#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2doe n SER 778 N 0.00 -2.42 -3.69 1.61 2.88 -1.26 -4.92 113.62 105.82 2doe n SER 778 Ca 0.00 -1.06 -0.13 0.00 -1.33 0.00 0.00 58.87 56.35 2doe n SER 778 Cb 0.00 -2.57 -0.09 0.00 -0.75 0.00 0.00 64.21 60.80 2doe n SER 778 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2doe s SER 779 N -3.51 -0.58 0.00 -3.46 0.15 -1.26 -5.14 113.70 99.90 2doe s SER 779 Ca 0.60 1.11 0.00 0.00 0.70 0.00 0.00 55.95 58.36 2doe s SER 779 Cb -0.33 1.11 0.00 0.00 -1.71 0.00 0.00 66.02 65.09 2doe s SER 779 CO 0.94 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.80 2doe n GLY 780 N 2.90 3.67 3.74 9.45 0.00 -1.26 -5.18 105.19 118.50 2doe n GLY 780 Ca -0.14 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 2doe n GLY 780 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2doe s SER 781 N 0.00 4.16 -0.06 1.61 0.01 -1.26 -5.08 113.70 113.09 2doe s SER 781 Ca 0.00 -1.46 -0.19 0.00 1.31 0.00 0.00 55.95 55.61 2doe s SER 781 Cb 0.00 0.13 -0.14 0.00 0.21 0.00 0.00 66.02 66.22 2doe s SER 781 CO 0.00 -0.74 0.79 0.28 0.41 0.00 0.00 173.24 173.98 2doe h SER 782 N 1.40 -0.19 0.00 2.44 0.02 -2.04 -3.50 113.55 111.67 2doe h SER 782 Ca -0.43 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.20 2doe h SER 782 Cb 1.29 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.88 2doe h SER 782 CO 0.73 0.36 0.00 0.61 -1.14 0.00 0.00 176.83 177.40 2doe n GLY 783 N 0.70 -0.22 3.66 -3.77 0.00 -1.26 -5.03 105.19 99.26 2doe n GLY 783 Ca -0.07 -0.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.83 2doe n GLY 783 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2doe n GLU 784 N -0.01 -4.70 -3.51 1.61 1.02 -1.26 -4.95 120.64 108.84 2doe n GLU 784 Ca 0.00 0.64 -0.38 0.00 -0.02 0.00 0.00 57.16 57.40 2doe n GLU 784 Cb 0.00 -5.20 -0.10 0.00 -0.02 0.00 0.00 31.44 26.13 2doe n GLU 784 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2doe s LYS 785 N -5.86 4.02 -0.58 3.49 -2.85 -1.26 -4.97 119.74 111.73 2doe s LYS 785 Ca 0.05 -0.12 0.01 0.00 -1.00 0.00 0.00 55.97 54.90 2doe s LYS 785 Cb -0.01 -3.62 0.44 0.00 -2.06 0.00 0.00 37.83 32.58 2doe s LYS 785 CO 0.81 -0.16 1.78 0.39 0.10 0.00 0.00 175.35 178.27 2doe n GLU 786 N 4.97 2.97 -4.38 1.78 -0.58 -1.26 -4.98 120.64 119.15 2doe n GLU 786 Ca -0.11 -3.59 -0.26 0.00 -0.42 0.00 0.00 57.16 52.78 2doe n GLU 786 Cb 0.51 -2.28 -0.09 0.00 -0.57 0.00 0.00 31.44 29.01 2doe n GLU 786 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2doe s ASP 787 N -2.29 4.13 -0.13 1.62 1.11 -1.26 -5.02 116.67 114.83 2doe s ASP 787 Ca 0.60 -1.17 -0.02 0.00 0.18 0.00 0.00 52.55 52.13 2doe s ASP 787 Cb 0.47 -0.45 -0.02 0.00 1.07 0.00 0.00 42.92 43.99 2doe s ASP 787 CO -0.04 -0.41 2.56 -1.20 1.18 0.00 0.00 175.17 177.26 2doe n SER 788 N -1.04 5.71 -0.08 0.27 7.64 -1.26 -4.26 113.62 120.59 2doe n SER 788 Ca -0.03 -2.68 -0.15 0.00 1.01 0.00 