#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 1.09 -5.66 0.53 2.04 -2.05 -3.43 117.51 110.02 2kle h ILE 725 Ca 0.00 -0.55 -0.42 0.00 1.00 0.00 0.00 64.86 64.89 2kle h ILE 725 Cb 0.00 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 2kle h ILE 725 CO 0.00 0.14 -0.15 -1.20 0.00 0.00 0.00 178.15 176.94 2kle n SER 726 N -5.02 2.08 -5.02 1.72 7.64 -1.26 -4.95 113.62 108.81 2kle n SER 726 Ca -0.08 -2.36 -0.20 0.00 1.01 0.00 0.00 58.87 57.23 2kle n SER 726 Cb 0.17 -0.15 0.06 0.00 -1.01 0.00 0.00 64.21 63.27 2kle n SER 726 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2kle s GLU 727 N -3.86 2.28 0.00 1.43 2.02 -1.26 -5.07 118.70 114.23 2kle s GLU 727 Ca 0.33 -1.70 0.00 0.00 0.02 0.00 0.00 54.97 53.62 2kle s GLU 727 Cb -0.03 -2.59 0.00 0.00 0.10 0.00 0.00 34.13 31.62 2kle s GLU 727 CO 0.21 -0.87 0.82 0.43 0.02 0.00 0.00 175.26 175.87 2kle n SER 728 N -2.22 0.00 0.00 -0.19 7.64 -1.26 -4.79 113.62 112.81 2kle n SER 728 Ca 0.14 0.82 0.00 0.00 1.01 0.00 0.00 58.87 60.84 2kle n SER 728 Cb 0.62 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 2kle n SER 728 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2kle n LEU 729 N -1.58 0.00 -0.07 -3.43 4.77 -1.26 -4.82 117.00 110.61 2kle n LEU 729 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 2kle n LEU 729 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2kle n LEU 729 CO 0.00 0.00 0.44 0.08 -1.33 0.00 0.00 177.39 176.58 2kle h ARG 730 N 0.00 0.84 0.09 3.23 0.11 -1.95 0.14 114.38 116.83 2kle h ARG 730 Ca 0.00 -0.53 -0.15 0.00 0.10 0.00 0.00 59.98 59.40 2kle h ARG 730 Cb 0.00 0.06 0.01 0.00 1.11 0.00 0.00 29.97 31.15 2kle h ARG 730 CO 0.00 1.16 -0.68 0.37 0.10 0.00 0.00 179.97 180.93 2kle h GLN 731 N 0.64 0.20 0.00 0.08 5.75 -1.87 -3.27 115.11 116.63 2kle h GLN 731 Ca 0.01 -0.34 0.00 0.00 -0.15 0.00 0.00 58.65 58.18 2kle h GLN 731 Cb 1.15 0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.83 2kle h GLN 731 CO 0.12 1.16 0.00 0.41 -2.65 0.00 0.00 178.83 177.87 2kle n GLY 732 N 1.65 -1.20 2.23 2.39 0.00 -1.22 -3.53 105.19 105.52 2kle n GLY 732 Ca -0.15 0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.27 2.76 0.00 -0.02 0.00 0.48 -4.46 105.19 103.67 2kle n GLY 733 Ca 0.01 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 1.28 -1.83 3.42 -0.02 0.00 -1.23 -4.69 105.19 102.13 2kle n GLY 734 Ca 0.21 0.62 -0.10 0.00 0.00 0.00 0.00 46.02 46.75 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 1.24 -0.09 1.61 0.00 -1.24 -4.21 119.74 117.06 2kle s LYS 735 Ca 0.00 -0.93 0.03 0.00 0.00 0.00 0.00 55.97 55.06 2kle s LYS 735 Cb 0.00 0.46 0.01 0.00 0.00 0.00 0.00 37.83 38.30 2kle s LYS 735 CO 0.00 -0.50 -0.16 -0.51 0.00 0.00 0.00 175.35 174.18 2kle s LEU 736 N -2.89 1.79 0.03 2.77 1.43 