#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d5g n PRO 749 N 0.00 0.00 -4.18 0.52 -0.02 -1.26 -5.04 135.00 125.02 2d5g n PRO 749 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.15 2d5g n PRO 749 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.40 2d5g n PRO 749 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2d5g n ASP 751 N 1.36 -2.07 0.00 0.00 2.03 -1.26 -5.04 116.55 111.57 2d5g n ASP 751 Ca -0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.17 2d5g n ASP 751 Cb 0.53 -1.05 0.00 0.00 -0.72 0.00 0.00 41.12 39.88 2d5g n ASP 751 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2d5g n SER 752 N -0.90 0.00 -4.90 1.67 3.41 -1.26 -3.03 113.62 108.61 2d5g n SER 752 Ca 0.00 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.40 2d5g n SER 752 Cb 0.40 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.33 2d5g n SER 752 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2d5g s ILE 753 N 0.00 2.55 -0.30 -1.33 1.01 -0.99 -4.54 121.20 117.60 2d5g s ILE 753 Ca 0.00 -1.30 -0.10 0.00 0.00 0.00 0.00 60.65 59.25 2d5g s ILE 753 Cb 0.00 -2.85 -0.02 0.00 0.01 0.00 0.00 42.46 39.60 2d5g s ILE 753 CO 0.00 0.00 0.16 -0.69 0.00 0.00 0.00 174.94 174.41 2d5g s VAL 754 N -2.51 4.79 -0.19 2.92 1.01 -1.26 -1.82 120.40 123.35 2d5g s VAL 754 Ca 0.48 -0.27 -0.09 0.00 0.00 0.00 0.00 61.98 62.10 2d5g s VAL 754 Cb -0.04 -3.40 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 2d5g s VAL 754 CO 0.28 0.11 0.13 -0.69 0.00 0.00 0.00 175.10 174.93 2d5g s VAL 755 N 1.65 5.37 -0.00 2.92 1.01 -0.72 -0.31 120.40 130.32 2d5g s VAL 755 Ca 0.05 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.21 2d5g s VAL 755 Cb -0.17 -3.43 0.01 0.00 0.00 0.00 0.00 36.38 32.79 2d5g s VAL 755 CO 0.07 0.47 0.00 0.00 0.00 0.00 0.00 175.10 175.64 2d5g s ALA 756 N 0.16 0.04 0.05 5.51 0.00 0.15 -1.60 121.76 126.07 2d5g s ALA 756 Ca 0.09 0.05 0.03 0.00 0.00 0.00 0.00 51.96 52.12 2d5g s ALA 756 Cb -0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 2d5g s ALA 756 CO -0.01 -0.02 -0.10 1.52 0.00 0.00 0.00 175.76 177.16 2d5g s TYR 757 N 0.20 0.84 -0.23 0.00 1.13 -0.60 -0.56 117.35 118.13 2d5g s TYR 757 Ca -0.02 -0.45 -0.15 0.00 -1.41 0.00 0.00 57.07 55.05 2d5g s TYR 757 Cb -0.03 -0.50 -0.04 0.00 -1.10 0.00 0.00 41.96 40.30 2d5g s TYR 757 CO -0.01 -0.03 0.36 0.71 -2.51 0.00 0.00 175.55 174.07 2d5g s TYR 758 N -1.22 3.32 -0.19 -3.49 1.51 0.33 -1.61 117.35 116.00 2d5g s TYR 758 Ca -0.06 0.49 -0.08 0.00 -1.01 0.00 0.00 57.07 56.40 2d5g s TYR 758 Cb -0.09 -2.51 -0.04 0.00 -0.11 0.00 0.00 41.96 39.20 2d5g s TYR 758 CO 0.01 -0.09 0.09 0.12 -1.11 0.00 0.00 175.55 174.58 2d5g s PHE 759 N 1.58 3.33 0.00 2.71 2.19 -1.26 -0.96 117.98 125.56 2d5g s PHE 759 Ca 0.16 0.20 0.00 0.00 0.33 0.00 0.00 56.93 57.62 2d5g s PHE 759 