#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 1.23 -1.31 0.53 2.04 -2.06 -3.42 117.51 114.52 2kle h ILE 725 Ca 0.00 -0.79 -0.50 0.00 1.00 0.00 0.00 64.86 64.57 2kle h ILE 725 Cb 0.00 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 2kle h ILE 725 CO 0.00 0.26 -0.33 -0.44 0.00 0.00 0.00 178.15 177.64 2kle s SER 726 N -5.88 5.07 0.16 1.72 0.01 -1.26 -5.15 113.70 108.37 2kle s SER 726 Ca -0.14 -0.79 0.01 0.00 1.31 0.00 0.00 55.95 56.35 2kle s SER 726 Cb 0.08 -0.36 0.01 0.00 0.21 0.00 0.00 66.02 65.96 2kle s SER 726 CO 0.74 -0.79 0.12 -0.62 0.41 0.00 0.00 173.24 173.10 2kle n GLU 727 N -1.68 1.25 0.00 12.44 1.02 -1.26 -5.09 120.64 127.33 2kle n GLU 727 Ca 0.04 -1.01 0.00 0.00 -0.02 0.00 0.00 57.16 56.17 2kle n GLU 727 Cb 0.62 0.11 0.00 0.00 -0.02 0.00 0.00 31.44 32.15 2kle n GLU 727 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2kle n SER 728 N -1.96 0.00 0.00 1.62 7.64 -1.26 -4.80 113.62 114.86 2kle n SER 728 Ca -0.01 0.87 0.00 0.00 1.01 0.00 0.00 58.87 60.74 2kle n SER 728 Cb 0.18 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 2kle n SER 728 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2kle n LEU 729 N -1.76 0.00 -0.04 -3.43 7.94 -1.26 -4.80 117.00 113.65 2kle n LEU 729 Ca 0.00 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.77 2kle n LEU 729 Cb 0.00 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 43.95 2kle n LEU 729 CO 0.00 0.00 0.44 0.08 -1.11 0.00 0.00 177.39 176.80 2kle h ARG 730 N 0.00 0.74 0.08 1.96 0.11 -1.96 0.98 114.38 116.29 2kle h ARG 730 Ca 0.00 -0.47 -0.13 0.00 0.10 0.00 0.00 59.98 59.48 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 1.10 -0.59 0.37 0.10 0.00 0.00 179.97 180.95 2kle h GLN 731 N 0.56 0.18 0.00 0.08 5.75 -1.87 -3.29 115.11 116.52 2kle h GLN 731 Ca 0.01 -0.30 0.00 0.00 -0.15 0.00 0.00 58.65 58.21 2kle h GLN 731 Cb 1.14 0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.80 2kle h GLN 731 CO 0.12 1.14 0.00 0.78 -2.65 0.00 0.00 178.83 178.22 2kle h GLY 732 N -0.59 0.00 -6.24 2.39 0.00 -1.81 -3.30 103.07 93.52 2kle h GLY 732 Ca -0.11 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.65 2kle h GLY 732 CO 0.08 0.00 -0.97 0.61 0.00 0.00 0.00 176.54 176.25 2kle n GLY 733 N -0.26 2.10 0.00 4.60 0.00 0.34 -4.46 105.19 107.50 2kle n GLY 733 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.77 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 2.63 -0.72 3.38 -0.02 0.00 -1.24 -4.60 105.19 104.61 2kle n GLY 734 Ca 0.28 0.38 -0.10 0.00 0.00 0.00 0.00 46.02 46.58 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 1.18 -0.07 1.61 0.00 -1.24 -4.09 119.74 117.13 2kle s LYS 735 Ca 0.00 -0.99 0.03 0.00 0.00 0.00 0.00 55.97 55.02 2kle s LYS 735 Cb 