#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 0.67 -3.59 5.18 2.04 -2.02 -3.46 117.51 116.33 2kle h ILE 725 Ca 0.00 -1.05 -0.50 0.00 1.00 0.00 0.00 64.86 64.31 2kle h ILE 725 Cb 0.00 1.68 0.01 0.00 -0.74 0.00 0.00 36.82 37.77 2kle h ILE 725 CO 0.00 0.23 0.08 -0.44 0.00 0.00 0.00 178.15 178.02 2kle s SER 726 N -6.28 6.45 0.18 1.72 0.01 -1.26 -4.96 113.70 109.56 2kle s SER 726 Ca -0.01 1.02 -0.06 0.00 1.31 0.00 0.00 55.95 58.21 2kle s SER 726 Cb 0.11 -2.28 -0.06 0.00 0.21 0.00 0.00 66.02 64.01 2kle s SER 726 CO 0.64 -0.41 0.44 -1.61 0.41 0.00 0.00 173.24 172.71 2kle s GLU 727 N -4.02 3.67 0.05 12.44 8.01 -1.26 -5.01 118.70 132.58 2kle s GLU 727 Ca 0.49 0.02 -0.25 0.00 0.01 0.00 0.00 54.97 55.24 2kle s GLU 727 Cb -0.10 -2.77 -0.13 0.00 -4.31 0.00 0.00 34.13 26.81 2kle s GLU 727 CO 0.34 0.40 1.37 0.77 0.01 0.00 0.00 175.26 178.16 2kle h SER 728 N 2.64 -0.84 0.00 -0.19 0.02 -1.92 -3.47 113.55 109.79 2kle h SER 728 Ca -0.46 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 2kle h SER 728 Cb 1.17 0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.95 2kle h SER 728 CO 0.71 -0.50 0.00 -0.11 -1.14 0.00 0.00 176.83 175.79 2kle n LEU 729 N -4.43 0.00 -0.04 5.07 7.94 -1.26 -4.91 117.00 119.37 2kle n LEU 729 Ca -0.10 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.67 2kle n LEU 729 Cb 0.34 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.27 2kle n LEU 729 CO 0.23 0.00 0.42 0.08 -1.11 0.00 0.00 177.39 177.01 2kle h ARG 730 N 0.00 0.75 0.01 1.96 0.11 -1.95 -0.81 114.38 114.45 2kle h ARG 730 Ca 0.00 -0.50 -0.03 0.00 0.10 0.00 0.00 59.98 59.55 2kle h ARG 730 Cb 0.00 0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.15 2kle h ARG 730 CO 0.00 1.12 -0.13 0.37 0.10 0.00 0.00 179.97 181.43 2kle h GLN 731 N 0.56 0.07 0.00 0.08 5.75 -1.87 -3.07 115.11 116.64 2kle h GLN 731 Ca 0.00 -0.09 -0.04 0.00 -0.15 0.00 0.00 58.65 58.37 2kle h GLN 731 Cb 1.18 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.75 2kle h GLN 731 CO 0.12 0.92 -0.19 0.78 -2.65 0.00 0.00 178.83 177.80 2kle h GLY 732 N -0.73 0.00 -4.88 2.39 0.00 -1.81 -3.14 103.07 94.90 2kle h GLY 732 Ca -0.02 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.79 2kle h GLY 732 CO 0.03 0.00 -0.88 0.61 0.00 0.00 0.00 176.54 176.29 2kle n GLY 733 N -0.77 4.52 1.39 4.60 0.00 -0.31 -4.67 105.19 109.94 2kle n GLY 733 Ca -0.02 -2.28 0.00 0.00 0.00 0.00 0.00 46.02 43.72 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 -0.27 -1.92 3.43 -0.02 0.00 -1.16 -4.83 105.19 100.42 2kle n GLY 734 Ca 0.28 0.53 -0.10 0.00 0.00 0.00 0.00 46.02 46.74 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 -0.93 1.26 -0.10 1.61 0.00 -1.22 -4.35 119.74 116.01 2kle s LYS 735 Ca 0.00 -0.96 0.03 0.00 0.00 0.00 0.00 55.97 