#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 1.44 -0.18 -1.45 3.04 -1.99 -2.62 116.25 114.48 2oax h VAL 739 Ca 0.00 -2.15 -0.14 0.00 -1.01 0.00 0.00 66.70 63.41 2oax h VAL 739 Cb 0.00 2.14 -0.01 0.00 -2.01 0.00 0.00 31.29 31.41 2oax h VAL 739 CO 0.00 0.62 -0.46 -0.03 -1.01 0.00 0.00 177.57 176.69 2oax h MET 740 N 0.07 0.45 -0.32 4.17 -1.53 -2.00 -1.78 114.93 113.98 2oax h MET 740 Ca -0.01 -0.25 -0.07 0.00 -3.44 0.00 0.00 59.70 55.94 2oax h MET 740 Cb 1.15 0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 32.20 2oax h MET 740 CO 0.09 0.82 -0.06 0.28 0.14 0.00 0.00 176.91 178.19 2oax h VAL 741 N 0.36 1.27 -0.11 -5.77 2.07 -1.97 -2.31 116.25 109.80 2oax h VAL 741 Ca 0.02 -1.09 0.03 0.00 0.82 0.00 0.00 66.70 66.48 2oax h VAL 741 Cb 0.95 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 2oax h VAL 741 CO 0.08 0.35 -0.06 -0.07 0.02 0.00 0.00 177.57 177.89 2oax h LEU 742 N 0.40 -0.21 -1.79 2.57 3.38 -1.27 -1.68 115.31 116.71 2oax h LEU 742 Ca 0.08 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.16 2oax h LEU 742 Cb 0.54 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2oax h LEU 742 CO 0.03 -0.09 0.26 -0.33 0.09 0.00 0.00 178.44 178.40 2oax h GLU 743 N -0.06 0.25 -0.06 1.13 5.08 -1.23 -2.21 114.58 117.48 2oax h GLU 743 Ca 0.07 -0.02 -0.20 0.00 -1.00 0.00 0.00 59.36 58.21 2oax h GLU 743 Cb 0.16 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 2oax h GLU 743 CO -0.15 0.17 -0.80 -0.97 -1.00 0.00 0.00 179.01 176.26 2oax h ASN 744 N 0.26 0.51 -0.51 1.42 -1.24 -0.78 -3.27 115.58 111.97 2oax h ASN 744 Ca 0.17 -0.36 -0.12 0.00 0.71 0.00 0.00 56.30 56.70 2oax h ASN 744 Cb 0.34 -0.15 -0.07 0.00 0.73 0.00 0.00 38.32 39.16 2oax h ASN 744 CO -0.03 1.12 0.16 2.30 -1.29 0.00 0.00 177.43 179.68 2oax n ILE 745 N -3.81 2.16 -2.55 2.57 -5.35 -0.71 -4.92 119.36 106.76 2oax n ILE 745 Ca -0.05 -1.11 -0.40 0.00 -0.27 0.00 0.00 62.75 60.91 2oax n ILE 745 Cb 0.75 -0.44 -0.05 0.00 -1.74 0.00 0.00 39.64 38.16 2oax n ILE 745 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2oax s GLU 746 N -2.28 4.68 0.77 6.28 2.56 -1.15 -4.78 118.70 124.79 2oax s GLU 746 Ca 0.39 1.72 -0.15 0.00 0.00 0.00 0.00 54.97 56.92 2oax s GLU 746 Cb 0.31 -3.23 -0.01 0.00 2.00 0.00 0.00 34.13 33.20 2oax s GLU 746 CO 0.10 0.26 0.64 -0.35 -0.56 0.00 0.00 175.26 175.35 2oax n PRO 747 N 1.47 0.23 -2.92 4.30 -0.04 -1.26 -5.01 135.00 131.77 2oax n PRO 747 Ca -0.01 0.13 -0.21 0.00 -0.04 0.00 0.00 63.50 63.37 2oax n PRO 747 Cb 0.46 -1.95 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 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 -3.11 2.87 0.08 0.54 -1.05 -1.26 -5.01 118.70 111.76 2oax s GLU 748 Ca 0.66 -0.70 -0.37 0.00 -0.15 0.00 0.00 54.97 54.41 2oax s GLU 748 Cb -0.32 -2.58 -0.17 0.00 -0.44 0.00 0.00 34.13 30.62 2oax s GLU 748 CO 0.58 -0.39 1.25 -0.89 0.95 0.00 0.00 175.26 176.76 2oax n ILE 749 N -2.10 0.15 -3.91 1.83 5.41 -1.26 -4.98 119.36 114.50 2oax n ILE 749 Ca 0.04 -0.04 -0.25 0.00 1.00 0.00 0.00 62.75 63.50 2oax n ILE 749 Cb 0.58 -0.64 -0.17 0.00 -0.71 0.00 0.00 39.64 38.70 2oax n ILE 749 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 2oax s VAL 750 N 0.27 0.78 0.59 1.39 -7.23 -1.26 -5.14 120.40 109.80 2oax s VAL 750 Ca 0.84 -0.15 -0.13 0.00 -1.81 0.00 0.00 61.98 60.73 2oax s VAL 750 Cb -1.01 -0.84 -0.05 0.00 0.56 0.00 0.00 36.38 35.04 2oax s VAL 750 CO 0.50 0.32 1.02 -0.31 -0.31 0.00 0.00 175.10 176.32 2oax s TYR 751 N 1.70 3.47 -0.09 2.82 1.51 -1.26 -4.51 117.35 120.99 2oax s TYR 751 Ca 0.03 1.38 0.08 0.00 -1.01 0.00 0.00 57.07 57.55 2oax s TYR 751 Cb -0.13 -2.78 -0.24 0.00 -0.11 0.00 0.00 41.96 38.70 2oax s TYR 751 CO -0.06 -0.66 0.49 0.00 -1.11 0.00 0.00 175.55 174.20 2oax n ALA 752 N -2.32 1.34 -1.01 3.71 0.00 -1.26 -4.86 120.51 116.12 2oax n ALA 752 Ca 0.07 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.70 2oax n ALA 752 Cb 0.54 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.29 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 1.71 1.10 3.69 0.00 0.00 -1.26 -4.62 105.19 105.81 2oax n GLY 753 Ca -0.24 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 2oax n GLY 753 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2oax s TYR 754 N -2.27 2.53 -0.27 1.61 -0.00 -1.26 -4.99 117.35 112.69 2oax s TYR 754 Ca 0.00 0.42 0.03 0.00 -0.00 0.00 0.00 57.07 57.52 2oax s TYR 754 Cb 0.00 -3.91 0.07 0.00 -0.00 0.00 0.00 41.96 38.12 2oax s TYR 754 CO 0.00 -3.60 -0.05 0.34 -0.00 0.00 0.00 175.55 172.23 2oax s ASP 755 N 2.25 4.37 -0.33 -0.18 -1.08 -1.26 -5.14 116.67 115.30 2oax s ASP 755 Ca 0.72 -1.53 -0.24 0.00 -0.52 0.00 0.00 52.55 50.98 2oax s ASP 755 Cb -0.39 -1.46 0.00 0.00 -1.46 0.00 0.00 42.92 39.62 2oax s ASP 755 CO 0.31 -0.25 0.81 -0.94 0.52 0.00 0.00 175.17 175.62 2oax s SER 756 N 1.14 6.64 0.00 -0.34 1.04 -1.26 -5.21 113.70 115.71 2oax s SER 756 Ca -0.03 0.58 0.00 0.00 0.48 0.00 0.00 55.95 56.98 2oax s SER 756 Cb -0.19 -2.41 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2oax s SER 756 CO -0.07 -0.67 0.00 -0.90 0.98 0.00 0.00 173.24 172.58 2oax n ASP 760 N 6.33 0.00 -3.24 7.02 5.75 -1.26 -5.34 116.55 125.81 2oax n ASP 760 Ca 0.04 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.53 2oax n ASP 760 Cb 0.48 0.00 0.28 0.00 -1.03 0.00 0.00 41.12 40.85 2oax n ASP 760 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 2oax n THR 761 N 0.00 0.00 -0.19 2.12 5.66 -1.26 -4.56 114.28 116.06 2oax n THR 761 Ca 0.00 -0.05 0.08 0.00 -3.05 0.00 0.00 64.05 61.03 2oax n THR 761 Cb 0.00 -0.97 0.37 0.00 -1.55 0.00 0.00 70.33 68.19 2oax n THR 761 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2oax h ALA 762 N -3.48 1.76 -0.02 1.79 0.00 -1.97 -1.99 119.26 115.36 2oax h ALA 762 Ca -0.38 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.55 2oax h ALA 762 Cb 1.25 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 2oax h ALA 762 CO 0.23 0.10 -0.15 0.93 0.00 0.00 0.00 179.25 180.36 2oax h GLU 763 N 0.71 -0.23 -0.52 0.00 5.08 -1.86 -2.14 114.58 115.62 2oax h GLU 763 Ca 0.33 0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.65 2oax h GLU 763 Cb 0.37 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 2oax h GLU 763 CO -0.12 -0.15 0.09 -0.91 -1.00 0.00 0.00 179.01 176.92 2oax h ASN 764 N -0.24 0.81 -0.23 1.42 4.21 -1.67 -3.08 115.58 116.81 2oax h ASN 764 Ca 0.06 -0.25 0.02 0.00 1.21 0.00 0.00 56.30 57.33 2oax h ASN 764 Cb 0.31 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 37.27 2oax h ASN 764 CO -0.16 0.86 0.08 0.25 -1.29 0.00 0.00 177.43 177.18 2oax h LEU 765 N 0.73 0.10 -1.67 1.61 5.85 -1.26 -1.99 115.31 118.68 2oax h LEU 765 Ca 0.16 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2oax h LEU 765 Cb 0.39 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 2oax h LEU 765 CO 0.01 0.09 0.15 -0.07 -0.34 0.00 0.00 178.44 178.27 2oax h LEU 766 N 0.19 0.32 -0.75 2.25 3.38 -1.40 -1.60 115.31 117.70 2oax h LEU 766 Ca 0.10 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.94 2oax h LEU 766 Cb 0.06 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2oax h LEU 766 CO -0.10 0.26 -0.29 0.28 0.09 0.00 0.00 178.44 178.68 2oax h SER 767 N 0.37 0.64 -0.10 -0.43 0.02 -1.32 -2.39 113.55 110.33 2oax h SER 767 Ca 0.10 -0.24 -0.13 0.00 -0.84 0.00 0.00 61.79 60.67 2oax h SER 767 Cb 0.01 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 2oax h SER 767 CO -0.02 0.90 -0.38 0.74 -1.14 0.00 0.00 176.83 176.93 2oax h THR 768 N 0.53 1.29 -0.34 -2.27 2.02 -0.60 -0.58 112.91 112.96 2oax h THR 768 Ca 0.07 -1.54 -0.07 0.00 0.77 0.00 0.00 66.41 65.64 2oax h THR 768 Cb 0.77 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 2oax h THR 768 CO 0.06 0.49 -0.06 -0.07 0.37 0.00 0.00 175.52 176.31 2oax h LEU 769 N 0.51 0.65 -0.98 2.58 3.38 -1.25 0.12 115.31 120.32 2oax h LEU 769 Ca 0.05 -0.35 -0.07 0.00 0.09 0.00 0.00 57.88 57.59 2oax h LEU 769 Cb 0.89 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 2oax h LEU 769 CO 0.08 0.85 -0.03 0.78 0.09 0.00 0.00 178.44 180.21 2oax h ASN 770 N 0.44 0.68 -0.20 -0.43 2.35 -1.36 0.18 115.58 117.23 2oax h ASN 770 Ca 0.09 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 2oax h ASN 770 Cb 