#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kle h ILE 725 N 0.00 0.39 0.00 5.18 2.04 -2.01 -3.43 117.51 119.67 2kle h ILE 725 Ca 0.00 -0.73 -0.31 0.00 1.00 0.00 0.00 64.86 64.82 2kle h ILE 725 Cb 0.00 0.62 -0.05 0.00 -0.74 0.00 0.00 36.82 36.64 2kle h ILE 725 CO 0.00 0.09 -2.13 -1.20 0.00 0.00 0.00 178.15 174.91 2kle n SER 726 N -5.10 2.11 0.00 1.72 7.64 -1.25 -5.01 113.62 113.73 2kle n SER 726 Ca -0.08 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.83 2kle n SER 726 Cb 0.26 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 2kle n SER 726 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2kle n GLU 727 N -3.39 -0.21 0.01 1.43 4.71 0.12 -4.94 120.64 118.37 2kle n GLU 727 Ca -0.37 0.05 -0.04 0.00 -0.01 0.00 0.00 57.16 56.80 2kle n GLU 727 Cb 0.84 -3.22 -0.02 0.00 -1.01 0.00 0.00 31.44 28.03 2kle n GLU 727 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 2kle h SER 728 N 0.00 -0.37 0.00 1.62 0.02 -1.93 -3.47 113.55 109.41 2kle h SER 728 Ca 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2kle h SER 728 Cb 0.11 0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2kle h SER 728 CO 0.00 -0.12 0.00 -0.11 -1.14 0.00 0.00 176.83 175.46 2kle n LEU 729 N -3.17 0.00 -0.04 5.07 0.00 -1.26 -4.85 117.00 112.75 2kle n LEU 729 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 56.01 55.84 2kle n LEU 729 Cb 0.09 0.00 -0.07 0.00 0.00 0.00 0.00 43.42 43.44 2kle n LEU 729 CO 0.03 0.00 0.41 0.08 0.00 0.00 0.00 177.39 177.91 2kle h ARG 730 N 0.00 0.60 -0.00 1.96 0.11 -1.95 -1.60 114.38 113.50 2kle h ARG 730 Ca 0.00 -0.44 -0.13 0.00 0.10 0.00 0.00 59.98 59.52 2kle h ARG 730 Cb 0.00 0.07 0.01 0.00 1.11 0.00 0.00 29.97 31.16 2kle h ARG 730 CO 0.00 1.06 -0.49 0.37 0.10 0.00 0.00 179.97 181.01 2kle h GLN 731 N 0.25 0.34 0.00 0.08 5.75 -1.87 -3.23 115.11 116.42 2kle h GLN 731 Ca -0.02 -0.36 0.00 0.00 -0.15 0.00 0.00 58.65 58.13 2kle h GLN 731 Cb 1.10 0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.75 2kle h GLN 731 CO 0.10 1.04 0.00 0.41 -2.65 0.00 0.00 178.83 177.73 2kle n GLY 732 N 1.05 -0.94 2.45 2.39 0.00 -1.23 -3.49 105.19 105.40 2kle n GLY 732 Ca -0.10 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 2kle n GLY 732 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kle n GLY 733 N 0.54 2.24 0.00 -0.02 0.00 -0.60 -0.70 105.19 106.65 2kle n GLY 733 Ca 0.05 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.11 2kle n GLY 733 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kle n GLY 734 N 0.24 -1.32 3.31 -0.02 0.00 -1.23 -4.81 105.19 101.37 2kle n GLY 734 Ca 0.15 0.51 -0.09 0.00 0.00 0.00 0.00 46.02 46.59 2kle n GLY 734 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kle s LYS 735 N 0.00 1.09 -0.08 1.61 0.00 -1.24 -4.38 119.74 116.74 2kle s LYS 735 Ca 0.00 -1.14 0.03 0.00 0.00 0.00 0.00 55.97 