.00 176.83 176.57 2oax h TRP 816 N 0.84 0.41 -0.42 3.45 2.91 -1.05 -1.66 115.95 120.41 2oax h TRP 816 Ca 0.15 -0.02 -0.07 0.00 1.13 0.00 0.00 58.89 60.08 2oax h TRP 816 Cb 0.56 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 29.06 2oax h TRP 816 CO 0.04 0.38 -0.03 0.00 -1.03 0.00 0.00 178.44 177.81 2oax h ARG 817 N 0.31 0.70 -0.15 2.65 3.08 -1.28 -0.70 114.38 118.98 2oax h ARG 817 Ca 0.09 -0.18 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 2oax h ARG 817 Cb 0.14 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2oax h ARG 817 CO -0.01 0.73 -0.29 0.77 -1.07 0.00 0.00 179.97 180.10 2oax h SER 818 N 0.65 0.28 -0.05 7.04 0.02 -1.15 -1.05 113.55 119.29 2oax h SER 818 Ca 0.13 -0.09 -0.14 0.00 -0.84 0.00 0.00 61.79 60.84 2oax h SER 818 Cb 0.44 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 62.92 2oax h SER 818 CO 0.02 0.56 -0.52 0.22 -1.14 0.00 0.00 176.83 175.97 2oax h TYR 819 N 0.25 0.62 -0.06 3.45 3.20 -0.90 0.35 116.97 123.88 2oax h TYR 819 Ca 0.04 -0.30 -0.23 0.00 3.14 0.00 0.00 58.73 61.37 2oax h TYR 819 Cb 0.64 -0.09 0.01 0.00 1.54 0.00 0.00 36.73 38.83 2oax h TYR 819 CO 0.01 1.10 -0.89 0.87 -1.64 0.00 0.00 178.16 177.61 2oax h LYS 820 N -0.02 0.64 0.03 1.82 1.79 -1.02 -2.58 116.57 117.22 2oax h LYS 820 Ca -0.05 -0.60 -0.31 0.00 -2.18 0.00 0.00 60.65 57.51 2oax h LYS 820 Cb 1.20 0.15 -0.04 0.00 -1.58 0.00 0.00 32.23 31.96 2oax h LYS 820 CO 0.11 1.21 -1.81 0.72 -1.08 0.00 0.00 179.45 178.60 2oax n HIS 821 N -3.86 1.00 -0.37 -1.35 8.25 -0.41 -4.57 115.22 113.91 2oax n HIS 821 Ca -0.08 0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.70 2oax n HIS 821 Cb 0.80 -1.17 0.00 0.00 1.12 0.00 0.00 29.99 30.74 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 -3.12 0.45 -3.17 1.59 -2.24 -1.06 -5.00 114.28 101.72 2oax n THR 822 Ca -0.21 -0.54 -0.20 0.00 -2.27 0.00 0.00 64.05 60.83 2oax n THR 822 Cb 1.06 0.88 0.05 0.00 -2.10 0.00 0.00 70.33 70.22 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 -0.22 -5.71 -2.61 3.42 5.15 -0.97 -2.71 115.26 111.61 2oax n ASN 823 Ca 0.00 -0.35 -0.20 0.00 -0.60 0.00 0.00 54.58 53.43 2oax n ASN 823 Cb 0.27 -4.44 0.02 0.00 -0.53 0.00 0.00 39.78 35.10 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 -2.20 -5.62 -0.06 1.20 7.64 0.12 -4.89 113.62 109.81 2oax n SER 824 Ca -0.05 -0.21 -0.22 0.00 1.01 0.00 0.00 58.87 59.40 2oax n SER 824 Cb 0.58 -4.49 -0.13 0.00 -1.01 0.00 0.00 64.21 59.16 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 -3.52 0.68 -4.73 1.43 7.27 -1.10 -4.69 117.38 112.71 2oax n GLN 825 Ca -0.12 0.31 -0.32 0.00 0.07 0.00 0.00 57.00 56.93 2oax n GLN 825 Cb 0.62 -1.65 -0.08 0.00 2.41 0.00 0.00 30.24 31.53 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 -2.50 1.97 -0.44 3.69 0.08 -1.26 -5.03 117.98 114.48 2oax s PHE 826 Ca -0.28 -0.91 -0.13 0.00 0.12 0.00 0.00 56.93 55.73 2oax s PHE 826 Cb 0.08 -1.64 0.07 0.00 -0.57 0.00 0.00 43.02 40.96 2oax s PHE 826 CO 0.66 0.26 0.33 -0.51 -0.10 0.00 0.00 175.22 175.86 2oax s LEU 827 N -3.85 5.37 -1.05 -0.37 1.02 -1.20 -4.72 118.68 113.88 2oax s LEU 827 Ca 0.11 -1.37 -0.16 0.00 0.02 0.00 0.00 54.13 52.73 2oax s LEU 827 Cb 0.03 -2.10 0.16 0.00 0.02 0.00 0.00 46.19 44.30 2oax s LEU 827 CO 0.05 -0.58 1.23 -0.47 0.02 0.00 0.00 176.35 176.60 2oax s TYR 828 N 1.55 3.37 0.09 0.29 6.14 -1.26 -1.01 117.35 126.52 2oax s TYR 828 Ca 0.04 -1.80 -0.15 0.00 0.64 0.00 0.00 57.07 55.80 2oax s TYR 828 Cb -0.23 -4.24 -0.10 0.00 0.42 0.00 0.00 41.96 37.81 2oax s TYR 828 CO 0.05 -1.39 1.40 0.74 0.64 0.00 0.00 175.55 176.99 2oax h PHE 829 N 7.97 0.84 -2.51 4.97 -1.00 -1.79 -3.40 116.94 122.03 2oax h PHE 829 Ca 0.22 -0.27 0.08 0.00 2.81 0.00 0.00 57.97 60.82 2oax h PHE 829 Cb 0.96 -0.17 -0.13 0.00 3.61 0.00 0.00 35.95 40.22 2oax h PHE 829 CO 1.11 1.02 0.41 0.00 -1.61 0.00 0.00 178.31 179.24 2oax s ALA 830 N -4.27 -1.71 0.40 2.45 0.00 0.09 -4.96 121.76 113.76 2oax s ALA 830 Ca -0.12 0.68 0.20 0.00 0.00 0.00 0.00 51.96 52.72 2oax s ALA 830 Cb 0.08 0.59 1.16 0.00 0.00 0.00 0.00 23.12 24.95 2oax s ALA 830 CO 0.83 -0.78 1.75 -1.35 0.00 0.00 0.00 175.76 176.21 2oax h PRO 831 N 2.00 0.33 -0.03 0.00 0.11 -1.93 0.26 132.00 132.74 2oax h PRO 831 Ca -0.25 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2oax h PRO 831 Cb 1.26 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2oax h PRO 831 CO 0.31 0.22 0.00 -0.40 -0.21 0.00 0.00 178.00 177.92 2oax n ASP 832 N -4.64 2.91 -3.72 -2.05 3.85 -1.26 -4.83 116.55 106.81 2oax n ASP 832 Ca 0.27 -1.95 -0.28 0.00 -0.71 0.00 0.00 54.79 52.12 2oax n ASP 832 Cb 0.97 -0.00 -0.16 0.00 -1.35 0.00 0.00 41.12 40.57 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 -1.90 1.21 -0.12 -2.12 2.96 0.08 -4.63 118.68 114.16 2oax s LEU 833 Ca 0.27 -0.89 -0.02 0.00 -0.22 0.00 0.00 54.13 53.27 2oax s LEU 833 Cb 0.19 -0.60 0.04 0.00 0.50 0.00 0.00 46.19 46.33 2oax s LEU 833 CO 0.29 -0.32 0.02 -0.69 -1.32 0.00 0.00 176.35 174.33 2oax s VAL 834 N 1.86 0.41 0.23 1.68 1.01 -1.26 -0.73 120.40 123.59 2oax s VAL 834 Ca 0.00 -0.15 -0.30 0.00 0.00 0.00 0.00 61.98 61.54 2oax s VAL 834 Cb -0.17 -0.72 -0.09 0.00 0.00 0.00 0.00 36.38 35.40 2oax s VAL 834 CO -0.10 0.06 1.10 -0.36 0.00 0.00 0.00 175.10 175.79 2oax s PHE 835 N 1.94 3.60 0.00 5.22 0.40 -0.18 -4.92 117.98 124.04 2oax s PHE 835 Ca 0.03 1.65 0.00 0.00 -0.60 0.00 0.00 56.93 58.01 2oax s PHE 835 Cb -0.14 -3.27 0.00 0.00 0.51 0.00 0.00 43.02 40.12 2oax s PHE 835 CO -0.06 -0.55 0.00 0.09 0.70 0.00 0.00 175.22 175.40 2oax n ASN 836 N 1.79 0.00 0.10 1.36 