0.56 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 2oax h ASN 770 CO 0.03 0.76 0.10 -0.09 -1.65 0.00 0.00 177.43 176.58 2oax h ARG 771 N 0.66 0.28 -0.79 0.81 9.65 -0.79 -1.20 114.38 123.00 2oax h ARG 771 Ca 0.13 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.97 2oax h ARG 771 Cb 0.45 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.94 2oax h ARG 771 CO 0.02 0.29 0.48 1.25 2.80 0.00 0.00 179.97 184.81 2oax h LEU 772 N 0.20 0.94 -1.02 3.80 5.85 -0.07 -2.26 115.31 122.76 2oax h LEU 772 Ca 0.07 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2oax h LEU 772 Cb 0.10 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 2oax h LEU 772 CO -0.01 0.72 0.64 0.00 -0.34 0.00 0.00 178.44 179.45 2oax h ALA 773 N 1.44 1.28 -0.18 1.25 0.00 -0.20 -1.33 119.26 121.52 2oax h ALA 773 Ca 0.28 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2oax h ALA 773 Cb -0.05 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.34 2oax h ALA 773 CO -0.05 0.66 0.11 0.78 0.00 0.00 0.00 179.25 180.75 2oax h GLY 774 N 1.34 0.26 1.40 0.00 0.00 -0.62 -0.04 103.07 105.40 2oax h GLY 774 Ca 0.36 -0.11 -0.10 0.00 0.00 0.00 0.00 47.33 47.48 2oax h GLY 774 CO -0.08 0.10 -0.16 0.50 0.00 0.00 0.00 176.54 176.91 2oax h LYS 775 N 0.22 0.71 -0.49 4.80 1.57 -1.34 -2.81 116.57 119.22 2oax h LYS 775 Ca 0.06 -0.25 -0.10 0.00 -1.87 0.00 0.00 60.65 58.49 2oax h LYS 775 Cb 0.02 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 2oax h LYS 775 CO -0.01 0.83 -0.11 1.96 -0.57 0.00 0.00 179.45 181.55 2oax h GLN 776 N 0.63 0.91 -0.68 3.15 4.20 -0.99 -2.71 115.11 119.62 2oax h GLN 776 Ca 0.10 -0.32 0.03 0.00 0.06 0.00 0.00 58.65 58.52 2oax h GLN 776 Cb 0.63 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.30 2oax h GLN 776 CO 0.04 0.96 0.45 0.52 -0.67 0.00 0.00 178.83 180.14 2oax h MET 777 N 0.81 0.82 -0.40 1.46 2.86 -0.76 0.18 114.93 119.90 2oax h MET 777 Ca 0.13 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.72 2oax h MET 777 Cb 0.63 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.09 2oax h MET 777 CO 0.04 0.54 0.25 0.82 1.06 0.00 0.00 176.91 179.62 2oax h ILE 778 N 0.84 1.12 -0.58 -1.22 2.04 -1.30 -0.75 117.51 117.67 2oax h ILE 778 Ca 0.27 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 2oax h ILE 778 Cb 0.02 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 2oax h ILE 778 CO -0.07 0.12 0.24 1.56 0.00 0.00 0.00 178.15 180.00 2oax h GLN 779 N 0.53 0.83 -0.44 2.37 1.08 -0.84 -2.54 115.11 116.10 2oax h GLN 779 Ca 0.15 -0.12 -0.04 0.00 -1.45 0.00 0.00 58.65 57.19 2oax h GLN 779 Cb -0.02 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.24 2oax h GLN 779 CO -0.03 0.68 0.13 0.28 -0.95 0.00 0.00 178.83 178.94 2oax h VAL 780 N 0.83 1.22 -0.36 -0.54 2.07 0.46 0.18 116.25 120.10 2oax h VAL 780 Ca 0.20 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 2oax h VAL 780 Cb 0.15 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2oax h VAL 780 CO -0.02 0.27 0.20 0.58 0.02 0.00 0.00 177.57 178.61 2oax h VAL 781 N 0.57 1.14 -0.70 2.57 2.07 -1.05 0.40 116.25 121.25 2oax h VAL 781 Ca 0.14 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 2oax h VAL 781 Cb 0.27 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 2oax h VAL 781 CO -0.00 0.15 0.40 0.50 0.02 0.00 0.00 177.57 178.63 2oax h LYS 782 N 0.46 0.97 -0.57 1.57 3.64 -1.27 -1.00 116.57 120.37 2oax h LYS 782 Ca 0.13 -0.11 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 2oax h LYS 782 Cb 0.06 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 2oax h LYS 782 CO -0.02 0.72 -0.06 2.35 -2.27 0.00 0.00 179.45 180.16 2oax h TRP 783 N 0.96 1.16 -0.67 1.91 7.01 -0.26 -3.19 115.95 122.87 2oax h TRP 783 Ca 0.25 -0.22 -0.07 0.00 2.11 0.00 0.00 58.89 60.96 2oax h TRP 783 Cb 0.02 -0.29 -0.03 0.00 -2.10 0.00 0.00 29.16 26.75 2oax h TRP 783 CO -0.01 1.05 0.14 0.00 -2.79 0.00 0.00 178.44 176.83 2oax h ALA 784 N 0.97 0.98 0.00 2.65 0.00 0.35 -2.62 119.26 121.59 2oax h ALA 784 Ca 0.16 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2oax h ALA 784 Cb 0.63 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2oax h ALA 784 CO 0.04 0.65 0.00 0.36 0.00 0.00 0.00 179.25 180.30 2oax n LYS 785 N -4.23 0.05 0.00 0.00 2.85 -0.43 -2.54 118.16 113.86 2oax n LYS 785 Ca 0.05 0.25 0.02 0.00 -1.05 0.00 0.00 58.31 57.58 2oax n LYS 785 Cb 0.27 -1.50 0.01 0.00 -0.65 0.00 0.00 35.03 33.16 2oax n LYS 785 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 2oax n VAL 786 N -1.44 0.00 -2.10 0.58 0.24 -1.02 -4.72 118.33 109.87 2oax n VAL 786 Ca 0.04 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.34 61.42 2oax n VAL 786 Cb 0.13 1.07 -0.03 0.00 -1.47 0.00 0.00 33.84 33.55 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 -0.39 4.33 0.25 1.34 2.96 -1.02 -4.93 118.68 121.22 2oax s LEU 787 Ca 0.04 2.24 -0.31 0.00 -0.22 0.00 0.00 54.13 55.88 2oax s LEU 787 Cb 0.03 -3.56 -0.13 0.00 0.50 0.00 0.00 46.19 43.04 2oax s LEU 787 CO 0.05 -0.81 1.47 -2.65 -1.32 0.00 0.00 176.35 173.09 2oax n PRO 788 N 5.77 2.24 0.00 0.98 -0.02 -1.26 -2.26 135.00 140.45 2oax n PRO 788 Ca 0.15 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 2oax n PRO 788 Cb 0.42 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 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 2.22 2.60 0.13 -1.23 0.00 -1.26 -4.74 105.19 102.91 2oax n GLY 789 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 2oax n GLY 789 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2oax n PHE 790 N -1.99 0.21 0.26 1.61 7.35 -0.96 -4.34 117.46 119.59 2oax n PHE 790 Ca 0.00 0.05 0.14 0.00 -0.76 0.00 0.00 57.45 56.89 2oax n PHE 790 Cb 0.00 -1.03 0.77 0.00 0.35 0.00 0.00 39.48 39.57 2oax n PHE 790 CO 0.00 0.00 0.00 1.57 -0.76 0.00 0.00 176.76 177.57 2oax h LYS 791 N -0.23 0.00 0.00 -4.13 2.10 -1.71 -0.56 116.57 112.04 2oax h LYS 791 Ca -0.58 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 57.96 2oax h LYS 791 Cb 1.84 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 33.15 2oax h LYS 791 CO -0.14 0.00 -1.49 0.09 -2.00 0.00 0.00 179.45 175.91 2oax n ASN 792 N -2.60 0.63 -4.58 7.07 3.02 -1.26 -4.93 115.26 112.62 2oax n ASN 792 Ca -0.02 0.26 -0.32 0.00 -0.03 0.00 0.00 54.58 54.48 2oax n ASN 792 Cb 0.20 0.63 0.15 0.00 -0.61 0.00 0.00 39.78 40.15 2oax n ASN 792 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2oax n LEU 793 N -2.71 2.05 -4.73 3.41 4.77 -0.22 -4.89 117.00 114.68 2oax n LEU 793 Ca -0.08 0.40 -0.41 0.00 -0.03 0.00 0.00 56.01 55.88 2oax n LEU 793 Cb 0.74 -1.38 -0.03 0.00 -2.33 0.00 0.00 43.42 40.43 2oax n LEU 793 CO 0.43 -2.69 0.99 -2.16 -1.33 0.00 0.00 177.39 172.62 2oax s PRO 794 N -4.22 4.39 0.20 3.23 0.04 -1.26 -4.84 135.00 132.53 2oax s PRO 794 Ca 0.64 2.04 -0.10 0.00 0.04 0.00 0.00 61.00 63.62 2oax s PRO 794 Cb -0.23 -3.21 0.28 0.00 0.04 0.00 0.00 34.50 31.38 2oax s PRO 794 CO 0.61 -0.27 1.20 -0.11 0.04 0.00 0.00 177.00 178.48 2oax n LEU 795 N 2.81 -0.38 -0.24 -3.56 7.94 -1.26 -0.29 117.00 122.01 2oax n LEU 795 Ca 0.07 1.34 0.05 0.00 -1.11 0.00 0.00 56.01 56.35 2oax n LEU 795 Cb 0.43 -0.36 0.29 0.00 0.53 0.00 0.00 43.42 44.31 2oax n LEU 795 CO 0.58 -1.24 1.23 -0.33 -1.11 0.00 0.00 177.39 176.52 2oax h GLU 796 N 0.00 0.88 -0.02 1.96 3.07 -2.00 -0.77 114.58 117.70 2oax h GLU 796 Ca 0.32 -0.05 -0.17 0.00 -0.50 0.00 0.00 59.36 58.96 2oax h GLU 796 Cb 0.52 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 2oax h GLU 796 CO -0.78 0.58 -0.75 -0.44 -1.40 0.00 0.00 179.01 176.23 2oax h ASP 797 N 0.91 0.20 0.31 1.42 3.32 -1.02 -1.46 116.42 120.09 2oax h ASP 797 Ca 0.35 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 2oax h ASP 797 Cb 0.20 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2oax h ASP 797 CO -0.12 0.87 -0.15 1.56 -1.72 0.00 0.00 179.24 179.68 2oax h GLN 798 N 0.11 -0.40 -0.38 3.56 4.20 -0.54 0.17 115.11 121.83 2oax h GLN 798 Ca -0.02 0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.72 2oax h GLN 798 Cb 1.31 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 29.16 2oax h GLN 798 CO 0.11 -0.20 0.24 0.82 -0.67 0.00 0.00 178.83 179.13 2oax h ILE 799 N -0.50 1.07 -0.30 2.54 1.08 -1.22 -1.58 117.51 118.60 2oax h ILE 799 Ca -0.04 -0.17 0.04 0.00 -0.39 0.00 0.00 64.86 64.31 2oax h ILE 799 Cb 0.38 0.54 -0.04 0.00 -3.07 0.00 0.00 36.82 34.63 2oax h ILE 799 CO 0.07 0.09 0.04 0.74 -0.69 0.00 0.00 178.15 178.40 2oax h THR 800 N 0.49 0.84 -0.52 -0.27 2.02 -1.11 0.13 112.91 114.49 2oax h THR 800 Ca 0.14 -0.05 -0.03 0.00 0.77 0.00 0.00 66.41 67.25 2oax h THR 800 Cb -0.03 0.68 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 2oax h THR 800 CO -0.05 0.03 0.20 -0.07 0.37 0.00 0.00 175.52 176.00 2oax h LEU 801 N 0.15 0.67 -0.31 2.58 4.07 -0.28 -0.33 115.31 121.86 2oax h LEU 801 Ca 0.14 -0.08 -0.19 0.00 0.08 0.00 0.00 57.88 57.83 2oax h LEU 801 Cb 0.16 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.73 2oax h LEU 801 CO -0.20 0.61 -0.61 0.40 -1.08 0.00 0.00 178.44 177.56 2oax h ILE 802 N 0.73 1.29 -0.34 1.22 2.04 -0.67 -2.90 117.51 118.88 2oax h ILE 802 Ca 0.18 -1.82 -0.12 0.00 1.00 0.00 0.00 64.86 64.10 2oax h ILE 802 Cb 0.15 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 2oax h ILE 802 CO -0.02 0.58 -0.26 1.56 0.00 0.00 0.00 178.15 180.01 2oax h GLN 803 N 0.59 0.77 0.00 2.37 4.20 -0.41 -1.81 115.11 120.81 2oax h GLN 803 Ca -0.00 -0.38 0.00 0.00 0.06 0.00 0.00 58.65 58.32 2oax h GLN 803 Cb 1.