54.86 2kle s LYS 735 Cb 0.00 0.37 0.01 0.00 0.00 0.00 0.00 37.83 38.21 2kle s LYS 735 CO 0.00 -0.39 -0.16 -0.51 0.00 0.00 0.00 175.35 174.29 2kle s LEU 736 N -2.95 1.78 0.03 2.77 1.02 0.73 -4.63 118.68 117.44 2kle s LEU 736 Ca 0.15 -0.39 0.02 0.00 0.02 0.00 0.00 54.13 53.94 2kle s LEU 736 Cb 0.04 -1.02 -0.02 0.00 0.02 0.00 0.00 46.19 45.21 2kle s LEU 736 CO -0.02 0.07 -0.08 0.20 0.02 0.00 0.00 176.35 176.54 2kle s ASN 737 N 0.59 0.89 0.11 2.29 0.02 -1.26 -0.26 114.94 117.31 2kle s ASN 737 Ca -0.15 -0.46 -0.28 0.00 -1.02 0.00 0.00 52.86 50.94 2kle s ASN 737 Cb -0.16 0.00 -0.10 0.00 0.02 0.00 0.00 41.25 41.01 2kle s ASN 737 CO 0.05 -0.13 1.47 0.15 0.02 0.00 0.00 177.10 178.66 2kle h PHE 738 N 4.81 -1.46 -0.02 2.20 3.57 -1.22 1.94 116.94 126.76 2kle h PHE 738 Ca -0.35 0.07 -0.09 0.00 3.53 0.00 0.00 57.97 61.14 2kle h PHE 738 Cb 1.20 0.68 -0.01 0.00 2.79 0.00 0.00 35.95 40.60 2kle h PHE 738 CO 0.59 -0.43 -0.39 -0.44 -2.23 0.00 0.00 178.31 175.42 2kle h ASP 739 N -0.36 0.04 0.45 0.41 3.32 -1.97 -2.74 116.42 115.58 2kle h ASP 739 Ca 0.06 -0.02 -0.30 0.00 0.02 0.00 0.00 57.03 56.79 2kle h ASP 739 Cb 0.52 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.02 2kle h ASP 739 CO -0.50 0.43 -1.69 -0.08 -1.72 0.00 0.00 179.24 175.68 2kle h GLU 740 N 0.04 0.08 -0.11 3.56 4.57 -1.85 -3.31 114.58 117.56 2kle h GLU 740 Ca 0.00 -0.13 0.03 0.00 -1.18 0.00 0.00 59.36 58.08 2kle h GLU 740 Cb 0.71 0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 29.35 2kle h GLU 740 CO 0.05 0.73 0.09 1.25 -1.18 0.00 0.00 179.01 179.96 2kle h LEU 741 N 0.02 0.00 -1.43 1.64 5.85 0.32 0.35 115.31 122.06 2kle h LEU 741 Ca -0.29 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.49 2kle h LEU 741 Cb 2.00 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.99 2kle h LEU 741 CO 0.09 0.00 0.45 0.03 -0.34 0.00 0.00 178.44 178.67 2kle h ARG 742 N 0.00 0.68 -0.73 1.25 2.47 -1.58 0.13 114.38 116.61 2kle h ARG 742 Ca 0.05 -0.04 0.20 0.00 -1.26 0.00 0.00 59.98 58.93 2kle h ARG 742 Cb 0.23 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.37 2kle h ARG 742 CO -0.00 0.45 0.52 0.37 0.56 0.00 0.00 179.97 181.87 2kle h GLN 743 N 0.70 0.05 0.01 0.04 4.15 -0.49 2.04 115.11 121.62 2kle h GLN 743 Ca 0.29 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.71 2kle h GLN 743 Cb 0.25 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.93 2kle h GLN 743 CO -0.09 0.04 -0.01 0.22 -1.93 0.00 0.00 178.83 177.06 2kle h ASP 744 N 0.06 -0.01 -1.20 -0.69 3.58 -0.90 -3.39 116.42 113.87 2kle h ASP 744 Ca 0.35 -0.72 -0.61 0.00 0.42 0.00 0.00 57.03 56.47 2kle h ASP 744 Cb 1.31 0.00 -0.39 0.00 1.72 0.00 0.00 39.33 41.98 2kle h ASP 744 CO -0.02 0.83 -0.32 0.00 -2.88 0.00 0.00 179.24 176.85 2kle n LEU 745 N -4.68 5.57 -4.60 2.28 -0.00 0.38 -5.03 117.00 110.92 2kle n LEU 745 Ca -0.08 -4.86 -0.43 0.00 -0.00 0.00 0.00 56.01 50.65 2kle n LEU 745 Cb 0.35 -0.56 -0.03 0.00 -0.00 0.00 0.00 43.42 43.18 2kle n LEU 745 CO 0.26 2.02 1.81 0.29 -0.00 0.00 0.00 177.39 181.78 2kle n LYS 746 N -0.64 2.07 0.00 1.47 5.02 0.67 -4.21 118.16 122.53 2kle n LYS 746 Ca 0.46 0.60 0.00 0.00 -2.02 0.00 0.00 58.31 57.36 2kle n LYS 746 Cb 0.73 -3.18 0.00 0.00 -0.02 0.00 0.00 35.03 32.57 2kle n LYS 746 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2kle n GLY 747 N 5.61 0.04 0.00 0.72 0.00 -1.26 -5.06 105.19 105.24 2kle n GLY 747 Ca 0.29 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2kle n GLY 747 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2kle n LYS 748 N 0.00 0.04 -4.75 1.61 0.00 -1.26 -5.16 118.16 108.64 2kle n LYS 748 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 57.98 2kle n LYS 748 Cb 0.00 -0.09 -0.08 0.00 -0.00 0.00 0.00 35.03 34.86 2kle n LYS 748 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2kle s GLY 749 N -0.97 2.99 0.00 2.58 0.00 -1.26 -5.10 107.32 105.56 2kle s GLY 749 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 44.72 44.20 2kle s GLY 749 CO 0.00 -2.19 0.00 1.42 0.00 0.00 0.00 173.10 172.33 2kle n HIS 750 N -1.24 0.00 -4.14 1.90 8.25 -1.26 -4.98 115.22 113.75 2kle n HIS 750 Ca -0.18 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 56.96 2kle n HIS 750 Cb 0.67 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.70 2kle n HIS 750 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2kle s THR 751 N 0.00 4.36 0.40 1.59 2.01 -1.26 -5.00 115.64 117.74 2kle s THR 751 Ca 0.00 -0.70 0.15 0.00 0.31 0.00 0.00 61.69 61.45 2kle s THR 751 Cb 0.00 -3.03 0.36 0.00 0.01 0.00 0.00 72.50 69.84 2kle s THR 751 CO 0.00 0.24 1.85 0.44 -0.69 0.00 0.00 174.62 176.46 2kle h ASP 752 N 3.77 0.49 -0.66 3.53 5.19 -1.99 -1.55 116.42 125.19 2kle h ASP 752 Ca -0.48 0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 55.96 2kle h ASP 752 Cb 1.17 -0.04 -0.03 0.00 0.18 0.00 0.00 39.33 40.61 2kle h ASP 752 CO 0.62 0.20 0.33 0.00 -3.12 0.00 0.00 179.24 177.27 2kle h ALA 753 N 1.61 0.85 -0.47 3.45 0.00 -1.98 0.27 119.26 122.99 2kle h ALA 753 Ca 0.48 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 2kle h ALA 753 Cb 1.07 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2kle h ALA 753 CO -0.20 0.39 0.15 0.93 0.00 0.00 0.00 179.25 180.52 2kle h GLU 754 N 0.91 0.72 0.05 0.00 5.08 -1.70 -2.27 114.58 117.38 2kle h GLU 754 Ca 0.23 -0.15 -0.27 0.00 -1.00 0.00 0.00 59.36 58.17 2kle h GLU 754 Cb 0.09 -0.11 0.02 0.00 0.50 0.00 0.00 28.75 29.25 2kle h GLU 754 CO -0.03 0.68 -1.10 0.82 -1.00 0.00 0.00 179.01 178.39 2kle h ILE 755 N 0.62 1.33 -0.45 3.13 2.04 -1.28 -1.91 117.51 120.99 2kle h ILE 755 Ca 0.15 -2.44 -0.02 0.00 1.00 0.00 0.00 64.86 63.55 2kle h ILE 755 Cb 0.26 2.54 -0.02 0.00 -0.74 0.00 0.00 36.82 38.85 2kle h