Cb -0.15 -2.10 0.00 0.00 -1.31 0.00 0.00 43.02 39.46 2d5g s PHE 759 CO 0.08 0.24 0.00 0.00 1.83 0.00 0.00 175.22 177.37 2d5g n GLY 761 N 0.06 1.01 3.77 0.00 0.00 -1.26 -4.83 105.19 103.94 2d5g n GLY 761 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2d5g n GLY 761 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2d5g s GLU 762 N -0.31 3.22 -0.03 1.61 2.02 0.15 -4.99 118.70 120.37 2d5g s GLU 762 Ca 0.00 1.67 -0.23 0.00 0.02 0.00 0.00 54.97 56.43 2d5g s GLU 762 Cb 0.00 -1.98 -0.17 0.00 0.10 0.00 0.00 34.13 32.08 2d5g s GLU 762 CO 0.00 -0.97 1.05 -1.00 0.02 0.00 0.00 175.26 174.36 2d5g h PRO 763 N 1.06 -0.24 -6.37 0.39 0.13 -1.99 -3.39 132.00 121.59 2d5g h PRO 763 Ca -0.50 0.02 -0.55 0.00 -0.87 0.00 0.00 66.00 64.10 2d5g h PRO 763 Cb 1.27 0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 2d5g h PRO 763 CO 0.56 0.16 0.48 0.42 -0.23 0.00 0.00 178.00 179.40 2d5g s ILE 764 N -3.95 4.67 0.74 -3.56 1.01 -1.26 -5.02 121.20 113.84 2d5g s ILE 764 Ca -0.14 1.92 -0.10 0.00 0.00 0.00 0.00 60.65 62.34 2d5g s ILE 764 Cb 0.01 -4.23 0.06 0.00 0.01 0.00 0.00 42.46 38.30 2d5g s ILE 764 CO 0.53 0.09 1.10 -2.16 0.00 0.00 0.00 174.94 174.50 2d5g s PRO 765 N 1.42 2.29 -0.16 2.79 0.04 -1.26 -4.78 135.00 135.33 2d5g s PRO 765 Ca 0.52 0.09 -0.03 0.00 0.04 0.00 0.00 61.00 61.62 2d5g s PRO 765 Cb -0.22 -2.04 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 2d5g s PRO 765 CO 0.25 -1.32 -0.05 0.71 0.04 0.00 0.00 177.00 176.63 2d5g s TYR 766 N -3.41 2.98 0.07 0.56 1.51 -0.63 -4.96 117.35 113.48 2d5g s TYR 766 Ca 0.60 -0.43 0.08 0.00 -1.01 0.00 0.00 57.07 56.31 2d5g s TYR 766 Cb -0.11 -1.96 -0.03 0.00 -0.11 0.00 0.00 41.96 39.75 2d5g s TYR 766 CO 0.48 -0.13 -0.21 -2.00 -1.11 0.00 0.00 175.55 172.59 2d5g s GLU 767 N 0.51 1.26 -0.20 -0.62 2.12 -1.26 -1.56 118.70 118.95 2d5g s GLU 767 Ca -0.04 -1.06 -0.28 0.00 0.36 0.00 0.00 54.97 53.95 2d5g s GLU 767 Cb -0.15 -1.46 0.12 0.00 0.26 0.00 0.00 34.13 32.91 2d5g s GLU 767 CO 0.03 0.36 1.00 -0.08 -0.54 0.00 0.00 175.26 176.03 2d5g s THR 768 N -0.98 0.00 0.30 -1.70 -1.32 -0.62 -5.00 115.64 106.31 2d5g s THR 768 Ca 0.07 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.29 2d5g s THR 768 Cb -0.09 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.80 2d5g s THR 768 CO 0.03 0.00 0.92 -0.22 -2.21 0.00 0.00 174.62 173.14 2d5g s LEU 769 N -0.62 4.38 -0.14 9.08 2.96 -1.26 -1.76 118.68 131.32 2d5g s LEU 769 Ca -0.00 1.81 -0.01 0.00 -0.22 0.00 0.00 54.13 55.70 2d5g s LEU 769 Cb -0.02 -3.92 0.04 0.00 0.50 0.00 0.00 46.19 42.79 2d5g s LEU 769 CO -0.01 -0.03 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.28 2d5g s VAL 770 N -1.56 0.79 -0.13 1.68 1.01 -0.75 -4.92 120.40 116.52 2d5g s VAL 770 Ca 0.48 -0.38 -0.38 0.00 0.00 0.00 0.00 61.98 61.70 2d5g s VAL 770 