0.00 58.87 57.02 2doe n SER 788 Cb 0.65 -1.21 -0.10 0.00 -1.01 0.00 0.00 64.21 62.54 2doe n SER 788 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2doe h LYS 789 N 1.93 0.00 -0.12 1.43 1.79 -1.95 -3.36 116.57 116.28 2doe h LYS 789 Ca 0.17 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.63 2doe h LYS 789 Cb 1.09 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.73 2doe h LYS 789 CO 0.34 0.78 0.03 0.00 -1.08 0.00 0.00 179.45 179.52 2doe h THR 790 N -1.00 1.06 -0.75 -0.16 1.03 -1.97 -2.87 112.91 108.26 2doe h THR 790 Ca -0.16 -0.21 0.14 0.00 -0.01 0.00 0.00 66.41 66.17 2doe h THR 790 Cb 0.98 0.94 -0.14 0.00 -1.07 0.00 0.00 68.15 68.86 2doe h THR 790 CO -0.10 0.07 -0.26 -0.09 -0.01 0.00 0.00 175.52 175.14 2doe h ARG 791 N 0.16 -0.05 -0.08 0.00 9.65 -1.86 0.11 114.38 122.32 2doe h ARG 791 Ca 0.04 0.00 0.04 0.00 -1.10 0.00 0.00 59.98 58.97 2doe h ARG 791 Cb 0.06 0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 28.60 2doe h ARG 791 CO -0.00 -0.03 -0.30 0.78 2.80 0.00 0.00 179.97 183.21 2doe h GLY 792 N -0.05 -0.43 0.59 2.80 0.00 -1.70 0.12 103.07 104.39 2doe h GLY 792 Ca 0.33 0.37 0.02 0.00 0.00 0.00 0.00 47.33 48.05 2doe h GLY 792 CO -0.79 -0.22 -0.23 -2.09 0.00 0.00 0.00 176.54 173.22 2doe h GLU 793 N -0.40 -0.40 0.28 4.80 4.57 -1.31 -0.51 114.58 121.61 2doe h GLU 793 Ca 0.08 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2doe h GLU 793 Cb 0.53 0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 29.17 2doe h GLU 793 CO -0.31 -0.27 -0.52 -0.22 -1.18 0.00 0.00 179.01 176.51 2doe h LYS 794 N -0.41 -0.83 -0.96 1.92 3.64 -0.73 0.07 116.57 119.27 2doe h LYS 794 Ca 0.03 0.06 0.21 0.00 -1.27 0.00 0.00 60.65 59.68 2doe h LYS 794 Cb 0.44 0.19 -0.12 0.00 -0.41 0.00 0.00 32.23 32.34 2doe h LYS 794 CO -0.14 -0.55 0.53 0.82 -2.27 0.00 0.00 179.45 177.84 2doe h ILE 795 N -0.86 0.59 -0.08 2.00 2.04 -0.66 -0.44 117.51 120.10 2doe h ILE 795 Ca -0.03 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.62 2doe h ILE 795 Cb 0.81 -0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2doe h ILE 795 CO -0.20 0.11 0.04 0.50 0.00 0.00 0.00 178.15 178.60 2doe h LYS 796 N 0.60 0.11 0.14 2.37 3.64 -0.22 -1.78 116.57 121.43 2doe h LYS 796 Ca 0.58 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.96 2doe h LYS 796 Cb 1.02 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.79 2doe h LYS 796 CO -0.45 0.20 -0.29 0.77 -2.27 0.00 0.00 179.45 177.42 2doe h SER 797 N -0.00 -0.82 -0.79 4.20 0.02 0.59 -2.14 113.55 114.61 2doe h SER 797 Ca 0.03 0.09 0.12 0.00 -0.84 0.00 0.00 61.79 61.19 2doe h SER 797 Cb 0.13 0.31 -0.08 0.00 0.14 0.00 0.00 62.40 62.89 2doe h SER 797 CO -0.00 -0.38 0.40 0.44 -1.14 0.00 0.00 176.83 176.14 2doe h ASP 798 N -0.52 0.49 0.28 3.07 3.32 -1.26 -2.00 116.42 119.81 2doe h ASP 798 Ca 0.03 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2doe h ASP 798 Cb 