3.02 -1.26 -3.27 115.26 117.00 2oax n ASN 836 Ca 0.01 -0.84 0.02 0.00 -0.03 0.00 0.00 54.58 53.74 2oax n ASN 836 Cb 0.45 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.61 2oax n ASN 836 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2oax h GLU 837 N 0.00 0.00 0.13 3.52 4.39 -1.96 -2.51 114.58 118.14 2oax h GLU 837 Ca 0.00 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.40 2oax h GLU 837 Cb 0.00 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 28.68 2oax h GLU 837 CO 0.00 0.38 -1.26 0.93 -1.16 0.00 0.00 179.01 177.90 2oax h GLU 838 N 0.00 0.58 -0.34 2.33 5.08 -1.98 -1.09 114.58 119.16 2oax h GLU 838 Ca -0.06 -0.80 -0.07 0.00 -1.00 0.00 0.00 59.36 57.43 2oax h GLU 838 Cb 1.42 0.27 -0.02 0.00 0.50 0.00 0.00 28.75 30.92 2oax h GLU 838 CO 0.05 1.36 -0.06 0.87 -1.00 0.00 0.00 179.01 180.23 2oax h LYS 839 N 0.25 0.56 -0.42 2.33 1.79 -1.90 0.14 116.57 119.33 2oax h LYS 839 Ca -0.19 -0.15 -0.07 0.00 -2.18 0.00 0.00 60.65 58.06 2oax h LYS 839 Cb 1.93 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 32.50 2oax h LYS 839 CO 0.24 0.64 -0.03 0.52 -1.08 0.00 0.00 179.45 179.73 2oax h MET 840 N 0.53 0.76 -0.10 3.15 2.86 -1.39 -2.39 114.93 118.35 2oax h MET 840 Ca 0.10 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 2oax h MET 840 Cb 0.44 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.03 2oax h MET 840 CO 0.02 0.85 0.02 0.45 1.06 0.00 0.00 176.91 179.32 2oax h HIS 841 N 0.59 0.17 0.00 -0.22 3.86 -0.55 -2.94 115.15 116.06 2oax h HIS 841 Ca 0.11 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2oax h HIS 841 Cb 0.53 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.95 2oax h HIS 841 CO 0.04 0.35 0.00 0.00 0.86 0.00 0.00 177.93 179.18 2oax n GLN 842 N -4.86 0.81 0.00 2.45 10.64 -0.02 -3.07 117.38 123.33 2oax n GLN 842 Ca -0.06 0.00 0.13 0.00 -1.83 0.00 0.00 57.00 55.24 2oax n GLN 842 Cb 0.16 -1.46 0.46 0.00 -0.86 0.00 0.00 30.24 28.54 2oax n GLN 842 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 2oax n SER 843 N -0.96 0.64 -0.78 2.61 3.41 -0.90 -3.74 113.62 113.90 2oax n SER 843 Ca 0.18 -0.55 -0.10 0.00 -0.26 0.00 0.00 58.87 58.14 2oax n SER 843 Cb 0.08 0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 64.02 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 -0.98 -0.15 -2.55 7.33 0.00 -1.18 -4.79 120.51 118.18 2oax n ALA 844 Ca 0.11 0.16 0.01 0.00 0.00 0.00 0.00 53.44 53.73 2oax n ALA 844 Cb 0.32 -1.48 0.04 0.00 0.00 0.00 0.00 19.45 18.33 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 -1.65 1.02 0.01 0.00 0.00 -1.26 -4.97 117.12 110.27 2oax n MET 845 Ca -0.10 -2.83 -0.06 0.00 0.00 0.00 0.00 57.70 54.71 2oax n MET 845 Cb 0.47 -0.90 -0.04 0.00 0.00 0.00 0.00 33.22 32.75 2oax n MET 845 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 175.97 175.05 2oax h TYR 846 N 1.73 -0.63 -0.79 1.12 5.03 -1.79 -1.03 116.97 120.61 2oax h TYR 846 Ca -0.14 0.02 0.12 0.00 2.58 0.00 0.00 58.73 61.31 2oax h TYR 846 Cb 1.56 0.28 -0.08 0.00 1.55 0.00 0.00 36.73 40.04 2oax h TYR 846 CO 0.39 -0.22 0.40 0.93 -1.32 0.00 0.00 178.16 178.34 2oax h GLU 847 N -0.25 0.61 -0.45 1.82 4.39 -1.93 0.15 114.58 118.93 2oax h GLU 847 Ca 0.01 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 2oax h GLU 847 Cb 0.28 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2oax h GLU 847 CO -0.16 0.41 0.14 -0.07 -1.16 0.00 0.00 179.01 178.17 2oax h LEU 848 N 0.63 0.60 -0.05 1.33 3.38 -1.92 0.27 115.31 119.56 2oax h LEU 848 Ca 0.41 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.29 2oax h LEU 848 Cb 0.50 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2oax h LEU 848 CO -0.31 0.58 -0.01 0.00 0.09 0.00 0.00 178.44 178.79 2oax h GLN 850 N -0.26 0.00 -0.16 0.00 5.75 -0.24 0.34 115.11 120.54 2oax h GLN 850 Ca 0.01 0.00 -0.18 0.00 -0.15 0.00 0.00 58.65 58.33 2oax h GLN 850 Cb 0.39 0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.95 2oax h GLN 850 CO 0.00 0.01 -0.61 0.78 -2.65 0.00 0.00 178.83 176.37 2oax h GLY 851 N 0.29 0.77 1.11 2.39 0.00 0.07 -1.81 103.07 105.88 2oax h GLY 851 Ca -0.00 -1.03 -0.17 0.00 0.00 0.00 0.00 47.33 46.13 2oax h GLY 851 CO 0.00 0.92 -0.44 1.98 0.00 0.00 0.00 176.54 179.00 2oax h MET 852 N 0.39 0.87 -1.01 4.80 1.85 -0.61 -2.70 114.93 118.53 2oax h MET 852 Ca -0.03 -0.50 0.05 0.00 -0.61 0.00 0.00 59.70 58.61 2oax h MET 852 Cb 1.24 0.04 -0.06 0.00 0.43 0.00 0.00 31.60 33.24 2oax h MET 852 CO 0.13 1.15 0.66 1.25 -0.40 0.00 0.00 176.91 179.69 2oax h HIS 853 N 0.66 1.22 -0.26 1.39 6.17 -0.97 0.90 115.15 124.26 2oax h HIS 853 Ca 0.04 0.03 -0.09 0.00 0.71 0.00 0.00 60.37 61.06 2oax h HIS 853 Cb 1.04 -0.40 -0.01 0.00 2.52 0.00 0.00 27.41 30.56 2oax h HIS 853 CO 0.07 0.66 -0.22 1.96 0.71 0.00 0.00 177.93 181.12 2oax h GLN 854 N 1.23 0.49 -0.54 5.26 1.08 -1.23 -1.47 115.11 119.92 2oax h GLN 854 Ca 0.42 -0.17 -0.07 0.00 -1.45 0.00 0.00 58.65 57.38 2oax h GLN 854 Cb 0.09 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.47 2oax h GLN 854 CO -0.15 0.68 0.07 0.82 -0.95 0.00 0.00 178.83 179.30 2oax h ILE 855 N 0.44 1.26 0.00 2.54 1.08 -0.59 -2.57 117.51 119.66 2oax h ILE 855 Ca 0.07 -0.99 -0.04 0.00 -0.39 0.00 0.00 64.86 63.51 2oax h ILE 855 Cb 0.62 0.85 -0.01 0.00 -3.07 0.00 0.00 36.82 35.21 2oax h ILE 855 CO 0.04 0.36 -0.19 0.77 -0.69 0.00 0.00 178.15 178.44 2oax h SER 856 N 0.79 0.00 -0.37 1.72 4.64 -0.49 -2.61 113.55 117.22 2oax h SER 856 Ca 0.16 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.44 2oax h SER 856 Cb 0.43 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 