ILE 755 CO -0.01 0.74 0.21 -0.08 0.00 0.00 0.00 178.15 179.02 2kle h GLU 756 N 0.28 0.66 -0.03 2.37 4.81 -0.45 -1.91 114.58 120.32 2kle h GLU 756 Ca -0.13 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 58.98 2kle h GLU 756 Cb 1.75 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 31.02 2kle h GLU 756 CO 0.20 0.56 -0.03 0.00 -0.73 0.00 0.00 179.01 179.01 2kle h ALA 757 N 1.06 0.04 -0.62 2.92 0.00 -1.47 -3.29 119.26 117.89 2kle h ALA 757 Ca 0.16 -0.28 0.07 0.00 0.00 0.00 0.00 54.91 54.86 2kle h ALA 757 Cb 0.13 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 2kle h ALA 757 CO -0.02 -0.17 0.32 0.97 0.00 0.00 0.00 179.25 180.35 2kle h ILE 758 N -0.42 0.91 -0.13 0.00 -0.00 -1.21 -0.80 117.51 115.87 2kle h ILE 758 Ca 0.00 -0.20 -0.07 0.00 -0.00 0.00 0.00 64.86 64.59 2kle h ILE 758 Cb 0.56 0.28 -0.01 0.00 -0.00 0.00 0.00 36.82 37.65 2kle h ILE 758 CO 0.01 0.11 -0.24 2.19 -0.00 0.00 0.00 178.15 180.22 2kle h PHE 759 N 0.58 0.24 -0.65 2.19 -5.15 -1.49 0.22 116.94 112.88 2kle h PHE 759 Ca 0.29 -0.04 0.02 0.00 -0.20 0.00 0.00 57.97 58.03 2kle h PHE 759 Cb 0.23 -0.06 -0.03 0.00 0.22 0.00 0.00 35.95 36.31 2kle h PHE 759 CO -0.10 0.45 0.43 1.15 -2.00 0.00 0.00 178.31 178.23 2kle h THR 760 N 0.20 1.14 0.05 0.88 2.02 -1.20 0.60 112.91 116.59 2kle h THR 760 Ca 0.03 -0.29 -0.37 0.00 0.77 0.00 0.00 66.41 66.55 2kle h THR 760 Cb 0.53 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 67.12 2kle h THR 760 CO 0.04 0.15 -2.14 1.17 0.37 0.00 0.00 175.52 175.11 2kle n LYS 761 N -4.45 0.67 0.02 6.66 4.81 -0.97 -4.51 118.16 120.39 2kle n LYS 761 Ca 0.07 0.27 0.07 0.00 -0.87 0.00 0.00 58.31 57.84 2kle n LYS 761 Cb 0.07 -1.62 -0.11 0.00 0.02 0.00 0.00 35.03 33.39 2kle n LYS 761 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2kle n TYR 762 N -3.64 0.42 -1.41 5.64 4.01 0.72 -4.98 117.16 117.92 2kle n TYR 762 Ca -0.40 0.13 -0.34 0.00 -0.16 0.00 0.00 57.90 57.13 2kle n TYR 762 Cb 0.96 -0.78 0.09 0.00 -0.31 0.00 0.00 39.34 39.30 2kle n TYR 762 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2kle s ASP 763 N -5.06 4.18 0.20 7.72 2.15 0.21 -4.93 116.67 121.14 2kle s ASP 763 Ca -0.05 2.31 -0.11 0.00 0.43 0.00 0.00 52.55 55.13 2kle s ASP 763 Cb 0.11 -2.58 0.22 0.00 -0.30 0.00 0.00 42.92 40.37 2kle s ASP 763 CO 0.85 -2.27 1.76 1.56 -0.17 0.00 0.00 175.17 176.90 2kle h GLN 764 N -0.39 0.43 0.00 4.34 4.20 -1.94 -3.17 115.11 118.58 2kle h GLN 764 Ca -0.47 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.21 2kle h GLN 764 Cb 1.29 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.97 2kle h GLN 764 CO 0.49 0.28 -0.66 -3.47 -0.67 0.00 0.00 178.83 174.81 2kle n ASP 765 N -4.95 0.78 0.00 1.46 2.03 -1.26 -4.97 116.55 109.64 2kle n ASP 765 Ca 0.07 -0.65 0.00 0.00 0.52 0.00 0.00 54.79 54.73 2kle n ASP 765 Cb 0.22 1.07 0.00 0.00 -0.72 0.00 0.00 