0.54 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.05 2doe h ASP 798 CO -0.16 0.24 -0.51 0.15 -1.72 0.00 0.00 179.24 177.24 2doe h PHE 799 N 0.62 -1.46 -0.20 4.55 3.57 -0.69 -1.95 116.94 121.37 2doe h PHE 799 Ca 0.41 0.03 0.06 0.00 3.53 0.00 0.00 57.97 62.00 2doe h PHE 799 Cb 0.52 0.60 -0.07 0.00 2.79 0.00 0.00 35.95 39.79 2doe h PHE 799 CO -0.10 -0.62 -0.30 0.74 -2.23 0.00 0.00 178.31 175.80 2doe h PHE 800 N -0.85 -0.81 -0.76 0.41 0.04 -1.02 -1.94 116.94 112.01 2doe h PHE 800 Ca -0.03 0.04 0.12 0.00 2.80 0.00 0.00 57.97 60.90 2doe h PHE 800 Cb 0.80 0.39 -0.13 0.00 2.20 0.00 0.00 35.95 39.20 2doe h PHE 800 CO -0.37 -0.37 -0.37 0.93 -0.60 0.00 0.00 178.31 177.53 2doe h GLU 801 N -0.33 -0.10 0.38 1.51 5.08 -1.11 -0.59 114.58 119.42 2doe h GLU 801 Ca 0.12 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2doe h GLU 801 Cb 0.52 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 2doe h GLU 801 CO -0.39 -0.06 -0.37 1.25 -1.00 0.00 0.00 179.01 178.44 2doe h LEU 802 N -0.10 -1.01 -0.65 1.33 5.85 -0.69 -1.08 115.31 118.96 2doe h LEU 802 Ca 0.27 0.08 0.06 0.00 0.84 0.00 0.00 57.88 59.13 2doe h LEU 802 Cb 0.57 0.33 -0.08 0.00 0.37 0.00 0.00 40.66 41.85 2doe h LEU 802 CO -0.81 -0.49 -0.43 -0.07 -0.34 0.00 0.00 178.44 176.30 2doe h LEU 803 N -0.74 -1.54 -1.02 2.25 3.38 -0.63 0.49 115.31 117.49 2doe h LEU 803 Ca -0.05 0.23 0.23 0.00 0.09 0.00 0.00 57.88 58.38 2doe h LEU 803 Cb 0.64 0.67 -0.12 0.00 0.09 0.00 0.00 40.66 41.95 2doe h LEU 803 CO -0.04 -0.19 0.60 -1.28 0.09 0.00 0.00 178.44 177.62 2doe h SER 804 N -0.06 0.70 0.22 -0.43 0.87 -1.06 0.76 113.55 114.55 2doe h SER 804 Ca 0.10 0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.77 2doe h SER 804 Cb 0.33 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.29 2doe h SER 804 CO -0.64 0.15 -0.09 0.78 -0.53 0.00 0.00 176.83 176.51 2doe h ASN 805 N 0.62 0.00 -0.06 6.23 2.35 0.13 -2.76 115.58 122.10 2doe h ASN 805 Ca 0.63 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 56.34 2doe h ASN 805 Cb 1.15 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.50 2doe h ASN 805 CO -0.44 0.09 0.05 1.41 -1.65 0.00 0.00 177.43 176.88 2doe n HIS 806 N -3.80 0.19 -3.78 1.19 8.25 0.27 -4.80 115.22 112.73 2doe n HIS 806 Ca -0.02 -1.05 -0.24 0.00 -0.26 0.00 0.00 57.72 56.14 2doe n HIS 806 Cb 0.19 -0.52 -0.02 0.00 1.12 0.00 0.00 29.99 30.75 2doe n HIS 806 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2doe n HIS 807 N 1.25 -0.79 -0.83 4.41 -0.00 -1.04 -4.79 115.22 113.42 2doe n HIS 807 Ca 0.04 0.20 -0.35 0.00 0.46 0.00 0.00 57.72 58.07 2doe n HIS 807 Cb 0.52 -1.68 0.11 0.00 -0.12 0.00 0.00 29.99 28.81 2doe n HIS 807 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2doe n LEU 808 N -3.32 -2.59 -3.73 0.27 4.77 -1.25 -5.03 117.00 106.12 2doe n LEU 808 Ca -0.13 0.07 -0.09 0.00 -0.03 0.00 0.00 56.01 55.82 2doe n LEU 808 Cb 0.38 -0.88 -0.03 0.00 -2.33 0.00 0.00 43.42 40.56 2doe n LEU 808 CO 0.48 -3.60 0.35 -0.62 -1.33 0.00 0.00 177.39 172.67 2doe s ASP 809 N -1.56 -0.31 0.21 -1.43 2.15 -1.26 -5.03 116.67 109.45 2doe s ASP 809 Ca 0.49 -0.46 -0.10 0.00 0.43 0.00 0.00 52.55 52.92 2doe s ASP 809 Cb -0.10 0.63 0.17 0.00 -0.30 0.00 0.00 42.92 43.32 2doe s ASP 809 CO 0.69 -1.13 1.88 0.77 -0.17 0.00 0.00 175.17 177.21 2doe h SER 810 N 2.10 0.85 -0.50 -0.34 4.64 -1.96 -1.58 113.55 116.77 2doe h SER 810 Ca -0.27 -0.02 -0.26 0.00 -0.47 0.00 0.00 61.79 60.78 2doe h SER 810 Cb 1.27 -0.21 -0.15 0.00 -0.31 0.00 0.00 62.40 62.99 2doe h SER 810 CO 0.33 0.61 0.33 0.00 -0.87 0.00 0.00 176.83 177.23 2doe n GLN 811 N -4.57 1.63 -2.30 4.77 6.02 -1.26 -4.93 117.38 116.73 2doe n GLN 811 Ca 0.08 -1.50 -0.42 0.00 -0.01 0.00 0.00 57.00 55.14 2doe n GLN 811 Cb 0.03 -1.59 -0.03 0.00 1.02 0.00 0.00 30.24 29.67 2doe n GLN 811 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2doe s SER 812 N -0.14 6.92 -0.16 1.08 0.15 -0.60 -5.01 113.70 115.94 2doe s SER 812 Ca 0.28 2.02 -0.11 0.00 0.70 0.00 0.00 55.95 58.84 2doe s SER 812 Cb 0.24 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.94 2doe s SER 812 CO 0.05 -0.67 0.21 -0.13 1.20 0.00 0.00 173.24 173.90 2doe s ARG 813 N 2.28 4.05 0.07 5.44 1.81 -1.26 -5.00 118.95 126.34 2doe s ARG 813 Ca 0.61 -0.05 -0.32 0.00 -1.72 0.00 0.00 55.73 54.25 2doe s ARG 813 Cb -0.29 -3.37 -0.16 0.00 -0.45 0.00 0.00 34.95 30.68 2doe s ARG 813 CO 0.25 0.40 1.49 2.35 -0.68 0.00 0.00 175.30 179.11 2doe h TRP 814 N 6.22 -1.20 -1.01 -0.53 -0.00 -1.98 0.23 115.95 117.68 2doe h TRP 814 Ca -0.44 -0.00 0.42 0.00 -0.00 0.00 0.00 58.89 58.86 2doe h TRP 814 Cb 1.17 0.45 -0.18 0.00 -0.00 0.00 0.00 29.16 30.60 2doe h TRP 814 CO 0.63 -0.63 0.55 0.77 -0.00 0.00 0.00 178.44 179.76 2doe h SER 815 N -1.00 0.32 0.20 2.65 0.02 -1.98 0.44 113.55 114.20 2doe h SER 815 Ca -0.08 0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 2doe h SER 815 Cb 0.82 0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.63 2doe h SER 815 CO 0.03 -0.42 -0.10 0.11 -1.14 0.00 0.00 176.83 175.31 2doe h LYS 816 N 0.01 -0.26 -1.02 3.45 1.79 -1.85 -2.15 116.57 116.54 2doe h LYS 816 Ca 0.85 0.02 0.30 0.00 -2.18 0.00 0.00 60.65 59.63 2doe h LYS 816 Cb 2.24 0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 32.91 2doe h LYS 816 CO -0.76 -0.17 0.84 -0.24 -1.08 0.00 0.00 179.45 178.04 2doe h VAL 817 N -0.66 0.32 0.03 0.50 3.04 0.39 0.29 116.25 120.15 2doe h VAL 817 Ca -0.03 0.00 -0.11 0.00 -1.01 0.00 0.00 66.70 65.55 2doe h VAL 817 Cb 0.20 0.39 0.01 0.00 -2.01 0.00 0.00 31.29 29.88 2doe h VAL 817 CO 0.04 0.00 -0.46 0.50 -1.01 0.00 0.00 177.57 176.65 2doe h LYS 818 N 0.00 0.27 0.00 4.17 3.64 -0.23 -1.36 116.57 123.06 2doe h LYS 818 Ca 0.48 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2doe h LYS 818 Cb 2.15 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 