55.05 2kle s LYS 735 Cb 0.00 0.46 0.00 0.00 0.00 0.00 0.00 37.83 38.30 2kle s LYS 735 CO 0.00 -0.50 -0.21 -0.51 0.00 0.00 0.00 175.35 174.12 2kle s LEU 736 N -2.90 2.00 0.03 2.77 1.43 -0.28 -4.58 118.68 117.15 2kle s LEU 736 Ca 0.11 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 2kle s LEU 736 Cb 0.01 -1.30 -0.02 0.00 0.03 0.00 0.00 46.19 44.91 2kle s LEU 736 CO -0.03 0.12 -0.07 0.20 0.23 0.00 0.00 176.35 176.80 2kle s ASN 737 N 0.47 0.79 0.09 2.29 0.02 -1.26 0.18 114.94 117.52 2kle s ASN 737 Ca -0.17 -0.47 -0.23 0.00 -1.02 0.00 0.00 52.86 50.98 2kle s ASN 737 Cb -0.17 0.02 -0.08 0.00 0.02 0.00 0.00 41.25 41.04 2kle s ASN 737 CO 0.07 -0.16 1.38 0.15 0.02 0.00 0.00 177.10 178.55 2kle h PHE 738 N 4.77 -1.17 0.00 2.20 3.57 -1.04 1.93 116.94 127.19 2kle h PHE 738 Ca -0.34 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.16 2kle h PHE 738 Cb 1.20 0.55 -0.01 0.00 2.79 0.00 0.00 35.95 40.48 2kle h PHE 738 CO 0.61 -0.34 -0.25 -0.44 -2.23 0.00 0.00 178.31 175.66 2kle h ASP 739 N -0.29 0.00 0.30 0.41 5.19 -1.97 -2.74 116.42 117.32 2kle h ASP 739 Ca 0.05 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 56.13 2kle h ASP 739 Cb 0.42 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.89 2kle h ASP 739 CO -0.40 0.25 -1.88 1.21 -3.12 0.00 0.00 179.24 175.29 2kle n GLU 740 N -3.70 0.69 0.21 3.56 4.07 -0.96 -3.87 120.64 120.63 2kle n GLU 740 Ca -0.01 0.26 0.14 0.00 -0.06 0.00 0.00 57.16 57.49 2kle n GLU 740 Cb 0.36 -1.74 0.76 0.00 -0.06 0.00 0.00 31.44 30.76 2kle n GLU 740 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2kle h LEU 741 N 0.03 0.00 -1.45 4.31 5.85 0.32 0.38 115.31 124.75 2kle h LEU 741 Ca -0.36 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.41 2kle h LEU 741 Cb 2.03 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 43.02 2kle h LEU 741 CO 0.08 0.00 0.43 0.03 -0.34 0.00 0.00 178.44 178.64 2kle h ARG 742 N 0.00 0.67 -0.67 1.25 2.47 -1.60 0.16 114.38 116.66 2kle h ARG 742 Ca 0.07 -0.04 0.19 0.00 -1.26 0.00 0.00 59.98 58.94 2kle h ARG 742 Cb 0.31 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.45 2kle h ARG 742 CO -0.00 0.44 0.48 0.37 0.56 0.00 0.00 179.97 181.82 2kle h GLN 743 N 0.69 0.03 0.00 0.04 4.15 -0.44 2.02 115.11 121.60 2kle h GLN 743 Ca 0.28 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.69 2kle h GLN 743 Cb 0.21 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.90 2kle h GLN 743 CO -0.08 0.02 -0.00 0.22 -1.93 0.00 0.00 178.83 177.05 2kle h ASP 744 N 0.03 -0.01 -1.06 -0.69 1.82 -0.85 -3.39 116.42 112.28 2kle h ASP 744 Ca 0.32 -0.84 -0.60 0.00 -0.39 0.00 0.00 57.03 55.52 2kle h ASP 744 Cb 1.24 0.00 -0.39 0.00 0.68 0.00 0.00 39.33 40.86 2kle h ASP 744 CO -0.01 0.90 -0.36 0.00 -1.61 0.00 0.00 179.24 178.15 