0.00 0.43 0.01 0.00 0.00 0.00 0.00 37.83 38.27 2kle s LYS 735 CO 0.00 -0.46 -0.17 -0.51 0.00 0.00 0.00 175.35 174.21 2kle s LEU 736 N -2.90 1.84 0.03 2.77 1.02 -0.60 -4.56 118.68 116.28 2kle s LEU 736 Ca 0.11 -0.39 0.02 0.00 0.02 0.00 0.00 54.13 53.89 2kle s LEU 736 Cb 0.02 -1.04 -0.02 0.00 0.02 0.00 0.00 46.19 45.17 2kle s LEU 736 CO -0.04 0.10 -0.07 0.20 0.02 0.00 0.00 176.35 176.56 2kle s ASN 737 N 0.45 0.77 0.07 2.29 0.02 -1.26 -0.13 114.94 117.14 2kle s ASN 737 Ca -0.14 -0.47 -0.17 0.00 -1.02 0.00 0.00 52.86 51.06 2kle s ASN 737 Cb -0.16 0.02 -0.05 0.00 0.02 0.00 0.00 41.25 41.08 2kle s ASN 737 CO 0.05 -0.16 1.29 0.15 0.02 0.00 0.00 177.10 178.45 2kle h PHE 738 N 4.77 -0.95 0.00 2.20 3.57 -0.93 1.96 116.94 127.56 2kle h PHE 738 Ca -0.34 0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.16 2kle h PHE 738 Cb 1.20 0.45 -0.01 0.00 2.79 0.00 0.00 35.95 40.39 2kle h PHE 738 CO 0.61 -0.25 -0.23 -0.44 -2.23 0.00 0.00 178.31 175.77 2kle h ASP 739 N -0.15 0.00 0.35 0.41 5.19 -1.97 -2.72 116.42 117.51 2kle h ASP 739 Ca 0.05 0.00 -0.32 0.00 -0.62 0.00 0.00 57.03 56.14 2kle h ASP 739 Cb 0.29 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.77 2kle h ASP 739 CO -0.37 0.23 -1.81 -0.08 -3.12 0.00 0.00 179.24 174.09 2kle h GLU 740 N 0.00 0.12 -0.22 3.56 4.57 -1.82 -3.31 114.58 117.48 2kle h GLU 740 Ca -0.00 -0.21 0.06 0.00 -1.18 0.00 0.00 59.36 58.04 2kle h GLU 740 Cb 0.59 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.25 2kle h GLU 740 CO 0.03 0.82 0.17 1.25 -1.18 0.00 0.00 179.01 180.10 2kle h LEU 741 N 0.03 0.00 -1.42 1.64 5.85 0.33 0.38 115.31 122.12 2kle h LEU 741 Ca -0.34 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.44 2kle h LEU 741 Cb 2.02 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 43.01 2kle h LEU 741 CO 0.09 0.00 0.44 0.03 -0.34 0.00 0.00 178.44 178.66 2kle h ARG 742 N 0.00 0.69 -0.87 1.25 2.47 -1.57 0.14 114.38 116.49 2kle h ARG 742 Ca 0.11 -0.04 0.23 0.00 -1.26 0.00 0.00 59.98 59.01 2kle h ARG 742 Cb 0.45 -0.16 -0.05 0.00 -1.65 0.00 0.00 29.97 28.56 2kle h ARG 742 CO -0.00 0.46 0.60 0.37 0.56 0.00 0.00 179.97 181.96 2kle h GLN 743 N 0.72 0.17 0.00 0.04 5.75 -0.40 1.99 115.11 123.38 2kle h GLN 743 Ca 0.28 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.77 2kle h GLN 743 Cb 0.21 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.72 2kle h GLN 743 CO -0.09 0.12 -0.00 0.22 -2.65 0.00 0.00 178.83 176.43 2kle h ASP 744 N 0.18 -0.00 -1.20 -0.69 3.58 -0.88 -3.39 116.42 114.02 2kle h ASP 744 Ca 0.43 -0.89 -0.61 0.00 0.42 0.00 0.00 57.03 56.39 2kle h ASP 744 Cb 1.42 0.00 -0.39 0.00 1.72 0.00 0.00 39.33 42.08 2kle h ASP 744 CO -0.09 0.93 -0.35 0.00 -2.88 0.00 0.00 179.24 176.85 2kle n LEU 745 N -4.64 5.51 -4.56 2.28 -0.00 0.32 -4.95 117.00 110.96 2kle n LEU 745 Ca -0.09 -4.87 -0.38 0.00 -0.00 0.00 0.00 56.01 50.67 2kle n LEU 745 Cb 0.43 -0.55 -0.03 0.00 -0.00 0.00 0.00 43.42 43.27 2kle n LEU 745 CO 0.31 2.03 1.98 0.29 -0.00 0.00 0.00 177.39 182.01 2kle n LYS 746 N -0.64 1.29 0.00 1.47 5.02 0.65 -4.18 118.16 121.77 2kle n LYS 746 Ca 0.46 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.90 2kle n LYS 746 Cb 0.73 -3.35 0.00 0.00 -0.02 0.00 0.00 35.03 32.40 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 5.96 0.57 0.00 0.72 0.00 -1.26 -5.06 105.19 106.12 2kle n GLY 747 Ca 0.36 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 0.14 0.00 -4.40 1.61 0.00 -1.26 -5.15 118.16 109.10 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 -0.08 0.00 -0.00 0.00 0.00 35.03 34.95 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 -0.92 2.51 0.00 2.58 0.00 -1.26 -5.09 107.32 105.14 2kle s GLY 749 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 44.72 42.86 2kle s GLY 749 CO 0.00 -2.03 0.00 1.42 0.00 0.00 0.00 173.10 172.49 2kle n HIS 750 N -1.17 0.00 -4.34 1.90 8.25 -1.26 -4.96 115.22 113.64 2kle n HIS 750 Ca -0.05 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.10 2kle n HIS 750 Cb 0.66 -0.24 -0.10 0.00 1.12 0.00 0.00 29.99 31.43 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 -0.64 3.32 0.40 1.59 2.01 -1.26 -5.01 115.64 116.05 2kle s THR 751 Ca 0.00 -1.17 0.15 0.00 0.31 0.00 0.00 61.69 60.98 2kle s THR 751 Cb 0.00 -2.51 0.36 0.00 0.01 0.00 0.00 72.50 70.36 2kle s THR 751 CO 0.00 0.20 1.84 0.44 -0.69 0.00 0.00 174.62 176.41 2kle h ASP 752 N 3.92 0.48 -0.55 3.53 5.19 -1.99 -1.41 116.42 125.58 2kle h ASP 752 Ca -0.49 0.05 -0.04 0.00 -0.62 0.00 0.00 57.03 55.93 2kle h ASP 752 Cb 1.16 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 40.61 2kle h ASP 752 CO 0.52 0.19 0.18 0.00 -3.12 0.00 0.00 179.24 177.01 2kle h ALA 753 N 1.61 0.72 -0.49 3.45 0.00 -1.98 0.32 119.26 122.90 2kle h ALA 753 Ca 0.48 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 2kle h ALA 753 Cb 1.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2kle h ALA 753 CO -0.21 0.38 0.14 0.93 0.00 0.00 0.00 179.25 180.49 2kle h GLU 754 N 0.77 0.76 0.02 0.00 5.08 -1.68 -2.42 114.58 117.12 2kle h GLU 754 Ca 0.18 -0.17 -0.25 0.00 -1.00 0.00 0.00 59.36 58.11 2kle h GLU 754 Cb 0.27 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 29.43 2kle h GLU 754 CO -0.01 0.73 -1.03 0.82 -1.00 0.00 0.00 179.01 178.52 2kle h ILE 755 N 0.66 1.35 -0.38 3.13 2.04 -1.11 -1.77 117.51 121.44 2kle h ILE 755 Ca 0.15 -2.42 -0.04 0.00 1.00 0.00 0.00 64.86 63.55 2kle h ILE 755 Cb 0.30 2.47 -0.02 0.00 -0.74 0.00 0.00 36.82 38.84 2kle h ILE 755 CO -0.00 0.73 