34.07 2doe h LYS 818 CO -0.01 1.05 0.00 0.22 -2.27 0.00 0.00 179.45 178.44 2doe h ASP 819 N -0.38 0.00 0.31 4.20 1.82 0.13 0.39 116.42 122.90 2doe h ASP 819 Ca -0.06 0.00 -0.32 0.00 -0.39 0.00 0.00 57.03 56.25 2doe h ASP 819 Cb 1.23 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 41.19 2doe h ASP 819 CO 0.09 0.00 -1.93 1.17 -1.61 0.00 0.00 179.24 176.96 2doe n LYS 820 N -2.57 0.66 -0.01 0.28 3.00 0.32 -4.29 118.16 115.56 2doe n LYS 820 Ca 0.02 0.22 -0.07 0.00 -0.00 0.00 0.00 58.31 58.48 2doe n LYS 820 Cb 0.26 -1.71 -0.13 0.00 0.00 0.00 0.00 35.03 33.46 2doe n LYS 820 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.40 177.01 2doe h VAL 821 N 0.01 0.82 -0.84 3.15 -1.51 -1.00 -3.37 116.25 113.51 2doe h VAL 821 Ca -0.37 -2.59 0.21 0.00 -1.23 0.00 0.00 66.70 62.71 2doe h VAL 821 Cb 2.06 2.36 -0.14 0.00 -2.13 0.00 0.00 31.29 33.45 2doe h VAL 821 CO 0.06 0.47 0.18 1.05 -1.23 0.00 0.00 177.57 178.10 2doe h GLU 822 N 0.00 0.19 -1.18 5.19 4.11 -0.41 0.60 114.58 123.08 2doe h GLU 822 Ca -0.25 -0.01 0.34 0.00 0.07 0.00 0.00 59.36 59.51 2doe h GLU 822 Cb 1.91 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 31.07 2doe h GLU 822 CO 0.07 0.13 0.84 1.03 0.07 0.00 0.00 179.01 181.15 2doe h SER 823 N 0.20 0.02 -3.41 3.06 0.87 -1.78 -3.39 113.55 109.13 2doe h SER 823 Ca 0.50 0.01 -0.55 0.00 -1.23 0.00 0.00 61.79 60.52 2doe h SER 823 Cb 0.97 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.90 2doe h SER 823 CO -0.64 0.00 0.09 -0.62 -0.53 0.00 0.00 176.83 175.13 2doe s ASP 824 N -5.17 7.24 0.35 6.23 -1.08 0.21 -4.98 116.67 119.48 2doe s ASP 824 Ca -0.05 1.48 0.14 0.00 -0.52 0.00 0.00 52.55 53.60 2doe s ASP 824 Cb 0.23 -2.44 0.66 0.00 -1.46 0.00 0.00 42.92 39.91 2doe s ASP 824 CO 0.81 0.23 1.76 1.55 0.52 0.00 0.00 175.17 180.04 2doe h PRO 825 N 4.37 0.00 -0.84 4.34 0.13 -1.82 -3.06 132.00 135.12 2doe h PRO 825 Ca -0.48 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.73 2doe h PRO 825 Cb 1.21 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.28 2doe h PRO 825 CO 0.65 0.43 0.55 0.00 -0.23 0.00 0.00 178.00 179.39 2doe h ARG 826 N 0.00 0.83 -0.42 0.86 3.08 -1.92 -0.69 114.38 116.12 2doe h ARG 826 Ca -0.00 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 2doe h ARG 826 Cb 0.81 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 2doe h ARG 826 CO 0.06 0.55 0.22 -0.92 -1.07 0.00 0.00 179.97 178.81 2doe h TYR 827 N 0.86 0.56 0.00 3.04 5.03 -1.78 -1.18 116.97 123.51 2doe h TYR 827 Ca 0.38 -0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.66 2doe h TYR 827 Cb 0.34 -0.18 -0.00 0.00 1.55 0.00 0.00 36.73 38.43 2doe h TYR 827 CO -0.00 0.40 -0.10 0.87 -1.32 0.00 0.00 178.16 178.01 2doe h LYS 828 N 0.59 0.00 -0.53 1.82 1.57 -1.26 -3.10 116.57 115.66 2doe h LYS 828 Ca 0.15 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 59.00 2doe h LYS 828 Cb 0.03 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.24 2doe h LYS 828 CO -0.02 0.10 -0.50 0.00 -0.57 0.00 0.00 179.45 178.46 2doe h ALA 829 N 1.90 -0.55 -1.44 3.86 0.00 -1.18 -3.33 119.26 118.50 2doe h ALA 829 Ca -0.00 0.06 -0.46 0.00 0.00 0.00 0.00 54.91 54.51 2doe h ALA 829 Cb 0.24 1.