0.21 -4.62 118.68 117.40 2kle s LEU 736 Ca 0.10 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 2kle s LEU 736 Cb 0.01 -1.06 -0.02 0.00 0.03 0.00 0.00 46.19 45.15 2kle s LEU 736 CO -0.04 0.06 -0.06 0.20 0.23 0.00 0.00 176.35 176.74 2kle s ASN 737 N 0.67 0.70 0.05 2.29 0.02 -1.26 -0.23 114.94 117.17 2kle s ASN 737 Ca -0.14 -0.45 -0.11 0.00 -1.02 0.00 0.00 52.86 51.15 2kle s ASN 737 Cb -0.16 0.03 -0.03 0.00 0.02 0.00 0.00 41.25 41.10 2kle s ASN 737 CO 0.04 -0.16 1.18 0.15 0.02 0.00 0.00 177.10 178.33 2kle h PHE 738 N 4.83 -0.59 0.00 2.20 3.57 -0.84 1.96 116.94 128.08 2kle h PHE 738 Ca -0.34 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.14 2kle h PHE 738 Cb 1.20 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 40.22 2kle h PHE 738 CO 0.60 -0.15 -0.26 -0.44 -2.23 0.00 0.00 178.31 175.83 2kle h ASP 739 N -0.09 0.00 0.30 0.41 5.19 -1.98 -2.63 116.42 117.62 2kle h ASP 739 Ca 0.03 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 56.11 2kle h ASP 739 Cb 0.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.69 2kle h ASP 739 CO -0.24 0.26 -1.66 -0.08 -3.12 0.00 0.00 179.24 174.41 2kle h GLU 740 N 0.00 0.34 -0.25 3.56 4.57 -1.86 -3.29 114.58 117.65 2kle h GLU 740 Ca -0.00 -0.59 0.07 0.00 -1.18 0.00 0.00 59.36 57.66 2kle h GLU 740 Cb 0.62 0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 29.42 2kle h GLU 740 CO 0.03 1.24 0.19 1.25 -1.18 0.00 0.00 179.01 180.54 2kle h LEU 741 N 0.09 0.00 -1.41 1.64 5.85 0.33 0.39 115.31 122.20 2kle h LEU 741 Ca -0.30 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.48 2kle h LEU 741 Cb 2.07 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 43.06 2kle h LEU 741 CO 0.18 0.00 0.45 0.03 -0.34 0.00 0.00 178.44 178.76 2kle h ARG 742 N 0.00 0.70 -0.82 1.25 2.47 -1.54 0.17 114.38 116.61 2kle h ARG 742 Ca 0.12 -0.04 0.22 0.00 -1.26 0.00 0.00 59.98 59.02 2kle h ARG 742 Cb 0.50 -0.16 -0.04 0.00 -1.65 0.00 0.00 29.97 28.62 2kle h ARG 742 CO -0.00 0.47 0.58 0.37 0.56 0.00 0.00 179.97 181.94 2kle h GLN 743 N 0.73 0.12 0.00 0.04 4.15 -0.37 2.04 115.11 121.81 2kle h GLN 743 Ca 0.29 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.70 2kle h GLN 743 Cb 0.23 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.89 2kle h GLN 743 CO -0.09 0.08 -0.00 0.22 -1.93 0.00 0.00 178.83 177.11 2kle h ASP 744 N 0.12 -0.00 -1.15 -0.69 3.58 -0.82 -3.39 116.42 114.06 2kle h ASP 744 Ca 0.40 -0.82 -0.60 0.00 0.42 0.00 0.00 57.03 56.43 2kle h ASP 744 Cb 1.40 0.00 -0.39 0.00 1.72 0.00 0.00 39.33 42.06 2kle h ASP 744 CO -0.06 0.89 -0.35 0.00 -2.88 0.00 0.00 179.24 176.85 2kle n LEU 745 N -4.65 5.54 -4.67 2.28 -0.00 0.32 -4.90 117.00 110.92 2kle n LEU 745 Ca -0.08 -4.84 -0.43 0.00 -0.00 0.00 0.00 56.01 50.65 2kle n LEU 745 Cb 0.40 -0.55 -0.03 0.00 -0.00 0.00 0.00 43.42 43.24 2kle n LEU 745 CO 0.29 2.02 1.54 0.29 -0.00 0.00 0.00 177.39 181.53 2kle n LYS 746 N -0.65 2.70 -0.92 1.47 5.02 0.66 -4.28 118.16 122.17 2kle n LYS 746 Ca 0.46 0.99 0.00 0.00 -2.02 0.00 0.00 58.31 57.74 2kle n LYS 746 Cb 0.75 -2.90 0.00 0.00 -0.02 0.00 0.00 35.03 32.86 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 4.41 -1.85 0.00 0.72 0.00 -1.26 -5.06 105.19 102.15 2kle n GLY 747 Ca 0.20 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 0.52 0.00 -4.57 1.61 0.00 -1.26 -5.16 118.16 109.29 2kle n LYS 748 Ca 0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 58.04 2kle n LYS 748 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 35.03 34.94 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 -0.48 2.61 0.00 2.58 0.00 -1.26 -5.10 107.32 105.66 2kle s GLY 749 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.48 2kle s GLY 749 CO 0.00 -1.94 0.00 1.42 0.00 0.00 0.00 173.10 172.58 2kle n HIS 750 N -0.96 0.00 -4.19 1.90 8.25 -1.26 -4.96 115.22 113.99 2kle n HIS 750 Ca -0.09 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.07 2kle n HIS 750 Cb 0.66 -0.12 -0.09 0.00 1.12 0.00 0.00 29.99 31.57 2kle n HIS 750 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2kle s THR 751 N -0.35 3.90 0.40 1.59 -4.23 -1.26 -5.00 115.64 110.70 2kle s THR 751 Ca 0.00 -0.97 0.13 0.00 -1.18 0.00 0.00 61.69 59.67 2kle s THR 751 Cb 0.00 -2.83 0.34 0.00 1.34 0.00 0.00 72.50 71.35 2kle s THR 751 CO 0.00 0.17 1.92 0.44 -0.54 0.00 0.00 174.62 176.61 2kle h ASP 752 N 3.66 0.48 -0.58 3.99 3.32 -1.99 -1.42 116.42 123.88 2kle h ASP 752 Ca -0.48 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 56.56 2kle h ASP 752 Cb 1.17 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 2kle h ASP 752 CO 0.58 0.26 0.22 0.00 -1.72 0.00 0.00 179.24 178.58 2kle h ALA 753 N 1.63 0.75 -0.54 3.45 0.00 -1.98 0.31 119.26 122.89 2kle h ALA 753 Ca 0.37 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2kle h ALA 753 Cb 0.72 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2kle h ALA 753 CO -0.13 0.37 0.19 0.93 0.00 0.00 0.00 179.25 180.61 2kle h GLU 754 N 0.80 0.83 0.04 0.00 5.08 -1.68 -2.21 114.58 117.44 2kle h GLU 754 Ca 0.19 -0.17 -0.26 0.00 -1.00 0.00 0.00 59.36 58.12 2kle h GLU 754 Cb 0.21 -0.13 0.02 0.00 0.50 0.00 0.00 28.75 29.35 2kle h GLU 754 CO -0.01 0.75 -1.08 0.82 -1.00 0.00 0.00 179.01 178.49 2kle h ILE 755 N 0.75 1.33 -0.47 3.13 2.04 -1.14 -1.69 117.51 121.46 2kle h ILE 755 Ca 0.18 -2.42 -0.02 0.00 1.00 0.00 0.00 64.86 63.60 2kle h ILE 755 Cb 0.25 2.51 -0.02 0.00 -0.74 0.00 0.00 36.82 38.82 2kle h ILE 755 CO -0.01 0.73 0.22 -0.08 0.00 0.00 0.00 178.15 179.01 2kle h GLU 756 N 0.29 0.68 -0.02 2.37 4.81 -0.34 -1.80 114.58 