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.99 2oax h GLN 803 CO 0.13 1.01 0.00 0.66 -0.67 0.00 0.00 178.83 179.96 2oax n TYR 804 N -4.23 0.65 -2.09 2.96 0.53 -0.17 -4.09 117.16 110.71 2oax n TYR 804 Ca -0.03 0.24 0.01 0.00 -1.02 0.00 0.00 57.90 57.10 2oax n TYR 804 Cb 0.46 -0.89 0.01 0.00 -1.03 0.00 0.00 39.34 37.90 2oax n TYR 804 CO 0.00 0.00 0.00 -1.13 -1.02 0.00 0.00 176.86 174.71 2oax n SER 805 N -2.07 0.31 0.11 7.72 3.41 -1.10 -4.85 113.62 117.16 2oax n SER 805 Ca 0.03 -2.05 0.05 0.00 -0.26 0.00 0.00 58.87 56.65 2oax n SER 805 Cb 0.26 -0.23 0.51 0.00 -0.26 0.00 0.00 64.21 64.48 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 0.24 0.29 -0.25 7.33 5.08 -1.48 -2.15 115.95 125.02 2oax h TRP 806 Ca -0.05 0.00 -0.17 0.00 1.08 0.00 0.00 58.89 59.75 2oax h TRP 806 Cb 1.50 -0.10 -0.00 0.00 -3.00 0.00 0.00 29.16 27.56 2oax h TRP 806 CO 0.12 0.20 -0.54 1.98 -1.28 0.00 0.00 178.44 178.92 2oax h MET 807 N 0.31 0.75 -0.28 0.12 4.05 -1.88 -0.79 114.93 117.21 2oax h MET 807 Ca 0.08 -0.47 -0.03 0.00 -0.28 0.00 0.00 59.70 59.01 2oax h MET 807 Cb -0.00 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 2oax h MET 807 CO -0.02 1.09 0.07 0.00 0.23 0.00 0.00 176.91 178.29 2oax h LEU 809 N 0.28 -0.81 -0.97 0.00 3.38 -1.36 -0.14 115.31 115.69 2oax h LEU 809 Ca 0.09 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 2oax h LEU 809 Cb 0.27 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2oax h LEU 809 CO -0.00 -0.58 -0.04 -0.07 0.09 0.00 0.00 178.44 177.85 2oax h LEU 810 N -0.96 0.68 -0.12 1.67 3.38 -1.18 -1.57 115.31 117.22 2oax h LEU 810 Ca -0.10 -0.17 -0.24 0.00 0.09 0.00 0.00 57.88 57.47 2oax h LEU 810 Cb 0.73 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.32 2oax h LEU 810 CO 0.16 0.78 -0.85 0.77 0.09 0.00 0.00 178.44 179.39 2oax h SER 811 N 0.66 0.95 0.23 -0.43 4.64 -1.22 -1.65 113.55 116.72 2oax h SER 811 Ca 0.13 -0.66 -0.08 0.00 -0.47 0.00 0.00 61.79 60.71 2oax h SER 811 Cb 0.46 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 2oax h SER 811 CO 0.02 1.46 -0.31 0.15 -0.87 0.00 0.00 176.83 177.28 2oax h PHE 812 N 0.51 0.15 -0.00 4.77 3.57 -0.95 -2.13 116.94 122.86 2oax h PHE 812 Ca -0.07 -0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.23 2oax h PHE 812 Cb 1.49 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 40.17 2oax h PHE 812 CO 0.09 0.44 -0.76 0.00 -2.23 0.00 0.00 178.31 175.85 2oax h ALA 813 N 1.56 0.73 -0.09 2.41 0.00 -1.19 -2.91 119.26 119.78 2oax h ALA 813 Ca 0.02 -0.69 -0.01 0.00 0.00 0.00 0.00 54.91 54.22 2oax h ALA 813 Cb 0.62 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2oax h ALA 813 CO 0.05 0.95 0.02 1.25 0.00 0.00 0.00 179.25 181.51 2oax h LEU 814 N 0.01 0.14 -1.98 0.00 5.85 -0.68 -2.09 115.31 116.55 2oax h LEU 814 Ca -0.01 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.46 2oax h LEU 814 Cb 1.35 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.34 2oax h LEU 814 CO 0.10 0.36 0.03 0.28 -0.34 0.00 0.00 178.44 178.87 2oax h SER 815 N -0.09 0.02 -0.15 1.25 0.02 -1.41 -0.96 113.55 112.23 2oax h SER 815 Ca 0.03 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.88 2oax h SER 815 Cb 0.28 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2oax h SER 815 CO 0.00 0.02 -0.27 -0.25 -1.14 0.00 0.00 176.83 175.19 2oax h TRP 816 N 0.03 0.57 0.00 3.45 2.91 -1.27 -1.39 115.95 120.25 2oax h TRP 816 Ca 0.02 -0.20 -0.09 0.00 1.13 0.00 0.00 58.89 59.75 2oax h TRP 816 Cb 0.04 -0.11 -0.01 0.00 -0.51 0.00 0.00 29.16 28.57 2oax h TRP 816 CO -0.00 0.90 -0.45 0.00 -1.03 0.00 0.00 178.44 177.86 2oax h ARG 817 N 0.08 0.00 -0.12 2.65 3.08 -1.10 -0.93 114.38 118.04 2oax h ARG 817 Ca 0.01 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.93 2oax h ARG 817 Cb 0.85 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2oax h ARG 817 CO 0.06 0.45 -0.48 0.77 -1.07 0.00 0.00 179.97 179.70 2oax h SER 818 N 0.00 0.34 1.06 7.04 0.02 -1.07 -2.14 113.55 118.79 2oax h SER 818 Ca -0.00 -0.16 -0.19 0.00 -0.84 0.00 0.00 61.79 60.59 2oax h SER 818 Cb 0.85 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.26 2oax h SER 818 CO 0.06 0.76 -0.96 0.22 -1.14 0.00 0.00 176.83 175.77 2oax h TYR 819 N 0.25 0.00 0.09 3.45 3.20 -0.75 0.32 116.97 123.54 2oax h TYR 819 Ca 0.01 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.72 2oax h TYR 819 Cb 0.93 0.00 0.01 0.00 1.54 0.00 0.00 36.73 39.21 2oax h TYR 819 CO 0.02 0.88 -0.75 0.87 -1.64 0.00 0.00 178.16 177.55 2oax h LYS 820 N 0.00 0.20 0.20 1.82 1.57 -1.10 -3.00 116.57 116.25 2oax h LYS 820 Ca -0.03 -0.34 -0.35 0.00 -1.87 0.00 0.00 60.65 58.06 2oax h LYS 820 Cb 1.70 0.13 0.02 0.00 0.08 0.00 0.00 32.23 34.15 2oax h LYS 820 CO 0.11 1.16 -1.69 0.45 -0.57 0.00 0.00 179.45 178.91 2oax h HIS 821 N -0.56 0.77 -0.15 -1.35 3.86 -1.55 -3.39 115.15 112.78 2oax h HIS 821 Ca -0.15 -0.56 0.00 0.00 -1.16 0.00 0.00 60.37 58.50 2oax h HIS 821 Cb 1.48 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.92 2oax h HIS 821 CO 0.20 1.64 0.00 0.25 0.86 0.00 0.00 177.93 180.88 2oax n THR 822 N -3.61 0.66 -3.45 2.45 -2.24 -1.08 -4.97 114.28 102.02 2oax n THR 822 Ca -0.23 -0.83 -0.20 0.00 -2.27 0.00 0.00 64.05 60.53 2oax n THR 822 Cb 1.08 0.72 0.08 0.00 -2.10 0.00 0.00 70.33 70.11 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 0.23 -4.34 -3.33 3.42 5.15 -1.10 -2.85 115.26 112.45 2oax n ASN 823 Ca 0.06 -0.54 -0.24 0.00 -0.60 0.00 0.00 54.58 53.26 2oax n ASN 823 Cb 0.30 -4.82 0.02 0.00 -0.53 0.00 0.00 39.78 34.76 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 -2.87 -5.15 -0.07 1.20 7.64 0.11 -4.89 113.62 109.60 2oax n SER 824 Ca -0.12 -0.42 -0.18 0.00 1.01 0.00 0.00 58.87 59.17 2oax n SER 824 Cb 0.60 -4.16 -0.13 0.00 -1.01 0.00 0.00 64.21 59.51 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 -4.13 0.69 -4.43 1.43 7.27 -1.13 -4.64 117.38 112.44 2oax n GLN 825 Ca -0.04 0.18 -0.21 0.00 0.07 0.00 0.00 57.00 57.00 2oax n GLN 825 Cb 0.57 -1.60 -0.10 0.00 2.41 0.00 0.00 30.24 31.52 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 -2.54 1.97 -0.41 3.69 0.08 -1.26 -5.03 117.98 114.48 2oax s PHE 826 Ca -0.26 -0.68 -0.21 0.00 0.12 0.00 0.00 56.93 55.89 2oax s PHE 826 Cb 0.08 -1.11 0.02 0.00 -0.57 0.00 0.00 43.02 41.43 2oax s PHE 826 CO 0.70 0.30 0.69 -0.51 -0.10 0.00 0.00 175.22 176.29 2oax s LEU 827 N -3.45 4.33 -0.96 -0.37 1.43 -1.19 -4.70 118.68 113.77 2oax s LEU 827 Ca 0.29 -0.08 -0.17 0.00 -1.03 0.00 0.00 54.13 53.15 2oax s LEU 827 Cb 0.03 -2.83 0.15 0.00 0.03 0.00 0.00 46.19 43.58 2oax s LEU 827 CO 0.12 -0.75 1.12 -0.47 0.23 0.00 0.00 176.35 176.60 2oax s TYR 828 N 2.93 3.30 0.14 0.29 6.14 -1.26 0.11 117.35 129.00 2oax s TYR 828 Ca 0.26 -1.62 -0.09 0.00 0.64 0.00 0.00 57.07 56.26 2oax s TYR 828 Cb -0.14 -4.21 -0.05 0.00 0.42 0.00 0.00 41.96 37.98 2oax s TYR 828 CO 0.19 -1.39 1.40 0.74 0.64 0.00 0.00 175.55 177.12 2oax h PHE 829 N 8.38 0.95 -1.98 4.97 -1.00 -1.47 -3.40 116.94 123.39 2oax h PHE 829 