2kle n LEU 745 N -4.65 5.56 -4.68 2.28 -0.00 0.41 -5.03 117.00 110.90 2kle n LEU 745 Ca -0.09 -4.78 -0.43 0.00 -0.00 0.00 0.00 56.01 50.71 2kle n LEU 745 Cb 0.41 -0.53 -0.03 0.00 -0.00 0.00 0.00 43.42 43.26 2kle n LEU 745 CO 0.30 2.00 1.52 0.29 -0.00 0.00 0.00 177.39 181.50 2kle n LYS 746 N -0.68 2.73 -0.84 1.47 5.02 0.66 -4.24 118.16 122.28 2kle n LYS 746 Ca 0.47 1.00 0.00 0.00 -2.02 0.00 0.00 58.31 57.76 2kle n LYS 746 Cb 0.79 -2.91 0.00 0.00 -0.02 0.00 0.00 35.03 32.90 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 4.36 -1.57 0.16 0.72 0.00 -1.26 -5.06 105.19 102.54 2kle n GLY 747 Ca 0.19 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 0.34 0.00 -4.70 1.61 0.00 -1.26 -5.16 118.16 108.98 2kle n LYS 748 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.00 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 -1.09 2.91 0.00 2.58 0.00 -1.26 -5.10 107.32 105.36 2kle s GLY 749 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.07 2kle s GLY 749 CO 0.00 -2.12 0.00 1.42 0.00 0.00 0.00 173.10 172.40 2kle n HIS 750 N -1.17 0.00 -4.29 1.90 8.25 -1.26 -4.99 115.22 113.66 2kle n HIS 750 Ca -0.16 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 56.98 2kle n HIS 750 Cb 0.67 -0.11 -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 0.99 0.64 0.00 0.00 176.34 177.97 2kle s THR 751 N -0.68 4.02 0.40 1.59 2.01 -1.26 -5.00 115.64 116.73 2kle s THR 751 Ca 0.00 -0.71 0.12 0.00 0.31 0.00 0.00 61.69 61.41 2kle s THR 751 Cb 0.00 -2.81 0.33 0.00 0.01 0.00 0.00 72.50 70.03 2kle s THR 751 CO 0.00 0.33 1.94 0.44 -0.69 0.00 0.00 174.62 176.64 2kle h ASP 752 N 4.21 0.49 -0.68 3.53 3.32 -1.99 -1.49 116.42 123.81 2kle h ASP 752 Ca -0.49 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.57 2kle h ASP 752 Cb 1.17 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.61 2kle h ASP 752 CO 0.57 0.28 0.40 0.00 -1.72 0.00 0.00 179.24 178.77 2kle h ALA 753 N 1.64 0.87 -0.58 3.45 0.00 -1.98 0.36 119.26 123.03 2kle h ALA 753 Ca 0.34 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 2kle h ALA 753 Cb 0.60 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2kle h ALA 753 CO -0.12 0.35 0.16 0.93 0.00 0.00 0.00 179.25 180.58 2kle h GLU 754 N 0.92 0.91 0.12 0.00 5.08 -1.69 -2.27 114.58 117.66 2kle h GLU 754 Ca 0.24 -0.21 -0.29 0.00 -1.00 0.00 0.00 59.36 58.11 2kle h GLU 754 Cb -0.00 -0.13 0.02 0.00 0.50 0.00 0.00 28.75 29.14 2kle h GLU 754 CO -0.04 0.83 -1.23 0.82 -1.00 0.00 0.00 179.01 178.39 2kle h ILE 755 N 0.82 1.36 -0.47 3.13 2.04 -1.26 -2.00 117.51 121.13 2kle h ILE 755 Ca 0.18 -2.64 -0.02 0.00 1.00 0.00 0.00 64.86 63.38 2kle h ILE 755 Cb 0.31 2.76 -0.02 0.00 -0.74 0.00 0.00 36.82 39.13 2kle h ILE 755 CO -0.00 0.79 0.20 -0.08 0.00 0.00 0.00 178.15 179.06 