2oax h SER 856 CO 0.01 0.19 0.05 -0.07 -0.87 0.00 0.00 176.83 176.15 2oax h LEU 857 N 0.00 0.60 -1.71 5.97 3.38 -0.88 -2.65 115.31 120.02 2oax h LEU 857 Ca -0.00 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.74 2oax h LEU 857 Cb 0.48 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2oax h LEU 857 CO 0.02 0.71 0.25 1.56 0.09 0.00 0.00 178.44 181.08 2oax h GLN 858 N 0.46 0.37 -0.90 1.13 4.20 -1.25 -0.07 115.11 119.05 2oax h GLN 858 Ca 0.11 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.85 2oax h GLN 858 Cb 0.37 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 28.01 2oax h GLN 858 CO 0.01 0.25 0.58 0.74 -0.67 0.00 0.00 178.83 179.73 2oax h PHE 859 N 0.38 1.08 0.38 2.96 -1.00 -1.36 -0.44 116.94 118.94 2oax h PHE 859 Ca 0.16 0.03 -0.02 0.00 2.81 0.00 0.00 57.97 60.95 2oax h PHE 859 Cb 0.15 -0.35 0.00 0.00 3.61 0.00 0.00 35.95 39.36 2oax h PHE 859 CO -0.00 0.58 -0.18 0.28 -1.61 0.00 0.00 178.31 177.38 2oax h VAL 860 N 1.08 0.47 -0.09 -0.55 2.07 -0.97 0.13 116.25 118.39 2oax h VAL 860 Ca 0.38 -0.62 0.03 0.00 0.82 0.00 0.00 66.70 67.31 2oax h VAL 860 Cb 0.09 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2oax h VAL 860 CO -0.15 0.09 0.09 0.03 0.02 0.00 0.00 177.57 177.66 2oax h ARG 861 N -0.93 0.00 0.00 1.57 3.08 -1.19 -0.82 114.38 116.08 2oax h ARG 861 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2oax h ARG 861 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2oax h ARG 861 CO 0.09 0.00 -1.19 1.28 -1.07 0.00 0.00 179.97 179.07 2oax n LEU 862 N -3.96 0.70 -3.49 3.04 4.32 -0.18 -4.99 117.00 112.43 2oax n LEU 862 Ca -0.01 -0.30 -0.19 0.00 -0.02 0.00 0.00 56.01 55.50 2oax n LEU 862 Cb 0.20 -0.03 0.07 0.00 -1.62 0.00 0.00 43.42 42.04 2oax n LEU 862 CO 0.29 0.16 0.03 1.67 -1.22 0.00 0.00 177.39 178.32 2oax n GLN 863 N -1.73 -5.09 -1.70 3.23 -0.06 0.33 -4.88 117.38 107.48 2oax n GLN 863 Ca 0.02 0.76 -0.43 0.00 -2.00 0.00 0.00 57.00 55.35 2oax n GLN 863 Cb 0.40 -5.56 -0.02 0.00 -4.06 0.00 0.00 30.24 20.99 2oax n GLN 863 CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 2oax n LEU 864 N -4.02 3.67 -4.95 1.69 7.94 -0.44 -4.99 117.00 115.90 2oax n LEU 864 Ca -0.25 1.15 -0.25 0.00 -1.11 0.00 0.00 56.01 55.55 2oax n LEU 864 Cb 0.66 -1.50 -0.03 0.00 0.53 0.00 0.00 43.42 43.08 2oax n LEU 864 CO 0.63 -0.21 -0.08 0.42 -1.11 0.00 0.00 177.39 177.04 2oax s THR 865 N -0.09 5.31 0.47 1.96 -4.23 -1.26 -4.97 115.64 112.82 2oax s THR 865 Ca 0.66 -0.75 0.17 0.00 -1.18 0.00 0.00 61.69 60.58 2oax s THR 865 Cb -0.58 -3.77 0.34 0.00 1.34 0.00 0.00 72.50 69.83 2oax s THR 865 CO 0.50 -0.14 2.00 0.15 -0.54 0.00 0.00 174.62 176.59 2oax h PHE 866 N 1.93 0.28 0.00 3.99 3.57 -1.98 0.37 116.94 125.10 2oax h PHE 866 Ca -0.49 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 60.97 2oax h PHE 866 Cb 1.20 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.84 2oax h PHE 866 CO 0.51 0.14 -0.25 1.05 -2.23 0.00 0.00 178.31 177.54 2oax h GLU 867 N 0.27 0.00 0.22 1.11 4.11 -1.97 -0.22 114.58 118.10 2oax h GLU 867 Ca 0.24 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 59.32 2oax h GLU 867 Cb 0.58 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.85 2oax h GLU 867 CO -0.05 0.21 -1.61 0.93 0.07 0.00 0.00 179.01 178.55 2oax h GLU 868 N 0.00 0.47 -0.42 1.06 5.08 -1.62 -3.08 114.58 116.08 2oax h GLU 868 Ca -0.00 -0.81 0.00 0.00 -1.00 0.00 0.00 59.36 57.55 2oax h GLU 868 Cb 1.16 0.30 -0.02 0.00 0.50 0.00 0.00 28.75 30.69 2oax h GLU 868 CO 0.03 1.39 0.26 -0.92 -1.00 0.00 0.00 179.01 178.77 2oax h TYR 869 N 0.12 0.54 -0.94 4.33 3.20 -0.98 0.76 116.97 124.01 2oax h TYR 869 Ca -0.30 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.57 2oax h TYR 869 Cb 2.14 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 40.18 2oax h TYR 869 CO 0.12 0.37 0.57 0.00 -1.64 0.00 0.00 178.16 177.57 2oax h THR 870 N 0.56 1.26 -0.02 1.81 1.03 -1.12 -0.91 112.91 115.52 2oax h THR 870 Ca 0.15 -0.57 -0.26 0.00 -0.01 0.00 0.00 66.41 65.72 2oax h THR 870 Cb -0.03 -0.07 0.02 0.00 -1.07 0.00 0.00 68.15 67.00 2oax h THR 870 CO -0.03 0.27 -1.00 0.40 -0.01 0.00 0.00 175.52 175.15 2oax h ILE 871 N 1.30 1.29 0.00 0.00 1.08 -1.41 -3.17 117.51 116.60 2oax h ILE 871 Ca 0.34 -2.23 -0.05 0.00 -0.39 0.00 0.00 64.86 62.53 2oax h ILE 871 Cb -0.05 2.33 -0.01 0.00 -3.07 0.00 0.00 36.82 36.02 2oax h ILE 871 CO -0.06 0.69 -0.22 0.24 -0.69 0.00 0.00 178.15 178.10 2oax h MET 872 N 0.40 0.00 -0.32 2.37 2.86 -0.66 -2.38 114.93 117.20 2oax h MET 872 Ca -0.12 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.46 2oax h MET 872 Cb 1.65 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.30 2oax h MET 872 CO 0.20 0.22 -0.05 -0.22 1.06 0.00 0.00 176.91 178.12 2oax h LYS 873 N 0.00 0.61 -0.32 1.72 3.64 -1.17 -2.41 116.57 118.64 2oax h LYS 873 Ca -0.00 -0.22 -0.04 0.00 -1.27 0.00 0.00 60.65 59.12 2oax h LYS 873 Cb 0.42 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 2oax h LYS 873 CO 0.03 0.77 0.03 0.28 -2.27 0.00 0.00 179.45 178.29 2oax h VAL 874 N 0.39 1.17 -0.21 2.00 2.07 -1.43 -1.85 116.25 118.40 2oax h VAL 874 Ca 0.09 -0.65 -0.06 0.00 0.82 0.00 0.00 66.70 66.89 2oax h VAL 874 Cb 0.53 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2oax h VAL 874 CO 0.03 0.23 -0.14 -0.07 0.02 0.00 0.00 177.57 177.63 2oax h LEU 875 N 0.46 0.33 -0.60 2.57 3.38 -1.21 -1.59 115.31 118.65 2oax h LEU 875 Ca 0.10 -0.08 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 2oax h LEU 875 Cb 0.25 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2oax