Cb -0.19 -1.02 -0.15 0.00 0.00 0.00 0.00 36.38 35.03 2d5g s VAL 770 CO 0.24 0.12 1.70 0.54 0.00 0.00 0.00 175.10 177.70 2d5g n ARG 771 N 4.99 1.49 0.00 2.72 3.00 -1.26 -2.34 116.66 125.26 2d5g n ARG 771 Ca -0.10 0.55 0.00 0.00 -0.01 0.00 0.00 57.85 58.28 2d5g n ARG 771 Cb 0.48 -2.27 0.00 0.00 0.00 0.00 0.00 32.46 30.67 2d5g n ARG 771 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2d5g n GLY 772 N 3.90 0.54 4.84 -0.13 0.00 -1.17 -4.87 105.19 108.31 2d5g n GLY 772 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2d5g n GLY 772 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2d5g n ARG 773 N 0.00 0.00 -3.89 1.61 0.00 -1.26 -4.64 116.66 108.48 2d5g n ARG 773 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.55 2d5g n ARG 773 Cb 0.00 -1.95 -0.15 0.00 0.00 0.00 0.00 32.46 30.36 2d5g n ARG 773 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2d5g s ALA 774 N -0.03 1.99 -0.11 5.13 0.00 -1.26 -4.68 121.76 122.80 2d5g s ALA 774 Ca 0.00 -1.62 -0.02 0.00 0.00 0.00 0.00 51.96 50.32 2d5g s ALA 774 Cb 0.00 -1.57 -0.03 0.00 0.00 0.00 0.00 23.12 21.52 2d5g s ALA 774 CO 0.00 -1.40 -0.03 0.08 0.00 0.00 0.00 175.76 174.41 2d5g s VAL 775 N 1.38 4.05 0.24 0.00 1.01 -1.26 -5.02 120.40 120.80 2d5g s VAL 775 Ca 0.01 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.72 2d5g s VAL 775 Cb -0.18 -2.71 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 2d5g s VAL 775 CO -0.11 0.57 0.33 0.42 0.00 0.00 0.00 175.10 176.31 2d5g s THR 776 N -0.45 5.09 0.39 3.92 -4.23 -1.26 -0.07 115.64 119.04 2d5g s THR 776 Ca 0.07 -1.06 0.12 0.00 -1.18 0.00 0.00 61.69 59.64 2d5g s THR 776 Cb -0.12 -3.77 0.34 0.00 1.34 0.00 0.00 72.50 70.28 2d5g s THR 776 CO 0.02 -0.33 1.89 0.25 -0.54 0.00 0.00 174.62 175.92 2d5g h LEU 777 N 1.22 0.53 -0.49 4.79 5.85 -1.24 0.15 115.31 126.12 2d5g h LEU 777 Ca -0.51 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.16 2d5g h LEU 777 Cb 1.23 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 2d5g h LEU 777 CO 0.61 0.27 -0.01 1.23 -0.34 0.00 0.00 178.44 180.20 2d5g h GLY 778 N 0.57 0.94 1.19 3.75 0.00 -1.71 0.73 103.07 108.54 2d5g h GLY 778 Ca 0.41 -0.70 -0.05 0.00 0.00 0.00 0.00 47.33 46.99 2d5g h GLY 778 CO -0.16 0.65 0.24 1.46 0.00 0.00 0.00 176.54 178.72 2d5g h GLN 779 N 0.73 1.02 0.02 4.80 4.20 -1.52 -2.68 115.11 121.67 2d5g h GLN 779 Ca 0.14 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 2d5g h GLN 779 Cb 0.53 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.15 2d5g h GLN 779 CO 0.03 0.86 -0.01 0.35 -0.67 0.00 0.00 178.83 179.39 2d5g h PHE 780 N 0.99 -0.02 -0.90 2.96 3.04 0.34 -2.80 116.94 120.56 2d5g h PHE 780 Ca 0.23 -0.00 0.20 0.00 3.98 0.00 0.00 57.97 62.38 2d5g h PHE 780 Cb 0.24 0.01 -0.07 0.00 2.56 0.00 0.00 35.95 38.69 2d5g h PHE 780 CO 0.02 