0.08 -0.08 0.00 0.00 0.00 178.15 178.88 2kle h GLU 756 N 0.28 0.62 -0.04 2.37 4.81 -0.36 -2.22 114.58 120.04 2kle h GLU 756 Ca -0.11 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 58.94 2kle h GLU 756 Cb 1.68 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.99 2kle h GLU 756 CO 0.19 0.66 -0.04 0.00 -0.73 0.00 0.00 179.01 179.09 2kle h ALA 757 N 0.93 0.06 -0.61 2.92 0.00 -1.48 -3.29 119.26 117.78 2kle h ALA 757 Ca 0.12 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.83 2kle h ALA 757 Cb 0.33 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 2kle h ALA 757 CO 0.00 -0.15 0.29 0.97 0.00 0.00 0.00 179.25 180.36 2kle h ILE 758 N -0.37 0.87 -0.12 0.00 -0.00 -1.25 -0.63 117.51 116.01 2kle h ILE 758 Ca 0.01 -0.18 -0.07 0.00 -0.00 0.00 0.00 64.86 64.62 2kle h ILE 758 Cb 0.55 0.30 -0.01 0.00 -0.00 0.00 0.00 36.82 37.66 2kle h ILE 758 CO 0.01 0.10 -0.24 2.19 -0.00 0.00 0.00 178.15 180.21 2kle h PHE 759 N 0.52 0.23 -0.63 2.19 -5.15 -1.53 0.20 116.94 112.77 2kle h PHE 759 Ca 0.29 -0.04 0.02 0.00 -0.20 0.00 0.00 57.97 58.04 2kle h PHE 759 Cb 0.28 -0.06 -0.03 0.00 0.22 0.00 0.00 35.95 36.35 2kle h PHE 759 CO -0.12 0.44 0.42 1.15 -2.00 0.00 0.00 178.31 178.20 2kle h THR 760 N 0.20 1.13 0.03 0.88 2.02 -1.17 0.54 112.91 116.53 2kle h THR 760 Ca 0.03 -0.28 -0.37 0.00 0.77 0.00 0.00 66.41 66.56 2kle h THR 760 Cb 0.53 0.24 -0.05 0.00 -1.74 0.00 0.00 68.15 67.14 2kle h THR 760 CO 0.04 0.15 -2.10 1.17 0.37 0.00 0.00 175.52 175.14 2kle n LYS 761 N -4.45 0.64 0.05 6.66 4.81 -1.01 -4.52 118.16 120.34 2kle n LYS 761 Ca 0.07 0.30 0.10 0.00 -0.87 0.00 0.00 58.31 57.91 2kle n LYS 761 Cb 0.07 -1.61 -0.07 0.00 0.02 0.00 0.00 35.03 33.44 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 -3.84 0.61 -1.37 5.64 4.01 0.67 -4.94 117.16 117.93 2kle n TYR 762 Ca -0.42 0.18 -0.33 0.00 -0.16 0.00 0.00 57.90 57.17 2kle n TYR 762 Cb 0.91 -0.82 0.10 0.00 -0.31 0.00 0.00 39.34 39.22 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 -5.11 4.17 0.18 7.72 2.15 0.19 -4.93 116.67 121.04 2kle s ASP 763 Ca -0.04 2.25 -0.13 0.00 0.43 0.00 0.00 52.55 55.07 2kle s ASP 763 Cb 0.11 -2.58 0.16 0.00 -0.30 0.00 0.00 42.92 40.31 2kle s ASP 763 CO 0.84 -2.27 1.78 -0.61 -0.17 0.00 0.00 175.17 174.73 2kle h GLN 764 N -0.51 0.45 0.00 4.34 4.15 -1.92 -3.21 115.11 118.41 2kle h GLN 764 Ca -0.47 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.93 2kle h GLN 764 Cb 1.28 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.87 2kle h GLN 764 CO 0.49 0.30 -0.67 -0.25 -1.93 0.00 0.00 178.83 176.78 2kle n ASP 765 N -4.91 0.71 -1.46 -0.69 9.92 -1.26 -4.97 116.55 113.88 2kle n ASP 765 Ca 0.05 -0.73 -0.16 0.00 -0.53 0.00 0.00 54.79 53.42 2kle n ASP 765 Cb 0.16 1.05 -0.07 