2kle h GLU 756 N 0.20 0.69 -0.04 2.37 4.81 -0.26 -2.08 114.58 120.26 2kle h GLU 756 Ca -0.17 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 58.93 2kle h GLU 756 Cb 1.91 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 31.17 2kle h GLU 756 CO 0.22 0.61 -0.04 0.00 -0.73 0.00 0.00 179.01 179.07 2kle h ALA 757 N 1.05 0.06 -0.58 2.92 0.00 -1.48 -3.27 119.26 117.96 2kle h ALA 757 Ca 0.16 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.85 2kle h ALA 757 Cb 0.17 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 2kle h ALA 757 CO -0.02 -0.15 0.30 0.97 0.00 0.00 0.00 179.25 180.35 2kle h ILE 758 N -0.37 0.94 -0.09 0.00 -0.00 -1.26 -1.11 117.51 115.62 2kle h ILE 758 Ca 0.01 -0.19 -0.07 0.00 -0.00 0.00 0.00 64.86 64.60 2kle h ILE 758 Cb 0.55 0.33 -0.01 0.00 -0.00 0.00 0.00 36.82 37.70 2kle h ILE 758 CO 0.01 0.10 -0.28 2.19 -0.00 0.00 0.00 178.15 180.18 2kle h PHE 759 N 0.56 0.18 -0.72 2.19 -5.15 -1.51 0.16 116.94 112.65 2kle h PHE 759 Ca 0.26 -0.03 0.03 0.00 -0.20 0.00 0.00 57.97 58.02 2kle h PHE 759 Cb 0.17 -0.05 -0.04 0.00 0.22 0.00 0.00 35.95 36.26 2kle h PHE 759 CO -0.10 0.43 0.48 1.15 -2.00 0.00 0.00 178.31 178.27 2kle h THR 760 N 0.15 1.12 0.04 0.88 2.02 -1.24 0.59 112.91 116.48 2kle h THR 760 Ca 0.02 -0.31 -0.36 0.00 0.77 0.00 0.00 66.41 66.53 2kle h THR 760 Cb 0.57 0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 67.09 2kle h THR 760 CO 0.04 0.16 -2.08 1.17 0.37 0.00 0.00 175.52 175.18 2kle n LYS 761 N -4.45 0.66 0.02 6.66 4.81 -0.97 -4.46 118.16 120.43 2kle n LYS 761 Ca 0.09 0.29 0.03 0.00 -0.87 0.00 0.00 58.31 57.85 2kle n LYS 761 Cb 0.10 -1.63 -0.10 0.00 0.02 0.00 0.00 35.03 33.43 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 -3.75 0.65 -1.52 5.64 4.01 0.51 -4.96 117.16 117.75 2kle n TYR 762 Ca -0.40 0.21 -0.34 0.00 -0.16 0.00 0.00 57.90 57.21 2kle n TYR 762 Cb 0.93 -0.94 0.08 0.00 -0.31 0.00 0.00 39.34 39.10 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 -5.42 4.40 0.20 7.72 2.15 0.21 -4.93 116.67 120.99 2kle s ASP 763 Ca -0.05 2.30 -0.11 0.00 0.43 0.00 0.00 52.55 55.12 2kle s ASP 763 Cb 0.09 -2.58 0.22 0.00 -0.30 0.00 0.00 42.92 40.35 2kle s ASP 763 CO 0.83 -2.12 1.77 1.56 -0.17 0.00 0.00 175.17 177.04 2kle h GLN 764 N -0.18 0.47 -0.00 4.34 1.08 -1.93 -3.08 115.11 115.81 2kle h GLN 764 Ca -0.48 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 56.70 2kle h GLN 764 Cb 1.29 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.61 2kle h GLN 764 CO 0.51 0.31 -0.55 -0.25 -0.95 0.00 0.00 178.83 177.90 2kle n ASP 765 N -4.92 0.61 -0.61 1.46 8.00 -1.26 -4.97 116.55 114.86 2kle n ASP 765 Ca 0.07 -0.80 -0.07 0.00 0.71 0.00 0.00 54.79 54.70 2kle n ASP 765 Cb 0.21 0.97 -0.03 0.00 -0.02 0.00 0.00 41.12 42.25 