#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2doe s SER 778 N 0.00 0.78 0.08 1.61 1.04 -1.26 -5.17 113.70 110.78 2doe s SER 778 Ca 0.00 -1.50 0.08 0.00 0.48 0.00 0.00 55.95 55.00 2doe s SER 778 Cb 0.00 0.41 -0.03 0.00 0.10 0.00 0.00 66.02 66.50 2doe s SER 778 CO 0.00 -0.89 -0.20 -0.55 0.98 0.00 0.00 173.24 172.57 2doe s SER 779 N -3.25 2.43 0.22 7.02 0.15 -1.26 -5.09 113.70 113.92 2doe s SER 779 Ca 0.39 -0.64 0.00 0.00 0.70 0.00 0.00 55.95 56.40 2doe s SER 779 Cb 0.06 -0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.22 2doe s SER 779 CO 0.17 0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.29 2doe n GLY 780 N 1.30 -0.10 2.83 9.45 0.00 -1.26 -4.83 105.19 112.57 2doe n GLY 780 Ca -0.19 -0.30 -0.14 0.00 0.00 0.00 0.00 46.02 45.39 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 -4.00 0.01 0.10 1.61 0.01 -1.26 -5.15 113.70 105.03 2doe s SER 781 Ca 0.00 0.10 -0.23 0.00 1.31 0.00 0.00 55.95 57.13 2doe s SER 781 Cb 0.00 0.01 0.06 0.00 0.21 0.00 0.00 66.02 66.30 2doe s SER 781 CO 0.00 -0.11 0.57 -0.44 0.41 0.00 0.00 173.24 173.66 2doe s SER 782 N 0.90 -0.51 0.00 2.44 0.01 -1.26 -5.18 113.70 110.11 2doe s SER 782 Ca -0.07 0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.27 2doe s SER 782 Cb -0.10 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.68 2doe s SER 782 CO -0.03 -0.85 0.00 0.61 0.41 0.00 0.00 173.24 173.38 2doe n GLY 783 N -0.02 1.62 3.04 3.44 0.00 -1.26 -5.03 105.19 106.98 2doe n GLY 783 Ca -0.17 -0.65 -0.17 0.00 0.00 0.00 0.00 46.02 45.03 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 0.00 0.74 -0.03 1.61 -0.58 -1.26 -5.07 120.64 116.06 2doe n GLU 784 Ca 0.00 -2.54 -0.03 0.00 -0.42 0.00 0.00 57.16 54.17 2doe n GLU 784 Cb 0.00 -0.03 -0.03 0.00 -0.57 0.00 0.00 31.44 30.82 2doe n GLU 784 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 2doe n LYS 785 N -1.83 0.75 -2.55 3.49 2.85 -1.26 -4.80 118.16 114.81 2doe n LYS 785 Ca 0.08 0.02 -0.15 0.00 -1.05 0.00 0.00 58.31 57.22 2doe n LYS 785 Cb 0.48 -1.11 0.02 0.00 -0.65 0.00 0.00 35.03 33.78 2doe n LYS 785 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2doe n GLU 786 N -2.56 2.27 -4.08 -1.58 1.02 -1.26 -5.07 120.64 109.38 2doe n GLU 786 Ca -0.09 -3.79 -0.09 0.00 -0.02 0.00 0.00 57.16 53.17 2doe n GLU 786 Cb 0.61 -1.75 -0.10 0.00 -0.02 0.00 0.00 31.44 30.17 2doe n GLU 786 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2doe s ASP 787 N -3.45 0.65 -0.41 1.62 1.01 -1.26 -5.04 116.67 109.80 2doe s ASP 787 Ca 0.37 -0.83 -0.00 0.00 0.71 0.00 0.00 52.55 52.79 2doe s ASP 787 Cb 0.41 0.13 0.36 0.00 1.01 0.00 0.00 42.92 44.83 2doe s ASP 787 CO -0.04 -0.45 1.90 -1.54 0.21 0.00 0.00 175.17 175.25 2doe n SER 788 N 0.57 5.84 0.09 0.27 3.41 -1.26 -4.50 113.62 118.04 2doe n SER 788 Ca -0.17 -3.27 -0.06 0.00 -0.26 0.00 0.00 58.87 55.11 2doe n SER 788 