#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 -0.51 -4.10 1.61 7.64 -1.26 -4.97 113.62 112.03 2doe n SER 778 Ca 0.00 0.74 -0.33 0.00 1.01 0.00 0.00 58.87 60.29 2doe n SER 778 Cb 0.00 -1.24 -0.14 0.00 -1.01 0.00 0.00 64.21 61.81 2doe n SER 778 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2doe s SER 779 N -1.23 4.71 0.00 6.43 0.15 -1.26 -5.06 113.70 117.45 2doe s SER 779 Ca 0.71 -1.54 0.00 0.00 0.70 0.00 0.00 55.95 55.82 2doe s SER 779 Cb -0.43 -1.64 0.00 0.00 -1.71 0.00 0.00 66.02 62.24 2doe s SER 779 CO 0.52 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 175.30 2doe n GLY 780 N 4.47 1.91 0.66 9.45 0.00 -1.26 -5.08 105.19 115.35 2doe n GLY 780 Ca -0.10 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2doe n GLY 780 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2doe n SER 781 N 0.00 1.38 -4.56 1.61 3.41 -1.26 -4.99 113.62 109.21 2doe n SER 781 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 2doe n SER 781 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2doe n SER 781 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2doe s SER 782 N -4.37 6.41 0.00 4.04 0.01 -1.26 -4.76 113.70 113.77 2doe s SER 782 Ca 0.00 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.22 2doe s SER 782 Cb 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2doe s SER 782 CO 0.00 -1.43 0.00 0.61 0.41 0.00 0.00 173.24 172.83 2doe n GLY 783 N 5.09 -0.51 3.24 3.44 0.00 -1.26 -5.14 105.19 110.05 2doe n GLY 783 Ca 0.06 0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 2doe n GLY 783 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2doe s GLU 784 N 0.00 1.24 -0.59 1.61 2.02 -1.26 -5.04 118.70 116.68 2doe s GLU 784 Ca 0.00 -0.97 -0.02 0.00 0.02 0.00 0.00 54.97 54.01 2doe s GLU 784 Cb 0.00 -1.37 0.37 0.00 0.10 0.00 0.00 34.13 33.22 2doe s GLU 784 CO 0.00 0.34 2.06 0.36 0.02 0.00 0.00 175.26 178.04 2doe n LYS 785 N 1.66 2.46 -1.18 1.61 2.85 -1.26 -4.65 118.16 119.65 2doe n LYS 785 Ca -0.18 -2.84 -0.25 0.00 -1.05 0.00 0.00 58.31 54.00 2doe n LYS 785 Cb 0.54 -2.11 0.03 0.00 -0.65 0.00 0.00 35.03 32.83 2doe n LYS 785 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 2doe n GLU 786 N -0.50 2.19 -4.42 -1.58 0.28 -1.26 -4.90 120.64 110.45 2doe n GLU 786 Ca 0.53 -2.25 -0.26 0.00 -0.16 0.00 0.00 57.16 55.02 2doe n GLU 786 Cb 0.60 -1.92 -0.13 0.00 1.43 0.00 0.00 31.44 31.42 2doe n GLU 786 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 2doe s ASP 787 N -0.34 2.76 0.05 -1.84 -4.77 -1.26 -5.04 116.67 106.23 2doe s ASP 787 Ca 0.46 -0.66 0.12 0.00 -3.30 0.00 0.00 52.55 49.17 2doe s ASP 787 Cb 0.35 -0.18 -0.18 0.00 -1.09 0.00 0.00 42.92 41.82 2doe s ASP 787 CO -0.08 0.12 0.93 -1.28 0.70 0.00 0.00 175.17 175.57 2doe h SER 788 N 4.22 0.00 -0.42 2.11 0.87 -2.02 -3.36 113.55 114.96 2doe h SER 788 Ca -0.47 0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.16 