0.27 0.60 0.87 -2.02 0.00 0.00 178.31 178.05 2d5g h LYS 781 N -0.31 0.40 0.00 1.11 1.57 0.52 0.34 116.57 120.19 2d5g h LYS 781 Ca -0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2d5g h LYS 781 Cb 0.30 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2d5g h LYS 781 CO 0.00 0.26 0.00 0.39 -0.57 0.00 0.00 179.45 179.54 2d5g n GLU 782 N -4.51 0.12 0.06 3.15 1.02 -1.02 -0.83 120.64 118.63 2d5g n GLU 782 Ca 0.19 0.54 -0.03 0.00 -0.02 0.00 0.00 57.16 57.84 2d5g n GLU 782 Cb 0.70 -1.84 -0.07 0.00 -0.02 0.00 0.00 31.44 30.21 2d5g n GLU 782 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2d5g h LEU 783 N 0.00 0.00 -9.92 -4.62 3.38 -0.40 -3.47 115.31 100.28 2d5g h LEU 783 Ca 0.00 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.46 2d5g h LEU 783 Cb 0.11 0.00 0.06 0.00 0.09 0.00 0.00 40.66 40.91 2d5g h LEU 783 CO 0.00 0.77 0.55 -0.76 0.09 0.00 0.00 178.44 179.08 2d5g s LEU 784 N -6.33 4.28 -0.07 1.67 2.01 -0.01 -4.93 118.68 115.29 2d5g s LEU 784 Ca 0.00 2.46 0.13 0.00 0.01 0.00 0.00 54.13 56.73 2d5g s LEU 784 Cb 0.09 -3.89 -0.23 0.00 0.01 0.00 0.00 46.19 42.16 2d5g s LEU 784 CO 0.80 -0.63 0.55 0.35 1.01 0.00 0.00 176.35 178.43 2d5g n THR 785 N 0.33 1.57 -4.29 5.49 -2.24 -1.26 -4.93 114.28 108.95 2d5g n THR 785 Ca 0.03 -0.80 -0.31 0.00 -2.27 0.00 0.00 64.05 60.70 2d5g n THR 785 Cb 0.45 -0.95 -0.10 0.00 -2.10 0.00 0.00 70.33 67.63 2d5g n THR 785 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2d5g s LYS 786 N -2.58 2.41 0.44 -0.78 3.01 -1.26 -5.12 119.74 115.87 2d5g s LYS 786 Ca -0.06 -0.85 -0.02 0.00 -1.01 0.00 0.00 55.97 54.03 2d5g s LYS 786 Cb 0.08 -2.45 -0.02 0.00 -1.01 0.00 0.00 37.83 34.43 2d5g s LYS 786 CO 0.82 0.55 0.70 -1.59 0.51 0.00 0.00 175.35 176.35 2d5g s LYS 787 N -1.92 3.33 0.00 1.68 -2.85 -1.26 -5.02 119.74 113.70 2d5g s LYS 787 Ca 0.21 -0.16 0.00 0.00 -1.00 0.00 0.00 55.97 55.02 2d5g s LYS 787 Cb -0.11 -2.50 0.00 0.00 -2.06 0.00 0.00 37.83 33.16 2d5g s LYS 787 CO 0.12 -0.17 0.00 0.41 0.10 0.00 0.00 175.35 175.81 2d5g n GLY 788 N -2.11 0.80 3.60 0.59 0.00 -1.26 -5.06 105.19 101.75 2d5g n GLY 788 Ca -0.00 -2.06 -0.37 0.00 0.00 0.00 0.00 46.02 43.59 2d5g n GLY 788 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d5g s SER 789 N -2.80 5.90 0.23 1.61 0.15 -1.26 -5.08 113.70 112.45 2d5g s SER 789 Ca 0.00 0.02 0.07 0.00 0.70 0.00 0.00 55.95 56.74 2d5g s SER 789 Cb 0.00 -2.07 -0.05 0.00 -1.71 0.00 0.00 66.02 62.19 2d5g s SER 789 CO 0.00 0.02 -0.10 -0.31 1.20 0.00 0.00 173.24 174.05 2d5g s TYR 790 N 1.34 1.74 -0.03 3.44 2.02 -1.26 -1.93 117.35 122.66 2d5g s TYR 790 Ca 0.07 -0.66 0.01 0.00 -0.37 0.00 0.00 57.07 56.12 2d5g s TYR 790 Cb -0.15 -0.90 -0.03 0.00 -0.40 0.00 0.00 41.96 40.49 2d5g s TYR 790 CO 0.06 0.27 -0.03 1.03 -1.57 0.00 0.00 175.55 175.31 2d5g s