Ca 0.18 -0.37 0.18 0.00 2.81 0.00 0.00 57.97 60.76 2oax h PHE 829 Cb 1.00 -0.16 -0.15 0.00 3.61 0.00 0.00 35.95 40.24 2oax h PHE 829 CO 1.13 1.18 0.61 0.00 -1.61 0.00 0.00 178.31 179.62 2oax s ALA 830 N -3.92 -1.91 0.30 2.45 0.00 -0.48 -4.96 121.76 113.24 2oax s ALA 830 Ca -0.09 1.06 0.02 0.00 0.00 0.00 0.00 51.96 52.95 2oax s ALA 830 Cb 0.10 0.28 0.73 0.00 0.00 0.00 0.00 23.12 24.23 2oax s ALA 830 CO 0.88 -0.73 1.61 -1.35 0.00 0.00 0.00 175.76 176.16 2oax h PRO 831 N 2.00 0.09 -0.64 0.00 0.11 -1.93 0.49 132.00 132.12 2oax h PRO 831 Ca -0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.91 2oax h PRO 831 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2oax h PRO 831 CO 0.28 0.06 0.00 -0.40 -0.21 0.00 0.00 178.00 177.72 2oax n ASP 832 N -5.37 5.11 -3.10 -2.05 3.85 -1.26 -4.71 116.55 109.04 2oax n ASP 832 Ca 0.22 -2.79 -0.06 0.00 -0.71 0.00 0.00 54.79 51.44 2oax n ASP 832 Cb 0.73 -0.66 -0.02 0.00 -1.35 0.00 0.00 41.12 39.82 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 -2.38 -0.98 -0.17 -2.12 2.96 0.17 -4.64 118.68 111.53 2oax s LEU 833 Ca 0.48 -1.47 -0.02 0.00 -0.22 0.00 0.00 54.13 52.89 2oax s LEU 833 Cb 0.36 1.48 -0.01 0.00 0.50 0.00 0.00 46.19 48.51 2oax s LEU 833 CO 0.14 -0.14 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.26 2oax s VAL 834 N 1.27 3.33 -0.06 1.68 1.01 -1.25 -1.15 120.40 125.22 2oax s VAL 834 Ca 0.23 -0.54 -0.25 0.00 0.00 0.00 0.00 61.98 61.42 2oax s VAL 834 Cb -0.04 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 2oax s VAL 834 CO -0.07 0.48 0.76 -0.36 0.00 0.00 0.00 175.10 175.92 2oax s PHE 835 N 0.78 3.58 0.66 5.22 0.40 0.12 -4.95 117.98 123.78 2oax s PHE 835 Ca -0.03 1.33 0.04 0.00 -0.60 0.00 0.00 56.93 57.67 2oax s PHE 835 Cb -0.15 -2.88 0.12 0.00 0.51 0.00 0.00 43.02 40.63 2oax s PHE 835 CO 0.01 0.04 0.91 -1.71 0.70 0.00 0.00 175.22 175.18 2oax n ASN 836 N 3.92 1.65 -0.08 1.36 2.85 -1.26 -3.18 115.26 120.51 2oax n ASN 836 Ca 0.01 -2.29 -0.11 0.00 -0.11 0.00 0.00 54.58 52.07 2oax n ASN 836 Cb 0.51 -0.55 -0.04 0.00 1.24 0.00 0.00 39.78 40.94 2oax n ASN 836 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 2oax h GLU 837 N 0.00 0.42 0.00 1.20 4.22 -1.97 -1.09 114.58 117.35 2oax h GLU 837 Ca -0.30 -0.11 -0.07 0.00 0.08 0.00 0.00 59.36 58.95 2oax h GLU 837 Cb 1.22 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 2oax h GLU 837 CO 0.37 0.54 -0.35 1.05 -2.18 0.00 0.00 179.01 178.44 2oax h GLU 838 N 0.23 0.00 -0.51 1.92 4.11 -2.00 -2.51 114.58 115.82 2oax h GLU 838 Ca 0.08 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.39 2oax h GLU 838 Cb 0.33 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2oax h GLU 838 CO 0.00 0.35 -0.14 0.87 0.07 0.00 0.00 179.01 180.16 2oax h LYS 839 N 0.00 0.99 -0.59 1.06 6.56 -1.83 -0.61 116.57 122.16 2oax h LYS 839 Ca -0.00 -0.38 -0.06 0.00 -1.06 0.00 0.00 60.65 59.14 2oax h LYS 839 Cb 0.65 -0.06 -0.03 0.00 -0.57 0.00 0.00 32.23 32.23 2oax h LYS 839 CO 0.04 1.06 0.11 0.52 -2.06 0.00 0.00 179.45 179.13 2oax h MET 840 N 0.88 0.93 -0.20 3.15 2.86 -0.78 -3.10 114.93 118.67 2oax h MET 840 Ca 0.13 -0.22 -0.18 0.00 -2.06 0.00 0.00 59.70 57.37 2oax h MET 840 Cb 0.71 -0.13 0.01 0.00 0.06 0.00 0.00 31.60 32.25 2oax h MET 840 CO 0.05 0.85 -0.60 0.45 1.06 0.00 0.00 176.91 178.73 2oax h HIS 841 N 0.89 0.98 0.00 -0.22 3.86 -1.21 -3.11 115.15 116.33 2oax h HIS 841 Ca 0.19 -0.39 0.00 0.00 -1.16 0.00 0.00 60.37 59.00 2oax h HIS 841 Cb 0.36 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.67 2oax h HIS 841 CO 0.02 1.20 0.00 1.04 0.86 0.00 0.00 177.93 181.06 2oax n GLN 842 N -4.06 0.43 0.00 2.45 1.13 -0.26 -1.88 117.38 115.19 2oax n GLN 842 Ca -0.06 0.00 0.09 0.00 -1.94 0.00 0.00 57.00 55.09 2oax n GLN 842 Cb 0.65 -1.43 0.01 0.00 0.11 0.00 0.00 30.24 29.59 2oax n GLN 842 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 2oax n SER 843 N -0.93 1.93 -0.13 1.08 3.41 -1.18 -3.71 113.62 114.09 2oax n SER 843 Ca 0.09 -1.46 -0.02 0.00 -0.26 0.00 0.00 58.87 57.22 2oax n SER 843 Cb 0.04 0.39 -0.01 0.00 -0.26 0.00 0.00 64.21 64.38 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 0.12 -0.02 -0.65 7.33 0.00 -0.79 -4.75 120.51 121.74 2oax n ALA 844 Ca 0.08 0.03 0.07 0.00 0.00 0.00 0.00 53.44 53.62 2oax n ALA 844 Cb 0.41 -1.54 0.23 0.00 0.00 0.00 0.00 19.45 18.54 2oax n ALA 844 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2oax n MET 845 N 0.73 3.00 -0.73 0.00 2.81 -1.26 -5.03 117.12 116.65 2oax n MET 845 Ca -0.02 -2.55 -0.32 0.00 -1.81 0.00 0.00 57.70 53.01 2oax n MET 845 Cb 0.51 -1.63 0.15 0.00 -0.71 0.00 0.00 33.22 31.54 2oax n MET 845 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 2oax n TYR 846 N -0.00 -0.92 0.00 2.03 4.19 -1.20 -1.37 117.16 119.89 2oax n TYR 846 Ca 0.18 0.23 0.00 0.00 3.31 0.00 0.00 57.90 61.62 2oax n TYR 846 Cb 0.72 -1.80 0.00 0.00 0.49 0.00 0.00 39.34 38.75 2oax n TYR 846 CO 0.00 0.00 0.00 -1.91 0.91 0.00 0.00 176.86 175.86 2oax n GLU 847 N -2.57 0.00 0.02 2.98 4.07 -1.26 -4.38 120.64 119.50 2oax n GLU 847 Ca 0.07 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 57.02 2oax n GLU 847 Cb 0.54 -0.01 -0.04 0.00 -0.06 0.00 0.00 31.44 31.87 2oax n GLU 847 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2oax h LEU 848 N 0.00 0.76 -0.81 4.31 4.07 -1.63 -0.56 115.31 121.45 2oax h LEU 848 Ca 0.00 -0.52 -0.10 0.00 0.08 0.00 0.00 57.88 57.33 2oax h LEU 848 Cb 0.00 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.50 2oax h LEU 848 CO 0.00 1.31 -0.49 0.00 -1.08 0.00 0.00 178.44 178.17 2oax h GLN 850 N 0.00 0.00 -0.35 0.00 1.08 -1.80 -2.11 115.11 111.93 2oax h GLN 850 Ca -0.00 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.08 2oax h GLN 850 Cb 1.01 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.44 2oax h GLN 850 CO 0.06 0.66 -0.22 0.78 -0.95 0.00 0.00 178.83 179.17 2oax h GLY 851 N 2.60 0.84 2.00 3.46 0.00 -0.72 0.12 103.07 111.37 2oax h GLY 851 Ca -0.01 -0.79 -0.16 0.00 0.00 0.00 0.00 47.33 46.37 2oax h GLY 851 CO 0.09 0.72 -0.77 -0.33 0.00 0.00 0.00 176.54 176.24 2oax h MET 852 N 0.56 0.00 -0.69 4.80 2.86 -1.52 -2.92 114.93 118.01 2oax h MET 852 Ca 0.07 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.64 2oax h MET 852 Cb 0.78 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.41 2oax h MET 852 CO 0.06 0.77 0.16 1.25 1.06 0.00 0.00 176.91 180.21 2oax h HIS 853 N 0.00 1.17 -0.13 -0.22 6.17 -1.24 -2.00 115.15 118.90 2oax h HIS 853 Ca -0.01 -0.14 -0.08 0.00 0.71 0.00 0.00 60.37 60.85 2oax h HIS 853 Cb 1.46 -0.33 -0.01 0.00 2.52 0.00 0.00 27.41 31.05 2oax h HIS 853 CO 0.00 0.96 -0.27 1.96 0.71 0.00 0.00 177.93 181.29 2oax h GLN 854 N 1.04 0.24 -0.51 5.26 1.08 -0.88 -1.62 115.11 119.72 2oax h GLN 854 Ca 0.22 -0.08 -0.09 0.00 -1.45 0.00 0.00 58.65 57.25 2oax h GLN 854 Cb 0.38 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.78 2oax h GLN 854 CO 0.00 0.49 -0.01 0.82 -0.95 0.00 0.00 178.83 179.19 2oax h ILE 855 N 0.21 1.26 -0.11 2.54 1.08 -1.26 -2.28 117.51 118.96 2oax h ILE 855 Ca 0.03 -1.11 -0.06 0.00 -0.39 0.00 0.00 64.86 63.33 2oax h ILE 855 Cb 0.59 0.96 -0.01 0.00 -3.07 0.00 0.00 36.82 35.29 2oax h ILE 855 CO 0.04 0.39 -0.21 0.77 -0.69 0.00 0.00 178.15 178.45 2oax h SER 856 N 0.79 0.18 0.19 1.72 4.64 -0.81 -1.63 113.55 118.62 2oax h SER 856 Ca 0.14 -0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.36 2oax h SER 856 Cb 0.54 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2oax h SER 856 CO 0.03 0.41 -0.23 -0.07 -0.87 0.00 0.00 176.83 176.10 2oax h LEU 857 N 0.17 0.07 -0.75 5.97 3.38 -0.83 -1.69 115.31 121.63 2oax h LEU 857 Ca 0.03 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 2oax h LEU 857 Cb 0.48 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2oax h LEU 857 CO 0.03 0.30 -0.59 1.56 0.09 0.00 0.00 178.44 179.84 2oax h GLN 858 N 0.07 0.12 -0.90 1.13 4.20 -0.76 -2.26 115.11 116.71 2oax h GLN 858 Ca 0.01 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.66 2oax h GLN 858 Cb 0.44 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.19 2oax h GLN 858 CO 0.03 0.67 0.59 0.74 -0.67 0.00 0.00 178.83 180.20 2oax h PHE 859 N 0.09 1.12 -0.52 2.96 -1.00 -1.04 0.11 116.94 118.66 2oax h PHE 