h LEU 875 CO 0.00 0.50 -0.60 -0.07 0.09 0.00 0.00 178.44 178.36 2oax h LEU 876 N 0.32 0.00 -1.26 1.67 3.38 -0.86 -1.88 115.31 116.69 2oax h LEU 876 Ca 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2oax h LEU 876 Cb 0.45 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2oax h LEU 876 CO 0.03 0.60 -0.02 0.25 0.09 0.00 0.00 178.44 179.39 2oax h LEU 877 N 0.00 0.00 -3.37 1.67 5.85 -0.73 -2.90 115.31 115.82 2oax h LEU 877 Ca -0.01 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.61 2oax h LEU 877 Cb 1.19 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.16 2oax h LEU 877 CO 0.08 0.02 0.03 0.18 -0.34 0.00 0.00 178.44 178.41 2oax n LEU 878 N -3.12 4.31 -0.08 2.25 4.77 -0.76 -4.60 117.00 119.76 2oax n LEU 878 Ca 0.01 -3.32 -0.17 0.00 -0.03 0.00 0.00 56.01 52.50 2oax n LEU 878 Cb 0.34 -0.61 -0.13 0.00 -2.33 0.00 0.00 43.42 40.69 2oax n LEU 878 CO 0.28 0.90 -1.13 -1.20 -1.33 0.00 0.00 177.39 174.92 2oax n SER 879 N -0.71 1.67 -4.22 -1.43 7.64 -0.85 -4.93 113.62 110.79 2oax n SER 879 Ca 0.29 0.01 -0.35 0.00 1.01 0.00 0.00 58.87 59.83 2oax n SER 879 Cb 1.02 -0.31 -0.14 0.00 -1.01 0.00 0.00 64.21 63.77 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 -2.53 2.94 0.44 0.44 2.01 -1.26 -1.55 115.64 116.12 2oax s THR 880 Ca -0.26 -0.87 0.06 0.00 0.31 0.00 0.00 61.69 60.93 2oax s THR 880 Cb 0.08 -2.43 -0.05 0.00 0.01 0.00 0.00 72.50 70.11 2oax s THR 880 CO 0.69 0.29 0.09 0.27 -0.69 0.00 0.00 174.62 175.27 2oax s ILE 881 N 1.37 1.94 1.05 1.82 -4.36 -1.23 -4.63 121.20 117.16 2oax s ILE 881 Ca 0.02 -1.87 -0.12 0.00 -0.26 0.00 0.00 60.65 58.42 2oax s ILE 881 Cb -0.16 -2.81 0.22 0.00 1.25 0.00 0.00 42.46 40.96 2oax s ILE 881 CO -0.05 0.00 1.07 -2.84 0.24 0.00 0.00 174.94 173.36 2oax s PRO 882 N -3.84 -0.00 0.07 0.37 0.02 -1.26 -4.36 135.00 125.99 2oax s PRO 882 Ca 0.32 0.79 -0.36 0.00 0.02 0.00 0.00 61.00 61.77 2oax s PRO 882 Cb 0.06 -1.66 -0.19 0.00 0.02 0.00 0.00 34.50 32.72 2oax s PRO 882 CO 0.17 -3.10 1.55 -0.22 -0.33 0.00 0.00 177.00 175.08 2oax h LYS 883 N -2.17 -1.16 0.00 5.54 3.64 -1.82 -3.38 116.57 117.23 2oax h LYS 883 Ca -0.56 0.08 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2oax h LYS 883 Cb 1.32 0.26 0.00 0.00 -0.41 0.00 0.00 32.23 33.40 2oax h LYS 883 CO 0.53 -0.77 -0.03 -0.44 -2.27 0.00 0.00 179.45 176.46 2oax h ASP 884 N -1.20 0.00 0.00 4.20 5.19 -1.93 -3.50 116.42 119.18 2oax h ASP 884 Ca -0.11 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.30 2oax h ASP 884 Cb 0.96 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.47 2oax h ASP 884 CO 0.11 0.32 0.00 0.61 -3.12 0.00 0.00 179.24 177.17 2oax n GLY 885 N 1.84 -0.99 4.00 2.75 0.00 -1.26 -5.14 105.19 106.39 2oax n GLY 885 Ca -0.00 -1.03 -0.17 0.00 0.00 0.00 0.00 46.02 44.81 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 0.00 3.65 0.49 0.99 1.43 -1.26 -4.75 118.68 119.23 2oax s LEU 886 Ca 0.00 -0.44 0.21 0.00 -1.03 0.00 0.00 54.13 52.86 2oax s LEU 886 Cb 0.00 -2.61 1.24 0.00 0.03 0.00 0.00 46.19 44.85 2oax s LEU 886 CO 0.00 -0.74 1.98 0.50 0.23 0.00 0.00 176.35 178.32 2oax h LYS 887 N 0.69 0.17 -2.30 1.70 3.64 -1.98 -3.17 116.57 115.33 2oax h LYS 887 Ca -0.40 -0.01 -0.58 0.00 -1.27 0.00 0.00 60.65 58.38 2oax h LYS 887 Cb 1.28 -0.04 -0.39 0.00 -0.41 0.00 0.00 32.23 32.67 2oax h LYS 887 CO 0.46 0.11 -0.99 0.45 -2.27 0.00 0.00 179.45 177.22 2oax n SER 888 N -4.43 -0.09 -0.12 4.20 2.88 -1.26 -4.98 113.62 109.83 2oax n SER 888 Ca 0.10 -2.51 0.04 0.00 -1.33 0.00 0.00 58.87 55.17 2oax n SER 888 Cb 0.53 -0.58 0.35 0.00 -0.75 0.00 0.00 64.21 63.75 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 5.18 0.74 0.00 -1.46 5.75 -1.94 -1.77 115.11 121.60 2oax h GLN 889 Ca 0.21 -0.04 -0.10 0.00 -0.15 0.00 0.00 58.65 58.57 2oax h GLN 889 Cb 0.89 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 29.26 2oax h GLN 889 CO 0.42 0.49 -0.47 0.00 -2.65 0.00 0.00 178.83 176.62 2oax h ALA 890 N 1.63 1.05 -0.12 3.38 0.00 -1.93 -2.53 119.26 120.74 2oax h ALA 890 Ca 0.24 -0.43 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 2oax h ALA 890 Cb 0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2oax h ALA 890 CO -0.06 0.58 -0.54 0.00 0.00 0.00 0.00 179.25 179.24 2oax h ALA 891 N 1.53 0.85 -0.16 0.00 0.00 -1.75 -3.05 119.26 116.68 2oax h ALA 891 Ca -0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 2oax h ALA 891 Cb 0.93 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 2oax h ALA 891 CO 0.06 0.68 -0.11 0.35 0.00 0.00 0.00 179.25 180.23 2oax h PHE 892 N 0.28 0.42 0.26 0.00 3.57 -1.17 -2.88 116.94 117.41 2oax h PHE 892 Ca 0.01 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.38 2oax h PHE 892 Cb 1.03 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.68 2oax h PHE 892 CO 0.03 0.71 -0.13 0.93 -2.23 0.00 0.00 178.31 177.62 2oax h GLU 893 N 0.01 -0.34 -1.00 1.11 4.39 -1.49 -1.39 114.58 115.88 2oax h GLU 893 Ca 0.03 0.02 0.09 0.00 0.34 0.00 0.00 59.36 59.85 2oax h GLU 893 Cb 0.61 0.08 -0.08 0.00 -0.10 0.00 0.00 28.75 29.26 2oax h GLU 893 CO 0.03 -0.23 0.64 0.93 -1.16 0.00 0.00 179.01 179.22 2oax h GLU 894 N -0.35 1.04 0.90 2.33 4.39 -1.63 0.12 114.58 121.39 2oax h GLU 894 Ca -0.04 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.56 2oax h GLU 894 Cb 0.27 -0.24 0.01 0.00 -0.10 0.00 0.00 28.75 28.69 2oax h GLU 894 CO 0.06 0.69 -0.43 0.52 -1.16 0.00 0.00 179.01 178.68 2oax h MET 895 N 1.07 -1.17 -0.57 2.33 2.86 -1.26 -1.21 114.93 116.99 2oax h MET 895 Ca 0.46 0.08 0.08 0.00 -2.06 0.00 0.00 59.70 58.27 2oax h MET 895 