41.12 41.69 2kle n ASP 765 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kle n GLY 766 N 1.34 0.09 0.05 0.27 0.00 -1.20 -4.76 105.19 100.98 2kle n GLY 766 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 2kle n GLY 766 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2kle n ASP 767 N 0.00 1.18 -2.93 1.61 8.00 -1.26 -4.45 116.55 118.70 2kle n ASP 767 Ca 0.00 0.49 -0.16 0.00 0.71 0.00 0.00 54.79 55.83 2kle n ASP 767 Cb 0.00 -0.74 0.02 0.00 -0.02 0.00 0.00 41.12 40.38 2kle n ASP 767 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2kle n GLN 768 N -3.79 -0.87 0.00 -1.24 7.27 -1.26 -4.77 117.38 112.71 2kle n GLN 768 Ca -0.05 0.90 0.00 0.00 0.07 0.00 0.00 57.00 57.92 2kle n GLN 768 Cb 0.18 -1.22 0.00 0.00 2.41 0.00 0.00 30.24 31.61 2kle n GLN 768 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 2kle n GLU 769 N 0.55 0.00 -4.08 3.69 -0.00 -0.64 -0.69 120.64 119.48 2kle n GLU 769 Ca -0.04 0.00 -0.35 0.00 -0.00 0.00 0.00 57.16 56.78 2kle n GLU 769 Cb 0.50 0.00 -0.12 0.00 -0.00 0.00 0.00 31.44 31.82 2kle n GLU 769 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2kle s LEU 770 N 0.00 3.40 0.66 -1.84 1.02 0.64 -4.78 118.68 117.78 2kle s LEU 770 Ca 0.00 -0.13 -0.08 0.00 0.02 0.00 0.00 54.13 53.95 2kle s LEU 770 Cb 0.00 -1.86 0.03 0.00 0.02 0.00 0.00 46.19 44.38 2kle s LEU 770 CO 0.00 0.09 0.99 0.42 0.02 0.00 0.00 176.35 177.88 2kle s THR 771 N 0.84 3.11 0.38 5.49 -4.23 -1.26 -2.45 115.64 117.52 2kle s THR 771 Ca 0.01 0.02 0.07 0.00 -1.18 0.00 0.00 61.69 60.61 2kle s THR 771 Cb -0.14 -3.30 0.29 0.00 1.34 0.00 0.00 72.50 70.69 2kle s THR 771 CO 0.02 -0.33 1.99 -0.08 -0.54 0.00 0.00 174.62 175.68 2kle h GLU 772 N -0.46 0.66 -0.49 3.99 4.22 -1.94 0.57 114.58 121.13 2kle h GLU 772 Ca -0.45 -0.04 -0.02 0.00 0.08 0.00 0.00 59.36 58.93 2kle h GLU 772 Cb 1.28 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 2kle h GLU 772 CO 0.62 0.44 0.23 0.45 -2.18 0.00 0.00 179.01 178.57 2kle h HIS 773 N 0.68 0.72 -0.06 0.92 3.86 -1.94 0.21 115.15 119.54 2kle h HIS 773 Ca 0.26 -0.04 -0.17 0.00 -1.16 0.00 0.00 60.37 59.27 2kle h HIS 773 Cb 0.18 -0.22 0.01 0.00 1.06 0.00 0.00 27.41 28.44 2kle h HIS 773 CO -0.00 0.57 -0.61 0.93 0.86 0.00 0.00 177.93 179.68 2kle h GLU 774 N 0.65 0.52 -0.07 2.45 5.08 -1.70 -3.06 114.58 118.46 2kle h GLU 774 Ca 0.17 -0.48 -0.05 0.00 -1.00 0.00 0.00 59.36 58.00 2kle h GLU 774 Cb 0.13 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2kle h GLU 774 CO -0.02 1.11 -0.18 1.25 -1.00 0.00 0.00 179.01 180.17 2kle h HIS 775 N 0.09 0.11 -0.29 4.33 2.76 -0.79 -2.14 115.15 119.22 2kle h HIS 775 Ca -0.06 -0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.01 2kle h HIS 775 Cb 1.28 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 30.19 2kle h HIS 775 CO 0.12 0.29 -0.17 0.37 -1.30 0.00 0.00 177.93 177.24 2kle