ARG 791 N -3.70 2.75 -0.15 -0.62 0.52 0.85 -4.90 118.95 113.70 2d5g s ARG 791 Ca 0.25 -0.59 0.01 0.00 -0.52 0.00 0.00 55.73 54.88 2d5g s ARG 791 Cb 0.02 -2.63 -0.00 0.00 0.52 0.00 0.00 34.95 32.86 2d5g s ARG 791 CO 0.08 0.64 -0.16 0.71 0.02 0.00 0.00 175.30 176.59 2d5g s TYR 792 N -0.95 2.76 0.08 -0.53 1.51 -1.26 -1.81 117.35 117.14 2d5g s TYR 792 Ca 0.16 -1.06 0.08 0.00 -1.01 0.00 0.00 57.07 55.24 2d5g s TYR 792 Cb -0.11 -1.87 -0.03 0.00 -0.11 0.00 0.00 41.96 39.84 2d5g s TYR 792 CO 0.06 -0.47 -0.21 0.71 -1.11 0.00 0.00 175.55 174.52 2d5g s TYR 793 N 0.77 1.82 -0.04 2.71 2.02 -0.35 -0.95 117.35 123.34 2d5g s TYR 793 Ca -0.06 -0.40 0.01 0.00 -0.37 0.00 0.00 57.07 56.25 2d5g s TYR 793 Cb -0.15 -1.04 0.02 0.00 -0.40 0.00 0.00 41.96 40.39 2d5g s TYR 793 CO 0.00 0.16 -0.02 -0.06 -1.57 0.00 0.00 175.55 174.06 2d5g s PHE 794 N -1.00 0.54 0.83 2.71 0.08 0.78 -0.07 117.98 121.84 2d5g s PHE 794 Ca 0.07 -0.11 -0.14 0.00 0.12 0.00 0.00 56.93 56.87 2d5g s PHE 794 Cb -0.09 -0.54 0.03 0.00 -0.57 0.00 0.00 43.02 41.84 2d5g s PHE 794 CO 0.03 -0.16 0.77 1.63 -0.10 0.00 0.00 175.22 177.39 2d5g n LYS 795 N 4.10 0.06 0.00 0.44 5.02 0.82 -1.38 118.16 127.22 2d5g n LYS 795 Ca -0.25 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 2d5g n LYS 795 Cb 0.51 -2.08 0.00 0.00 -0.02 0.00 0.00 35.03 33.43 2d5g n LYS 795 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2d5g n LYS 796 N -2.08 0.00 -4.11 1.97 4.81 -0.34 -4.58 118.16 113.83 2d5g n LYS 796 Ca 0.10 0.00 -0.35 0.00 -0.87 0.00 0.00 58.31 57.20 2d5g n LYS 796 Cb 0.51 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.49 2d5g n LYS 796 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 2d5g s VAL 797 N -2.00 4.85 -0.07 3.15 -7.23 -1.26 0.30 120.40 118.13 2d5g s VAL 797 Ca 0.00 -0.19 0.03 0.00 -1.81 0.00 0.00 61.98 60.00 2d5g s VAL 797 Cb 0.00 -3.15 0.01 0.00 0.56 0.00 0.00 36.38 33.80 2d5g s VAL 797 CO 0.00 0.49 -0.15 -0.44 -0.31 0.00 0.00 175.10 174.69 2d5g s SER 798 N -1.33 2.09 0.00 4.85 0.01 -0.91 -4.88 113.70 113.52 2d5g s SER 798 Ca 0.18 -0.36 0.26 0.00 1.31 0.00 0.00 55.95 57.35 2d5g s SER 798 Cb -0.12 -0.96 0.83 0.00 0.21 0.00 0.00 66.02 65.98 2d5g s SER 798 CO 0.08 0.06 1.62 -0.90 0.41 0.00 0.00 173.24 174.51 2d5g n ASP 799 N 3.77 1.87 -0.32 2.44 3.85 -1.26 -3.69 116.55 123.22 2d5g n ASP 799 Ca -0.22 -1.63 0.04 0.00 -0.71 0.00 0.00 54.79 52.26 2d5g n ASP 799 Cb 0.52 -0.02 0.05 0.00 -1.35 0.00 0.00 41.12 40.32 2d5g n ASP 799 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 2d5g n GLU 800 N 0.46 0.68 -4.54 0.11 0.28 -1.26 -5.07 120.64 111.30 2d5g n GLU 800 Ca 0.18 -1.15 -0.26 0.00 -0.16 0.00 0.00 57.16 55.77 2d5g n GLU 800 Cb 0.41 -1.15 -0.09 0.00 1.43 0.00 0.00 31.44 32.04 2d5g n GLU 800 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 