Cb 0.59 -0.93 -0.04 0.00 -0.26 0.00 0.00 64.21 63.57 2doe n SER 788 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2doe h LYS 789 N 1.36 -0.31 -1.39 4.33 1.63 -1.98 -3.32 116.57 116.89 2doe h LYS 789 Ca 0.42 0.02 -0.39 0.00 -0.85 0.00 0.00 60.65 59.85 2doe h LYS 789 Cb 1.34 0.07 -0.17 0.00 -0.60 0.00 0.00 32.23 32.87 2doe h LYS 789 CO 0.98 -0.13 0.51 2.41 -3.45 0.00 0.00 179.45 179.77 2doe n THR 790 N -4.99 2.91 -0.09 1.00 -1.04 -1.26 -4.37 114.28 106.45 2doe n THR 790 Ca -0.05 -1.86 -0.15 0.00 -2.04 0.00 0.00 64.05 59.94 2doe n THR 790 Cb 0.17 -1.26 -0.10 0.00 -1.82 0.00 0.00 70.33 67.32 2doe n THR 790 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 2doe h ARG 791 N 1.51 0.00 -0.93 -2.82 2.43 -1.86 -3.37 114.38 109.33 2doe h ARG 791 Ca 0.36 0.00 0.28 0.00 -0.81 0.00 0.00 59.98 59.81 2doe h ARG 791 Cb 0.98 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 30.37 2doe h ARG 791 CO 0.92 0.79 0.33 0.78 -1.51 0.00 0.00 179.97 181.27 2doe h GLY 792 N -1.00 1.61 -0.58 2.80 0.00 -1.83 0.33 103.07 104.41 2doe h GLY 792 Ca -0.17 -0.08 0.34 0.00 0.00 0.00 0.00 47.33 47.42 2doe h GLY 792 CO -0.10 -0.45 0.62 -2.09 0.00 0.00 0.00 176.54 174.51 2doe h GLU 793 N 0.20 0.28 0.80 4.80 4.81 -1.89 -0.18 114.58 123.40 2doe h GLU 793 Ca 0.63 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.81 2doe h GLU 793 Cb 1.37 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.68 2doe h GLU 793 CO -0.68 0.19 -0.49 -0.22 -0.73 0.00 0.00 179.01 177.07 2doe h LYS 794 N 0.29 -1.16 -1.00 1.92 1.63 -0.54 -1.28 116.57 116.42 2doe h LYS 794 Ca 0.74 0.08 0.11 0.00 -0.85 0.00 0.00 60.65 60.73 2doe h LYS 794 Cb 1.81 0.26 -0.08 0.00 -0.60 0.00 0.00 32.23 33.62 2doe h LYS 794 CO -0.55 -0.77 0.64 0.82 -3.45 0.00 0.00 179.45 176.13 2doe h ILE 795 N -1.20 0.95 -0.34 2.00 5.03 -1.18 -1.05 117.51 121.71 2doe h ILE 795 Ca -0.11 -0.35 0.03 0.00 -0.12 0.00 0.00 64.86 64.31 2doe h ILE 795 Cb 0.96 -0.16 -0.03 0.00 -3.03 0.00 0.00 36.82 34.56 2doe h ILE 795 CO 0.11 0.19 0.14 0.50 -0.68 0.00 0.00 178.15 178.40 2doe h LYS 796 N 1.02 0.29 0.23 2.37 3.64 -0.89 0.96 116.57 124.19 2doe h LYS 796 Ca 0.49 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.84 2doe h LYS 796 Cb 0.44 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2doe h LYS 796 CO -0.25 0.19 -0.11 0.66 -2.27 0.00 0.00 179.45 177.67 2doe h SER 797 N 0.30 -0.26 -0.31 4.20 4.64 -0.35 -2.17 113.55 119.58 2doe h SER 797 Ca 0.15 -0.15 0.07 0.00 -0.47 0.00 0.00 61.79 61.38 2doe h SER 797 Cb 0.10 0.07 -0.06 0.00 -0.31 0.00 0.00 62.40 62.19 2doe h SER 797 CO -0.13 0.01 -0.10 0.44 -0.87 0.00 0.00 176.83 176.17 2doe h ASP 798 N -0.54 -0.37 -0.14 4.97 5.19 -1.08 -0.82 116.42 123.64 2doe h ASP 798 Ca -0.03 0.10 0.05 0.00 -0.62 0.00 0.00 57.03 56.53 2doe h ASP 798 Cb 0.40 0.22 -0.05 0.00 0.18 0.00 0.00 39.33 40.08 2doe