h GLN 776 N 0.10 0.52 0.09 5.26 5.75 -0.48 -3.26 115.11 123.10 2kle h GLN 776 Ca 0.02 -0.17 -0.27 0.00 -0.15 0.00 0.00 58.65 58.08 2kle h GLN 776 Cb 0.38 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.88 2kle h GLN 776 CO 0.03 0.68 -1.39 1.96 -2.65 0.00 0.00 178.83 177.46 2kle h GLN 777 N 0.48 0.20 0.00 1.69 4.20 -1.45 -3.46 115.11 116.77 2kle h GLN 777 Ca 0.08 -0.34 0.00 0.00 0.06 0.00 0.00 58.65 58.45 2kle h GLN 777 Cb 0.57 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.48 2kle h GLN 777 CO 0.04 1.16 0.00 -1.33 -0.67 0.00 0.00 178.83 178.03 2kle n MET 778 N -3.98 0.00 -2.08 1.46 2.81 -0.84 -4.93 117.12 109.56 2kle n MET 778 Ca -0.26 0.00 -0.28 0.00 -1.81 0.00 0.00 57.70 55.35 2kle n MET 778 Cb 0.86 -0.49 0.05 0.00 -0.71 0.00 0.00 33.22 32.93 2kle n MET 778 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2kle s ARG 779 N -0.12 2.62 -0.32 0.03 0.52 -1.25 -5.05 118.95 115.39 2kle s ARG 779 Ca 0.00 0.17 -0.01 0.00 -0.52 0.00 0.00 55.73 55.37 2kle s ARG 779 Cb 0.00 -2.10 0.11 0.00 0.52 0.00 0.00 34.95 33.48 2kle s ARG 779 CO 0.00 -1.07 0.13 -0.51 0.02 0.00 0.00 175.30 173.87 2kle s ASP 780 N -4.41 3.84 -0.17 0.23 1.01 -1.26 -4.81 116.67 111.11 2kle s ASP 780 Ca 0.58 -1.73 -0.19 0.00 0.71 0.00 0.00 52.55 51.92 2kle s ASP 780 Cb -0.11 -0.77 -0.16 0.00 1.01 0.00 0.00 42.92 42.89 2kle s ASP 780 CO 0.48 -0.40 0.26 -0.78 0.21 0.00 0.00 175.17 174.95 2kle h ASP 781 N 7.92 0.00 1.15 0.27 1.82 -1.95 -3.37 116.42 122.25 2kle h ASP 781 Ca -0.12 -0.49 -0.05 0.00 -0.39 0.00 0.00 57.03 55.98 2kle h ASP 781 Cb 1.00 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.00 2kle h ASP 781 CO 0.45 1.12 -0.24 0.25 -1.61 0.00 0.00 179.24 179.21 2kle h LEU 782 N -1.00 0.00 -2.02 2.28 5.85 -1.94 -1.60 115.31 116.88 2kle h LEU 782 Ca -0.16 0.00 0.12 0.00 0.84 0.00 0.00 57.88 58.68 2kle h LEU 782 Cb 0.94 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 2kle h LEU 782 CO -0.10 0.24 0.30 -0.08 -0.34 0.00 0.00 178.44 178.47 2kle h GLU 783 N 0.00 0.00 -2.02 1.25 4.57 -1.98 -3.25 114.58 113.15 2kle h GLU 783 Ca -0.00 0.00 -0.53 0.00 -1.18 0.00 0.00 59.36 57.65 2kle h GLU 783 Cb 0.89 0.00 -0.40 0.00 -0.16 0.00 0.00 28.75 29.08 2kle h GLU 783 CO 0.03 0.00 -1.12 1.17 -1.18 0.00 0.00 179.01 177.91 2kle n LYS 784 N -4.34 0.97 -3.64 1.92 4.81 -0.61 -5.03 118.16 112.24 2kle n LYS 784 Ca 0.07 -3.39 -0.14 0.00 -0.87 0.00 0.00 58.31 53.97 2kle n LYS 784 Cb 0.49 -1.50 -0.07 0.00 0.02 0.00 0.00 35.03 33.96 2kle n LYS 784 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2kle s GLU 785 N -1.86 0.80 -0.14 1.64 2.12 -1.20 -4.95 118.70 115.11 2kle s GLU 785 Ca 0.38 0.93 -0.03 0.00 0.36 0.00 0.00 54.97 56.61 2kle s GLU 785 Cb 0.25 0.39 -0.03 0.00 0.26 0.00 0.00 34.13 35.00 2kle s GLU 785 CO -0.09 -0.10 -0.05 0.50 -0.54 0.00 0.00 175.26 174.98 2kle s ARG 