Cb 0.34 0.27 -0.07 0.00 0.06 0.00 0.00 31.60 32.20 2oax h MET 895 CO -0.22 -0.78 0.21 -0.09 1.06 0.00 0.00 176.91 177.09 2oax h ARG 896 N -1.30 0.38 0.00 1.72 2.43 -1.00 0.10 114.38 116.72 2oax h ARG 896 Ca -0.12 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 2oax h ARG 896 Cb 0.93 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.39 2oax h ARG 896 CO 0.20 0.25 -0.07 1.15 -1.51 0.00 0.00 179.97 180.00 2oax h THR 897 N 0.39 0.69 -0.02 0.20 2.02 -0.74 -0.34 112.91 115.11 2oax h THR 897 Ca 0.28 -0.27 -0.26 0.00 0.77 0.00 0.00 66.41 66.93 2oax h THR 897 Cb 0.33 1.17 0.02 0.00 -1.74 0.00 0.00 68.15 67.92 2oax h THR 897 CO -0.28 0.07 -0.99 0.78 0.37 0.00 0.00 175.52 175.46 2oax h ASN 898 N 0.00 0.86 0.50 4.18 2.35 0.45 -2.45 115.58 121.47 2oax h ASN 898 Ca -0.00 -0.67 -0.14 0.00 -0.55 0.00 0.00 56.30 54.93 2oax h ASN 898 Cb 0.16 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 2oax h ASN 898 CO 0.01 1.47 -0.63 1.88 -1.65 0.00 0.00 177.43 178.51 2oax h TYR 899 N 0.39 0.16 -0.26 1.19 0.05 -0.58 -0.71 116.97 117.21 2oax h TYR 899 Ca -0.11 -0.06 -0.03 0.00 0.05 0.00 0.00 58.73 58.57 2oax h TYR 899 Cb 1.64 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 39.34 2oax h TYR 899 CO 0.09 0.72 0.03 0.82 -1.05 0.00 0.00 178.16 178.78 2oax h ILE 900 N 0.09 1.23 -0.14 -2.88 2.04 -1.10 -1.07 117.51 115.68 2oax h ILE 900 Ca -0.01 -0.80 -0.04 0.00 1.00 0.00 0.00 64.86 65.00 2oax h ILE 900 Cb 1.13 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 38.46 2oax h ILE 900 CO 0.09 0.26 -0.11 0.50 0.00 0.00 0.00 178.15 178.88 2oax h LYS 901 N 0.24 0.22 -0.39 2.37 1.63 -1.25 -1.00 116.57 118.39 2oax h LYS 901 Ca 0.08 -0.05 -0.04 0.00 -0.85 0.00 0.00 60.65 59.80 2oax h LYS 901 Cb 0.35 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.93 2oax h LYS 901 CO 0.01 0.34 0.10 1.49 -3.45 0.00 0.00 179.45 177.94 2oax h GLU 902 N 0.21 0.62 -0.35 1.90 4.57 -0.63 0.34 114.58 121.25 2oax h GLU 902 Ca 0.04 -0.15 -0.11 0.00 -1.18 0.00 0.00 59.36 57.97 2oax h GLU 902 Cb 0.34 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 2oax h GLU 902 CO 0.02 0.65 -0.23 1.25 -1.18 0.00 0.00 179.01 179.52 2oax h LEU 903 N 0.49 0.70 0.01 1.64 5.85 -0.68 -0.17 115.31 123.14 2oax h LEU 903 Ca 0.12 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 2oax h LEU 903 Cb 0.30 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.14 2oax h LEU 903 CO 0.00 0.91 -0.00 0.03 -0.34 0.00 0.00 178.44 179.04 2oax h ARG 904 N 0.61 -0.01 -0.63 1.25 3.08 -0.94 -2.01 114.38 115.72 2oax h ARG 904 Ca 0.09 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.19 2oax h ARG 904 Cb 0.71 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.71 2oax h ARG 904 CO 0.05 0.22 0.34 -0.22 -1.07 0.00 0.00 179.97 179.30 2oax h LYS 905 N -0.24 0.63 -0.92 0.04 3.64 -0.86 -1.38 116.57 117.48 2oax h LYS 905 Ca -0.00 -0.04 0.18 0.00 -1.27 0.00 0.00 60.65 59.53 2oax h LYS 905 Cb 0.24 -0.14 -0.11 0.00 -0.41 0.00 0.00 32.23 31.81 2oax h LYS 905 CO 0.00 0.41 0.49 1.98 -2.27 0.00 0.00 179.45 180.06 2oax h MET 906 N 0.64 0.59 0.00 1.90 4.05 -0.63 -3.33 114.93 118.16 2oax h MET 906 Ca 0.28 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.67 2oax h MET 906 Cb 0.17 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 2oax h MET 906 CO -0.18 0.39 -0.75 1.33 0.23 0.00 0.00 176.91 177.94 2oax n VAL 907 N -4.88 1.14 0.00 -5.77 0.24 -0.79 -4.90 118.33 103.35 2oax n VAL 907 Ca 0.21 0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.74 2oax n VAL 907 Cb 0.55 -2.15 0.00 0.00 -1.47 0.00 0.00 33.84 30.78 2oax n VAL 907 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2oax n THR 908 N -3.99 0.00 -3.41 3.34 -1.04 -0.57 -5.10 114.28 103.51 2oax n THR 908 Ca -0.10 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 61.72 2oax n THR 908 Cb 0.39 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.80 2oax n THR 908 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2oax s LYS 909 N 0.00 0.40 0.00 -2.82 3.01 -1.26 -5.03 119.74 114.04 2oax s LYS 909 Ca 0.00 -0.44 0.00 0.00 -1.01 0.00 0.00 55.97 54.52 2oax s LYS 909 Cb 0.00 -0.76 0.00 0.00 -1.01 0.00 0.00 37.83 36.06 2oax s LYS 909 CO 0.00 -1.08 0.00 0.94 0.51 0.00 0.00 175.35 175.72 2oax n GLN 919 N 4.95 0.00 0.22 1.68 7.27 -1.26 -5.17 117.38 125.08 2oax n GLN 919 Ca 0.02 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.20 2oax n GLN 919 Cb 0.45 -1.22 0.43 0.00 2.41 0.00 0.00 30.24 32.31 2oax n GLN 919 CO 0.00 0.00 0.00 -0.09 0.07 0.00 0.00 177.06 177.04 2oax h ARG 920 N 0.00 0.00 -0.06 3.69 2.43 -1.98 -1.44 114.38 117.02 2oax h ARG 920 Ca 0.00 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.04 2oax h ARG 920 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 2oax h ARG 920 CO 0.00 0.19 -0.53 0.35 -1.51 0.00 0.00 179.97 178.46 2oax h PHE 921 N 0.00 0.21 -0.06 2.20 3.57 -1.96 -1.16 116.94 119.73 2oax h PHE 921 Ca -0.00 -0.07 -0.17 0.00 3.53 0.00 0.00 57.97 61.26 2oax h PHE 921 Cb 0.80 -0.04 0.01 0.00 2.79 0.00 0.00 35.95 39.51 2oax h PHE 921 CO 0.00 0.67 -0.61 -0.92 -2.23 0.00 0.00 178.31 175.21 2oax h TYR 922 N 0.13 0.74 -0.31 0.41 3.20 -1.86 -1.39 116.97 117.88 2oax h TYR 922 Ca 0.00 -0.36 -0.09 0.00 3.14 0.00 0.00 58.73 61.43 2oax h TYR 922 Cb 0.99 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 2oax h TYR 922 CO 0.01 1.16 -0.17 1.96 -1.64 0.00 0.00 178.16 179.48 2oax h GLN 923 N 0.11 0.56 -0.09 1.82 4.20 -1.16 -0.02 115.11 120.54 2oax h GLN 923 Ca -0.06 -0.19 -0.14 0.00 0.06 0.00 0.00 58.65 58.33 2oax h GLN 923 