2d5g s PHE 801 N -0.69 1.85 0.44 -1.84 0.08 -1.24 -5.16 117.98 111.41 2d5g s PHE 801 Ca 0.10 -1.16 0.05 0.00 0.12 0.00 0.00 56.93 56.04 2d5g s PHE 801 Cb 0.06 -1.26 0.01 0.00 -0.57 0.00 0.00 43.02 41.27 2d5g s PHE 801 CO 0.09 -0.15 0.62 -0.51 -0.10 0.00 0.00 175.22 175.18 2d5g s ASP 802 N -3.62 5.62 0.00 1.36 1.01 -1.26 -4.57 116.67 115.21 2d5g s ASP 802 Ca 0.24 -0.19 0.00 0.00 0.71 0.00 0.00 52.55 53.31 2d5g s ASP 802 Cb 0.04 -0.91 0.00 0.00 1.01 0.00 0.00 42.92 43.06 2d5g s ASP 802 CO 0.13 -0.80 0.00 0.00 0.21 0.00 0.00 175.17 174.71 2d5g n GLY 804 N -0.10 2.06 3.96 0.00 0.00 -1.26 -5.01 105.19 104.83 2d5g n GLY 804 Ca 0.00 -0.64 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 2d5g n GLY 804 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d5g s VAL 805 N 0.00 3.87 0.20 1.61 1.01 -1.26 -2.13 120.40 123.70 2d5g s VAL 805 Ca 0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 61.98 61.36 2d5g s VAL 805 Cb 0.00 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 2d5g s VAL 805 CO 0.00 -0.26 0.10 0.68 0.00 0.00 0.00 175.10 175.62 2d5g s VAL 806 N -2.50 0.20 -0.39 2.92 -7.23 0.15 -4.80 120.40 108.74 2d5g s VAL 806 Ca 0.49 -1.99 -0.11 0.00 -1.81 0.00 0.00 61.98 58.57 2d5g s VAL 806 Cb -0.10 -2.44 0.05 0.00 0.56 0.00 0.00 36.38 34.45 2d5g s VAL 806 CO 0.37 -0.10 0.23 -0.36 -0.31 0.00 0.00 175.10 174.93 2d5g s PHE 807 N -4.01 3.27 -0.01 2.82 0.40 -1.26 -1.20 117.98 117.99 2d5g s PHE 807 Ca 0.36 -1.17 -0.27 0.00 -0.60 0.00 0.00 56.93 55.25 2d5g s PHE 807 Cb 0.07 -2.64 -0.04 0.00 0.51 0.00 0.00 43.02 40.92 2d5g s PHE 807 CO 0.10 -0.73 0.85 -2.00 0.70 0.00 0.00 175.22 174.15 2d5g s GLU 808 N 1.51 4.52 0.29 0.44 2.12 -0.48 -4.67 118.70 122.43 2d5g s GLU 808 Ca 0.02 1.19 -0.28 0.00 0.36 0.00 0.00 54.97 56.26 2d5g s GLU 808 Cb -0.21 -3.44 -0.10 0.00 0.26 0.00 0.00 34.13 30.65 2d5g s GLU 808 CO 0.05 0.05 0.94 -2.00 -0.54 0.00 0.00 175.26 173.77 2d5g s GLU 809 N 0.73 4.69 -0.12 4.30 2.12 -1.26 -0.16 118.70 129.00 2d5g s GLU 809 Ca 0.45 1.40 0.01 0.00 0.36 0.00 0.00 54.97 57.19 2d5g s GLU 809 Cb -0.20 -2.99 0.02 0.00 0.26 0.00 0.00 34.13 31.22 2d5g s GLU 809 CO 0.24 0.37 -0.15 0.08 -0.54 0.00 0.00 175.26 175.27 2d5g s VAL 810 N -1.44 1.49 -0.19 3.70 1.01 -0.12 -4.94 120.40 119.92 2d5g s VAL 810 Ca 0.47 -0.62 -0.16 0.00 0.00 0.00 0.00 61.98 61.66 2d5g s VAL 810 Cb -0.22 -1.38 -0.07 0.00 0.00 0.00 0.00 36.38 34.71 2d5g s VAL 810 CO 0.27 0.44 -0.33 0.54 0.00 0.00 0.00 175.10 176.02 2d5g n ARG 811 N 4.38 0.51 -3.08 2.72 3.00 -1.26 -4.35 116.66 118.58 2d5g n ARG 811 Ca -0.18 0.21 -0.39 0.00 -0.01 0.00 0.00 57.85 57.47 2d5g n ARG 811 Cb 0.51 -1.38 -0.06 0.00 0.00 0.00 0.00 32.46 31.53 2d5g n ARG 811 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 2d5g s GLU 812 N -2.76 4.43 