120.57 2kle h GLU 756 Ca -0.13 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 58.99 2kle h GLU 756 Cb 1.73 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.99 2kle h GLU 756 CO 0.20 0.59 -0.02 0.00 -0.73 0.00 0.00 179.01 179.05 2kle h ALA 757 N 1.06 0.02 -0.60 2.92 0.00 -1.45 -3.30 119.26 117.92 2kle h ALA 757 Ca 0.16 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.86 2kle h ALA 757 Cb 0.14 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 2kle h ALA 757 CO -0.02 -0.20 0.31 0.97 0.00 0.00 0.00 179.25 180.32 2kle h ILE 758 N -0.46 0.94 -0.11 0.00 -0.00 -1.16 -0.71 117.51 116.01 2kle h ILE 758 Ca 0.00 -0.20 -0.07 0.00 -0.00 0.00 0.00 64.86 64.60 2kle h ILE 758 Cb 0.54 0.31 -0.01 0.00 -0.00 0.00 0.00 36.82 37.66 2kle h ILE 758 CO 0.00 0.11 -0.23 2.19 -0.00 0.00 0.00 178.15 180.22 2kle h PHE 759 N 0.58 0.20 -0.79 2.19 -5.15 -1.47 0.23 116.94 112.73 2kle h PHE 759 Ca 0.27 -0.03 0.01 0.00 -0.20 0.00 0.00 57.97 58.02 2kle h PHE 759 Cb 0.19 -0.05 -0.04 0.00 0.22 0.00 0.00 35.95 36.27 2kle h PHE 759 CO -0.10 0.41 0.53 1.15 -2.00 0.00 0.00 178.31 178.30 2kle h THR 760 N 0.17 1.19 0.05 0.88 2.02 -1.20 0.49 112.91 116.51 2kle h THR 760 Ca 0.03 -0.36 -0.37 0.00 0.77 0.00 0.00 66.41 66.48 2kle h THR 760 Cb 0.51 0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 66.92 2kle h THR 760 CO 0.04 0.19 -2.10 1.17 0.37 0.00 0.00 175.52 175.19 2kle n LYS 761 N -4.42 0.67 0.03 6.66 4.81 -0.97 -4.43 118.16 120.50 2kle n LYS 761 Ca 0.09 0.29 0.08 0.00 -0.87 0.00 0.00 58.31 57.90 2kle n LYS 761 Cb 0.04 -1.63 -0.09 0.00 0.02 0.00 0.00 35.03 33.37 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 -3.71 0.52 -1.40 5.64 4.01 0.78 -4.94 117.16 118.06 2kle n TYR 762 Ca -0.40 0.16 -0.33 0.00 -0.16 0.00 0.00 57.90 57.17 2kle n TYR 762 Cb 0.94 -0.80 0.09 0.00 -0.31 0.00 0.00 39.34 39.27 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 -5.09 4.25 0.19 7.72 2.15 0.17 -4.92 116.67 121.13 2kle s ASP 763 Ca -0.04 2.23 -0.13 0.00 0.43 0.00 0.00 52.55 55.04 2kle s ASP 763 Cb 0.11 -2.57 0.19 0.00 -0.30 0.00 0.00 42.92 40.34 2kle s ASP 763 CO 0.84 -2.22 1.74 -0.61 -0.17 0.00 0.00 175.17 174.75 2kle h GLN 764 N -0.47 0.31 0.00 4.34 -0.00 -1.93 -3.15 115.11 114.21 2kle h GLN 764 Ca -0.47 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.17 2kle h GLN 764 Cb 1.28 -0.07 0.00 0.00 0.00 0.00 0.00 27.48 28.69 2kle h GLN 764 CO 0.50 0.21 -0.62 -0.25 0.00 0.00 0.00 178.83 178.66 2kle n ASP 765 N -5.04 0.64 0.00 -0.69 8.00 -1.26 -4.96 116.55 113.24 2kle n ASP 765 Ca 0.05 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.78 2kle n ASP 765 Cb 0.22 1.02 0.00 0.00 -0.02 0.00 0.00 41.12 42.33 2kle n ASP 765 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kle n GLY 766 