0.00 -0.64 0.00 0.00 41.12 41.62 2kle n ASP 765 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2kle n GLY 766 N 1.33 1.50 0.37 0.44 0.00 -1.21 -4.78 105.19 102.84 2kle n GLY 766 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.81 0.59 -3.28 1.61 8.00 -1.26 -4.64 116.55 116.76 2kle n ASP 767 Ca -0.16 0.09 -0.31 0.00 0.71 0.00 0.00 54.79 55.13 2kle n ASP 767 Cb 0.52 -0.43 0.03 0.00 -0.02 0.00 0.00 41.12 41.22 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 -3.08 -1.53 0.00 -1.24 7.27 -1.26 -4.78 117.38 112.76 2kle n GLN 768 Ca -0.03 1.21 0.00 0.00 0.07 0.00 0.00 57.00 58.25 2kle n GLN 768 Cb 0.12 -1.69 0.00 0.00 2.41 0.00 0.00 30.24 31.09 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 -5.04 3.69 0.28 -0.84 -0.24 120.64 118.56 2kle n GLU 769 Ca -0.07 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.61 2kle n GLU 769 Cb 0.61 0.00 -0.16 0.00 1.43 0.00 0.00 31.44 33.32 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 2.35 0.70 -1.84 1.02 0.81 -4.82 118.68 116.90 2kle s LEU 770 Ca 0.00 -0.45 -0.08 0.00 0.02 0.00 0.00 54.13 53.62 2kle s LEU 770 Cb 0.00 -1.49 0.05 0.00 0.02 0.00 0.00 46.19 44.77 2kle s LEU 770 CO 0.00 0.18 1.02 0.42 0.02 0.00 0.00 176.35 177.99 2kle s THR 771 N 0.27 2.60 0.36 5.49 -4.23 -1.26 -2.43 115.64 116.44 2kle s THR 771 Ca -0.14 -0.11 0.06 0.00 -1.18 0.00 0.00 61.69 60.32 2kle s THR 771 Cb -0.17 -3.13 0.29 0.00 1.34 0.00 0.00 72.50 70.83 2kle s THR 771 CO 0.07 -0.14 1.97 -0.08 -0.54 0.00 0.00 174.62 175.90 2kle h GLU 772 N -0.59 0.73 -0.19 3.99 4.22 -1.94 0.10 114.58 120.90 2kle h GLU 772 Ca -0.45 -0.04 -0.12 0.00 0.08 0.00 0.00 59.36 58.83 2kle h GLU 772 Cb 1.30 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 2kle h GLU 772 CO 0.62 0.48 -0.41 0.45 -2.18 0.00 0.00 179.01 177.97 2kle h HIS 773 N 0.75 0.51 0.06 0.92 3.86 -1.92 0.15 115.15 119.48 2kle h HIS 773 Ca 0.29 -0.14 -0.28 0.00 -1.16 0.00 0.00 60.37 59.09 2kle h HIS 773 Cb 0.21 -0.11 0.02 0.00 1.06 0.00 0.00 27.41 28.59 2kle h HIS 773 CO -0.00 0.77 -1.13 0.93 0.86 0.00 0.00 177.93 179.37 2kle h GLU 774 N 0.36 0.60 -0.09 2.45 5.08 -1.64 -3.15 114.58 118.18 2kle h GLU 774 Ca 0.03 -0.72 -0.05 0.00 -1.00 0.00 0.00 59.36 57.62 2kle h GLU 774 Cb 0.87 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 2kle h GLU 774 CO 0.07 1.31 -0.18 1.25 -1.00 0.00 0.00 179.01 180.46 2kle h HIS 775 N 0.30 0.15 -0.32 4.33 2.76 -0.63 -0.89 115.15 120.85 2kle h HIS 775 Ca -0.15 -0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 57.96 2kle h HIS 775 Cb 1.79 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 30.69 2kle h HIS 775 CO 0.10 0.32 -0.01 0.37 -1.30 0.00 0.00 177.93 177.41 2kle h GLN 776 N 0.14 0.49 0.12 5.26 5.75 -0.66 -3.26 115.11 122.95 2kle h GLN 776 Ca 0.03 -0.10 -0.32 0.00 -0.15 0.00 0.00 58.65 58.10 2kle h GLN 776 Cb 0.40 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.87 2kle h GLN 776 CO 0.03 0.53 -1.71 1.96 -2.65 0.00 0.00 178.83 176.99 2kle h GLN 777 N 0.48 0.25 0.00 1.69 4.20 -1.25 -3.46 115.11 117.01 2kle h GLN 777 Ca 0.10 -0.43 0.00 0.00 0.06 0.00 0.00 58.65 58.38 2kle h GLN 777 Cb 0.32 0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.26 2kle h GLN 777 CO 0.01 1.21 0.00 -1.33 -0.67 0.00 0.00 178.83 178.05 2kle n MET 778 N -3.74 0.00 -2.27 1.46 2.81 -0.45 -5.00 117.12 109.93 2kle n MET 778 Ca -0.29 0.00 -0.27 0.00 -1.81 0.00 0.00 57.70 55.33 2kle n MET 778 Cb 0.97 -0.18 0.15 0.00 -0.71 0.00 0.00 33.22 33.45 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 0.00 1.11 -0.29 0.03 0.52 -1.25 -5.07 118.95 113.99 2kle s ARG 779 Ca 0.00 -0.80 -0.03 0.00 -0.52 0.00 0.00 55.73 54.37 2kle s ARG 779 Cb 0.00 -2.09 0.10 0.00 0.52 0.00 0.00 34.95 33.48 2kle s ARG 779 CO 0.00 -1.96 0.12 -0.51 0.02 0.00 0.00 175.30 172.97 2kle s ASP 780 N -4.83 3.64 -0.18 0.23 1.01 -1.26 -4.83 116.67 110.45 2kle s ASP 780 Ca 0.71 -1.36 -0.23 0.00 0.71 0.00 0.00 52.55 52.38 2kle s ASP 780 Cb -0.04 -0.48 -0.20 0.00 1.01 0.00 0.00 42.92 43.21 2kle s ASP 780 CO 0.49 -0.43 0.38 -0.78 0.21 0.00 0.00 175.17 175.03 2kle h ASP 781 N 8.33 0.00 1.43 0.27 3.58 -1.95 -3.38 116.42 124.70 2kle h ASP 781 Ca -0.18 -0.63 0.00 0.00 0.42 0.00 0.00 57.03 56.64 2kle h ASP 781 Cb 1.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.06 2kle h ASP 781 CO 0.44 1.24 0.00 0.25 -2.88 0.00 0.00 179.24 178.30 2kle h LEU 782 N -1.00 0.00 -1.63 2.28 5.85 -1.95 -2.81 115.31 116.05 2kle h LEU 782 Ca -0.20 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.60 2kle h LEU 782 Cb 1.11 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 2kle h LEU 782 CO -0.12 0.00 0.37 -0.08 -0.34 0.00 0.00 178.44 178.27 2kle h GLU 783 N 0.00 0.42 -1.43 1.25 4.57 -1.98 -3.31 114.58 114.11 2kle h GLU 783 Ca 0.00 -0.03 -0.41 0.00 -1.18 0.00 0.00 59.36 57.75 2kle h GLU 783 Cb 0.72 -0.09 -0.28 0.00 -0.16 0.00 0.00 28.75 28.93 2kle h GLU 783 CO 0.00 0.28 -0.81 1.63 -1.18 0.00 0.00 179.01 178.93 2kle n LYS 784 N -4.47 0.55 0.00 1.92 5.02 -1.07 -5.05 118.16 115.06 2kle n LYS 784 Ca 0.08 -2.62 0.00 0.00 -2.02 0.00 0.00 58.31 53.75 2kle n LYS 784 Cb 0.31 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 2kle n LYS 784 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2kle n GLU 785 N 2.15 0.00 -4.27 1.97 0.00 -1.19 -4.93 120.64 114.37 2kle n GLU 785 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 57.16 57.05 2kle n GLU 785 Cb 0.55 0.00 -0.16 0.00 0.00 0.00 0.00 31.44 31.82 2kle n GLU 785 