0.12 5.56 2.02 -1.26 -4.99 118.70 121.82 2d5g s GLU 812 Ca -0.29 0.98 -0.23 0.00 0.02 0.00 0.00 54.97 55.45 2d5g s GLU 812 Cb 0.06 -3.30 -0.05 0.00 0.10 0.00 0.00 34.13 30.95 2d5g s GLU 812 CO 0.42 0.48 1.68 -0.44 0.02 0.00 0.00 175.26 177.41 2d5g h ASP 813 N 4.94 -0.39 0.00 -0.19 5.19 -1.95 -2.84 116.42 121.19 2d5g h ASP 813 Ca -0.46 0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.01 2d5g h ASP 813 Cb 1.21 0.18 0.00 0.00 0.18 0.00 0.00 39.33 40.90 2d5g h ASP 813 CO 0.67 -0.17 0.00 -0.62 -3.12 0.00 0.00 179.24 176.00 2d5g n GLU 814 N -5.27 0.66 -3.53 3.56 -0.58 -1.26 -2.15 120.64 112.07 2d5g n GLU 814 Ca -0.04 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.35 2d5g n GLU 814 Cb 0.19 -1.30 -0.06 0.00 -0.57 0.00 0.00 31.44 29.70 2d5g n GLU 814 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2d5g s ALA 815 N -1.11 3.70 -0.11 0.62 0.00 -1.07 -4.95 121.76 118.84 2d5g s ALA 815 Ca 0.00 -0.32 -0.22 0.00 0.00 0.00 0.00 51.96 51.42 2d5g s ALA 815 Cb 0.00 -2.33 -0.03 0.00 0.00 0.00 0.00 23.12 20.76 2d5g s ALA 815 CO 0.00 0.54 0.66 0.42 0.00 0.00 0.00 175.76 177.38 2d5g s ILE 816 N -1.39 5.06 0.28 0.00 -1.09 -1.26 -1.54 121.20 121.25 2d5g s ILE 816 Ca 0.33 1.33 -0.29 0.00 -2.23 0.00 0.00 60.65 59.79 2d5g s ILE 816 Cb -0.14 -3.99 -0.09 0.00 -1.58 0.00 0.00 42.46 36.65 2d5g s ILE 816 CO 0.18 0.22 1.02 -0.76 -1.23 0.00 0.00 174.94 174.38 2d5g s LEU 817 N 1.05 4.53 0.78 2.97 1.43 0.90 -4.92 118.68 125.43 2d5g s LEU 817 Ca 0.34 2.09 -0.13 0.00 -1.03 0.00 0.00 54.13 55.40 2d5g s LEU 817 Cb -0.17 -3.71 0.07 0.00 0.03 0.00 0.00 46.19 42.41 2d5g s LEU 817 CO 0.15 -0.06 1.17 -2.16 0.23 0.00 0.00 176.35 175.68 2d5g s PRO 818 N -1.51 1.87 0.05 1.29 0.04 -1.26 -4.80 135.00 130.67 2d5g s PRO 818 Ca 0.45 1.62 0.06 0.00 0.04 0.00 0.00 61.00 63.16 2d5g s PRO 818 Cb -0.28 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 2d5g s PRO 818 CO 0.35 -2.01 -0.11 0.08 0.04 0.00 0.00 177.00 175.35 2d5g s VAL 819 N -2.29 3.31 -0.07 -0.36 1.01 -1.26 -4.74 120.40 116.00 2d5g s VAL 819 Ca 0.70 -1.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.62 2d5g s VAL 819 Cb -0.26 -2.47 0.03 0.00 0.00 0.00 0.00 36.38 33.69 2d5g s VAL 819 CO 0.50 0.29 0.02 0.12 0.00 0.00 0.00 175.10 176.02 2d5g s PHE 820 N -1.05 0.53 -1.52 5.22 5.36 0.08 -4.78 117.98 121.82 2d5g s PHE 820 Ca 0.18 -0.08 -0.08 0.00 -0.96 0.00 0.00 56.93 55.99 2d5g s PHE 820 Cb -0.11 -0.73 0.07 0.00 -0.34 0.00 0.00 43.02 41.91 2d5g s PHE 820 CO 0.09 -0.30 0.64 0.39 -1.46 0.00 0.00 175.22 174.58 2d5g n GLU 821 N 5.18 -3.65 0.00 10.12 1.02 -1.26 -0.90 120.64 131.15 2d5g n GLU 821 Ca -0.06 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 2d5g n GLU 821 Cb 0.50 -4.89 0.00 0.00 -0.02 0.00 0.00 31.44 27.03 2d5g n GLU 821 