h ASP 798 CO 0.05 -0.13 -0.18 0.15 -3.12 0.00 0.00 179.24 176.01 2doe h PHE 799 N -0.04 -0.48 -0.18 4.55 3.57 -0.79 -2.36 116.94 121.22 2doe h PHE 799 Ca 0.16 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.73 2doe h PHE 799 Cb 0.27 0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.20 2doe h PHE 799 CO -0.32 -0.26 -0.13 0.74 -2.23 0.00 0.00 178.31 176.12 2doe h PHE 800 N -0.23 -0.31 -0.42 0.41 0.04 -0.86 -2.35 116.94 113.22 2doe h PHE 800 Ca 0.10 0.02 0.06 0.00 2.80 0.00 0.00 57.97 60.95 2doe h PHE 800 Cb 0.38 0.17 -0.09 0.00 2.20 0.00 0.00 35.95 38.61 2doe h PHE 800 CO -0.30 -0.19 -0.53 0.93 -0.60 0.00 0.00 178.31 177.62 2doe h GLU 801 N -0.13 -0.36 -0.03 1.51 4.39 -0.71 -0.33 114.58 118.93 2doe h GLU 801 Ca 0.11 0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.85 2doe h GLU 801 Cb 0.29 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.98 2doe h GLU 801 CO -0.26 -0.24 -0.36 1.25 -1.16 0.00 0.00 179.01 178.24 2doe h LEU 802 N -0.38 -1.13 -0.34 1.33 5.85 -1.16 0.13 115.31 119.62 2doe h LEU 802 Ca 0.09 0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.97 2doe h LEU 802 Cb 0.59 0.43 -0.05 0.00 0.37 0.00 0.00 40.66 42.01 2doe h LEU 802 CO -0.60 -0.34 -0.28 -0.07 -0.34 0.00 0.00 178.44 176.81 2doe h LEU 803 N -0.43 -0.97 -0.79 2.25 3.38 -0.99 0.79 115.31 118.54 2doe h LEU 803 Ca 0.01 0.14 0.19 0.00 0.09 0.00 0.00 57.88 58.31 2doe h LEU 803 Cb 0.48 0.42 -0.12 0.00 0.09 0.00 0.00 40.66 41.52 2doe h LEU 803 CO -0.26 -0.15 0.19 0.77 0.09 0.00 0.00 178.44 179.08 2doe h SER 804 N -0.10 -0.02 -0.16 -0.43 4.64 -0.88 0.79 113.55 117.40 2doe h SER 804 Ca 0.06 0.17 0.04 0.00 -0.47 0.00 0.00 61.79 61.59 2doe h SER 804 Cb 0.24 0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2doe h SER 804 CO -0.37 -0.09 0.15 0.78 -0.87 0.00 0.00 176.83 176.44 2doe h ASN 805 N 0.24 0.00 -0.18 4.97 2.35 0.15 -1.44 115.58 121.68 2doe h ASN 805 Ca 0.46 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 56.11 2doe h ASN 805 Cb 0.85 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.17 2doe h ASN 805 CO -0.58 0.00 0.13 1.41 -1.65 0.00 0.00 177.43 176.75 2doe n HIS 806 N -3.96 0.56 -3.84 1.19 8.25 0.28 -4.84 115.22 112.87 2doe n HIS 806 Ca 0.01 -1.00 -0.26 0.00 -0.26 0.00 0.00 57.72 56.21 2doe n HIS 806 Cb 0.27 -0.50 -0.03 0.00 1.12 0.00 0.00 29.99 30.86 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 0.56 -0.86 -0.90 4.41 8.25 -0.54 -4.78 115.22 121.35 2doe n HIS 807 Ca 0.11 0.22 -0.35 0.00 -0.26 0.00 0.00 57.72 57.43 2doe n HIS 807 Cb 0.64 -1.83 0.08 0.00 1.12 0.00 0.00 29.99 29.99 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 -3.53 -3.41 -4.20 2.41 4.77 -1.25 -5.02 117.00 106.77 2doe n LEU 808 Ca -0.15 0.14 -0.18 0.00 -0.03 0.00 0.00 56.01 55.80 2doe n LEU 808 Cb 0.42 -0.85 -0.06 0.00 -2.33 0.00 0.00 43.42 40.59 2doe n LEU 