786 N 0.34 3.50 0.45 4.30 3.52 -1.26 -4.93 118.95 124.86 2kle s ARG 786 Ca -0.00 -0.53 -0.22 0.00 -0.13 0.00 0.00 55.73 54.84 2kle s ARG 786 Cb -0.05 -2.84 -0.08 0.00 -1.56 0.00 0.00 34.95 30.42 2kle s ARG 786 CO 0.01 0.32 1.09 -1.21 -0.81 0.00 0.00 175.30 174.70 2kle s GLU 787 N 0.15 3.88 0.94 5.12 8.01 -1.26 -5.04 118.70 130.50 2kle s GLU 787 Ca -0.02 1.56 -0.12 0.00 0.01 0.00 0.00 54.97 56.41 2kle s GLU 787 Cb -0.14 -2.35 0.15 0.00 -4.31 0.00 0.00 34.13 27.49 2kle s GLU 787 CO 0.03 -0.40 1.09 0.34 0.01 0.00 0.00 175.26 176.33 2kle s ASP 788 N -1.62 3.04 -0.99 -0.19 2.15 -1.26 -4.92 116.67 112.89 2kle s ASP 788 Ca 0.63 1.50 -0.18 0.00 0.43 0.00 0.00 52.55 54.93 2kle s ASP 788 Cb -0.23 -2.17 0.13 0.00 -0.30 0.00 0.00 42.92 40.35 2kle s ASP 788 CO 0.28 -2.91 1.21 -0.22 -0.17 0.00 0.00 175.17 173.35 2kle s LEU 789 N -6.39 4.94 0.45 -1.34 2.96 -1.26 -4.94 118.68 113.10 2kle s LEU 789 Ca 0.64 -2.17 0.05 0.00 -0.22 0.00 0.00 54.13 52.44 2kle s LEU 789 Cb -0.19 -2.41 -0.04 0.00 0.50 0.00 0.00 46.19 44.04 2kle s LEU 789 CO 0.58 -1.04 0.07 -0.62 -1.32 0.00 0.00 176.35 174.02 2kle s ASP 790 N 3.60 4.13 -0.05 3.68 -1.08 -1.26 -5.11 116.67 120.58 2kle s ASP 790 Ca 0.35 -1.39 -0.06 0.00 -0.52 0.00 0.00 52.55 50.94 2kle s ASP 790 Cb -0.04 -0.06 -0.02 0.00 -1.46 0.00 0.00 42.92 41.34 2kle s ASP 790 CO -0.08 -0.65 -0.11 -0.11 0.52 0.00 0.00 175.17 174.75 2kle n LEU 791 N -1.18 0.65 0.00 -1.34 0.00 -1.26 -5.04 117.00 108.83 2kle n LEU 791 Ca -0.08 0.11 0.00 0.00 0.00 0.00 0.00 56.01 56.03 2kle n LEU 791 Cb 0.66 -0.52 0.00 0.00 0.00 0.00 0.00 43.42 43.56 2kle n LEU 791 CO 0.44 -0.44 0.00 -0.67 0.00 0.00 0.00 177.39 176.72 2kle n ASP 792 N -3.15 0.00 -4.07 1.96 2.03 -1.26 -5.12 116.55 106.94 2kle n ASP 792 Ca -0.04 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.19 2kle n ASP 792 Cb 0.16 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.46 2kle n ASP 792 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 2kle s HIS 793 N -0.21 0.47 -0.27 -0.67 2.46 -1.26 -5.08 115.29 110.73 2kle s HIS 793 Ca 0.00 -0.97 0.07 0.00 0.47 0.00 0.00 55.06 54.63 2kle s HIS 793 Cb 0.00 -0.35 0.25 0.00 -0.13 0.00 0.00 32.58 32.35 2kle s HIS 793 CO 0.00 -0.35 1.18 -1.13 -2.47 0.00 0.00 174.74 171.96 2kle n SER 794 N 0.34 -1.16 -4.55 9.88 3.41 -1.26 -5.05 113.62 115.22 2kle n SER 794 Ca -0.16 -1.89 -0.37 0.00 -0.26 0.00 0.00 58.87 56.20 2kle n SER 794 Cb 0.60 0.65 -0.03 0.00 -0.26 0.00 0.00 64.21 65.17 2kle n SER 794 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2kle s SER 795 N -0.71 5.76 0.00 4.04 0.15 -1.26 -5.19 113.70 116.49 2kle s SER 795 Ca 0.09 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.22 2kle s SER 795 Cb 0.27 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 62.02 2kle s SER 795 CO -0.07 -2.12 0.16 0.18 1.20 0.00 0.00 173.24 172.59