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2d5g n GLU 822 N -4.43 0.00 -3.49 3.49 1.02 -1.26 -4.94 120.64 111.03 2d5g n GLU 822 Ca -0.13 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.81 2d5g n GLU 822 Cb 0.60 -2.06 -0.02 0.00 -0.02 0.00 0.00 31.44 29.94 2d5g n GLU 822 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2d5g s LYS 823 N 0.00 2.55 -0.22 3.49 1.02 -0.08 -4.48 119.74 122.02 2d5g s LYS 823 Ca 0.00 -1.52 -0.05 0.00 0.02 0.00 0.00 55.97 54.41 2d5g s LYS 823 Cb 0.00 -2.42 -0.02 0.00 -0.52 0.00 0.00 37.83 34.87 2d5g s LYS 823 CO 0.00 -0.25 0.01 0.42 -0.92 0.00 0.00 175.35 174.61 2d5g s ILE 824 N -2.48 3.88 -0.18 2.17 1.01 0.58 -0.74 121.20 125.44 2d5g s ILE 824 Ca 0.49 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.82 2d5g s ILE 824 Cb -0.04 -2.78 0.04 0.00 0.01 0.00 0.00 42.46 39.69 2d5g s ILE 824 CO 0.29 0.40 -0.08 -0.63 0.00 0.00 0.00 174.94 174.91 2d5g s ILE 825 N 1.37 1.42 0.08 2.92 1.01 -1.25 0.33 121.20 127.07 2d5g s ILE 825 Ca 0.05 -0.84 0.10 0.00 0.00 0.00 0.00 60.65 59.95 2d5g s ILE 825 Cb -0.15 -1.53 -0.03 0.00 0.01 0.00 0.00 42.46 40.76 2d5g s ILE 825 CO 0.01 0.16 -0.26 -0.83 0.00 0.00 0.00 174.94 174.02 2d5g s GLY 826 N 1.50 1.49 -0.26 6.18 0.00 0.27 -0.13 107.32 116.37 2d5g s GLY 826 Ca -0.00 -1.33 -0.08 0.00 0.00 0.00 0.00 44.72 43.31 2d5g s GLY 826 CO -0.08 -1.25 0.08 0.54 0.00 0.00 0.00 173.10 172.39 2d5g s LYS 827 N -1.56 3.58 -0.20 2.90 -0.14 0.90 0.12 119.74 125.34 2d5g s LYS 827 Ca 0.13 -0.53 -0.14 0.00 -1.36 0.00 0.00 55.97 54.07 2d5g s LYS 827 Cb -0.10 -3.36 -0.04 0.00 -1.68 0.00 0.00 37.83 32.64 2d5g s LYS 827 CO 0.04 -0.24 0.33 0.08 -0.76 0.00 0.00 175.35 174.80 2d5g s VAL 828 N 1.61 5.25 -0.06 3.17 1.01 -0.13 -1.21 120.40 130.04 2d5g s VAL 828 Ca 0.06 0.57 0.01 0.00 0.00 0.00 0.00 61.98 62.62 2d5g s VAL 828 Cb -0.15 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.58 2d5g s VAL 828 CO 0.04 0.30 -0.07 -1.61 0.00 0.00 0.00 175.10 173.76 2d5g s GLU 829 N 1.08 1.18 0.27 2.72 0.41 -0.75 0.35 118.70 123.96 2d5g s GLU 829 Ca 0.16 -0.20 -0.29 0.00 -0.41 0.00 0.00 54.97 54.23 2d5g s GLU 829 Cb -0.14 -1.13 -0.09 0.00 -1.78 0.00 0.00 34.13 30.99 2d5g s GLU 829 CO 0.06 -0.09 0.98 0.21 -0.49 0.00 0.00 175.26 175.93 2d5g s LYS 830 N 1.03 4.75 0.37 1.61 2.20 -1.26 -0.11 119.74 128.33 2d5g s LYS 830 Ca -0.09 1.53 -0.16 0.00 -0.36 0.00 0.00 55.97 56.89 2d5g s LYS 830 Cb -0.14 -3.16 -0.09 0.00 -1.51 0.00 0.00 37.83 32.93 2d5g s LYS 830 CO -0.00 0.40 0.81 0.08 -0.36 0.00 0.00 175.35 176.27 2d5g s VAL 831 N -1.26 4.60 0.00 4.02 1.01 -0.81 -4.88 120.40 123.07 2d5g s VAL 831 Ca 0.44 1.08 0.00 0.00 0.00 0.00 0.00 61.98 63.50 2d5g s VAL 831 Cb -0.26 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.50 2d5g s VAL 831 CO 0.32 -0.28 0.00 0.47 0.00 0.00 0.00 175.10 175.61