808 CO 0.53 -4.31 0.01 1.51 -1.33 0.00 0.00 177.39 173.80 2doe s ASP 809 N -1.38 1.41 0.19 -1.43 -4.77 -1.26 -5.05 116.67 104.37 2doe s ASP 809 Ca 0.46 -1.66 0.08 0.00 -3.30 0.00 0.00 52.55 48.13 2doe s ASP 809 Cb -0.12 0.62 0.04 0.00 -1.09 0.00 0.00 42.92 42.37 2doe s ASP 809 CO 0.73 -1.19 1.43 0.77 0.70 0.00 0.00 175.17 177.61 2doe h SER 810 N 2.10 0.01 -0.68 2.11 4.64 -1.95 -3.14 113.55 116.64 2doe h SER 810 Ca -0.26 -0.01 -0.27 0.00 -0.47 0.00 0.00 61.79 60.78 2doe h SER 810 Cb 1.23 -0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.16 2doe h SER 810 CO 0.37 0.83 0.35 0.00 -0.87 0.00 0.00 176.83 177.51 2doe n GLN 811 N -3.56 2.73 -2.37 4.77 1.13 -1.26 -4.95 117.38 113.87 2doe n GLN 811 Ca -0.01 -2.44 -0.42 0.00 -1.94 0.00 0.00 57.00 52.19 2doe n GLN 811 Cb 0.80 -2.00 -0.03 0.00 0.11 0.00 0.00 30.24 29.11 2doe n GLN 811 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 2doe s SER 812 N -0.76 7.03 -0.05 1.08 0.01 -1.19 -5.03 113.70 114.79 2doe s SER 812 Ca 0.45 2.08 0.02 0.00 1.31 0.00 0.00 55.95 59.81 2doe s SER 812 Cb 0.37 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.99 2doe s SER 812 CO 0.10 -0.50 -0.09 -0.13 0.41 0.00 0.00 173.24 173.03 2doe s ARG 813 N 1.04 2.65 0.01 12.44 1.81 -1.26 -5.03 118.95 130.61 2doe s ARG 813 Ca 0.60 -0.61 -0.03 0.00 -1.72 0.00 0.00 55.73 53.96 2doe s ARG 813 Cb -0.31 -2.52 -0.02 0.00 -0.45 0.00 0.00 34.95 31.66 2doe s ARG 813 CO 0.30 0.64 1.05 2.35 -0.68 0.00 0.00 175.30 178.96 2doe h TRP 814 N 5.16 -0.13 -0.71 -0.53 -0.00 -1.98 0.58 115.95 118.33 2doe h TRP 814 Ca -0.48 0.00 0.28 0.00 -0.00 0.00 0.00 58.89 58.69 2doe h TRP 814 Cb 1.17 0.05 -0.13 0.00 -0.00 0.00 0.00 29.16 30.25 2doe h TRP 814 CO 0.55 -0.06 0.31 0.43 -0.00 0.00 0.00 178.44 179.67 2doe n SER 815 N -2.57 0.18 0.12 2.65 7.64 -1.26 0.16 113.62 120.55 2doe n SER 815 Ca -0.01 1.19 -0.05 0.00 1.01 0.00 0.00 58.87 61.01 2doe n SER 815 Cb 0.04 -0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 62.67 2doe n SER 815 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2doe h LYS 816 N 0.00 -0.35 -0.85 1.43 1.79 -1.86 -2.25 116.57 114.50 2doe h LYS 816 Ca 0.57 0.02 0.25 0.00 -2.18 0.00 0.00 60.65 59.31 2doe h LYS 816 Cb 1.46 0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 32.15 2doe h LYS 816 CO -0.57 -0.23 0.76 -0.24 -1.08 0.00 0.00 179.45 178.08 2doe h VAL 817 N -0.70 0.32 -0.01 0.50 3.04 0.17 0.16 116.25 119.73 2doe h VAL 817 Ca -0.04 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.61 2doe h VAL 817 Cb 0.27 0.43 0.00 0.00 -2.01 0.00 0.00 31.29 29.99 2doe h VAL 817 CO 0.06 0.00 -0.18 0.50 -1.01 0.00 0.00 177.57 176.94 2doe h LYS 818 N 0.00 0.14 0.00 4.17 3.64 -0.29 -1.65 116.57 122.58 2doe h LYS 818 Ca 0.40 -0.13 -0.02 0.00 -1.27 0.00 0.00 60.65 59.63 2doe h LYS 818 Cb 1.91 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.76 