N 1.31 0.00 0.04 0.44 0.00 -1.19 -4.78 105.19 101.01 2kle n GLY 766 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.80 0.80 -3.02 1.61 8.00 -1.26 -4.51 116.55 117.37 2kle n ASP 767 Ca 0.00 0.21 -0.30 0.00 0.71 0.00 0.00 54.79 55.40 2kle n ASP 767 Cb 0.45 -0.61 0.03 0.00 -0.02 0.00 0.00 41.12 40.97 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 -3.30 -1.48 0.00 -1.24 7.27 -1.26 -4.71 117.38 112.65 2kle n GLN 768 Ca -0.05 1.12 0.00 0.00 0.07 0.00 0.00 57.00 58.14 2kle n GLN 768 Cb 0.19 -1.56 0.00 0.00 2.41 0.00 0.00 30.24 31.28 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 -0.07 0.00 -4.00 3.69 0.28 -0.40 -0.13 120.64 120.01 2kle n GLU 769 Ca -0.07 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.58 2kle n GLU 769 Cb 0.55 0.00 -0.12 0.00 1.43 0.00 0.00 31.44 33.30 2kle n GLU 769 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2kle s LEU 770 N 0.00 3.36 0.70 -1.84 1.02 0.68 -4.79 118.68 117.81 2kle s LEU 770 Ca 0.00 -0.17 -0.08 0.00 0.02 0.00 0.00 54.13 53.90 2kle s LEU 770 Cb 0.00 -1.86 0.05 0.00 0.02 0.00 0.00 46.19 44.39 2kle s LEU 770 CO 0.00 0.05 1.03 0.42 0.02 0.00 0.00 176.35 177.87 2kle s THR 771 N 1.06 2.67 0.33 5.49 -4.23 -1.26 -2.44 115.64 117.26 2kle s THR 771 Ca 0.03 -0.08 0.03 0.00 -1.18 0.00 0.00 61.69 60.50 2kle s THR 771 Cb -0.14 -3.15 0.29 0.00 1.34 0.00 0.00 72.50 70.83 2kle s THR 771 CO 0.02 -0.17 1.94 -0.08 -0.54 0.00 0.00 174.62 175.79 2kle h GLU 772 N -0.60 0.86 -0.38 3.99 4.22 -1.94 0.19 114.58 120.93 2kle h GLU 772 Ca -0.45 -0.05 -0.10 0.00 0.08 0.00 0.00 59.36 58.84 2kle h GLU 772 Cb 1.30 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 2kle h GLU 772 CO 0.62 0.57 -0.16 0.45 -2.18 0.00 0.00 179.01 178.30 2kle h HIS 773 N 0.88 0.77 0.03 0.92 3.86 -1.92 0.29 115.15 119.98 2kle h HIS 773 Ca 0.34 -0.15 -0.24 0.00 -1.16 0.00 0.00 60.37 59.16 2kle h HIS 773 Cb 0.21 -0.19 0.02 0.00 1.06 0.00 0.00 27.41 28.51 2kle h HIS 773 CO -0.00 0.81 -0.95 0.93 0.86 0.00 0.00 177.93 179.59 2kle h GLU 774 N 0.62 0.59 0.00 2.45 5.08 -1.67 -3.22 114.58 118.44 2kle h GLU 774 Ca 0.10 -0.68 -0.04 0.00 -1.00 0.00 0.00 59.36 57.74 2kle h GLU 774 Cb 0.63 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 2kle h GLU 774 CO 0.04 1.27 -0.19 1.25 -1.00 0.00 0.00 179.01 180.38 2kle h HIS 775 N 0.20 0.00 -0.90 4.33 2.76 -0.42 0.41 115.15 121.54 2kle h HIS 775 Ca -0.13 0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.10 2kle h HIS 775 Cb 1.63 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 30.53 2kle h HIS 775 CO 0.12 0.19 0.57 0.37 -1.30 0.00 0.00 177.93 177.88 2kle h GLN 776 N 0.00 1.01 0.11 5.26 5.75 -0.44 -3.17 115.11 123.64 2kle h GLN 776 Ca -0.00 -0.06 -0.30 0.00 -0.15 0.00 0.00 58.65 58.14 2kle h GLN 776 Cb 0.37 