2doe h SER 788 Cb 1.17 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.07 2doe h SER 788 CO 0.40 0.87 0.07 0.11 -0.53 0.00 0.00 176.83 177.76 2doe h LYS 789 N 0.00 0.19 -0.55 2.24 1.79 -2.00 -0.05 116.57 118.20 2doe h LYS 789 Ca -0.16 -0.01 0.16 0.00 -2.18 0.00 0.00 60.65 58.46 2doe h LYS 789 Cb 1.81 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 32.39 2doe h LYS 789 CO 0.09 0.13 0.82 0.00 -1.08 0.00 0.00 179.45 179.41 2doe h THR 790 N 0.20 0.12 -0.47 -0.16 1.03 -1.98 0.34 112.91 111.98 2doe h THR 790 Ca 0.21 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.61 2doe h THR 790 Cb 0.26 0.30 -0.02 0.00 -1.07 0.00 0.00 68.15 67.62 2doe h THR 790 CO -0.28 0.00 0.29 -0.09 -0.01 0.00 0.00 175.52 175.43 2doe h ARG 791 N 0.00 0.64 -0.99 0.00 2.43 -1.22 -2.62 114.38 112.61 2doe h ARG 791 Ca 0.26 -0.05 0.24 0.00 -0.81 0.00 0.00 59.98 59.62 2doe h ARG 791 Cb 1.90 -0.13 -0.12 0.00 -0.42 0.00 0.00 29.97 31.19 2doe h ARG 791 CO -0.00 0.46 0.56 0.78 -1.51 0.00 0.00 179.97 180.26 2doe h GLY 792 N 0.63 1.85 -0.98 2.80 0.00 -0.46 -1.68 103.07 105.23 2doe h GLY 792 Ca 0.17 -0.29 0.15 0.00 0.00 0.00 0.00 47.33 47.37 2doe h GLY 792 CO -0.03 -0.25 -0.37 1.18 0.00 0.00 0.00 176.54 177.07 2doe n GLU 793 N -4.91 -0.22 0.16 4.80 1.02 -0.99 -0.56 120.64 119.94 2doe n GLU 793 Ca 0.26 1.50 -0.10 0.00 -0.02 0.00 0.00 57.16 58.80 2doe n GLU 793 Cb 0.73 -2.23 -0.06 0.00 -0.02 0.00 0.00 31.44 29.86 2doe n GLU 793 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2doe h LYS 794 N 0.00 -0.55 -0.89 3.49 3.64 -1.47 0.14 116.57 120.93 2doe h LYS 794 Ca 0.35 0.04 0.24 0.00 -1.27 0.00 0.00 60.65 60.01 2doe h LYS 794 Cb 0.59 0.13 -0.15 0.00 -0.41 0.00 0.00 32.23 32.39 2doe h LYS 794 CO -0.97 -0.37 0.18 0.82 -2.27 0.00 0.00 179.45 176.84 2doe h ILE 795 N -0.57 0.24 0.73 2.00 2.04 -1.27 0.14 117.51 120.82 2doe h ILE 795 Ca -0.03 -0.05 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 2doe h ILE 795 Cb 0.50 0.09 0.01 0.00 -0.74 0.00 0.00 36.82 36.67 2doe h ILE 795 CO -0.05 0.03 -0.35 0.50 0.00 0.00 0.00 178.15 178.27 2doe h LYS 796 N 0.14 -0.94 0.26 2.37 3.64 -0.40 -0.73 116.57 120.92 2doe h LYS 796 Ca 0.56 0.06 0.01 0.00 -1.27 0.00 0.00 60.65 60.01 2doe h LYS 796 Cb 1.14 0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 33.14 2doe h LYS 796 CO -0.72 -0.62 -0.45 1.03 -2.27 0.00 0.00 179.45 176.42 2doe h SER 797 N -0.99 -1.29 -0.13 4.20 0.87 0.64 -2.52 113.55 114.34 2doe h SER 797 Ca -0.10 0.13 0.03 0.00 -1.23 0.00 0.00 61.79 60.62 2doe h SER 797 Cb 0.75 0.46 -0.06 0.00 -0.44 0.00 0.00 62.40 63.11 2doe h SER 797 CO 0.16 -0.55 -0.51 -0.78 -0.53 0.00 0.00 176.83 174.63 2doe h ASP 798 N -0.78 -1.61 -0.92 6.23 3.58 -0.82 -1.82 116.42 120.29 2doe h ASP 798 Ca -0.01 0.19 0.14 0.00 0.42 0.00 0.00 57.03 57.77 2doe h ASP 798 Cb 0.74 0.63 -0.15 0.00 1.72 0.00 0.00 39.33 42.28 2doe h