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 2kle s ARG 786 N -0.10 2.62 0.57 5.31 3.52 -1.26 -4.74 118.95 124.87 2kle s ARG 786 Ca 0.00 -0.69 -0.19 0.00 -0.13 0.00 0.00 55.73 54.71 2kle s ARG 786 Cb 0.00 -2.26 -0.04 0.00 -1.56 0.00 0.00 34.95 31.09 2kle s ARG 786 CO 0.00 -0.15 1.19 -1.21 -0.81 0.00 0.00 175.30 174.33 2kle s GLU 787 N 1.20 3.13 0.67 5.12 8.01 -1.26 -5.01 118.70 130.55 2kle s GLU 787 Ca 0.00 1.80 -0.11 0.00 0.01 0.00 0.00 54.97 56.67 2kle s GLU 787 Cb -0.14 -2.00 -0.01 0.00 -4.31 0.00 0.00 34.13 27.67 2kle s GLU 787 CO -0.08 -1.07 1.05 0.34 0.01 0.00 0.00 175.26 175.51 2kle s ASP 788 N -1.58 5.75 -0.95 -0.19 2.15 -1.26 -4.98 116.67 115.61 2kle s ASP 788 Ca 0.75 1.44 -0.16 0.00 0.43 0.00 0.00 52.55 55.01 2kle s ASP 788 Cb -0.29 -2.38 0.18 0.00 -0.30 0.00 0.00 42.92 40.12 2kle s ASP 788 CO 0.32 -1.18 1.06 -0.22 -0.17 0.00 0.00 175.17 174.98 2kle s LEU 789 N -5.36 5.69 0.00 -1.34 2.96 -1.26 -4.99 118.68 114.38 2kle s LEU 789 Ca 0.57 -2.51 0.05 0.00 -0.22 0.00 0.00 54.13 52.01 2kle s LEU 789 Cb -0.12 -2.33 0.10 0.00 0.50 0.00 0.00 46.19 44.34 2kle s LEU 789 CO 0.54 -0.80 0.75 -0.67 -1.32 0.00 0.00 176.35 174.85 2kle n ASP 790 N 5.30 1.51 0.00 3.68 -0.08 -1.26 -5.08 116.55 120.62 2kle n ASP 790 Ca 0.23 -2.16 -0.02 0.00 -1.51 0.00 0.00 54.79 51.33 2kle n ASP 790 Cb 0.47 -0.44 -0.01 0.00 2.34 0.00 0.00 41.12 43.48 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 0.49 0.09 -2.67 0.00 -1.26 -5.08 117.00 108.58 2kle n LEU 791 Ca 0.14 0.07 0.00 0.00 0.00 0.00 0.00 56.01 56.22 2kle n LEU 791 Cb 0.50 -0.17 0.00 0.00 0.00 0.00 0.00 43.42 43.75 2kle n LEU 791 CO 0.33 -0.17 0.00 -0.67 0.00 0.00 0.00 177.39 176.88 2kle n ASP 792 N -3.26 -1.39 -4.19 1.96 2.03 -1.26 -5.13 116.55 105.30 2kle n ASP 792 Ca -0.04 0.33 -0.11 0.00 0.52 0.00 0.00 54.79 55.49 2kle n ASP 792 Cb 0.39 1.55 -0.10 0.00 -0.72 0.00 0.00 41.12 42.24 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 -1.39 1.01 -0.19 -0.67 2.46 -1.26 -5.10 115.29 110.16 2kle s HIS 793 Ca 0.00 -1.10 0.07 0.00 0.47 0.00 0.00 55.06 54.50 2kle s HIS 793 Cb 0.00 -0.58 0.23 0.00 -0.13 0.00 0.00 32.58 32.10 2kle s HIS 793 CO 0.00 -0.34 1.11 -1.13 -2.47 0.00 0.00 174.74 171.91 2kle n SER 794 N -0.15 -0.90 -4.62 9.88 3.41 -1.26 -5.10 113.62 114.87 2kle n SER 794 Ca -0.07 -1.72 -0.35 0.00 -0.26 0.00 0.00 58.87 56.48 2kle n SER 794 Cb 0.63 0.41 -0.10 0.00 -0.26 0.00 0.00 64.21 64.89 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 5.59 0.00 4.04 0.15 -1.26 -5.19 113.70 116.31 2kle s SER 795 Ca 0.05 0.06 0.25 0.00 0.70 0.00 0.00 55.95 57.02 2kle s SER 795 Cb 0.25 -1.96 0.41 0.00 -1.71 0.00 0.00 66.02 63.02 2kle s SER 795 CO -0.07 0.17 1.38 0.18 1.20 0.00 0.00 173.24 176.10