Cb 1.28 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 29.02 2oax h GLN 923 CO 0.12 0.71 -0.48 -0.07 -0.67 0.00 0.00 178.83 178.45 2oax h LEU 924 N 0.51 0.57 -0.72 1.46 3.38 -1.22 -1.53 115.31 117.76 2oax h LEU 924 Ca 0.09 -0.65 -0.11 0.00 0.09 0.00 0.00 57.88 57.29 2oax h LEU 924 Cb 0.58 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 2oax h LEU 924 CO 0.04 1.13 -0.17 0.71 0.09 0.00 0.00 178.44 180.24 2oax h THR 925 N 0.05 1.27 -0.53 0.22 1.35 -1.21 -2.14 112.91 111.91 2oax h THR 925 Ca -0.04 -1.27 -0.03 0.00 -0.55 0.00 0.00 66.41 64.52 2oax h THR 925 Cb 1.13 1.12 -0.03 0.00 -1.73 0.00 0.00 68.15 68.65 2oax h THR 925 CO 0.10 0.43 0.19 0.50 -0.25 0.00 0.00 175.52 176.49 2oax h LYS 926 N 0.71 0.78 -0.56 4.72 1.63 -0.99 -1.59 116.57 121.26 2oax h LYS 926 Ca 0.11 -0.12 -0.07 0.00 -0.85 0.00 0.00 60.65 59.72 2oax h LYS 926 Cb 0.68 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 32.15 2oax h LYS 926 CO 0.05 0.66 0.10 1.25 -3.45 0.00 0.00 179.45 178.05 2oax h LEU 927 N 0.77 0.89 -1.54 5.20 6.46 -0.82 -1.69 115.31 124.57 2oax h LEU 927 Ca 0.18 -0.26 -0.05 0.00 -0.12 0.00 0.00 57.88 57.64 2oax h LEU 927 Cb 0.19 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 39.87 2oax h LEU 927 CO -0.01 0.92 -0.23 -0.07 -0.62 0.00 0.00 178.44 178.43 2oax h LEU 928 N 0.83 0.00 -0.16 2.25 3.38 -0.88 -1.53 115.31 119.20 2oax h LEU 928 Ca 0.17 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.91 2oax h LEU 928 Cb 0.40 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.16 2oax h LEU 928 CO 0.01 0.23 -0.84 0.44 0.09 0.00 0.00 178.44 178.37 2oax h ASP 929 N 0.00 0.87 1.29 -0.43 5.19 -0.69 -3.02 116.42 119.62 2oax h ASP 929 Ca -0.00 -0.60 0.00 0.00 -0.62 0.00 0.00 57.03 55.81 2oax h ASP 929 Cb 0.51 -0.26 0.00 0.00 0.18 0.00 0.00 39.33 39.76 2oax h ASP 929 CO 0.03 1.40 0.00 0.77 -3.12 0.00 0.00 179.24 178.32 2oax h SER 930 N 0.47 0.00 -0.04 6.45 4.64 -0.83 -2.80 113.55 121.43 2oax h SER 930 Ca -0.07 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.24 2oax h SER 930 Cb 1.47 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.56 2oax h SER 930 CO 0.17 0.00 -0.04 0.24 -0.87 0.00 0.00 176.83 176.33 2oax h MET 931 N 0.00 0.10 -0.40 4.77 2.86 -1.19 -2.69 114.93 118.38 2oax h MET 931 Ca 0.00 -0.05 0.05 0.00 -2.06 0.00 0.00 59.70 57.63 2oax h MET 931 Cb 0.64 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.28 2oax h MET 931 CO 0.00 0.55 0.27 0.45 1.06 0.00 0.00 176.91 179.24 2oax h HIS 932 N -0.35 0.34 -0.47 -0.22 -0.00 -1.41 0.69 115.15 113.73 2oax h HIS 932 Ca 0.01 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.38 2oax h HIS 932 Cb 0.53 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 27.81 2oax h HIS 932 CO 0.09 0.19 0.28 -0.44 -0.00 0.00 0.00 177.93 178.05 2oax h ASP 933 N 0.35 0.58 -0.00 2.45 3.45 -1.25 -1.74 116.42 120.25 2oax h ASP 933 Ca 0.17 -0.07 -0.26 0.00 0.43 0.00 0.00 57.03 57.31 2oax h ASP 933 Cb 0.24 -0.15 0.02 0.00 -0.56 0.00 0.00 39.33 38.88 2oax h ASP 933 CO -0.04 0.47 -1.00 0.25 -1.57 0.00 0.00 179.24 177.36 2oax h LEU 934 N 0.63 0.90 -1.03 1.55 5.85 -0.95 -3.23 115.31 119.03 2oax h LEU 934 Ca 0.17 -0.70 0.10 0.00 0.84 0.00 0.00 57.88 58.29 2oax h LEU 934 Cb 0.01 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 40.69 2oax h LEU 934 CO -0.03 1.50 0.63 0.58 -0.34 0.00 0.00 178.44 180.79 2oax h VAL 935 N 0.41 0.97 -0.43 1.05 2.07 -0.78 0.63 116.25 120.17 2oax h VAL 935 Ca -0.12 -0.36 0.07 0.00 0.82 0.00 0.00 66.70 67.11 2oax h VAL 935 Cb 1.65 -0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 2oax h VAL 935 CO 0.20 0.19 0.10 -1.28 0.02 0.00 0.00 177.57 176.79 2oax h SER 936 N 1.04 0.03 -0.37 0.57 0.87 -1.33 -0.22 113.55 114.13 2oax h SER 936 Ca 0.47 0.07 -0.11 0.00 -1.23 0.00 0.00 61.79 61.00 2oax h SER 936 Cb 0.39 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.43 2oax h SER 936 CO -0.23 0.05 -0.15 0.44 -0.53 0.00 0.00 176.83 176.42 2oax h ASP 937 N 0.23 0.83 -0.46 6.23 3.32 -1.17 -2.84 116.42 122.57 2oax h ASP 937 Ca 0.21 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 56.93 2oax h ASP 937 Cb 0.25 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 2oax h ASP 937 CO -0.26 0.98 0.11 -0.07 -1.72 0.00 0.00 179.24 178.28 2oax h LEU 938 N 0.74 0.75 -0.92 1.55 3.38 -0.09 -2.35 115.31 118.37 2oax h LEU 938 Ca 0.12 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 2oax h LEU 938 Cb 0.66 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2oax h LEU 938 CO 0.05 0.75 -0.13 -0.07 0.09 0.00 0.00 178.44 179.12 2oax h LEU 939 N 0.77 0.64 -0.10 1.67 3.38 -0.93 -1.45 115.31 119.29 2oax h LEU 939 Ca 0.17 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2oax h LEU 939 Cb 0.31 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2oax h LEU 939 CO 0.00 0.79 0.04 -0.33 0.09 0.00 0.00 178.44 179.04 2oax h GLU 940 N 0.59 0.15 -0.69 1.13 5.08 -1.20 0.30 114.58 119.94 2oax h GLU 940 Ca 0.10 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2oax h GLU 940 Cb 0.57 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 2oax h GLU 940 CO 0.04 0.24 0.41 0.35 -1.00 0.00 0.00 179.01 179.05 2oax h PHE 941 N 0.01 0.91 0.72 4.33 3.57 -1.30 -1.06 116.94 124.12 2oax h PHE 941 Ca 0.03 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 2oax h PHE 941 Cb 0.15 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.59 2oax h PHE 941 CO -0.02 0.62 -0.43 0.00 -2.23 0.00 0.00 178.31 176.25 2oax h PHE 943 N -1.08 0.61 0.37 0.00 0.04 -0.84 0.41 116.94 116.45 2oax h PHE 943 Ca -0.09 