ASP 798 CO -0.18 -0.45 -0.37 0.33 -2.88 0.00 0.00 179.24 175.70 2doe n PHE 799 N -5.22 0.01 -0.02 0.28 7.35 -0.28 0.17 117.46 119.75 2doe n PHE 799 Ca -0.06 1.13 -0.09 0.00 -0.76 0.00 0.00 57.45 57.68 2doe n PHE 799 Cb 0.35 -0.83 -0.03 0.00 0.35 0.00 0.00 39.48 39.33 2doe n PHE 799 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2doe h PHE 800 N 0.00 -0.39 -0.17 -5.13 0.04 -0.92 -2.20 116.94 108.18 2doe h PHE 800 Ca 0.31 0.02 0.02 0.00 2.80 0.00 0.00 57.97 61.13 2doe h PHE 800 Cb 0.54 0.20 -0.04 0.00 2.20 0.00 0.00 35.95 38.85 2doe h PHE 800 CO -0.81 -0.22 -0.25 0.93 -0.60 0.00 0.00 178.31 177.35 2doe h GLU 801 N -0.18 -0.18 -0.15 1.51 4.39 0.48 0.08 114.58 120.53 2doe h GLU 801 Ca 0.11 0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.84 2doe h GLU 801 Cb 0.33 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 2doe h GLU 801 CO -0.27 -0.12 -0.21 1.25 -1.16 0.00 0.00 179.01 178.50 2doe h LEU 802 N -0.19 -0.70 -0.85 1.33 5.85 -1.24 0.16 115.31 119.67 2doe h LEU 802 Ca 0.03 0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.92 2doe h LEU 802 Cb 0.27 0.28 -0.10 0.00 0.37 0.00 0.00 40.66 41.49 2doe h LEU 802 CO -0.26 -0.15 -0.50 0.18 -0.34 0.00 0.00 178.44 177.37 2doe n LEU 803 N -3.70 -0.90 -0.35 2.25 4.77 -0.84 0.72 117.00 118.95 2doe n LEU 803 Ca -0.01 1.64 0.12 0.00 -0.03 0.00 0.00 56.01 57.73 2doe n LEU 803 Cb 0.13 -0.26 0.30 0.00 -2.33 0.00 0.00 43.42 41.26 2doe n LEU 803 CO 0.00 -1.30 1.20 -1.28 -1.33 0.00 0.00 177.39 174.68 2doe h SER 804 N 0.00 0.80 -0.00 -1.43 0.87 -0.47 0.36 113.55 113.68 2doe h SER 804 Ca 0.14 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 2doe h SER 804 Cb 0.35 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.25 2doe h SER 804 CO -0.80 0.31 0.00 0.78 -0.53 0.00 0.00 176.83 176.60 2doe h ASN 805 N 0.80 0.00 0.00 6.23 -0.26 0.33 -2.77 115.58 119.91 2doe h ASN 805 Ca 0.56 0.00 -0.06 0.00 -0.56 0.00 0.00 56.30 56.25 2doe h ASN 805 Cb 0.82 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 38.06 2doe h ASN 805 CO -0.36 0.00 -0.11 1.41 -1.06 0.00 0.00 177.43 177.31 2doe n HIS 806 N -4.12 0.00 -3.72 1.19 8.25 0.13 -4.77 115.22 112.17 2doe n HIS 806 Ca -0.03 -1.09 -0.22 0.00 -0.26 0.00 0.00 57.72 56.13 2doe n HIS 806 Cb 0.09 -0.81 -0.02 0.00 1.12 0.00 0.00 29.99 30.36 2doe n HIS 806 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2doe n HIS 807 N 1.85 -0.72 -1.12 4.41 8.25 -1.05 -4.77 115.22 122.07 2doe n HIS 807 Ca 0.13 0.18 -0.35 0.00 -0.26 0.00 0.00 57.72 57.41 2doe n HIS 807 Cb 0.59 -1.53 0.08 0.00 1.12 0.00 0.00 29.99 30.25 2doe n HIS 807 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2doe n LEU 808 N -3.12 0.06 -3.83 2.41 4.77 -1.23 -5.01 117.00 111.05 2doe n LEU 808 Ca -0.12 0.50 -0.07 0.00 -0.03 0.00 0.00 56.01 56.29 2doe n LEU 808 Cb 0.35 -1.18 0.01 0.00 -2.33 0.00 0.00 43.42 40.27 2doe n LEU 808 