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2doe h ALA 829 CO 0.01 -0.94 1.37 0.08 0.00 0.00 0.00 179.25 179.77 2doe s VAL 830 N -5.73 3.23 0.12 0.00 1.01 -1.17 -4.80 120.40 113.06 2doe s VAL 830 Ca -0.14 0.09 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 2doe s VAL 830 Cb 0.11 -3.60 -0.18 0.00 0.00 0.00 0.00 36.38 32.70 2doe s VAL 830 CO 0.64 -0.58 1.29 0.44 0.00 0.00 0.00 175.10 176.89 2doe h ASP 831 N 16.23 0.65 -2.91 3.32 3.32 -1.88 -3.43 116.42 131.71 2doe h ASP 831 Ca -0.22 -0.50 -0.57 0.00 0.02 0.00 0.00 57.03 55.76 2doe h ASP 831 Cb 1.18 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 40.50 2doe h ASP 831 CO 1.19 1.29 0.95 -0.44 -1.72 0.00 0.00 179.24 180.51 2doe s SER 832 N -7.12 6.83 0.05 6.45 0.01 -1.26 -4.93 113.70 113.74 2doe s SER 832 Ca -0.07 1.65 -0.26 0.00 1.31 0.00 0.00 55.95 58.58 2doe s SER 832 Cb 0.09 -2.54 -0.17 0.00 0.21 0.00 0.00 66.02 63.61 2doe s SER 832 CO 0.88 -0.87 1.55 -1.28 0.41 0.00 0.00 173.24 173.93 2doe h SER 833 N 8.70 -0.23 -0.98 2.44 0.87 -2.01 -2.86 113.55 119.50 2doe h SER 833 Ca -0.28 -0.10 0.33 0.00 -1.23 0.00 0.00 61.79 60.51 2doe h SER 833 Cb 1.11 0.06 -0.17 0.00 -0.44 0.00 0.00 62.40 62.96 2doe h SER 833 CO 0.98 -0.04 0.37 0.28 -0.53 0.00 0.00 176.83 177.89 2doe h SER 834 N -0.40 0.12 -0.59 6.23 0.02 -1.99 0.85 113.55 117.79 2doe h SER 834 Ca -0.03 0.24 -0.04 0.00 -0.84 0.00 0.00 61.79 61.12 2doe h SER 834 Cb 0.31 0.29 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 2doe h SER 834 CO 0.04 -0.30 0.20 0.24 -1.14 0.00 0.00 176.83 175.87 2doe h MET 835 N 0.11 0.90 0.27 3.45 2.07 -1.92 0.26 114.93 120.07 2doe h MET 835 Ca 0.71 -0.19 0.00 0.00 -2.07 0.00 0.00 59.70 58.16 2doe h MET 835 Cb 1.68 -0.13 -0.02 0.00 -1.87 0.00 0.00 31.60 31.25 2doe h MET 835 CO -0.75 0.80 -0.31 0.00 1.07 0.00 0.00 176.91 177.72 2doe h ARG 836 N 0.82 -0.60 0.54 1.72 3.08 0.85 0.33 114.38 121.12 2doe h ARG 836 Ca 0.19 0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.26 2doe h ARG 836 Cb 0.26 0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.46 2doe h ARG 836 CO -0.01 -0.40 -0.26 0.93 -1.07 0.00 0.00 179.97 179.16 2doe h GLU 837 N -0.63 -0.70 0.02 0.04 5.08 -1.35 -1.49 114.58 115.56 2doe h GLU 837 Ca -0.01 0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2doe h GLU 837 Cb 0.59 0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.95 2doe h GLU 837 CO -0.09 -0.40 -0.45 0.22 -1.00 0.00 0.00 179.01 177.29 2doe h ASP 838 N -0.91 -1.38 -0.21 1.42 3.58 -0.91 0.26 116.42 118.27 2doe h ASP 838 Ca -0.07 0.15 0.04 0.00 0.42 0.00 0.00 57.03 57.57 