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 2kle h GLN 776 CO 0.03 0.67 -1.57 1.96 -2.65 0.00 0.00 178.83 177.26 2kle h GLN 777 N 1.04 0.24 -4.82 1.69 4.20 -1.46 -3.45 115.11 112.55 2kle h GLN 777 Ca 0.39 -0.40 -0.67 0.00 0.06 0.00 0.00 58.65 58.03 2kle h GLN 777 Cb 0.15 0.15 -0.22 0.00 0.30 0.00 0.00 27.48 27.86 2kle h GLN 777 CO -0.17 1.19 -0.57 -1.64 -0.67 0.00 0.00 178.83 176.98 2kle s MET 778 N -2.49 3.43 0.00 1.46 -1.94 0.06 -4.94 119.30 114.87 2kle s MET 778 Ca -0.21 -0.65 0.00 0.00 -1.71 0.00 0.00 55.69 53.12 2kle s MET 778 Cb 0.05 -3.53 0.00 0.00 2.01 0.00 0.00 34.83 33.36 2kle s MET 778 CO 0.75 -0.36 0.00 0.54 -0.01 0.00 0.00 175.02 175.94 2kle n ARG 779 N 4.98 0.00 -3.54 2.03 1.74 -1.26 -4.23 116.66 116.37 2kle n ARG 779 Ca -0.14 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.65 2kle n ARG 779 Cb 0.50 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.82 2kle n ARG 779 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2kle s ASP 780 N -0.19 2.97 -0.19 0.55 1.01 -1.26 -4.88 116.67 114.67 2kle s ASP 780 Ca 0.00 -2.54 -0.21 0.00 0.71 0.00 0.00 52.55 50.51 2kle s ASP 780 Cb 0.00 -0.64 -0.21 0.00 1.01 0.00 0.00 42.92 43.08 2kle s ASP 780 CO 0.00 -0.26 0.29 -0.78 0.21 0.00 0.00 175.17 174.62 2kle h ASP 781 N 6.62 0.04 1.08 0.27 3.58 -1.96 -3.38 116.42 122.67 2kle h ASP 781 Ca 0.08 -0.59 -0.04 0.00 0.42 0.00 0.00 57.03 56.90 2kle h ASP 781 Cb 0.94 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.97 2kle h ASP 781 CO 0.37 1.48 -0.17 0.25 -2.88 0.00 0.00 179.24 178.28 2kle h LEU 782 N -0.90 0.00 -2.00 2.28 5.85 -1.93 -1.93 115.31 116.67 2kle h LEU 782 Ca -0.32 0.00 0.19 0.00 0.84 0.00 0.00 57.88 58.59 2kle h LEU 782 Cb 1.35 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.35 2kle h LEU 782 CO -0.16 0.17 0.47 -0.08 -0.34 0.00 0.00 178.44 178.50 2kle h GLU 783 N 0.00 0.00 -0.96 1.25 4.57 -1.97 -3.26 114.58 114.21 2kle h GLU 783 Ca -0.00 0.00 -0.37 0.00 -1.18 0.00 0.00 59.36 57.81 2kle h GLU 783 Cb 0.76 0.00 -0.40 0.00 -0.16 0.00 0.00 28.75 28.94 2kle h GLU 783 CO 0.02 0.00 -1.12 1.17 -1.18 0.00 0.00 179.01 177.90 2kle n LYS 784 N -4.33 1.57 -3.59 1.92 4.81 -0.73 -5.04 118.16 112.77 2kle n LYS 784 Ca 0.13 -3.46 -0.16 0.00 -0.87 0.00 0.00 58.31 53.94 2kle n LYS 784 Cb 0.72 -1.45 -0.07 0.00 0.02 0.00 0.00 35.03 34.26 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 -3.30 0.91 -0.10 1.64 2.12 -1.22 -5.06 118.70 113.69 2kle s GLU 785 Ca 0.30 0.57 -0.01 0.00 0.36 0.00 0.00 54.97 56.19 2kle s GLU 785 Cb 0.43 0.43 -0.03 0.00 0.26 0.00 0.00 34.13 35.23 2kle s GLU 785 CO 0.00 -0.21 -0.07 0.50 -0.54 0.00 0.00 175.26 174.94 2kle s ARG 786 N -0.44 3.13 0.48 4.30 3.52 -1.26 -4.89 118.95 123.79 2kle s ARG 786 Ca -0.06 -0.57 -0.14 