859 Ca -0.00 0.03 -0.12 0.00 2.81 0.00 0.00 57.97 60.69 2oax h PHE 859 Cb 1.06 -0.38 -0.02 0.00 3.61 0.00 0.00 35.95 40.23 2oax h PHE 859 CO 0.01 0.68 -0.13 0.28 -1.61 0.00 0.00 178.31 177.55 2oax h VAL 860 N 1.19 1.27 0.00 -0.55 2.07 -1.31 0.79 116.25 119.71 2oax h VAL 860 Ca 0.34 -1.29 -0.07 0.00 0.82 0.00 0.00 66.70 66.50 2oax h VAL 860 Cb -0.09 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2oax h VAL 860 CO -0.09 0.45 -0.33 -0.09 0.02 0.00 0.00 177.57 177.54 2oax h ARG 861 N 0.88 0.00 0.00 1.57 2.43 -0.82 -2.82 114.38 115.62 2oax h ARG 861 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2oax h ARG 861 Cb 0.70 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 2oax h ARG 861 CO 0.05 0.33 -1.11 1.28 -1.51 0.00 0.00 179.97 179.02 2oax n LEU 862 N -3.68 0.64 -3.52 3.80 4.77 0.32 -4.99 117.00 114.35 2oax n LEU 862 Ca -0.01 -0.37 -0.20 0.00 -0.03 0.00 0.00 56.01 55.40 2oax n LEU 862 Cb 0.44 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.58 2oax n LEU 862 CO 0.36 0.16 0.00 1.67 -1.33 0.00 0.00 177.39 178.25 2oax n GLN 863 N -1.61 -4.32 -1.68 3.23 -0.06 0.26 -4.83 117.38 108.37 2oax n GLN 863 Ca 0.02 0.72 -0.45 0.00 -2.00 0.00 0.00 57.00 55.29 2oax n GLN 863 Cb 0.33 -5.38 -0.03 0.00 -4.06 0.00 0.00 30.24 21.10 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 -3.99 3.36 -4.90 1.69 7.94 -0.38 -4.99 117.00 115.74 2oax n LEU 864 Ca -0.22 1.10 -0.28 0.00 -1.11 0.00 0.00 56.01 55.50 2oax n LEU 864 Cb 0.65 -1.47 -0.02 0.00 0.53 0.00 0.00 43.42 43.11 2oax n LEU 864 CO 0.64 -0.23 0.33 0.42 -1.11 0.00 0.00 177.39 177.44 2oax s THR 865 N 0.60 4.93 0.43 1.96 -4.23 -1.26 -4.95 115.64 113.12 2oax s THR 865 Ca 0.74 0.21 0.27 0.00 -1.18 0.00 0.00 61.69 61.72 2oax s THR 865 Cb -0.63 -3.78 0.29 0.00 1.34 0.00 0.00 72.50 69.72 2oax s THR 865 CO 0.41 -0.53 2.08 0.15 -0.54 0.00 0.00 174.62 176.19 2oax h PHE 866 N 1.11 0.00 -0.11 3.99 3.57 -1.99 -0.60 116.94 122.91 2oax h PHE 866 Ca -0.48 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 60.81 2oax h PHE 866 Cb 1.20 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.94 2oax h PHE 866 CO 0.58 0.12 -0.79 0.93 -2.23 0.00 0.00 178.31 176.91 2oax h GLU 867 N 0.00 0.62 -0.08 1.11 3.07 -1.96 -2.68 114.58 114.67 2oax h GLU 867 Ca -0.00 -0.53 -0.14 0.00 -0.50 0.00 0.00 59.36 58.19 2oax h GLU 867 Cb 0.31 0.12 0.01 0.00 -0.84 0.00 0.00 28.75 28.35 2oax h GLU 867 CO 0.02 1.15 -0.50 0.93 -1.40 0.00 0.00 179.01 179.20 2oax h GLU 868 N 0.42 0.47 0.32 2.33 5.08 -1.66 -3.19 114.58 118.36 2oax h GLU 868 Ca -0.05 -0.41 -0.01 0.00 -1.00 0.00 0.00 59.36 57.89 2oax h GLU 868 Cb 1.40 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.72 2oax h GLU 868 CO 0.15 1.05 -0.40 -0.92 -1.00 0.00 0.00 179.01 177.89 2oax h TYR 869 N 0.03 -1.13 -1.10 4.33 3.20 -1.21 0.12 116.97 121.22 2oax h TYR 869 Ca -0.04 0.01 0.30 0.00 3.14 0.00 0.00 58.73 62.14 2oax h TYR 869 Cb 1.16 0.45 -0.09 0.00 1.54 0.00 0.00 36.73 39.79 2oax h TYR 869 CO 0.12 -0.51 0.72 0.00 -1.64 0.00 0.00 178.16 176.85 2oax h THR 870 N -0.74 0.45 0.09 1.81 1.03 -1.60 0.13 112.91 114.08 2oax h THR 870 Ca -0.04 -0.10 -0.28 0.00 -0.01 0.00 0.00 66.41 65.98 2oax h THR 870 Cb 0.66 0.13 -0.01 0.00 -1.07 0.00 0.00 68.15 67.86 2oax h THR 870 CO -0.09 0.05 -1.39 0.40 -0.01 0.00 0.00 175.52 174.48 2oax h ILE 871 N 0.29 1.31 0.00 0.00 2.04 -1.46 -3.15 117.51 116.54 2oax h ILE 871 Ca 0.62 -2.96 -0.07 0.00 1.00 0.00 0.00 64.86 63.46 2oax h ILE 871 Cb 1.77 2.80 -0.01 0.00 -0.74 0.00 0.00 36.82 40.64 2oax h ILE 871 CO -0.27 0.84 -0.34 0.24 0.00 0.00 0.00 178.15 178.62 2oax h MET 872 N 0.05 0.00 -0.16 2.37 2.86 0.17 -2.04 114.93 118.18 2oax h MET 872 Ca -0.18 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.29 2oax h MET 872 Cb 1.97 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.62 2oax h MET 872 CO 0.16 0.34 -0.60 -0.22 1.06 0.00 0.00 176.91 177.64 2oax h LYS 873 N 0.00 0.55 -0.20 1.72 3.64 -1.02 -1.98 116.57 119.28 2oax h LYS 873 Ca -0.00 -0.38 -0.09 0.00 -1.27 0.00 0.00 60.65 58.91 2oax h LYS 873 Cb 0.60 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2oax h LYS 873 CO 0.04 0.99 -0.28 0.28 -2.27 0.00 0.00 179.45 178.21 2oax h VAL 874 N 0.41 1.27 -0.42 2.00 2.07 -1.42 -2.66 116.25 117.50 2oax h VAL 874 Ca -0.00 -1.28 -0.14 0.00 0.82 0.00 0.00 66.70 66.09 2oax h VAL 874 Cb 1.16 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 2oax h VAL 874 CO 0.11 0.40 -0.29 -0.07 0.02 0.00 0.00 177.57 177.74 2oax h LEU 875 N 0.34 0.95 -1.06 2.57 3.38 -1.09 -2.83 115.31 117.56 2oax h LEU 875 Ca 0.05 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.60 2oax h LEU 875 Cb 0.68 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 2oax h LEU 875 CO 0.05 1.17 0.32 -0.07 0.09 0.00 0.00 178.44 180.00 2oax h LEU 876 N 0.77 0.89 -2.18 1.67 3.38 -1.16 0.31 115.31 118.99 2oax h LEU 876 Ca 0.09 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2oax h LEU 876 Cb 0.86 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 2oax h LEU 876 CO 0.08 0.76 0.04 0.25 0.09 0.00 0.00 178.44 179.66 2oax h LEU 877 N 0.98 0.00 -3.65 1.67 5.85 -1.24 -0.67 115.31 118.24 2oax h LEU 877 Ca 0.24 0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.59 2oax h LEU 877 Cb 0.11 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 40.93 2oax h LEU 877 CO -0.03 0.00 0.20 0.18 -0.34 0.00 0.00 178.44 178.45 2oax n LEU 878 N -4.23 5.40 -0.02 2.25 4.77 0.04 -4.55 117.00 120.65 2oax n LEU 878 Ca -0.02 -3.86 -0.01 0.00 -0.03 0.00 0.00 56.01 52.09 2oax n LEU 878 Cb 0.14 -0.72 -0.12 0.00 -2.33 0.00 0.00 43.42 40.39 2oax n LEU 878 CO 0.31 1.28 -0.66 -1.20 -1.33 0.00 0.00 177.39 175.80 2oax n SER 879 N -1.09 0.43 -3.98 -1.43 7.64 -0.26 -4.92 113.62 110.01 2oax n SER 879 Ca 0.46 0.19 -0.25 0.00 1.01 0.00 0.00 58.87 60.28 2oax n SER 879 Cb 1.20 0.77 -0.17 0.00 -1.01 0.00 0.00 64.21 65.00 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 -2.90 1.08 0.23 0.44 2.01 -1.26 0.24 115.64 115.48 2oax s THR 880 Ca -0.06 -0.41 0.04 0.00 0.31 0.00 0.00 61.69 61.57 2oax s THR 880 Cb 0.09 -1.02 -0.05 0.00 0.01 0.00 0.00 72.50 71.52 2oax s THR 880 CO 0.84 0.35 -0.03 0.27 -0.69 0.00 0.00 174.62 175.36 2oax s ILE 881 N 1.00 1.15 0.74 1.82 -4.36 -0.98 -4.81 121.20 115.76 2oax s ILE 881 Ca -0.08 -2.05 -0.14 0.00 -0.26 0.00 0.00 60.65 58.11 2oax s ILE 881 Cb -0.15 -2.29 0.05 0.00 1.25 0.00 0.00 42.46 41.32 2oax s ILE 881 CO -0.00 -0.38 1.19 -2.84 0.24 0.00 0.00 174.94 173.15 2oax s PRO 882 N -3.82 2.09 0.19 0.37 0.02 -1.26 0.72 135.00 133.31 2oax s PRO 882 Ca 0.27 1.68 -0.15 0.00 0.02 0.00 0.00 61.00 62.83 2oax s PRO 882 Cb 0.05 -1.84 0.18 0.00 0.02 0.00 0.00 34.50 32.91 2oax s PRO 882 CO 0.08 -1.85 1.66 1.57 -0.33 0.00 0.00 177.00 178.13 2oax h LYS 883 N -0.46 0.04 -0.66 5.54 2.10 -1.23 -1.60 116.57 120.30 2oax h LYS 883 Ca -0.47 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 2oax h LYS 883 Cb 1.29 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 2oax h LYS 883 CO 0.49 0.03 0.00 -0.25 -2.00 0.00 0.00 179.45 177.72 2oax n ASP 884 N -5.31 4.13 0.00 7.07 8.00 -1.26 -4.97 116.55 124.20 2oax n ASP 884 Ca 0.05 -2.53 0.00 0.00 0.71 0.00 0.00 54.79 53.02 2oax n ASP 884 Cb 0.28 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 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 0.67 -2.71 2.52 0.44 0.00 -0.60 -5.02 105.19 100.49 2oax n GLY 885 Ca 0.20 -1.80 -0.16 0.00 0.00 0.00 0.00 46.02 44.26 2oax n GLY 885 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oax n LEU 886 N 0.00 0.00 -0.11 0.99 4.77 -1.26 -4.42 117.00 116.97 2oax n LEU 886 Ca 0.00 -1.84 -0.10 0.00 -0.03 0.00 0.00 56.01 54.03 2oax n LEU 886 Cb 0.00 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 40.99 2oax n LEU 886 CO 0.00 -0.51 0.81 0.50 -1.33 0.00 0.00 177.39 176.86 2oax h LYS 887 N 0.00 0.54 -2.80 3.23 3.64 -1.96 -3.31 116.57 115.91 2oax h LYS 887 Ca -0.22 -0.15 -0.66 0.00 -1.27 0.00 0.00 60.65 58.35 2oax h LYS 887 Cb 0.84 -0.06 -0.39 0.00 -0.41 0.00 0.00 32.23 32.21 2oax h LYS 887 CO 0.34 0.64 -0.29 0.43 -2.27 0.00 0.00 179.45 178.30 2oax n SER 888 N -4.60 4.03 -0.07 4.20 7.64 -1.26 -4.93 113.62 118.63 2oax n SER 888 Ca -0.02 -3.30 -0.10 0.00 1.01 0.00 0.00 58.87 56.46 2oax n SER 888 Cb 0.23 -0.87 -0.03 0.00 -1.01 0.00 0.00 64.21 62.53 2oax n SER 888 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2oax h GLN 889 N 5.10 0.33 -0.57 1.43 5.75 -1.97 -2.12 115.11 123.06 2oax h GLN 889 Ca 0.18 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.63 2oax h GLN 889 Cb 0.72 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.17 2oax h GLN 889 CO 0.87 0.28 0.28 0.00 -2.65 0.00 0.00 178.83 177.61 2oax h ALA 890 N 1.04 1.42 -0.46 3.38 0.00 -1.94 -0.95 119.26 121.75 2oax h ALA 890 Ca 0.09 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2oax h ALA 890 Cb 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2oax h ALA 890 CO -0.02 0.46 -0.00 0.00 0.00 0.00 0.00 179.25 179.69 2oax h ALA 891 N 1.51 1.13 0.62 0.00 0.00 -1.90 -2.59 119.26 118.02 2oax h ALA 891 Ca 0.20 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2oax h ALA 891 Cb 0.07 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.68 2oax h ALA 891 CO -0.03 0.56 -0.30 0.35 0.00 0.00 0.00 179.25 179.83 2oax h PHE 892 N 0.71 -0.77 -0.80 0.00 3.57 -0.58 -3.01 116.94 116.05 2oax h PHE 892 Ca 0.14 -0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.81 2oax h PHE 892 Cb 0.44 0.25 -0.12 0.00 2.79 0.00 0.00 35.95 39.31 2oax h PHE 892 CO 0.02 -0.48 0.21 0.93 -2.23 0.00 0.00 178.31 176.77 2oax h GLU 893 N -1.06 0.26 0.00 1.11 5.08 -1.22 0.40 114.58 119.15 2oax h GLU 893 Ca -0.08 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 2oax h GLU 893 Cb 0.64 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 2oax h GLU 893 CO 0.14 0.17 -0.09 1.49 -1.00 0.00 0.00 179.01 179.72 2oax h GLU 894 N 0.26 0.00 0.00 2.33 4.22 -1.53 -0.17 114.58 119.69 2oax h GLU 894 Ca 0.47 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.91 2oax h GLU 894 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2oax h GLU 894 CO -0.56 0.09 -0.00 1.98 -2.18 0.00 0.00 179.01 178.33 2oax h MET 895 N 0.00 -0.00 -0.21 1.92 4.05 -0.12 -2.78 114.93 117.79 2oax h MET 895 Ca -0.00 0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.46 2oax h MET 895 Cb 0.21 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 30.97 2oax h MET 895 CO 0.01 0.90 -0.06 -0.09 0.23 0.00 0.00 176.91 177.90 2oax h ARG 896 N -0.99 -0.01 -0.89 0.39 2.43 -0.95 -0.86 114.38 113.50 2oax h ARG 896 Ca -0.00 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.30 2oax h ARG 896 Cb 0.90 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.38 2oax h ARG 896 CO 0.00 -0.01 0.57 1.15 -1.51 0.00 0.00 179.97 180.18 2oax h THR 897 N -0.01 0.89 -0.13 0.20 2.02 -1.15 0.97 112.91 115.68 2oax h THR 897 Ca 0.11 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 2oax h THR 897 Cb 0.17 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.62 2oax h THR 897 CO -0.23 0.14 0.01 0.78 0.37 0.00 0.00 175.52 176.60 2oax h ASN 898 N 0.78 0.22 0.08 4.18 2.35 -0.91 -1.59 115.58 120.69 2oax h ASN 898 Ca 0.44 -0.28 -0.07 0.00 -0.55 0.00 0.00 56.30 55.84 2oax h ASN 898 Cb 0.59 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.89 2oax h ASN 898 CO -0.20 0.44 -0.21 1.88 -1.65 0.00 0.00 177.43 177.69 2oax h TYR 899 N -0.01 0.27 -0.34 1.19 0.05 -0.43 -0.66 116.97 117.04 2oax h TYR 899 Ca 0.04 -0.04 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 2oax h TYR 899 Cb 0.32 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 2oax h TYR 899 CO 0.02 0.45 0.20 0.82 -1.05 0.00 0.00 178.16 178.60 2oax h ILE 900 N 0.23 1.13 0.00 -2.88 2.04 -0.62 -0.88 117.51 116.53 2oax h ILE 900 Ca 0.04 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 2oax h ILE 900 Cb 0.51 0.72 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2oax h ILE 900 CO 0.03 0.13 -0.09 0.11 0.00 0.00 0.00 178.15 178.33 2oax h LYS 901 N 0.43 0.00 0.00 2.37 6.56 -0.69 0.14 116.57 125.37 2oax h LYS 901 Ca 0.12 0.00 -0.17 0.00 -1.06 0.00 0.00 60.65 59.54 2oax h LYS 901 Cb 0.03 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.67 2oax h LYS 901 CO -0.02 0.09 -0.80 1.49 -2.06 0.00 0.00 179.45 178.15 2oax h GLU 902 N 0.00 0.00 0.11 3.15 4.57 0.16 -3.07 114.58 119.49 2oax h GLU 902 Ca -0.00 0.00 -0.29 0.00 -1.18 0.00 0.00 59.36 57.89 2oax h GLU 902 Cb 0.32 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 2oax h GLU 902 CO 0.01 0.80 -1.46 1.25 -1.18 0.00 0.00 179.01 178.43 2oax h LEU 903 N 0.00 0.35 -1.08 1.64 5.85 -0.07 -1.90 115.31 120.10 2oax h LEU 903 Ca -0.01 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2oax h LEU 903 Cb 1.52 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.43 2oax h LEU 903 CO 0.10 1.38 0.00 -1.14 -0.34 0.00 0.00 178.44 178.45 2oax n ARG 904 N -3.44 0.13 -0.12 1.25 3.00 0.36 -2.21 116.66 115.64 2oax n ARG 904 Ca -0.14 0.56 -0.24 0.00 -0.00 0.00 0.00 57.85 58.03 2oax n ARG 904 Cb 1.03 -1.88 -0.09 0.00 0.00 0.00 0.00 32.46 31.52 2oax n ARG 904 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2oax n LYS 905 N -2.15 0.53 0.00 -0.14 4.81 -1.16 -4.39 118.16 115.65 2oax n LYS 905 Ca -0.00 0.20 0.01 0.00 -0.87 0.00 0.00 58.31 57.65 2oax n LYS 905 Cb 0.08 -1.39 0.05 0.00 0.02 0.00 0.00 35.03 33.79 2oax n LYS 905 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 2oax n MET 906 N -3.87 0.00 -1.39 1.64 1.56 -0.72 -5.12 117.12 109.22 2oax n MET 906 Ca -0.46 0.45 0.00 0.00 -0.27 0.00 0.00 57.70 57.41 2oax n MET 906 Cb 0.86 -1.50 0.00 0.00 2.15 0.00 0.00 33.22 34.73 2oax n MET 906 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 2oax n VAL 907 N -1.49 0.00 -0.11 1.12 0.31 -0.94 -4.83 118.33 112.40 2oax n VAL 907 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 2oax n VAL 907 Cb 0.03 -0.59 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 2oax n VAL 907 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2oax n GLN 916 N -0.59 -0.23 -0.03 5.55 0.00 -1.26 -4.99 117.38 115.84 2oax n GLN 916 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.00 56.84 2oax n GLN 916 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 30.24 30.11 2oax n GLN 916 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 2oax h SER 917 N 0.00 0.18 0.45 1.69 0.87 -2.02 -3.03 113.55 111.69 2oax h SER 917 Ca 0.00 -0.96 -0.13 0.00 -1.23 0.00 0.00 61.79 59.47 2oax h SER 917 Cb 0.00 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 2oax h SER 917 CO 0.00 1.13 -0.55 4.11 -0.53 0.00 0.00 176.83 180.98 2oax h TRP 918 N -0.74 0.14 -0.12 2.24 5.08 -1.97 -3.08 115.95 117.50 2oax h TRP 918 Ca -0.05 -0.05 -0.04 0.00 1.08 0.00 0.00 58.89 59.83 2oax h TRP 918 Cb 1.21 -0.03 -0.01 0.00 -3.00 0.00 0.00 29.16 27.34 2oax h TRP 918 CO 0.24 0.64 -0.11 0.37 -1.28 0.00 0.00 178.44 178.30 2oax h GLN 919 N 0.08 0.18 -0.02 0.12 -0.00 -2.01 -1.47 115.11 111.99 2oax h GLN 919 Ca -0.00 -0.04 -0.16 0.00 -0.00 0.00 0.00 58.65 58.45 2oax h GLN 919 Cb 1.01 -0.03 -0.02 0.00 0.00 0.00 0.00 27.48 28.44 2oax h GLN 919 CO 0.08 0.31 -0.73 -0.09 0.00 0.00 0.00 178.83 178.40 2oax h ARG 920 N 0.18 0.13 -0.70 1.69 2.43 -1.46 -2.90 114.38 113.75 2oax h ARG 920 Ca 0.04 -0.11 0.03 0.00 -0.81 0.00 0.00 59.98 59.12 2oax h ARG 920 Cb 0.32 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 2oax h ARG 920 CO 0.02 0.80 0.44 0.35 -1.51 0.00 0.00 179.97 180.07 2oax h PHE 921 N 0.08 0.83 -0.84 2.20 3.57 -1.20 -0.51 116.94 121.07 2oax h PHE 921 Ca -0.02 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2oax h PHE 921 Cb 1.28 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 39.71 2oax h PHE 921 CO 0.01 0.48 0.48 -0.92 -2.23 0.00 0.00 178.31 176.14 2oax h TYR 922 N 0.87 1.13 -0.54 0.41 3.20 -1.31 -1.02 116.97 119.70 2oax h TYR 922 Ca 0.28 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 62.03 2oax h TYR 922 Cb -0.00 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 37.88 2oax h TYR 922 CO -0.04 0.77 -0.07 1.96 -1.64 0.00 0.00 178.16 179.13 2oax h GLN 923 N 1.17 0.98 -0.11 1.82 4.20 -1.04 -1.15 115.11 120.97 2oax h GLN 923 Ca 0.30 -0.34 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 2oax h GLN 923 Cb -0.01 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.70 2oax h GLN 923 CO -0.05 1.01 -0.26 -0.07 -0.67 0.00 0.00 178.83 178.78 2oax h LEU 