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 1.27 0.67 0.20 0.44 0.00 -1.17 -4.76 105.19 101.84 2kle n GLY 766 Ca 0.02 0.00 -0.05 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 -0.57 1.11 -3.38 1.61 8.00 -1.26 -4.51 116.55 117.55 2kle n ASP 767 Ca -0.07 0.18 -0.25 0.00 0.71 0.00 0.00 54.79 55.36 2kle n ASP 767 Cb 0.48 -0.58 0.03 0.00 -0.02 0.00 0.00 41.12 41.02 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 -3.60 -1.37 0.00 -1.24 7.27 -1.26 -4.80 117.38 112.37 2kle n GLN 768 Ca -0.07 1.22 0.00 0.00 0.07 0.00 0.00 57.00 58.22 2kle n GLN 768 Cb 0.27 -1.75 0.00 0.00 2.41 0.00 0.00 30.24 31.17 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 0.34 0.00 -4.33 3.69 0.28 -0.69 -0.41 120.64 119.52 2kle n GLU 769 Ca -0.05 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.61 2kle n GLU 769 Cb 0.61 0.00 -0.12 0.00 1.43 0.00 0.00 31.44 33.36 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 3.18 0.65 -1.84 1.02 0.13 -4.80 118.68 117.03 2kle s LEU 770 Ca 0.00 -0.18 -0.07 0.00 0.02 0.00 0.00 54.13 53.90 2kle s LEU 770 Cb 0.00 -1.78 0.03 0.00 0.02 0.00 0.00 46.19 44.47 2kle s LEU 770 CO 0.00 0.13 0.97 0.42 0.02 0.00 0.00 176.35 177.90 2kle s THR 771 N 0.57 3.05 0.46 5.49 -4.23 -1.26 -2.36 115.64 117.36 2kle s THR 771 Ca -0.03 -0.05 0.13 0.00 -1.18 0.00 0.00 61.69 60.56 2kle s THR 771 Cb -0.14 -3.27 0.30 0.00 1.34 0.00 0.00 72.50 70.73 2kle s THR 771 CO 0.03 -0.29 2.05 -0.08 -0.54 0.00 0.00 174.62 175.79 2kle h GLU 772 N -0.42 0.31 -0.53 3.99 4.81 -1.94 0.23 114.58 121.04 2kle h GLU 772 Ca -0.45 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 58.70 2kle h GLU 772 Cb 1.28 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 2kle h GLU 772 CO 0.61 0.21 0.08 0.45 -0.73 0.00 0.00 179.01 179.62 2kle h HIS 773 N 0.32 0.94 0.04 0.92 3.86 -1.93 0.77 115.15 120.06 2kle h HIS 773 Ca 0.16 -0.13 -0.14 0.00 -1.16 0.00 0.00 60.37 59.10 2kle h HIS 773 Cb 0.24 -0.26 0.01 0.00 1.06 0.00 0.00 27.41 28.46 2kle h HIS 773 CO -0.00 0.84 -0.57 0.93 0.86 0.00 0.00 177.93 180.00 2kle h GLU 774 N 0.76 0.32 0.00 2.45 5.08 -1.59 -3.21 114.58 118.39 2kle h GLU 774 Ca 0.16 -0.39 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 2kle h GLU 774 Cb 0.42 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 2kle h GLU 774 CO 0.01 1.10 -0.11 1.25 -1.00 0.00 0.00 179.01 180.26 2kle h HIS 775 N -0.29 0.00 -0.57 4.33 2.76 -0.59 0.43 115.15 121.22 2kle h HIS 775 Ca -0.08 0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.14 2kle h HIS 775 Cb 1.33 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.24 2kle h HIS 775 CO 0.17 0.11 0.29 0.37 -1.30 0.00 0.00 177.93 177.57 2kle h GLN 776 N 0.00 0.53 0.11 5.26 -0.00 -0.84 -3.19 115.11 116.98 2kle h GLN 776 Ca -0.00 -0.03 -0.29 0.00 -0.00 0.00 0.00 58.65 58.32 2kle h GLN 776 Cb 0.23 -0.12 -0.01 0.00 0.00 0.00 0.00 27.48 27.59 2kle h GLN 776 CO 0.01 0.35 -1.52 1.96 0.00 0.00 0.00 178.83 179.64 2kle h GLN 777 N 0.55 0.24 -4.31 1.69 4.20 -1.38 -3.45 115.11 112.65 2kle h GLN 777 Ca 0.26 -0.41 -0.74 0.00 0.06 0.00 0.00 58.65 57.82 2kle h GLN 777 Cb 0.18 0.15 -0.22 0.00 0.30 0.00 0.00 27.48 27.89 2kle h GLN 777 CO -0.19 1.20 -0.29 -1.64 -0.67 0.00 0.00 178.83 177.24 2kle s MET 778 N -2.49 2.99 0.00 1.46 -1.94 0.04 -4.89 119.30 114.47 2kle s MET 778 Ca -0.21 -1.39 0.00 0.00 -1.71 0.00 0.00 55.69 52.38 2kle s MET 778 Cb 0.05 -4.16 0.00 0.00 2.01 0.00 0.00 34.83 32.73 2kle s MET 778 CO 0.76 -1.10 0.00 0.54 -0.01 0.00 0.00 175.02 175.21 2kle n ARG 779 N 5.28 0.00 -3.67 2.03 1.74 -1.26 -4.50 116.66 116.27 2kle n ARG 779 Ca -0.12 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.67 2kle n ARG 779 Cb 0.43 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.75 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 -0.50 3.33 -0.14 0.55 1.01 -1.26 -4.88 116.67 114.78 2kle s ASP 780 Ca 0.00 -3.18 -0.22 0.00 0.71 0.00 0.00 52.55 49.86 2kle s ASP 780 Cb 0.00 -1.04 -0.25 0.00 1.01 0.00 0.00 42.92 42.64 2kle s ASP 780 CO 0.00 -0.17 0.56 -0.78 0.21 0.00 0.00 175.17 174.99 2kle h ASP 781 N 5.93 0.17 1.23 0.27 1.82 -1.94 -3.36 116.42 120.55 2kle h ASP 781 Ca 0.13 -0.81 -0.02 0.00 -0.39 0.00 0.00 57.03 55.94 2kle h ASP 781 Cb 0.86 -0.06 -0.00 0.00 0.68 0.00 0.00 39.33 40.81 2kle h ASP 781 CO 0.53 1.38 -0.09 0.25 -1.61 0.00 0.00 179.24 179.69 2kle h LEU 782 N -0.70 0.00 -1.79 2.28 5.85 -1.92 -2.31 115.31 116.71 2kle h LEU 782 Ca -0.21 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.57 2kle h LEU 782 Cb 1.40 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 2kle h LEU 782 CO -0.02 0.09 0.26 -0.08 -0.34 0.00 0.00 178.44 178.35 2kle h GLU 783 N 0.00 0.25 -2.00 1.25 4.81 -1.96 -3.20 114.58 113.72 2kle h GLU 783 Ca -0.00 -0.02 -0.53 0.00 -0.13 0.00 0.00 59.36 58.68 2kle h GLU 783 Cb 0.73 -0.06 -0.39 0.00 0.63 0.00 0.00 28.75 29.66 2kle h GLU 783 CO 0.01 0.17 -1.14 1.63 -0.73 0.00 0.00 179.01 178.95 2kle n LYS 784 N -4.47 0.81 -3.75 1.92 5.02 -0.88 -5.05 118.16 111.75 2kle n LYS 784 Ca 0.05 -3.28 -0.13 0.00 -2.02 0.00 0.00 58.31 52.92 2kle n LYS 784 Cb 0.27 -1.39 -0.10 0.00 -0.02 0.00 0.00 35.03 33.78 2kle n LYS 784 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2kle s GLU 785 N -1.64 0.44 -0.11 1.97 2.12 -1.13 -4.93 118.70 115.42 2kle s GLU 785 Ca 0.37 0.47 -0.02 0.00 0.36 0.00 0.00 54.97 56.15 2kle s GLU 785 Cb 0.23 0.21 -0.03 0.00 0.26 0.00 0.00 34.13 34.81 2kle s GLU 785 CO -0.10 -0.06 -0.05 0.50 -0.54 0.00 0.00 175.26 175.01 2kle s ARG 786 N 0.11 3.25 0.50 4.30 3.52 -1.26 -4.93 118.95 124.44 