2doe h ASP 838 Cb 0.62 0.52 -0.07 0.00 1.72 0.00 0.00 39.33 42.12 2doe h ASP 838 CO 0.12 -0.44 -0.48 -0.07 -2.88 0.00 0.00 179.24 175.49 2doe h LEU 839 N -0.57 -1.54 0.08 2.28 3.38 -0.41 0.24 115.31 118.77 2doe h LEU 839 Ca 0.01 0.20 0.01 0.00 0.09 0.00 0.00 57.88 58.19 2doe h LEU 839 Cb 0.61 0.62 -0.04 0.00 0.09 0.00 0.00 40.66 41.94 2doe h LEU 839 CO -0.29 -0.44 -0.41 0.15 0.09 0.00 0.00 178.44 177.54 2doe h PHE 840 N -0.49 -1.20 -0.79 1.13 3.57 -0.97 -1.53 116.94 116.66 2doe h PHE 840 Ca 0.07 0.03 0.19 0.00 3.53 0.00 0.00 57.97 61.79 2doe h PHE 840 Cb 0.64 0.51 -0.12 0.00 2.79 0.00 0.00 35.95 39.77 2doe h PHE 840 CO -0.57 -0.46 0.19 0.87 -2.23 0.00 0.00 178.31 176.10 2doe h LYS 841 N -0.58 0.24 0.08 1.11 1.57 -0.17 -1.23 116.57 117.59 2doe h LYS 841 Ca -0.00 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2doe h LYS 841 Cb 0.59 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.79 2doe h LYS 841 CO -0.23 0.16 -0.39 1.96 -0.57 0.00 0.00 179.45 180.37 2doe h GLN 842 N 0.24 -0.58 0.14 3.15 4.20 0.27 0.20 115.11 122.73 2doe h GLN 842 Ca 0.46 0.04 0.01 0.00 0.06 0.00 0.00 58.65 59.22 2doe h GLN 842 Cb 0.84 0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.71 2doe h GLN 842 CO -0.57 -0.38 -0.51 -0.92 -0.67 0.00 0.00 178.83 175.77 2doe h TYR 843 N -0.60 -1.49 -0.45 2.96 5.03 -0.29 -1.98 116.97 120.16 2doe h TYR 843 Ca 0.03 0.04 0.09 0.00 2.58 0.00 0.00 58.73 61.47 2doe h TYR 843 Cb 0.65 0.63 -0.09 0.00 1.55 0.00 0.00 36.73 39.47 2doe h TYR 843 CO -0.37 -0.59 -0.14 0.82 -1.32 0.00 0.00 178.16 176.57 2doe h ILE 844 N -0.75 0.50 -0.87 1.81 1.08 -1.20 -0.51 117.51 117.57 2doe h ILE 844 Ca -0.01 0.00 0.22 0.00 -0.39 0.00 0.00 64.86 64.68 2doe h ILE 844 Cb 0.75 0.50 -0.13 0.00 -3.07 0.00 0.00 36.82 34.87 2doe h ILE 844 CO -0.27 0.00 0.31 -0.08 -0.69 0.00 0.00 178.15 177.42 2doe h GLU 845 N -0.04 0.30 -0.09 2.37 4.81 -0.12 0.29 114.58 122.10 2doe h GLU 845 Ca 0.22 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2doe h GLU 845 Cb 0.36 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 2doe h GLU 845 CO -0.48 0.20 0.04 -0.22 -0.73 0.00 0.00 179.01 177.82 2doe h LYS 846 N 0.30 0.14 0.08 1.92 3.64 -0.38 -1.76 116.57 120.52 2doe h LYS 846 Ca 0.54 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.90 2doe h LYS 846 Cb 1.05 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 2doe h LYS 846 CO -0.58 0.24 -0.21 0.82 -2.27 0.00 0.00 179.45 177.45 2doe h ILE 847 N -0.00 0.00 -0.56 2.00 2.04 -0.40 -2.46 117.51 118.12 2doe h ILE 847 Ca 0.03 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.00 2doe h ILE 847 Cb 0.15 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.12 2doe h ILE 847 CO -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 178.15 177.97 2doe h ALA 848 N -1.20 0.30 -0.92 1.87 0.00 -1.39 -1.02 119.26 116.89 2doe h ALA 848 Ca -0.01 0.21 0.18 0.00 0.00 0.00 