924 N 0.88 0.43 -1.60 1.46 3.38 -0.81 -1.51 115.31 117.55 2oax h LEU 924 Ca 0.15 -0.57 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 2oax h LEU 924 Cb 0.62 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2oax h LEU 924 CO 0.04 0.93 -0.06 0.71 0.09 0.00 0.00 178.44 180.14 2oax h THR 925 N -0.05 1.12 -0.27 0.22 1.35 -1.17 0.11 112.91 114.22 2oax h THR 925 Ca -0.00 -0.51 -0.12 0.00 -0.55 0.00 0.00 66.41 65.23 2oax h THR 925 Cb 0.86 1.10 -0.00 0.00 -1.73 0.00 0.00 68.15 68.38 2oax h THR 925 CO 0.06 0.16 -0.30 0.11 -0.25 0.00 0.00 175.52 175.30 2oax h LYS 926 N 0.17 0.68 -0.94 4.72 1.79 -1.12 -0.70 116.57 121.18 2oax h LYS 926 Ca 0.04 -0.37 -0.01 0.00 -2.18 0.00 0.00 60.65 58.14 2oax h LYS 926 Cb 0.23 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.85 2oax h LYS 926 CO 0.01 0.98 0.56 1.25 -1.08 0.00 0.00 179.45 181.16 2oax h LEU 927 N 0.41 1.13 -0.18 2.94 6.46 -0.44 -1.19 115.31 124.44 2oax h LEU 927 Ca 0.04 -0.07 -0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2oax h LEU 927 Cb 0.87 -0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 40.50 2oax h LEU 927 CO 0.07 0.87 0.10 -0.07 -0.62 0.00 0.00 178.44 178.79 2oax h LEU 928 N 1.29 0.22 -0.50 2.25 3.38 -0.61 -2.85 115.31 118.50 2oax h LEU 928 Ca 0.33 -0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.30 2oax h LEU 928 Cb -0.04 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.59 2oax h LEU 928 CO -0.06 0.24 0.14 0.44 0.09 0.00 0.00 178.44 179.29 2oax h ASP 929 N 0.19 0.09 0.10 -0.43 3.32 -0.24 -1.72 116.42 117.73 2oax h ASP 929 Ca 0.06 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2oax h ASP 929 Cb 0.06 0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2oax h ASP 929 CO -0.01 0.08 0.00 -1.54 -1.72 0.00 0.00 179.24 176.05 2oax n SER 930 N -5.06 0.16 -0.11 6.45 3.41 -0.54 -2.25 113.62 115.69 2oax n SER 930 Ca 0.06 0.57 -0.10 0.00 -0.26 0.00 0.00 58.87 59.13 2oax n SER 930 Cb 0.23 -0.59 0.03 0.00 -0.26 0.00 0.00 64.21 63.62 2oax n SER 930 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 2oax h MET 931 N 0.00 0.87 -0.65 4.33 2.86 -1.25 -3.14 114.93 117.95 2oax h MET 931 Ca 0.00 -0.40 0.10 0.00 -2.06 0.00 0.00 59.70 57.34 2oax h MET 931 Cb 0.05 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 31.62 2oax h MET 931 CO 0.00 1.04 0.27 0.45 1.06 0.00 0.00 176.91 179.73 2oax h HIS 932 N 0.73 0.47 -0.66 -0.22 3.86 -1.60 0.40 115.15 118.13 2oax h HIS 932 Ca 0.08 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.25 2oax h HIS 932 Cb 0.85 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 29.18 2oax h HIS 932 CO 0.05 0.13 0.13 -0.44 0.86 0.00 0.00 177.93 178.66 2oax h ASP 933 N 0.46 1.03 0.35 2.45 5.19 -1.74 -1.75 116.42 122.42 2oax h ASP 933 Ca 0.33 -0.25 -0.02 0.00 -0.62 0.00 0.00 57.03 56.47 2oax h ASP 933 Cb 0.40 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 39.64 2oax h ASP 933 CO -0.30 1.02 -0.17 0.25 -3.12 0.00 0.00 179.24 176.91 2oax h LEU 934 N 1.01 -0.40 -1.18 1.55 7.12 -1.29 -3.00 115.31 119.11 2oax h LEU 934 Ca 0.21 -0.13 0.12 0.00 0.13 0.00 0.00 57.88 58.20 2oax h LEU 934 Cb 0.40 0.10 -0.07 0.00 -0.53 0.00 0.00 40.66 40.57 2oax h LEU 934 CO 0.01 -0.08 0.59 0.58 -0.13 0.00 0.00 178.44 179.40 2oax h VAL 935 N -0.75 0.92 -0.18 1.05 2.07 -0.20 -0.34 116.25 118.82 2oax h VAL 935 Ca -0.05 -0.29 0.02 0.00 0.82 0.00 0.00 66.70 67.20 2oax h VAL 935 Cb 0.51 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 2oax h VAL 935 CO 0.08 0.16 0.05 0.28 0.02 0.00 0.00 177.57 178.15 2oax h SER 936 N 0.85 0.04 -0.32 0.57 0.02 -1.30 0.23 113.55 113.64 2oax h SER 936 Ca 0.44 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.37 2oax h SER 936 Cb 0.52 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 2oax h SER 936 CO -0.21 0.05 0.06 0.44 -1.14 0.00 0.00 176.83 176.03 2oax h ASP 937 N 0.13 0.59 -0.05 3.07 5.19 -1.08 -0.94 116.42 123.32 2oax h ASP 937 Ca 0.08 -0.10 -0.01 0.00 -0.62 0.00 0.00 57.03 56.38 2oax h ASP 937 Cb 0.06 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 39.41 2oax h ASP 937 CO -0.09 0.62 -0.00 -0.07 -3.12 0.00 0.00 179.24 176.57 2oax h LEU 938 N 0.61 0.09 -0.82 1.55 3.38 -0.35 -2.57 115.31 117.19 2oax h LEU 938 Ca 0.13 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.81 2oax h LEU 938 Cb 0.30 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 2oax h LEU 938 CO 0.00 0.40 0.52 -0.07 0.09 0.00 0.00 178.44 179.38 2oax h LEU 939 N -0.23 0.85 -1.26 1.67 3.38 -0.31 -1.38 115.31 118.03 2oax h LEU 939 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2oax h LEU 939 Cb 0.36 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2oax h LEU 939 CO 0.00 0.57 0.42 -0.08 0.09 0.00 0.00 178.44 179.44 2oax h GLU 940 N 0.99 0.92 -0.19 1.13 4.81 -1.12 0.27 114.58 121.39 2oax h GLU 940 Ca 0.34 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.34 2oax h GLU 940 Cb 0.05 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 2oax h GLU 940 CO -0.13 0.64 -0.49 0.35 -0.73 0.00 0.00 179.01 178.65 2oax h PHE 941 N 0.94 0.64 -0.20 0.92 3.57 -0.94 -2.05 116.94 119.81 2oax h PHE 941 Ca 0.25 -0.21 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 2oax h PHE 941 Cb -0.05 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.56 2oax h PHE 941 CO 0.00 0.91 -0.01 0.00 -2.23 0.00 0.00 178.31 176.98 2oax h PHE 943 N 0.12 0.42 -0.74 0.00 0.05 -0.47 -1.80 116.94 114.53 2oax h PHE 943 Ca 0.06 -0.00 0.02 0.00 3.82 0.00 0.00 57.97 61.87 2oax h PHE 943 Cb 0.42 -0.14 -0.04 0.00 2.00 0.00 0.00 35.95 38.19 2oax h PHE 943 CO 0.04 0.31 0.47 -0.92 -0.18 0.00 0.00 178.31 178.03 2oax h TYR 944 N 0.41 0.88 0.00 -0.55 5.03 -1.34 -1.21 116.97 120.20 2oax h TYR 944 Ca 0.11 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.45 2oax h TYR 944 Cb 0.01 -0.29 -0.00 0.00 1.55 0.00 0.00 36.73 38.00 2oax h TYR 944 CO -0.04 0.52 -0.01 1.15 -1.32 0.00 0.00 178.16 178.46 2oax h THR 945 N 0.93 0.01 0.01 1.81 2.02 -1.16 -2.44 112.91 114.09 2oax h THR 945 Ca 0.29 -0.58 -0.00 0.00 0.77 0.00 0.00 66.41 66.89 2oax h THR 945 Cb -0.02 1.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.96 2oax h THR 945 CO -0.10 0.01 -0.01 0.15 0.37 0.00 0.00 175.52 175.94 2oax h PHE 946 N 0.00 -0.01 -0.78 3.16 3.57 -0.38 -0.95 116.94 121.55 2oax h PHE 946 Ca -0.00 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.53 2oax h PHE 946 Cb 0.57 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.27 2oax h PHE 946 CO 0.00 0.79 0.50 0.00 -2.23 0.00 0.00 178.31 177.37 2oax h ARG 947 N -0.91 0.96 -0.68 1.11 3.08 -1.26 -1.57 114.38 115.11 2oax h ARG 947 Ca -0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2oax h ARG 947 Cb 0.81 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2oax h ARG 947 CO 0.00 0.63 0.00 -1.91 -1.07 0.00 0.00 179.97 177.63 2oax n GLU 948 N -4.59 3.53 0.31 0.04 4.07 -0.92 -4.49 120.64 118.58 2oax n GLU 948 Ca 0.09 -2.17 0.16 0.00 -0.06 0.00 0.00 57.16 55.17 2oax n GLU 948 Cb 0.07 -1.95 0.83 0.00 -0.06 0.00 0.00 31.44 30.34 2oax n GLU 948 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2oax h SER 949 N 2.86 0.00 0.25 4.31 4.64 -0.10 -2.29 113.55 123.21 2oax h SER 949 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2oax h SER 949 Cb 1.