CO 0.44 -3.46 0.59 -0.62 -1.33 0.00 0.00 177.39 173.01 2doe s ASP 809 N -1.58 -0.05 0.27 -1.43 2.15 -1.26 -5.03 116.67 109.74 2doe s ASP 809 Ca 0.61 -0.92 -0.03 0.00 0.43 0.00 0.00 52.55 52.64 2doe s ASP 809 Cb -0.31 0.74 0.38 0.00 -0.30 0.00 0.00 42.92 43.43 2doe s ASP 809 CO 0.62 -1.45 1.93 0.77 -0.17 0.00 0.00 175.17 176.87 2doe h SER 810 N 2.00 1.04 -0.23 -0.34 4.64 -1.95 -1.21 113.55 117.50 2doe h SER 810 Ca -0.29 -0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 60.90 2doe h SER 810 Cb 1.24 -0.25 -0.07 0.00 -0.31 0.00 0.00 62.40 63.01 2doe h SER 810 CO 0.36 0.73 0.15 0.00 -0.87 0.00 0.00 176.83 177.20 2doe n GLN 811 N -4.43 1.29 -2.49 4.77 10.64 -1.26 -4.88 117.38 121.02 2doe n GLN 811 Ca 0.12 -0.70 -0.43 0.00 -1.83 0.00 0.00 57.00 54.16 2doe n GLN 811 Cb 0.07 -1.27 -0.02 0.00 -0.86 0.00 0.00 30.24 28.16 2doe n GLN 811 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 2doe s SER 812 N 0.47 7.00 -0.11 2.61 1.04 -0.46 -5.02 113.70 119.22 2doe s SER 812 Ca 0.13 1.62 -0.03 0.00 0.48 0.00 0.00 55.95 58.15 2doe s SER 812 Cb 0.11 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.66 2doe s SER 812 CO 0.03 -0.72 0.00 -0.13 0.98 0.00 0.00 173.24 173.40 2doe s ARG 813 N 3.31 3.26 0.03 4.02 3.00 -1.26 -5.01 118.95 126.29 2doe s ARG 813 Ca 0.52 -0.42 -0.28 0.00 0.00 0.00 0.00 55.73 55.55 2doe s ARG 813 Cb -0.20 -2.88 -0.17 0.00 0.00 0.00 0.00 34.95 31.70 2doe s ARG 813 CO 0.13 0.55 1.29 2.35 0.00 0.00 0.00 175.30 179.62 2doe h TRP 814 N 5.67 -0.77 -0.96 -0.53 -0.00 -1.97 -0.31 115.95 117.09 2doe h TRP 814 Ca -0.45 -0.02 0.30 0.00 -0.00 0.00 0.00 58.89 58.72 2doe h TRP 814 Cb 1.19 0.25 -0.17 0.00 -0.00 0.00 0.00 29.16 30.44 2doe h TRP 814 CO 0.60 -0.43 0.24 0.77 -0.00 0.00 0.00 178.44 179.63 2doe h SER 815 N -1.05 -0.09 0.26 2.65 0.02 -1.98 0.57 113.55 113.94 2doe h SER 815 Ca -0.08 0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 2doe h SER 815 Cb 0.68 0.35 0.00 0.00 0.14 0.00 0.00 62.40 63.57 2doe h SER 815 CO 0.14 -0.30 -0.12 0.11 -1.14 0.00 0.00 176.83 175.52 2doe h LYS 816 N 0.09 -0.34 -0.82 3.45 1.79 -1.97 -1.71 116.57 117.06 2doe h LYS 816 Ca 0.65 0.02 0.24 0.00 -2.18 0.00 0.00 60.65 59.38 2doe h LYS 816 Cb 1.44 0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 32.14 2doe h LYS 816 CO -0.78 -0.22 0.80 -0.24 -1.08 0.00 0.00 179.45 177.92 2doe h VAL 817 N -0.71 0.25 0.25 0.50 3.04 -0.24 0.55 116.25 119.88 2doe h VAL 817 Ca -0.04 0.00 -0.34 0.00 -1.01 0.00 0.00 66.70 65.31 2doe h VAL 817 Cb 0.27 0.38 0.03 0.00 -2.01 0.00 0.00 31.29 29.96 2doe h VAL 817 CO 0.06 0.00 -1.54 0.50 -1.01 0.00 0.00 177.57 175.57 2doe h LYS 818 N 0.00 0.52 0.00 4.17 3.64 0.12 -1.26 116.57 123.76 2doe h LYS 818 Ca 0.39 -0.89 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2doe h LYS 818 Cb 1.99 0.33 0.00 0.00 -0.41 0.00 0.00 32.23 34.14 2doe h LYS 818 CO -0.00 1.42 