0.00 -0.13 0.00 0.00 55.73 54.83 2kle s ARG 786 Cb -0.03 -2.69 -0.07 0.00 -1.56 0.00 0.00 34.95 30.61 2kle s ARG 786 CO 0.05 0.46 0.91 -1.21 -0.81 0.00 0.00 175.30 174.70 2kle s GLU 787 N -0.25 3.88 0.69 5.12 8.01 -1.26 -5.07 118.70 129.83 2kle s GLU 787 Ca 0.03 0.77 -0.11 0.00 0.01 0.00 0.00 54.97 55.68 2kle s GLU 787 Cb -0.13 -2.23 0.01 0.00 -4.31 0.00 0.00 34.13 27.47 2kle s GLU 787 CO 0.03 -0.19 1.07 0.34 0.01 0.00 0.00 175.26 176.51 2kle s ASP 788 N -3.12 5.49 -0.91 -0.19 2.15 -1.26 -4.96 116.67 113.87 2kle s ASP 788 Ca 0.56 1.40 -0.19 0.00 0.43 0.00 0.00 52.55 54.75 2kle s ASP 788 Cb -0.10 -2.29 0.12 0.00 -0.30 0.00 0.00 42.92 40.36 2kle s ASP 788 CO 0.32 -1.34 1.12 -0.22 -0.17 0.00 0.00 175.17 174.88 2kle s LEU 789 N -5.44 4.95 0.00 -1.34 2.96 -1.26 -4.96 118.68 113.60 2kle s LEU 789 Ca 0.58 -1.95 0.04 0.00 -0.22 0.00 0.00 54.13 52.58 2kle s LEU 789 Cb -0.13 -2.41 0.06 0.00 0.50 0.00 0.00 46.19 44.22 2kle s LEU 789 CO 0.54 -1.11 0.50 -0.67 -1.32 0.00 0.00 176.35 174.29 2kle n ASP 790 N 6.71 1.05 -0.05 3.68 -0.08 -1.26 -5.07 116.55 121.53 2kle n ASP 790 Ca 0.22 -1.80 -0.09 0.00 -1.51 0.00 0.00 54.79 51.61 2kle n ASP 790 Cb 0.49 -0.29 -0.04 0.00 2.34 0.00 0.00 41.12 43.62 2kle n ASP 790 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 2kle n LEU 791 N 0.00 1.64 0.00 -2.67 0.00 -1.26 -5.05 117.00 109.65 2kle n LEU 791 Ca 0.09 0.05 0.00 0.00 0.00 0.00 0.00 56.01 56.16 2kle n LEU 791 Cb 0.34 -0.32 0.00 0.00 0.00 0.00 0.00 43.42 43.44 2kle n LEU 791 CO 0.22 0.40 0.00 -0.67 0.00 0.00 0.00 177.39 177.34 2kle n ASP 792 N -3.19 0.00 0.00 1.96 -0.08 -1.26 -5.17 116.55 108.81 2kle n ASP 792 Ca -0.19 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.09 2kle n ASP 792 Cb 0.66 0.09 0.00 0.00 2.34 0.00 0.00 41.12 44.21 2kle n ASP 792 CO 0.00 0.00 0.00 1.57 0.12 0.00 0.00 177.20 178.89 2kle n HIS 793 N -2.27 0.00 -2.12 -0.67 -0.00 -1.26 -5.07 115.22 103.83 2kle n HIS 793 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.67 2kle n HIS 793 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 29.97 2kle n HIS 793 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 2kle n SER 794 N 0.00 -1.00 0.00 0.26 3.41 -1.26 -5.05 113.62 109.99 2kle n SER 794 Ca 0.00 -1.86 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 2kle n SER 794 Cb 0.00 0.35 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 2kle n SER 794 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2kle n SER 795 N -0.34 0.00 0.00 4.04 7.64 -1.26 -4.22 113.62 119.48 2kle n SER 795 Ca -0.23 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.65 2kle n SER 795 Cb 0.70 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.90 2kle n SER 795 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92