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2oax h SER 949 CO 0.30 0.00 -0.12 1.12 -0.87 0.00 0.00 176.83 177.26 2oax h HIS 950 N 0.00 -0.31 0.21 4.77 -0.00 -1.82 -2.36 115.15 115.63 2oax h HIS 950 Ca 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.35 2oax h HIS 950 Cb 0.51 0.10 0.00 0.00 -0.00 0.00 0.00 27.41 28.02 2oax h HIS 950 CO 0.00 -0.19 -0.10 0.00 -0.00 0.00 0.00 177.93 177.64 2oax h ALA 951 N -1.55 -0.28 -0.30 6.11 0.00 -1.89 -2.77 119.26 118.59 2oax h ALA 951 Ca -0.03 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.83 2oax h ALA 951 Cb 0.25 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2oax h ALA 951 CO 0.06 -0.57 0.23 -0.07 0.00 0.00 0.00 179.25 178.90 2oax h LEU 952 N -0.46 0.00 -1.81 0.00 3.38 -1.60 -3.46 115.31 111.37 2oax h LEU 952 Ca -0.03 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.66 2oax h LEU 952 Cb 0.35 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.25 2oax h LEU 952 CO 0.05 0.00 -0.68 0.29 0.09 0.00 0.00 178.44 178.19 2oax n LYS 953 N -4.28 -5.25 -4.40 1.13 5.02 -0.90 -4.78 118.16 104.69 2oax n LYS 953 Ca 0.04 0.74 -0.35 0.00 -2.02 0.00 0.00 58.31 56.73 2oax n LYS 953 Cb 0.40 -5.41 -0.10 0.00 -0.02 0.00 0.00 35.03 29.90 2oax n LYS 953 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2oax s VAL 954 N -3.32 4.19 0.13 -0.18 1.01 -1.13 -4.82 120.40 116.28 2oax s VAL 954 Ca 0.05 -0.29 -0.19 0.00 0.00 0.00 0.00 61.98 61.56 2oax s VAL 954 Cb -0.01 -2.77 -0.07 0.00 0.00 0.00 0.00 36.38 33.53 2oax s VAL 954 CO 0.64 0.58 0.61 -1.61 0.00 0.00 0.00 175.10 175.32 2oax s GLU 955 N -0.64 4.20 -0.22 2.72 0.41 -1.26 -4.89 118.70 119.02 2oax s GLU 955 Ca 0.10 0.75 -0.03 0.00 -0.41 0.00 0.00 54.97 55.38 2oax s GLU 955 Cb -0.12 -3.11 0.07 0.00 -1.78 0.00 0.00 34.13 29.20 2oax s GLU 955 CO 0.02 0.55 0.06 -0.06 -0.49 0.00 0.00 175.26 175.34 2oax s PHE 956 N -1.27 1.01 1.10 1.61 0.40 -1.26 -4.68 117.98 114.89 2oax s PHE 956 Ca 0.34 -0.96 -0.14 0.00 -0.60 0.00 0.00 56.93 55.58 2oax s PHE 956 Cb -0.18 -1.10 0.20 0.00 0.51 0.00 0.00 43.02 42.45 2oax s PHE 956 CO 0.20 -0.66 0.76 -2.30 0.70 0.00 0.00 175.22 173.92 2oax n PRO 957 N 5.05 -1.76 -0.10 0.24 -0.02 -1.26 -4.55 135.00 132.60 2oax n PRO 957 Ca -0.07 -0.48 -0.10 0.00 -2.02 0.00 0.00 63.50 60.83 2oax n PRO 957 Cb 0.46 -2.07 -0.04 0.00 -0.02 0.00 0.00 33.50 31.83 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 -2.33 -0.39 -0.31 3.55 0.00 -1.99 -1.35 119.26 116.44 2oax h ALA 958 Ca -0.55 0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.47 2oax h ALA 958 Cb 1.32 0.82 -0.02 0.00 0.00 0.00 0.00 17.79 19.92 2oax h ALA 958 CO 0.44 -0.84 0.21 1.98 0.00 0.00 0.00 179.25 181.04 2oax h MET 959 N -0.34 0.20 -0.09 0.00 1.85 -1.95 0.20 114.93 114.80 2oax h MET 959 Ca 0.13 -0.01 -0.11 0.00 -0.61 0.00 0.00 59.70 59.10 2oax h MET 959 Cb 0.58 -0.04 0.00 0.00 0.43 0.00 0.00 31.60 32.57 2oax h MET 959 CO -0.53 0.13 -0.39 -0.07 -0.40 0.00 0.00 176.91 175.65 2oax h LEU 960 N 0.20 0.50 -0.06 3.39 3.38 -1.70 -0.77 115.31 120.25 2oax h LEU 960 Ca 0.14 -0.64 0.02 0.00 0.09 0.00 0.00 57.88 57.49 2oax h LEU 960 Cb 0.29 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2oax h LEU 960 CO -0.02 1.05 -0.08 0.58 0.09 0.00 0.00 178.44 180.06 2oax h VAL 961 N -0.02 0.78 -0.09 1.22 2.07 -0.22 0.28 116.25 120.26 2oax h VAL 961 Ca -0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.54 2oax h VAL 961 Cb 1.03 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 31.53 2oax h VAL 961 CO 0.08 0.00 -0.23 -0.08 0.02 0.00 0.00 177.57 177.36 2oax h GLU 962 N -0.11 -0.30 0.90 1.57 4.81 -0.63 -0.99 114.58 119.82 2oax h GLU 962 Ca 0.05 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.26 2oax h GLU 962 Cb 0.19 0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.64 2oax h GLU 962 CO -0.13 -0.20 -0.43 0.82 -0.73 0.00 0.00 179.01 178.34 2oax h ILE 963 N -0.31 0.00 -0.16 2.32 2.04 -0.72 -2.65 117.51 118.03 2oax h ILE 963 Ca 0.09 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 65.97 2oax h ILE 963 Cb 0.44 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.45 2oax h ILE 963 CO -0.27 0.00 -0.29 0.40 0.00 0.00 0.00 178.15 177.99 2oax h ILE 964 N -1.24 0.33 0.00 -0.67 2.04 -0.39 0.37 117.51 117.95 2oax h ILE 964 Ca -0.12 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.74 2oax h ILE 964 Cb 0.92 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 2oax h ILE 964 CO 0.20 0.00 0.00 -1.54 0.00 0.00 0.00 178.15 176.81 2oax n SER 965 N -5.40 0.37 -0.09 1.72 3.41 -0.38 -0.62 113.62 112.63 2oax n SER 965 Ca -0.03 0.62 -0.21 0.00 -0.26 0.00 0.00 58.87 58.99 2oax n SER 965 Cb 0.31 -0.69 -0.12 0.00 -0.26 0.00 0.00 64.21 63.46 2oax n SER 965 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2oax h ASP 966 N 0.00 0.03 0.40 4.04 1.82 -0.59 -3.40 116.42 118.72 2oax h ASP 966 Ca 0.00 -0.58 -0.02 0.00 -0.39 0.00 0.00 57.03 56.04 2oax h ASP 966 Cb 0.20 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.20 2oax h ASP 966 CO 0.00 1.48 -0.19 1.56 -1.61 0.00 0.00 179.24 180.48 2oax h GLN 967 N -0.92 -0.52 -0.92 0.28 4.20 -0.04 -3.33 115.11 113.86 2oax h GLN 967 Ca -0.33 0.04 0.34 0.00 0.06 0.00 0.00 58.65 58.75 2oax h GLN 967 Cb 1.34 0.12 -0.11 0.00 0.30 0.00 0.00 27.48 29.12 2oax h GLN 967 CO -0.17 -0.21 0.57 -0.11 -0.67 0.00 0.00 178.83 178.24 2oax n LEU 968 N -5.17 0.18 0.00 1.46 7.94 0.21 0.12 117.00 121.74 2oax n LEU 968 Ca -0.09 1.07 0.00 0.00 -1.11 0.00 0.00 56.01 55.88 2oax n LEU 968 Cb 0.28 -0.52 0.00 0.00 0.53 0.00 0.00 43.42 43.71 2oax n LEU 968 CO 0.27 -1.18 0.36 -2.65 -1.11 0.00 0.00 177.39 173.08 2oax n PRO 969 N -4.30 0.00 -0.05 1.96 -0.02 -1.25 -2.41 135.00 128.92 2oax n PRO 969 Ca 0.29 0.35 0.05 0.00 -2.02 0.00 0.00 63.50 62.17 2oax n PRO 969 Cb 1.08 -1.27 0.41 0.00 -0.02 0.00 0.00 33.50 33.70 2oax n PRO 969 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2oax h LYS 970 N 0.00 0.58 -0.19 -0.52 6.56 -1.05 0.65 116.57 122.60 2oax h LYS 970 Ca 0.00 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 2oax h LYS 970 Cb 0.00 -0.13 0.00 0.00 -0.57 0.00 0.00 32.23 31.53 2oax h LYS 970 CO 0.00 0.38 0.00 0.28 -2.06 0.00 0.00 179.45 178.05 2oax n VAL 971 N -4.47 0.00 0.04 0.50 0.31 0.32 -2.76 118.33 112.27 2oax n VAL 971 Ca 0.06 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.16 2oax n VAL 971 Cb 0.13 -0.12 -0.14 0.00 -0.91 0.00 0.00 33.84 32.79 2oax n VAL 971 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2oax h GLU 972 N 0.01 0.33 0.00 5.55 4.57 0.68 -3.47 114.58 122.24 2oax h GLU 972 Ca 0.00 -0.56 -0.50 0.00 -1.18 0.00 0.00 59.36 57.12 2oax h GLU 972 Cb 0.10 0.21 0.02 0.00 -0.16 0.00 0.00 28.75 28.91 2oax h GLU 972 CO 0.00 1.27 -0.10 -1.13 -1.18 0.00 0.00 179.01 177.86 2oax n SER 973 N -3.65 2.22 -2.80 1.04 3.41 -1.11 -4.99 113.62 107.74 2oax n SER 973 Ca -0.27 -2.60 -0.29 0.00 -0.26 0.00 0.00 58.87 55.46 2oax n SER 973 Cb 1.03 -0.36 -0.08 0.00 -0.26 0.00 0.00 64.21 64.54 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 -1.99 3.93 0.64 5.00 0.00 -1.26 -4.27 105.19 107.23 2oax n GLY 974 Ca 0.13 -1.49 0.12 0.00 0.00 0.00 0.00 46.02 44.77 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 2.75 2.26 -4.26 1.61 3.02 -1.25 -4.76 115.26 114.64 2oax n ASN 975 Ca 0.62 -1.64 -0.39 0.00 -0.03 0.00 0.00 54.58 53.15 2oax n ASN 975 Cb 0.50 0.27 -0.11 0.00 -0.61 0.00 0.00 39.78 39.83 2oax n ASN 975 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oax s ALA 976 N -2.29 3.16 -0.56 5.41 0.00 -1.26 -0.71 121.76 125.51 2oax s ALA 976 Ca 0.23 -1.98 -0.20 0.00 0.00 0.00 0.00 51.96 50.01 2oax s ALA 976 Cb 0.19 -2.45 0.07 0.00 0.00 0.00 0.00 23.12 20.93 2oax s ALA 976 CO 0.46 -1.51 0.74 0.21 0.00 0.00 0.00 175.76 175.67 2oax s LYS 977 N 1.39 3.13 0.22 0.00 2.20 0.22 -4.92 119.74 121.99 2oax s LYS 977 Ca 0.01 -0.92 -0.30 0.00 -0.36 0.00 0.00 55.97 54.40 2oax s LYS 977 Cb -0.21 -4.16 -0.09 0.00 -1.51 0.00 0.00 37.83 31.86 2oax s LYS 977 CO 0.02 -1.43 1.34 -2.14 -0.36 0.00 0.00 175.35 172.78 2oax s PRO 978 N 3.03 4.36 -0.30 4.03 0.02 -1.26 -2.33 135.00 142.55 2oax s PRO 978 Ca 0.17 2.13 -0.10 0.00 0.02 0.00 0.00 61.00 63.22 2oax s PRO 978 Cb -0.19 -3.17 -0.02 0.00 0.02 0.00 0.00 34.50 31.14 2oax s PRO 978 CO 0.11 -0.29 0.15 -0.51 -0.33 0.00 0.00 177.00 176.13 2oax s LEU 979 N -0.25 4.01 0.33 -5.54 1.43 0.14 -5.00 118.68 113.80 2oax s LEU 979 Ca 0.57 -0.36 0.07 0.00 -1.03 0.00 0.00 54.13 53.39 2oax s LEU 979 Cb -0.38 -2.02 -0.02 0.00 0.03 0.00 0.00 46.19 43.79 2oax s LEU 979 CO 0.40 -0.14 0.32 -0.31 0.23 0.00 0.00 176.35 176.85 2oax s TYR 980 N 1.65 2.96 -0.12 0.29 2.02 -1.26 -4.89 117.35 118.00 2oax s TYR 980 Ca 0.06 -0.27 0.20 0.00 -0.37 0.00 0.00 57.07 56.68 2oax s TYR 980 Cb -0.17 -1.82 -0.21 0.00 -0.40 0.00 0.00 41.96 39.37 2oax s TYR 980 CO 0.07 0.16 0.58 1.19 -1.57 0.00 0.00 175.55 175.99 2oax n PHE 981 N -1.42 0.42 -0.45 2.71 3.72 -1.26 -5.11 117.46 116.06 2oax n PHE 981 Ca -0.02 0.13 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 2oax n PHE 981 Cb 0.59 -0.83 0.00 0.00 -0.94 0.00 0.00 39.48 38.30 2oax n PHE 981 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43