2kle s ARG 786 Ca -0.01 -0.53 -0.21 0.00 -0.13 0.00 0.00 55.73 54.85 2kle s ARG 786 Cb -0.03 -2.76 -0.07 0.00 -1.56 0.00 0.00 34.95 30.54 2kle s ARG 786 CO 0.01 0.43 1.16 -1.21 -0.81 0.00 0.00 175.30 174.88 2kle s GLU 787 N -0.18 3.54 0.62 5.12 0.41 -1.26 -5.02 118.70 121.93 2kle s GLU 787 Ca 0.03 1.72 -0.10 0.00 -0.41 0.00 0.00 54.97 56.20 2kle s GLU 787 Cb -0.13 -2.21 -0.02 0.00 -1.78 0.00 0.00 34.13 29.99 2kle s GLU 787 CO 0.03 -0.72 1.00 0.34 -0.49 0.00 0.00 175.26 175.42 2kle s ASP 788 N -1.54 6.02 -1.01 -0.19 2.15 -1.26 -4.96 116.67 115.88 2kle s ASP 788 Ca 0.68 1.24 -0.16 0.00 0.43 0.00 0.00 52.55 54.74 2kle s ASP 788 Cb -0.27 -2.27 0.16 0.00 -0.30 0.00 0.00 42.92 40.24 2kle s ASP 788 CO 0.31 -0.94 1.19 -0.22 -0.17 0.00 0.00 175.17 175.34 2kle s LEU 789 N -5.15 5.28 -0.04 -1.34 2.96 -1.26 -4.96 118.68 114.17 2kle s LEU 789 Ca 0.55 -2.48 0.03 0.00 -0.22 0.00 0.00 54.13 52.00 2kle s LEU 789 Cb -0.11 -2.37 -0.03 0.00 0.50 0.00 0.00 46.19 44.18 2kle s LEU 789 CO 0.52 -0.88 -0.11 -0.62 -1.32 0.00 0.00 176.35 173.94 2kle s ASP 790 N 3.13 4.31 -0.01 3.68 -1.08 -1.26 -5.02 116.67 120.42 2kle s ASP 790 Ca 0.34 -0.14 0.08 0.00 -0.52 0.00 0.00 52.55 52.31 2kle s ASP 790 Cb -0.05 -0.98 -0.23 0.00 -1.46 0.00 0.00 42.92 40.20 2kle s ASP 790 CO -0.06 0.34 0.79 0.25 0.52 0.00 0.00 175.17 177.00 2kle h LEU 791 N 5.15 0.08 0.00 -1.34 5.85 -2.07 -3.44 115.31 119.55 2kle h LEU 791 Ca -0.48 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.10 2kle h LEU 791 Cb 1.16 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.17 2kle h LEU 791 CO 0.51 1.12 0.00 -0.67 -0.34 0.00 0.00 178.44 179.07 2kle n ASP 792 N -3.19 0.00 -4.03 1.25 2.03 -1.26 -5.04 116.55 106.31 2kle n ASP 792 Ca -0.15 0.03 -0.10 0.00 0.52 0.00 0.00 54.79 55.10 2kle n ASP 792 Cb 1.03 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 41.35 2kle n ASP 792 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2kle s HIS 793 N -0.07 0.57 0.00 -0.67 3.76 -1.26 -5.07 115.29 112.56 2kle s HIS 793 Ca 0.00 -0.94 0.00 0.00 -0.15 0.00 0.00 55.06 53.97 2kle s HIS 793 Cb 0.00 -0.21 0.00 0.00 1.11 0.00 0.00 32.58 33.48 2kle s HIS 793 CO 0.00 -0.66 0.31 0.43 -0.85 0.00 0.00 174.74 173.97 2kle n SER 794 N -0.18 -0.02 -4.68 1.40 7.64 -1.26 -4.97 113.62 111.55 2kle n SER 794 Ca -0.06 -0.61 -0.32 0.00 1.01 0.00 0.00 58.87 58.88 2kle n SER 794 Cb 0.63 0.01 -0.09 0.00 -1.01 0.00 0.00 64.21 63.75 2kle n SER 794 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2kle s SER 795 N -0.02 5.12 0.00 6.43 0.15 -1.26 -5.15 113.70 118.98 2kle s SER 795 Ca 0.00 -0.01 0.19 0.00 0.70 0.00 0.00 55.95 56.83 2kle s SER 795 Cb 0.00 -1.34 0.15 0.00 -1.71 0.00 0.00 66.02 63.12 2kle s SER 795 CO 0.00 0.28 1.10 0.18 1.20 0.00 0.00 173.24 176.00