0.00 0.22 -2.27 0.00 0.00 179.45 178.82 2doe h ASP 819 N 0.14 0.00 0.15 4.20 1.82 0.94 -0.16 116.42 123.51 2doe h ASP 819 Ca -0.28 0.00 -0.35 0.00 -0.39 0.00 0.00 57.03 56.01 2doe h ASP 819 Cb 2.16 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 42.12 2doe h ASP 819 CO 0.26 0.00 -2.15 1.17 -1.61 0.00 0.00 179.24 176.91 2doe n LYS 820 N -2.87 0.68 0.07 0.28 3.00 0.17 -4.32 118.16 115.17 2doe n LYS 820 Ca 0.02 0.17 -0.08 0.00 -0.00 0.00 0.00 58.31 58.41 2doe n LYS 820 Cb 0.35 -1.63 -0.11 0.00 0.00 0.00 0.00 35.03 33.64 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 0.02 1.66 -0.35 3.15 -1.51 -1.17 -3.26 116.25 114.78 2doe h VAL 821 Ca -0.46 -3.28 0.10 0.00 -1.23 0.00 0.00 66.70 61.83 2doe h VAL 821 Cb 2.06 2.83 -0.01 0.00 -2.13 0.00 0.00 31.29 34.03 2doe h VAL 821 CO 0.03 0.94 0.84 1.05 -1.23 0.00 0.00 177.57 179.20 2doe h GLU 822 N 0.02 0.00 -0.94 5.19 4.11 -1.21 0.94 114.58 122.69 2doe h GLU 822 Ca -0.03 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.31 2doe h GLU 822 Cb 1.77 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.97 2doe h GLU 822 CO 0.14 0.00 0.11 0.45 0.07 0.00 0.00 179.01 179.79 2doe n SER 823 N -2.97 2.90 -3.98 3.06 2.88 -1.23 -4.80 113.62 109.48 2doe n SER 823 Ca 0.07 -2.40 -0.17 0.00 -1.33 0.00 0.00 58.87 55.04 2doe n SER 823 Cb 0.96 -0.58 -0.15 0.00 -0.75 0.00 0.00 64.21 63.69 2doe n SER 823 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2doe s ASP 824 N 0.07 0.76 0.29 -3.46 -1.08 0.33 -5.04 116.67 108.53 2doe s ASP 824 Ca 0.17 -0.12 0.07 0.00 -0.52 0.00 0.00 52.55 52.16 2doe s ASP 824 Cb 0.14 -0.09 0.44 0.00 -1.46 0.00 0.00 42.92 41.94 2doe s ASP 824 CO 0.04 0.08 1.68 1.55 0.52 0.00 0.00 175.17 179.03 2doe h PRO 825 N 6.01 0.17 -0.04 4.34 0.13 -1.87 -2.96 132.00 137.78 2doe h PRO 825 Ca -0.29 -0.09 -0.04 0.00 -0.87 0.00 0.00 66.00 64.71 2doe h PRO 825 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2doe h PRO 825 CO 0.50 0.61 -0.15 0.00 -0.23 0.00 0.00 178.00 178.73 2doe h ARG 826 N 0.14 0.07 0.00 0.86 3.08 -1.96 -1.66 114.38 114.91 2doe h ARG 826 Ca 0.01 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 2doe h ARG 826 Cb 0.89 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.93 2doe h ARG 826 CO 0.07 0.22 -0.16 -0.92 -1.07 0.00 0.00 179.97 178.11 2doe h TYR 827 N 0.06 0.00 0.00 3.04 5.03 -1.81 -1.84 116.97 121.46 2doe h TYR 827 Ca 0.01 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.32 2doe h TYR 827 Cb 0.31 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.59 2doe h TYR 827 CO 0.00 0.16 0.00 0.87 -1.32 0.00 0.00 178.16 177.88 2doe h LYS 828 N 0.00 0.00 -0.72 1.82 1.57 -1.40 -3.25 116.57 114.58 2doe h LYS 828 Ca -0.00 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.90 2doe h LYS 828 Cb 0.47 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.74 2doe h LYS 828 CO 0.02 0.00 0.48 0.00 -0.57 