2doe h LYS 818 CO -0.00 0.85 -0.07 0.22 -2.27 0.00 0.00 179.45 178.18 2doe h ASP 819 N -0.53 0.00 0.16 4.20 1.82 -0.12 0.32 116.42 122.27 2doe h ASP 819 Ca -0.02 0.00 -0.28 0.00 -0.39 0.00 0.00 57.03 56.34 2doe h ASP 819 Cb 0.91 0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.93 2doe h ASP 819 CO 0.04 0.07 -1.36 0.11 -1.61 0.00 0.00 179.24 176.49 2doe h LYS 820 N 0.00 0.34 0.00 0.28 1.79 -1.13 -3.35 116.57 114.50 2doe h LYS 820 Ca -0.00 -0.59 -0.18 0.00 -2.18 0.00 0.00 60.65 57.71 2doe h LYS 820 Cb 0.32 0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 31.16 2doe h LYS 820 CO 0.01 1.28 -0.84 -0.39 -1.08 0.00 0.00 179.45 178.43 2doe h VAL 821 N -0.15 1.60 -1.57 0.50 -1.51 -1.02 -3.25 116.25 110.85 2doe h VAL 821 Ca -0.27 -2.89 0.46 0.00 -1.23 0.00 0.00 66.70 62.77 2doe h VAL 821 Cb 1.88 2.56 -0.06 0.00 -2.13 0.00 0.00 31.29 33.54 2doe h VAL 821 CO 0.14 0.82 1.27 1.05 -1.23 0.00 0.00 177.57 179.63 2doe h GLU 822 N 0.00 0.00 -0.94 5.19 -0.00 -0.51 1.93 114.58 120.24 2doe h GLU 822 Ca -0.01 0.00 -0.11 0.00 -0.00 0.00 0.00 59.36 59.24 2doe h GLU 822 Cb 1.49 0.00 -0.07 0.00 -0.00 0.00 0.00 28.75 30.18 2doe h GLU 822 CO 0.11 0.00 0.14 -1.13 -0.00 0.00 0.00 179.01 178.13 2doe n SER 823 N -3.75 3.03 -3.97 3.06 3.41 -1.23 -4.81 113.62 109.35 2doe n SER 823 Ca 0.35 -2.47 -0.16 0.00 -0.26 0.00 0.00 58.87 56.33 2doe n SER 823 Cb 1.75 -0.60 -0.14 0.00 -0.26 0.00 0.00 64.21 64.96 2doe n SER 823 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2doe s ASP 824 N 0.02 0.72 0.29 4.04 2.15 0.65 -5.04 116.67 119.50 2doe s ASP 824 Ca 0.20 -0.12 0.08 0.00 0.43 0.00 0.00 52.55 53.14 2doe s ASP 824 Cb 0.16 -0.08 0.45 0.00 -0.30 0.00 0.00 42.92 43.15 2doe s ASP 824 CO 0.05 0.07 1.68 1.55 -0.17 0.00 0.00 175.17 178.35 2doe h PRO 825 N 5.97 0.16 -0.08 4.34 0.13 -1.87 -2.96 132.00 137.68 2doe h PRO 825 Ca -0.29 -0.08 0.01 0.00 -0.87 0.00 0.00 66.00 64.77 2doe h PRO 825 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2doe h PRO 825 CO 0.50 0.60 0.06 0.00 -0.23 0.00 0.00 178.00 178.93 2doe h ARG 826 N 0.13 0.04 0.00 0.86 3.08 -1.96 0.82 114.38 117.35 2doe h ARG 826 Ca 0.01 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 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 0.03 0.00 0.98 -1.07 0.00 0.00 179.97 179.98 2doe n TYR 827 N -4.52 0.52 1.57 3.04 4.19 -1.12 -1.97 117.16 118.88 2doe n TYR 827 Ca -0.01 0.20 0.13 0.00 3.31 0.00 0.00 57.90 61.52 2doe n TYR 827 Cb 0.14 -0.82 0.56 0.00 0.49 0.00 0.00 39.34 39.70 2doe n TYR 827 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 2doe n LYS 828 N -1.97 1.48 0.03 2.98 5.02 0.28 -4.06 118.16 121.92 2doe n LYS 828 Ca 0.03 -0.71 -0.10 0.00 -2.02 0.00 0.00 58.31 55.51 2doe n LYS 828 Cb 0.23 -1.43 -0.07 0.00 -0.02 0.00 0.00 35.03 33.73 2doe n LYS 828 