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 2oax h PHE 943 Cb 0.86 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.84 2oax h PHE 943 CO -0.09 0.24 -0.18 -0.92 -0.60 0.00 0.00 178.31 176.75 2oax h TYR 944 N 0.60 -0.48 -0.73 -0.55 5.03 -1.04 -1.03 116.97 118.77 2oax h TYR 944 Ca 0.33 -0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.69 2oax h TYR 944 Cb 0.32 0.16 -0.05 0.00 1.55 0.00 0.00 36.73 38.72 2oax h TYR 944 CO -0.11 -0.30 0.48 1.15 -1.32 0.00 0.00 178.16 178.07 2oax h THR 945 N -0.51 1.02 -0.12 1.81 2.02 -0.46 -2.33 112.91 114.35 2oax h THR 945 Ca -0.05 -0.26 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 2oax h THR 945 Cb 0.39 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 2oax h THR 945 CO 0.08 0.14 0.07 0.15 0.37 0.00 0.00 175.52 176.32 2oax h PHE 946 N 0.76 0.16 0.00 3.16 3.57 0.41 -0.64 116.94 124.37 2oax h PHE 946 Ca 0.31 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.81 2oax h PHE 946 Cb 0.26 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.94 2oax h PHE 946 CO -0.00 0.17 0.00 0.54 -2.23 0.00 0.00 178.31 176.79 2oax n ARG 947 N -4.96 0.73 -1.35 1.11 1.74 -0.45 -3.22 116.66 110.26 2oax n ARG 947 Ca -0.05 0.01 0.04 0.00 -0.77 0.00 0.00 57.85 57.08 2oax n ARG 947 Cb 0.06 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.05 2oax n ARG 947 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2oax n GLU 948 N -1.04 0.21 0.22 5.56 -0.58 -0.96 -4.90 120.64 119.15 2oax n GLU 948 Ca 0.18 -2.14 0.05 0.00 -0.42 0.00 0.00 57.16 54.83 2oax n GLU 948 Cb 0.10 -0.22 0.48 0.00 -0.57 0.00 0.00 31.44 31.23 2oax n GLU 948 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2oax h SER 949 N 0.97 0.00 -0.02 1.62 4.64 -1.10 0.97 113.55 120.63 2oax h SER 949 Ca -0.19 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.12 2oax h SER 949 Cb 1.77 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.86 2oax h SER 949 CO 0.08 0.24 -0.02 -0.74 -0.87 0.00 0.00 176.83 175.52 2oax h HIS 950 N 0.00 0.07 -0.59 4.77 6.17 -1.87 0.48 115.15 124.17 2oax h HIS 950 Ca -0.00 -0.02 -0.08 0.00 0.71 0.00 0.00 60.37 60.97 2oax h HIS 950 Cb 0.44 -0.01 -0.02 0.00 2.52 0.00 0.00 27.41 30.33 2oax h HIS 950 CO 0.00 0.52 0.04 0.00 0.71 0.00 0.00 177.93 179.20 2oax h ALA 951 N 0.54 0.80 -0.00 5.26 0.00 -1.91 -2.58 119.26 121.37 2oax h ALA 951 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2oax h ALA 951 Cb 0.50 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2oax h ALA 951 CO 0.01 0.60 -0.14 1.28 0.00 0.00 0.00 179.25 180.99 2oax n LEU 952 N -4.25 0.47 -2.43 0.00 4.77 0.32 -4.93 117.00 110.96 2oax n LEU 952 Ca 0.03 0.03 -0.16 0.00 -0.03 0.00 0.00 56.01 55.87 2oax n LEU 952 Cb 0.31 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 2oax n LEU 952 CO 0.43 0.09 -0.21 0.29 -1.33 0.00 0.00 177.39 176.67 2oax n LYS 953 N -1.02 -2.01 -4.06 3.23 4.01 0.15 -4.65 118.16 113.81 2oax n LYS 953 Ca 0.13 0.79 -0.35 0.00 -0.51 0.00 0.00 58.31 58.36 2oax n LYS 953 Cb 0.29 -5.42 -0.08 0.00 -0.51 0.00 0.00 35.03 29.31 2oax n LYS 953 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2oax s VAL 954 N -2.82 4.92 0.11 -0.18 1.01 -0.35 -4.80 120.40 118.29 2oax s VAL 954 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.96 2oax s VAL 954 Cb -0.00 -3.15 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 2oax s VAL 954 CO 0.01 0.56 0.30 -1.61 0.00 0.00 0.00 175.10 174.36 2oax s GLU 955 N -0.49 3.53 -0.10 2.72 0.41 -1.26 -4.63 118.70 118.87 2oax s GLU 955 Ca 0.10 -0.27 0.00 0.00 -0.41 0.00 0.00 54.97 54.40 2oax s GLU 955 Cb -0.12 -2.93 0.02 0.00 -1.78 0.00 0.00 34.13 29.32 2oax s GLU 955 CO 0.02 0.52 -0.08 -0.06 -0.49 0.00 0.00 175.26 175.17 2oax s PHE 956 N -1.61 1.46 0.68 1.61 0.40 -1.26 -4.55 117.98 114.71 2oax s PHE 956 Ca 0.38 -0.69 -0.17 0.00 -0.60 0.00 0.00 56.93 55.85 2oax s PHE 956 Cb -0.12 -1.19 0.01 0.00 0.51 0.00 0.00 43.02 42.23 2oax s PHE 956 CO 0.26 -0.46 1.28 -2.30 0.70 0.00 0.00 175.22 174.70 2oax n PRO 957 N 4.69 0.91 -0.34 0.24 -0.02 -1.26 -4.70 135.00 134.53 2oax n PRO 957 Ca -0.15 0.37 0.15 0.00 -2.02 0.00 0.00 63.50 61.86 2oax n PRO 957 Cb 0.50 -2.52 0.35 0.00 -0.02 0.00 0.00 33.50 31.82 2oax n PRO 957 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oax h ALA 958 N 0.21 1.67 -0.70 3.55 0.00 -1.99 0.36 119.26 122.37 2oax h ALA 958 Ca -0.50 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 2oax h ALA 958 Cb 1.33 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 2oax h ALA 958 CO 0.51 -0.23 0.28 1.98 0.00 0.00 0.00 179.25 181.79 2oax h MET 959 N 0.58 1.04 -0.61 0.00 -1.53 -1.98 -1.68 114.93 110.75 2oax h MET 959 Ca 0.61 -0.19 -0.08 0.00 -3.44 0.00 0.00 59.70 56.60 2oax h MET 959 Cb 1.10 -0.17 -0.02 0.00 -0.55 0.00 0.00 31.60 31.96 2oax h MET 959 CO -0.46 0.86 0.08 -0.07 0.14 0.00 0.00 176.91 177.45 2oax h LEU 960 N 0.99 0.99 -1.08 3.39 3.38 -1.30 -1.93 115.31 119.75 2oax h LEU 960 Ca 0.23 -0.27 0.06 0.00 0.09 0.00 0.00 57.88 57.99 2oax h LEU 960 Cb 0.20 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.63 2oax h LEU 960 CO -0.02 1.01 0.62 0.58 0.09 0.00 0.00 178.44 180.72 2oax h VAL 961 N 0.93 1.10 0.70 1.22 2.07 -0.99 0.22 116.25 121.50 2oax h VAL 961 Ca 0.18 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 2oax h VAL 961 Cb 0.46 -0.12 0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2oax h VAL 961 CO 0.02 0.21 -0.34 -0.08 0.02 0.00 0.00 177.57 177.39 2oax h GLU 962 N 1.12 -0.91 0.19 1.57 4.22 -0.85 -0.33 114.58 119.59 2oax h GLU 962 Ca 0.40 0.06 -0.01 0.00 0.08 0.00 0.00 59.36 59.89 2oax h GLU 962 Cb 0.14 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2oax h GLU 962 CO -0.15 -0.59 -0.09 0.82 -2.18 0.00 0.00 179.01 176.82 2oax h ILE 963 N -0.99 0.87 -0.34 2.32 2.04 -0.91 -2.43 117.51 118.07 2oax h ILE 963 Ca -0.10 -0.26 0.03 0.00 1.00 0.00 0.00 64.86 65.54 2oax h ILE 963 Cb 0.74 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.81 2oax h ILE 963 CO 0.16 0.06 0.15 0.40 0.00 0.00 0.00 178.15 178.92 2oax h ILE 964 N -0.38 0.96 0.00 -0.67 2.04 -0.63 0.21 117.51 119.04 2oax h ILE 964 Ca -0.03 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2oax h ILE 964 Cb 0.29 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 2oax h ILE 964 CO 0.04 0.06 0.00 0.77 0.00 0.00 0.00 178.15 179.02 2oax h SER 965 N 0.32 0.00 0.14 1.72 4.64 -1.04 -0.68 113.55 118.65 2oax h SER 965 Ca 0.14 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.11 2oax h SER 965 Cb 0.08 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.12 2oax h SER 965 CO -0.12 0.00 -2.15 -0.67 -0.87 0.00 0.00 176.83 173.02 2oax n ASP 966 N -2.60 1.33 0.09 4.97 -0.08 -0.76 -4.52 116.55 114.97 2oax n ASP 966 Ca 0.01 0.11 -0.17 0.00 -1.51 0.00 0.00 54.79 53.24 2oax n ASP 966 Cb 0.24 -0.14 -0.14 0.00 2.34 0.00 0.00 41.12 43.41 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 0.02 0.27 -0.15 -0.67 4.15 -0.45 -3.39 115.11 114.89 2oax h GLN 967 Ca -0.46 -0.47 0.02 0.00 0.77 0.00 0.00 58.65 58.51 2oax h GLN 967 Cb 2.04 0.17 -0.04 0.00 0.21 0.00 0.00 27.48 29.86 2oax h GLN 967 CO 0.02 1.18 -0.35 1.25 -1.93 0.00 0.00 178.83 179.01 2oax h LEU 968 N 0.07 -1.12 -0.88 -2.39 6.46 -1.34 0.79 115.31 116.90 2oax h LEU 968 Ca -0.18 0.14 0.16 0.00 -0.12 0.00 0.00 57.88 57.87 2oax h LEU 968 Cb 2.00 0.45 -0.10 0.00 -0.73 0.00 0.00 40.66 42.28 2oax h LEU 968 CO 0.19 -0.29 0.46 1.55 -0.62 0.00 0.00 178.44 179.73 2oax h PRO 969 N -0.32 0.61 -0.41 5.25 0.13 -1.83 0.61 132.00 136.04 2oax h PRO 969 Ca 0.03 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 2oax h PRO 969 Cb 0.41 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.38 2oax h PRO 969 CO -0.31 0.40 0.13 0.87 -0.23 0.00 0.00 178.00 178.86 2oax h LYS 970 N 0.63 0.59 0.19 0.86 6.56 -1.54 -2.64 116.57 121.21 2oax h LYS 970 Ca 0.49 -0.09 -0.31 0.00 -1.06 0.00 0.00 60.65 59.68 2oax h LYS 970 Cb 0.72 -0.10 0.02 0.00 -0.57 0.00 0.00 32.23 32.29 2oax h LYS 970 CO -0.38 0.52 -1.38 0.28 -2.06 0.00 0.00 179.45 176.43 2oax h VAL 971 N 0.58 1.37 -0.96 0.50 2.07 0.16 -2.45 116.25 117.51 2oax h VAL 971 Ca 0.14 -2.87 0.21 0.00 0.82 0.00 0.00 66.70 64.99 2oax h VAL 971 Cb 0.18 2.97 -0.08 0.00 -1.52 0.00 0.00 31.29 32.84 2oax h VAL 971 CO -0.01 0.85 0.62 -0.08 0.02 0.00 0.00 177.57 178.97 2oax h GLU 972 N 0.11 0.53 -6.33 1.57 4.57 0.44 -3.40 114.58 112.06 2oax h GLU 972 Ca -0.20 -0.03 -0.46 0.00 -1.18 0.00 0.00 59.36 57.48 2oax h GLU 972 Cb 2.07 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 30.54 2oax h GLU 972 CO 0.23 0.35 -0.29 -1.54 -1.18 0.00 0.00 179.01 176.58 2oax s SER 973 N -5.51 5.32 0.00 1.04 1.04 -1.09 -4.97 113.70 109.53 2oax s SER 973 Ca -0.09 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 55.71 2oax s SER 973 Cb 0.24 -0.49 0.00 0.00 0.10 0.00 0.00 66.02 65.87 2oax s SER 973 CO 0.79 -0.79 0.69 0.61 0.98 0.00 0.00 173.24 175.52 2oax n GLY 974 N -1.76 1.23 0.03 7.32 0.00 -1.26 -3.91 105.19 106.84 2oax n GLY 974 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.22 2oax n GLY 974 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2oax n ASN 975 N 0.98 0.39 0.39 1.61 4.13 -0.94 -4.03 115.26 117.78 2oax n ASN 975 Ca 0.00 0.31 -0.17 0.00 1.68 0.00 0.00 54.58 56.40 2oax n ASN 975 Cb 0.28 -0.32 -0.08 0.00 -1.54 0.00 0.00 39.78 38.11 2oax n ASN 975 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2oax h ALA 976 N 2.82 -0.99 -5.67 5.41 0.00 -1.63 -2.80 119.26 116.41 2oax h ALA 976 Ca 0.00 -0.23 -0.21 0.00 0.00 0.00 0.00 54.91 54.47 2oax h ALA 976 Cb 0.59 0.38 0.09 0.00 0.00 0.00 0.00 17.79 18.85 2oax h ALA 976 CO 0.00 -0.98 -0.57 1.17 0.00 0.00 0.00 179.25 178.87 2oax n LYS 977 N -5.46 -1.64 -2.49 0.00 3.00 -1.26 -3.48 118.16 106.83 2oax n LYS 977 Ca -0.13 1.02 -0.43 0.00 -0.00 0.00 0.00 58.31 58.77 2oax n LYS 977 Cb 0.40 -5.20 -0.02 0.00 0.00 0.00 0.00 35.03 30.21 2oax n LYS 977 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.40 175.26 2oax s PRO 978 N -4.20 4.30 -0.14 1.64 0.02 -1.26 -3.88 135.00 131.48 2oax s PRO 978 Ca 0.25 1.61 -0.29 0.00 0.02 0.00 0.00 61.00 62.59 2oax s PRO 978 Cb -0.05 -3.64 -0.02 0.00 0.02 0.00 0.00 34.50 30.81 2oax s PRO 978 CO 0.78 -0.55 1.24 -0.51 -0.33 0.00 0.00 177.00 177.62 2oax s LEU 979 N 2.79 4.20 -0.14 -5.54 1.43 -0.60 -5.03 118.68 115.80 2oax s LEU 979 Ca 0.53 1.71 -0.07 0.00 -1.03 0.00 0.00 54.13 55.28 2oax s LEU 979 Cb -0.22 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.42 2oax s LEU 979 CO 0.17 -0.71 0.12 -0.31 0.23 0.00 0.00 176.35 175.85 2oax s TYR 980 N 3.15 3.48 0.17 0.29 2.02 -1.26 -4.97 117.35 120.22 2oax s TYR 980 Ca 0.55 0.40 -0.01 0.00 -0.37 0.00 0.00 57.07 57.64 2oax s TYR 980 Cb -0.22 -1.99 0.05 0.00 -0.40 0.00 0.00 41.96 39.40 2oax s TYR 980 CO 0.16 0.55 1.42 0.74 -1.57 0.00 0.00 175.55 176.86 2oax h PHE 981 N 5.56 0.52 0.00 2.71 0.04 -1.96 -3.52 116.94 120.30 2oax h PHE 981 Ca -0.49 -0.24 0.00 0.00 2.80 0.00 0.00 57.97 60.04 2oax h PHE 981 Cb 1.20 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 39.27 2oax h PHE 981 CO 0.68 1.00 0.00 0.72 -0.60 0.00 0.00 178.31 180.11