0.00 0.00 179.45 179.38 2doe h ALA 829 N 2.34 2.00 -2.20 3.86 0.00 -1.32 -3.38 119.26 120.56 2doe h ALA 829 Ca 0.00 -0.00 -0.60 0.00 0.00 0.00 0.00 54.91 54.31 2doe h ALA 829 Cb 0.81 -0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.41 2doe h ALA 829 CO 0.00 -0.18 0.46 0.08 0.00 0.00 0.00 179.25 179.61 2doe s VAL 830 N -5.46 4.75 -0.18 0.00 1.01 -1.23 -4.93 120.40 114.36 2doe s VAL 830 Ca -0.08 1.24 -0.21 0.00 0.00 0.00 0.00 61.98 62.92 2doe s VAL 830 Cb 0.20 -4.19 -0.18 0.00 0.00 0.00 0.00 36.38 32.21 2doe s VAL 830 CO 0.76 -0.29 0.33 -0.78 0.00 0.00 0.00 175.10 175.12 2doe h ASP 831 N 8.13 0.00 -2.86 3.32 1.82 -1.90 -3.45 116.42 121.48 2doe h ASP 831 Ca -0.24 -0.57 -0.57 0.00 -0.39 0.00 0.00 57.03 55.26 2doe h ASP 831 Cb 1.09 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.07 2doe h ASP 831 CO 0.91 1.22 1.09 -0.55 -1.61 0.00 0.00 179.24 180.29 2doe s SER 832 N -6.49 6.46 0.39 2.28 0.15 -1.26 -4.88 113.70 110.35 2doe s SER 832 Ca -0.23 1.53 0.09 0.00 0.70 0.00 0.00 55.95 58.04 2doe s SER 832 Cb 0.03 -2.53 0.86 0.00 -1.71 0.00 0.00 66.02 62.66 2doe s SER 832 CO 0.55 -1.21 1.95 -1.28 1.20 0.00 0.00 173.24 174.46 2doe h SER 833 N 10.34 0.55 -0.77 5.45 0.87 -2.02 -0.77 113.55 127.21 2doe h SER 833 Ca -0.32 0.01 0.14 0.00 -1.23 0.00 0.00 61.79 60.39 2doe h SER 833 Cb 1.14 -0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 62.94 2doe h SER 833 CO 1.01 0.34 0.51 0.28 -0.53 0.00 0.00 176.83 178.44 2doe h SER 834 N 0.62 0.45 -0.22 6.23 0.02 -2.00 -1.26 113.55 117.38 2doe h SER 834 Ca 0.32 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.25 2doe h SER 834 Cb 0.43 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2doe h SER 834 CO -0.11 0.24 -0.02 0.24 -1.14 0.00 0.00 176.83 176.04 2doe h MET 835 N 0.48 0.40 -0.13 3.45 2.86 -1.53 0.11 114.93 120.57 2doe h MET 835 Ca 0.38 -0.14 0.04 0.00 -2.06 0.00 0.00 59.70 57.92 2doe h MET 835 Cb 0.78 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.37 2doe h MET 835 CO -0.13 0.61 -0.11 0.00 1.06 0.00 0.00 176.91 178.34 2doe h ARG 836 N 0.16 -0.12 -0.15 1.72 3.08 -1.25 0.44 114.38 118.27 2doe h ARG 836 Ca 0.06 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 2doe h ARG 836 Cb 0.44 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 2doe h ARG 836 CO 0.01 -0.08 0.02 0.93 -1.07 0.00 0.00 179.97 179.79 2doe h GLU 837 N -0.12 0.25 0.40 0.04 5.08 -1.43 -1.44 114.58 117.37 2doe h GLU 837 Ca 0.09 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 2doe h GLU 837 Cb 0.25 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2doe h GLU 837 CO -0.21 0.43 -0.21 0.22 -1.00 0.00 0.00 179.01 178.25 2doe h ASP 838 N 0.03 -0.50 -0.59 1.42 3.58 -0.70 -0.53 116.42 119.13 2doe h ASP 838 Ca 0.05 0.02 0.11 0.00 0.42 0.00 0.00 57.03 57.63 2doe h ASP 838 Cb 0.30 0.14 -0.12 0.00 1.72 0.00 0.00 39.33 41.37 2doe h ASP 838 CO 