0.00 54.91 55.29 2doe h ALA 848 Cb 0.32 0.50 -0.17 0.00 0.00 0.00 0.00 17.79 18.43 2doe h ALA 848 CO -0.10 -0.48 -0.26 -0.22 0.00 0.00 0.00 179.25 178.19 2doe h LYS 849 N -0.04 -0.01 -3.83 0.00 3.64 -1.01 -3.13 116.57 112.19 2doe h LYS 849 Ca 0.27 0.00 -0.74 0.00 -1.27 0.00 0.00 60.65 58.91 2doe h LYS 849 Cb 0.45 0.00 -0.31 0.00 -0.41 0.00 0.00 32.23 31.97 2doe h LYS 849 CO -0.60 -0.01 -0.21 -0.80 -2.27 0.00 0.00 179.45 175.56 2doe s ASN 850 N -5.27 5.88 0.18 4.20 -0.87 -0.39 -5.06 114.94 113.62 2doe s ASN 850 Ca -0.15 -2.58 -0.33 0.00 -1.57 0.00 0.00 52.86 48.23 2doe s ASN 850 Cb 0.24 -2.02 -0.15 0.00 -0.02 0.00 0.00 41.25 39.31 2doe s ASN 850 CO 0.76 -0.52 1.31 0.18 -2.57 0.00 0.00 177.10 176.27 2doe n LEU 851 N 3.98 2.24 -4.69 0.60 4.77 -1.18 -4.84 117.00 117.88 2doe n LEU 851 Ca 0.06 1.13 -0.42 0.00 -0.03 0.00 0.00 56.01 56.75 2doe n LEU 851 Cb 0.42 -1.31 -0.03 0.00 -2.33 0.00 0.00 43.42 40.17 2doe n LEU 851 CO 0.36 -0.88 0.86 -0.62 -1.33 0.00 0.00 177.39 175.77 2doe s ASP 852 N 0.26 7.16 -0.69 -1.43 2.15 -1.26 -4.98 116.67 117.87 2doe s ASP 852 Ca 0.74 1.75 -0.23 0.00 0.43 0.00 0.00 52.55 55.23 2doe s ASP 852 Cb -0.78 -2.56 0.07 0.00 -0.30 0.00 0.00 42.92 39.35 2doe s ASP 852 CO 0.49 -0.48 1.03 -0.55 -0.17 0.00 0.00 175.17 175.49 2doe s SER 853 N 1.24 6.20 0.14 -0.34 0.15 -1.26 -4.98 113.70 114.85 2doe s SER 853 Ca 0.54 -0.98 -0.10 0.00 0.70 0.00 0.00 55.95 56.11 2doe s SER 853 Cb -0.23 -2.44 -0.00 0.00 -1.71 0.00 0.00 66.02 61.63 2doe s SER 853 CO 0.23 -1.49 0.27 -0.44 1.20 0.00 0.00 173.24 173.01 2doe s SER 854 N 3.72 0.04 0.01 5.45 0.01 -1.26 -5.09 113.70 116.57 2doe s SER 854 Ca 0.25 -0.74 -0.04 0.00 1.31 0.00 0.00 55.95 56.73 2doe s SER 854 Cb -0.15 0.41 -0.02 0.00 0.21 0.00 0.00 66.02 66.48 2doe s SER 854 CO 0.09 -0.84 1.06 1.23 0.41 0.00 0.00 173.24 175.20 2doe h GLY 855 N 2.59 -0.96 -7.10 3.44 0.00 -2.07 -3.38 103.07 95.58 2doe h GLY 855 Ca -0.33 0.42 -0.55 0.00 0.00 0.00 0.00 47.33 46.88 2doe h GLY 855 CO 0.51 -0.35 1.27 2.56 0.00 0.00 0.00 176.54 180.53 2doe s PRO 856 N -3.31 3.10 -0.11 4.80 0.04 -1.26 -4.98 135.00 133.28 2doe s PRO 856 Ca -0.02 1.04 -0.01 0.00 0.04 0.00 0.00 61.00 62.05 2doe s PRO 856 Cb 0.01 -4.24 -0.03 0.00 0.04 0.00 0.00 34.50 30.28 2doe s PRO 856 CO 0.07 -2.14 -0.07 -1.12 0.04 0.00 0.00 177.00 173.77 2doe s SER 857 N 6.51 4.57 -0.29 6.66 0.01 -1.26 -5.01 113.70 124.89 2doe s SER 857 Ca 0.72 -0.12 0.17 0.00 1.31 0.00 0.00 55.95 58.03 2doe s SER 857 Cb -0.17 -1.46 0.48 0.00 0.21 0.00 0.00 66.02 65.08 2doe s SER 857 CO 0.29 0.26 1.10 -1.54 0.41 0.00 0.00 173.24 173.75 2doe n SER 858 N 2.93 2.56 0.00 2.44 3.41 -1.26 -5.21 113.62 118.49 2doe n SER 858 Ca -0.18 -2.67 0.00 0.00 -0.26 0.00 0.00 58.87 55.76 2doe n SER 858 Cb 0.53 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 2doe n SER 858 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49