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2doe h ALA 829 N 4.10 -0.17 -3.10 7.82 0.00 -1.50 -3.45 119.26 122.96 2doe h ALA 829 Ca 0.00 -0.23 -0.56 0.00 0.00 0.00 0.00 54.91 54.12 2doe h ALA 829 Cb 0.34 0.07 0.16 0.00 0.00 0.00 0.00 17.79 18.36 2doe h ALA 829 CO 0.00 -0.23 0.54 0.28 0.00 0.00 0.00 179.25 179.84 2doe n VAL 830 N -4.87 4.78 -0.03 0.00 0.31 -1.26 -4.97 118.33 112.28 2doe n VAL 830 Ca -0.07 -0.50 -0.08 0.00 -0.01 0.00 0.00 64.34 63.68 2doe n VAL 830 Cb 0.26 -1.54 -0.03 0.00 -0.91 0.00 0.00 33.84 31.63 2doe n VAL 830 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2doe n ASP 831 N -1.74 1.02 -4.80 4.52 5.75 -1.26 -5.03 116.55 115.00 2doe n ASP 831 Ca 0.15 0.16 -0.34 0.00 -0.01 0.00 0.00 54.79 54.75 2doe n ASP 831 Cb 0.47 -0.38 -0.05 0.00 -1.03 0.00 0.00 41.12 40.13 2doe n ASP 831 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2doe s SER 832 N -5.95 6.69 0.02 -1.12 0.15 -1.26 -4.98 113.70 107.24 2doe s SER 832 Ca -0.13 1.86 -0.16 0.00 0.70 0.00 0.00 55.95 58.22 2doe s SER 832 Cb 0.04 -2.56 -0.35 0.00 -1.71 0.00 0.00 66.02 61.44 2doe s SER 832 CO 0.17 -0.54 0.96 0.77 1.20 0.00 0.00 173.24 175.81 2doe h SER 833 N 1.97 0.81 -0.75 5.45 4.64 -2.01 -3.33 113.55 120.33 2doe h SER 833 Ca -0.49 -0.92 0.09 0.00 -0.47 0.00 0.00 61.79 60.00 2doe h SER 833 Cb 1.20 -0.26 -0.07 0.00 -0.31 0.00 0.00 62.40 62.96 2doe h SER 833 CO 0.61 1.71 0.40 0.77 -0.87 0.00 0.00 176.83 179.44 2doe h SER 834 N 0.11 0.53 -0.81 4.97 4.64 -2.00 -0.46 113.55 120.54 2doe h SER 834 Ca -0.26 0.06 0.10 0.00 -0.47 0.00 0.00 61.79 61.21 2doe h SER 834 Cb 2.13 -0.04 -0.06 0.00 -0.31 0.00 0.00 62.40 64.13 2doe h SER 834 CO 0.26 0.30 0.53 0.24 -0.87 0.00 0.00 176.83 177.29 2doe h MET 835 N 0.67 0.73 0.60 4.77 2.07 -1.98 -0.33 114.93 121.45 2doe h MET 835 Ca 0.37 -0.04 -0.03 0.00 -2.07 0.00 0.00 59.70 57.92 2doe h MET 835 Cb 0.37 -0.16 0.01 0.00 -1.87 0.00 0.00 31.60 29.94 2doe h MET 835 CO -0.26 0.48 -0.29 0.00 1.07 0.00 0.00 176.91 177.91 2doe h ARG 836 N 0.75 -0.77 -0.99 1.72 3.08 -1.21 0.12 114.38 117.08 2doe h ARG 836 Ca 0.37 0.05 0.20 0.00 0.07 0.00 0.00 59.98 60.67 2doe h ARG 836 Cb 0.44 0.18 -0.10 0.00 0.08 0.00 0.00 29.97 30.57 2doe h ARG 836 CO -0.14 -0.51 0.61 0.93 -1.07 0.00 0.00 179.97 179.79 2doe h GLU 837 N -1.22 0.68 0.29 0.04 3.07 -1.19 0.31 114.58 116.56 2doe h GLU 837 Ca -0.08 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.72 2doe h GLU 837 Cb 0.62 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 2doe h GLU 837 CO 0.13 0.45 -0.14 0.22 -1.40 0.00 0.00 179.01 178.27 2doe h ASP 838 N 0.70 -0.33 0.51 1.42 1.82 -1.06 -1.86 116.42 117.62 2doe h ASP 838 Ca 0.57 -0.19 -0.02 0.00 -0.39 0.00 0.00 57.03 57.00 2doe h ASP 838 Cb 0.97 0.09 -0.02 0.00 0.68 0.00 0.00 39.33 41.05 2doe h ASP 838 CO -0.35 0.14 -0.50 -0.07 -1.61 0.00 0.00 179.24 176.86 2doe h