0.00 -0.34 -0.26 -0.07 -2.88 0.00 0.00 179.24 175.69 2doe h LEU 839 N -0.56 -0.91 0.17 2.28 3.38 -0.21 0.18 115.31 119.64 2doe h LEU 839 Ca -0.05 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2doe h LEU 839 Cb 0.43 0.49 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 2doe h LEU 839 CO 0.08 -0.27 -0.40 0.15 0.09 0.00 0.00 178.44 178.09 2doe h PHE 840 N -0.11 -1.14 -0.75 1.13 3.57 -1.23 -1.65 116.94 116.77 2doe h PHE 840 Ca 0.26 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.94 2doe h PHE 840 Cb 0.52 0.48 -0.10 0.00 2.79 0.00 0.00 35.95 39.64 2doe h PHE 840 CO -0.58 -0.47 0.25 0.87 -2.23 0.00 0.00 178.31 176.16 2doe h LYS 841 N -0.62 0.36 0.05 1.11 1.57 -0.46 -2.21 116.57 116.37 2doe h LYS 841 Ca -0.02 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2doe h LYS 841 Cb 0.60 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.78 2doe h LYS 841 CO -0.18 0.24 -0.47 1.96 -0.57 0.00 0.00 179.45 180.43 2doe h GLN 842 N 0.37 -0.61 -0.05 3.15 4.20 -0.06 0.14 115.11 122.25 2doe h GLN 842 Ca 0.42 0.04 0.02 0.00 0.06 0.00 0.00 58.65 59.19 2doe h GLN 842 Cb 0.67 0.14 -0.05 0.00 0.30 0.00 0.00 27.48 28.54 2doe h GLN 842 CO -0.45 -0.41 -0.49 -0.92 -0.67 0.00 0.00 178.83 175.89 2doe h TYR 843 N -0.63 -1.46 -0.65 2.96 5.03 -0.75 -1.69 116.97 119.78 2doe h TYR 843 Ca 0.00 0.05 0.13 0.00 2.58 0.00 0.00 58.73 61.49 2doe h TYR 843 Cb 0.66 0.64 -0.12 0.00 1.55 0.00 0.00 36.73 39.45 2doe h TYR 843 CO -0.47 -0.52 -0.16 0.82 -1.32 0.00 0.00 178.16 176.51 2doe h ILE 844 N -0.59 0.35 -0.49 1.81 1.08 -1.22 -0.20 117.51 118.26 2doe h ILE 844 Ca 0.02 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.59 2doe h ILE 844 Cb 0.65 0.35 -0.09 0.00 -3.07 0.00 0.00 36.82 34.65 2doe h ILE 844 CO -0.35 0.00 -0.13 -0.08 -0.69 0.00 0.00 178.15 176.89 2doe h GLU 845 N -0.00 -0.01 -0.88 2.37 4.81 0.06 0.13 114.58 121.06 2doe h GLU 845 Ca 0.31 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.64 2doe h GLU 845 Cb 0.48 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.78 2doe h GLU 845 CO -0.67 -0.01 0.52 -0.22 -0.73 0.00 0.00 179.01 177.90 2doe h LYS 846 N -0.01 0.84 0.54 1.92 3.64 -0.19 0.62 116.57 123.94 2doe h LYS 846 Ca 0.23 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.54 2doe h LYS 846 Cb 0.37 -0.19 0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2doe h LYS 846 CO -0.51 0.56 -0.26 0.82 -2.27 0.00 0.00 179.45 177.79 2doe h ILE 847 N 0.87 0.00 0.16 2.00 2.04 -0.39 0.54 117.51 122.73 2doe h ILE 847 Ca 0.42 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 66.23 2doe h ILE 847 Cb 0.37 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.41 2doe h ILE 847 CO -0.24 0.00 -0.51 0.00 0.00 0.00 0.00 178.15 177.39 2doe h ALA 848 N -1.60 -1.01 -0.01 1.87 0.00 -1.09 -2.13 119.26 115.29 2doe h ALA 848 Ca -0.07 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.73 2doe h ALA 848 Cb 0.56 0.87 -0.04 0.00 0.00 0.00 0.00 17.79 19.18 2doe h ALA 848 CO 0.12 -1.12 -0.40 0.87 0.00 0.00 0.00 179.25 178.72 2doe h LYS 849 N -0.76 -0.48 -4.08 0.00 1.79 -0.96 -3.34 116.57 108.75 2doe h LYS 849 Ca -0.01 0.03 -0.70 0.00 -2.18 0.00 0.00 60.65 57.79 2doe h LYS 849 Cb 0.75 0.11 -0.35 0.00 -1.58 0.00 0.00 32.23 31.16 2doe h LYS 849 CO -0.25 -0.32 -0.47 1.21 -1.08 0.00 0.00 179.45 178.54 2doe s ASN 850 N -4.18 5.25 0.07 0.86 2.47 0.18 -5.07 114.94 114.51 2doe s ASN 850 Ca -0.12 -2.40 -0.31 0.00 0.42 0.00 0.00 52.86 50.46 2doe s ASN 850 Cb 0.05 -1.84 -0.07 0.00 -1.45 0.00 0.00 41.25 37.93 2doe s ASN 850 CO 0.45 -0.47 1.46 -0.76 -3.72 0.00 0.00 177.10 174.06 2doe s LEU 851 N 0.61 4.35 1.15 3.21 2.01 -0.81 -4.27 118.68 124.92 2doe s LEU 851 Ca 0.12 2.30 -0.12 0.00 0.01 0.00 0.00 54.13 56.44 2doe s LEU 851 Cb -0.22 -3.57 0.28 0.00 0.01 0.00 0.00 46.19 42.68 2doe s LEU 851 CO -0.04 -0.74 1.04 -0.62 1.01 0.00 0.00 176.35 177.00 2doe s ASP 852 N 1.65 1.07 -0.13 2.29 -1.08 -1.26 -4.99 116.67 114.22 2doe s ASP 852 Ca 0.67 1.60 -0.13 0.00 -0.52 0.00 0.00 52.55 54.16 2doe s ASP 852 Cb -0.36 -2.34 -0.05 0.00 -1.46 0.00 0.00 42.92 38.71 2doe s ASP 852 CO 0.29 -4.16 0.30 -0.94 0.52 0.00 0.00 175.17 171.19 2doe s SER 853 N -2.50 6.50 0.79 -0.34 1.04 -1.26 -5.09 113.70 112.84 2doe s SER 853 Ca 0.68 0.59 -0.09 0.00 0.48 0.00 0.00 55.95 57.61 2doe s SER 853 Cb -0.25 -2.18 0.10 0.00 0.10 0.00 0.00 66.02 63.79 2doe s SER 853 CO 0.64 0.17 1.12 -0.94 0.98 0.00 0.00 173.24 175.21 2doe s SER 854 N 0.04 4.33 0.00 7.02 1.04 -1.26 -5.04 113.70 119.83 2doe s SER 854 Ca 0.18 0.41 0.00 0.00 0.48 0.00 0.00 55.95 57.02 2doe s SER 854 Cb -0.14 -0.87 0.00 0.00 0.10 0.00 0.00 66.02 65.12 2doe s SER 854 CO 0.06 -1.94 0.00 0.61 0.98 0.00 0.00 173.24 172.94 2doe n GLY 855 N -3.19 -0.53 0.00 7.32 0.00 -1.26 -4.93 105.19 102.60 2doe n GLY 855 Ca 0.10 -0.88 0.06 0.00 0.00 0.00 0.00 46.02 45.30 2doe n GLY 855 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2doe n PRO 856 N 0.00 0.49 -1.74 1.61 -0.04 -1.26 -4.83 135.00 129.23 2doe n PRO 856 Ca 0.00 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 2doe n PRO 856 Cb 0.00 -1.36 -0.01 0.00 -0.04 0.00 0.00 33.50 32.09 2doe n PRO 856 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2doe n SER 857 N -0.86 3.63 0.16 3.54 3.41 -1.26 -4.83 113.62 117.41 2doe n SER 857 Ca 0.08 1.17 0.09 0.00 -0.26 0.00 0.00 58.87 59.96 2doe n SER 857 Cb 0.04 -1.57 0.50 0.00 -0.26 0.00 0.00 64.21 62.92 2doe n SER 857 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2doe n SER 858 N 1.62 0.48 0.00 4.04 3.41 -1.26 -5.17 113.62 116.73 2doe n SER 858 Ca 0.07 0.69 0.00 0.00 -0.26 0.00 0.00 58.87 59.37 2doe n SER 858 Cb 0.37 -0.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.59 2doe n SER 858 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49