LEU 839 N -0.95 -1.35 -0.19 2.28 3.38 -0.18 0.16 115.31 118.47 2doe h LEU 839 Ca -0.04 0.11 0.05 0.00 0.09 0.00 0.00 57.88 58.09 2doe h LEU 839 Cb 0.50 0.44 -0.07 0.00 0.09 0.00 0.00 40.66 41.62 2doe h LEU 839 CO 0.07 -0.66 -0.32 0.15 0.09 0.00 0.00 178.44 177.77 2doe h PHE 840 N -1.00 -0.88 -0.64 1.13 3.57 -0.54 -1.42 116.94 117.16 2doe h PHE 840 Ca -0.06 0.04 0.11 0.00 3.53 0.00 0.00 57.97 61.59 2doe h PHE 840 Cb 0.86 0.42 -0.08 0.00 2.79 0.00 0.00 35.95 39.94 2doe h PHE 840 CO -0.24 -0.39 0.22 0.87 -2.23 0.00 0.00 178.31 176.53 2doe h LYS 841 N -0.36 0.37 -0.20 1.11 1.57 -1.18 -1.98 116.57 115.89 2doe h LYS 841 Ca 0.11 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.92 2doe h LYS 841 Cb 0.54 -0.08 -0.07 0.00 0.08 0.00 0.00 32.23 32.70 2doe h LYS 841 CO -0.39 0.24 -0.29 1.96 -0.57 0.00 0.00 179.45 180.40 2doe h GLN 842 N 0.38 -0.31 0.39 3.15 4.20 0.37 0.22 115.11 123.50 2doe h GLN 842 Ca 0.33 0.02 -0.00 0.00 0.06 0.00 0.00 58.65 59.06 2doe h GLN 842 Cb 0.45 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 2doe h GLN 842 CO -0.35 -0.21 -0.44 -0.92 -0.67 0.00 0.00 178.83 176.24 2doe h TYR 843 N -0.32 -1.21 -0.60 2.96 5.03 -0.76 -2.15 116.97 119.91 2doe h TYR 843 Ca 0.12 0.01 0.12 0.00 2.58 0.00 0.00 58.73 61.56 2doe h TYR 843 Cb 0.51 0.48 -0.09 0.00 1.55 0.00 0.00 36.73 39.18 2doe h TYR 843 CO -0.42 -0.59 0.09 0.82 -1.32 0.00 0.00 178.16 176.74 2doe h ILE 844 N -0.85 0.59 -0.71 1.81 1.08 -1.06 -0.66 117.51 117.70 2doe h ILE 844 Ca -0.03 -0.07 0.14 0.00 -0.39 0.00 0.00 64.86 64.50 2doe h ILE 844 Cb 0.77 0.37 -0.10 0.00 -3.07 0.00 0.00 36.82 34.79 2doe h ILE 844 CO -0.10 0.04 0.23 -0.08 -0.69 0.00 0.00 178.15 177.56 2doe h GLU 845 N 0.21 0.35 -0.58 2.37 4.22 -0.20 -0.47 114.58 120.48 2doe h GLU 845 Ca 0.32 -0.02 -0.01 0.00 0.08 0.00 0.00 59.36 59.73 2doe h GLU 845 Cb 0.49 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 2doe h GLU 845 CO -0.44 0.23 0.33 -0.22 -2.18 0.00 0.00 179.01 176.73 2doe h LYS 846 N 0.36 0.80 0.47 1.92 3.64 -0.50 0.36 116.57 123.63 2doe h LYS 846 Ca 0.39 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.67 2doe h LYS 846 Cb 0.61 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2doe h LYS 846 CO -0.43 0.60 -0.31 0.82 -2.27 0.00 0.00 179.45 177.86 2doe h ILE 847 N 0.79 0.00 -0.35 2.00 2.04 -0.52 -2.60 117.51 118.87 2doe h ILE 847 Ca 0.21 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.13 2doe h ILE 847 Cb 0.02 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.04 2doe h ILE 847 CO -0.04 0.00 -0.00 0.00 0.00 0.00 0.00 178.15 178.11 2doe h ALA 848 N -1.41 0.31 -0.63 1.87 0.00 -1.30 -2.80 119.26 115.30 2doe h ALA 848 Ca -0.06 0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.00 2doe h ALA 848 Cb 0.60 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 2doe h ALA 848 CO 0.05 -0.40 -0.40 -0.22 0.00 0.00 0.00 179.25 178.28 2doe h LYS 849 N 0.09 -0.04 -0.27 0.00 1.63 -0.85 -0.77 116.57 116.36 2doe h LYS 849 Ca 0.17 0.00 0.06 0.00 -0.85 0.00 0.00 60.65 60.03 2doe h LYS 849 Cb 0.23 0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 31.79 2doe h LYS 849 CO -0.28 -0.02 -0.36 -0.97 -3.45 0.00 0.00 179.45 174.36 2doe h ASN 850 N -0.04 -1.16 -0.90 4.20 -1.24 -1.26 -3.31 115.58 111.88 2doe h ASN 850 Ca 0.10 0.18 -0.36 0.00 0.71 0.00 0.00 56.30 56.93 2doe h ASN 850 Cb 0.30 0.51 -0.05 0.00 0.73 0.00 0.00 38.32 39.80 2doe h ASN 850 CO -0.61 -0.36 0.90 -0.76 -1.29 0.00 0.00 177.43 175.31 2doe s LEU 851 N -10.49 3.22 -0.42 0.34 1.43 -0.29 -4.93 118.68 107.54 2doe s LEU 851 Ca -0.15 -0.69 -0.25 0.00 -1.03 0.00 0.00 54.13 52.01 2doe s LEU 851 Cb 0.11 -2.56 0.02 0.00 0.03 0.00 0.00 46.19 43.80 2doe s LEU 851 CO 0.66 -2.53 0.88 -1.81 0.23 0.00 0.00 176.35 173.78 2doe s ASP 852 N 7.56 6.53 -0.19 2.29 1.01 -1.25 -4.83 116.67 127.79 2doe s ASP 852 Ca 0.66 0.23 -0.23 0.00 0.71 0.00 0.00 52.55 53.92 2doe s ASP 852 Cb -0.06 -2.43 -0.21 0.00 1.01 0.00 0.00 42.92 41.23 2doe s ASP 852 CO 0.00 -0.93 0.34 0.77 0.21 0.00 0.00 175.17 175.56 2doe h SER 853 N 8.82 0.00 -3.71 0.27 4.64 -1.92 -3.46 113.55 118.19 2doe h SER 853 Ca -0.24 -0.62 -0.50 0.00 -0.47 0.00 0.00 61.79 59.97 2doe h SER 853 Cb 1.08 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 2doe h SER 853 CO 0.98 1.38 0.36 -0.94 -0.87 0.00 0.00 176.83 177.74 2doe s SER 854 N -6.71 7.60 0.00 4.97 1.04 -1.26 -5.02 113.70 114.32 2doe s SER 854 Ca -0.27 1.93 0.00 0.00 0.48 0.00 0.00 55.95 58.09 2doe s SER 854 Cb 0.04 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.55 2doe s SER 854 CO 0.61 0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.54 2doe n GLY 855 N 1.64 1.09 3.74 7.32 0.00 -1.26 -4.98 105.19 112.74 2doe n GLY 855 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2doe n GLY 855 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2doe s PRO 856 N -0.10 1.63 0.01 1.61 0.04 -1.26 -5.08 135.00 131.85 2doe s PRO 856 Ca 0.00 0.96 -0.11 0.00 0.04 0.00 0.00 61.00 61.89 2doe s PRO 856 Cb 0.00 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 32.71 2doe s PRO 856 CO 0.00 -2.02 0.23 0.45 0.04 0.00 0.00 177.00 175.70 2doe s SER 857 N -3.40 -0.06 -1.59 6.66 0.15 -1.26 -4.89 113.70 109.30 2doe s SER 857 Ca 0.63 -0.15 -0.16 0.00 0.70 0.00 0.00 55.95 56.96 2doe s SER 857 Cb -0.18 0.28 0.16 0.00 -1.71 0.00 0.00 66.02 64.58 2doe s SER 857 CO 0.57 -0.48 0.41 -1.54 1.20 0.00 0.00 173.24 173.40 2doe n SER 858 N 1.06 -1.06 0.00 5.45 3.41 -1.26 -5.32 113.62 115.90 2doe n SER 858 Ca -0.21 -1.10 0.00 0.00 -0.26 0.00 0.00 58.87 57.30 2doe n SER 858 Cb 0.57 -1.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.12 2doe n SER 858 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49