#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 1.88 -4.67 1.61 2.88 -1.26 -4.96 113.62 109.10 2doe n SER 778 Ca 0.00 0.09 -0.43 0.00 -1.33 0.00 0.00 58.87 57.20 2doe n SER 778 Cb 0.00 -0.44 -0.03 0.00 -0.75 0.00 0.00 64.21 62.99 2doe n SER 778 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2doe n SER 779 N -3.49 4.03 -4.66 -3.46 7.64 -1.26 -4.98 113.62 107.45 2doe n SER 779 Ca -0.35 0.93 -0.27 0.00 1.01 0.00 0.00 58.87 60.20 2doe n SER 779 Cb 0.79 -1.51 -0.08 0.00 -1.01 0.00 0.00 64.21 62.40 2doe n SER 779 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2doe s GLY 780 N 3.97 1.74 -0.29 0.23 0.00 -1.26 -5.12 107.32 106.58 2doe s GLY 780 Ca 0.88 -1.36 -0.20 0.00 0.00 0.00 0.00 44.72 44.03 2doe s GLY 780 CO 0.42 -1.38 1.14 -1.35 0.00 0.00 0.00 173.10 171.94 2doe s SER 781 N -2.90 -0.31 0.59 1.64 1.04 -1.26 -5.17 113.70 107.34 2doe s SER 781 Ca 0.27 0.53 -0.14 0.00 0.48 0.00 0.00 55.95 57.09 2doe s SER 781 Cb -0.09 0.87 -0.04 0.00 0.10 0.00 0.00 66.02 66.85 2doe s SER 781 CO 0.18 -0.09 1.03 -0.55 0.98 0.00 0.00 173.24 174.79 2doe s SER 782 N 0.75 6.10 0.00 7.02 0.15 -1.26 -4.90 113.70 121.56 2doe s SER 782 Ca -0.03 1.62 0.00 0.00 0.70 0.00 0.00 55.95 58.24 2doe s SER 782 Cb -0.04 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2doe s SER 782 CO -0.12 -0.95 0.00 0.61 1.20 0.00 0.00 173.24 173.98 2doe n GLY 783 N -1.71 0.80 3.13 9.45 0.00 -1.26 -4.70 105.19 110.91 2doe n GLY 783 Ca 0.07 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.60 2doe n GLY 783 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2doe s GLU 784 N 0.00 0.26 -0.15 1.61 -1.05 -1.26 -5.15 118.70 112.96 2doe s GLU 784 Ca 0.00 0.72 -0.03 0.00 -0.15 0.00 0.00 54.97 55.50 2doe s GLU 784 Cb 0.00 -0.02 -0.02 0.00 -0.44 0.00 0.00 34.13 33.65 2doe s GLU 784 CO 0.00 -0.20 -0.05 0.15 0.95 0.00 0.00 175.26 176.11 2doe s LYS 785 N 1.71 3.61 -1.00 -4.83 3.01 -1.26 -5.05 119.74 115.93 2doe s LYS 785 Ca -0.06 -0.55 -0.03 0.00 -1.01 0.00 0.00 55.97 54.31 2doe s LYS 785 Cb -0.10 -2.87 0.28 0.00 -1.01 0.00 0.00 37.83 34.12 2doe s LYS 785 CO -0.10 0.21 1.17 -0.85 0.51 0.00 0.00 175.35 176.29 2doe n GLU 786 N 3.61 3.65 -3.84 1.68 0.28 -1.26 -4.91 120.64 119.86 2doe n GLU 786 Ca -0.18 -4.54 -0.21 0.00 -0.16 0.00 0.00 57.16 52.08 2doe n GLU 786 Cb 0.52 -2.47 -0.02 0.00 1.43 0.00 0.00 31.44 30.90 2doe n GLU 786 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2doe s ASP 787 N -0.82 5.83 -0.00 -1.84 1.01 -1.26 -5.04 116.67 114.55 2doe s ASP 787 Ca 0.32 -0.19 -0.23 0.00 0.71 0.00 0.00 52.55 53.16 2doe s ASP 787 Cb 0.00 -1.40 -0.19 0.00 1.01 0.00 0.00 42.92 42.34 2doe s ASP 787 CO 0.00 -0.22 1.21 0.28 0.21 0.00 0.00 175.17 176.65 2doe h SER 788 N 1.19 0.27 -0.98 0.27 0.02 -2.02 -3.26 113.55 109.03 2doe h SER 788 Ca -0.48 -0.60 0.24 0.00 -0.84 0.00 0.00 61.79 60.11 2doe h SER 788 Cb 1.24 -0.08 -0.18 0.00 0.14 0.00 0.00 62.40 63.52 2doe h SER 788 CO 0.58 0.82 -0.09 0.29 -1.14 0.00 0.00 176.83 177.29 2doe n LYS 789 N -4.57 -0.08 -3.66 3.45 4.01 -1.26 -4.04 118.16 112.00 2doe n LYS 789 Ca -0.08 1.50 -0.24 0.00 -0.51 0.00 0.00 58.31 58.98 2doe n LYS 789 Cb 0.41 -2.32 -0.17 0.00 -0.51 0.00 0.00 35.03 32.44 2doe n LYS 789 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 2doe s THR 790 N -6.09 0.04 -0.38 -0.18 -1.32 -1.23 -5.02 115.64 101.46 2doe s THR 790 Ca -0.14 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.40 2doe s THR 790 Cb 0.28 -0.50 0.45 0.00 -1.51 0.00 0.00 72.50 71.22 2doe s THR 790 CO 0.77 -0.06 1.31 -2.11 -2.21 0.00 0.00 174.62 172.32 2doe n ARG 791 N 5.24 3.44 -0.06 7.08 1.85 -1.25 -4.08 116.66 128.88 2doe n ARG 791 Ca -0.06 -4.09 -0.14 0.00 -1.00 0.00 0.00 57.85 52.56 2doe n ARG 791 Cb 0.49 -2.28 -0.02 0.00 -1.05 0.00 0.00 32.46 29.60 2doe n ARG 791 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 2doe h GLY 792 N 2.24 0.90 -0.44 2.89 0.00 -1.94 -3.21 103.07 103.50 2doe h GLY 792 Ca 0.40 -1.04 0.04 0.00 0.00 0.00 0.00 47.33 46.72 2doe h GLY 792 CO 0.90 0.94 -0.31 0.83 0.00 0.00 0.00 176.54 178.91 2doe h GLU 793 N 0.63 -0.05 -0.86 4.80 3.07 -1.91 0.42 114.58 120.68 2doe h GLU 793 Ca 0.01 0.00 0.13 0.00 -0.50 0.00 0.00 59.36 59.00 2doe h GLU 793 Cb 1.14 0.01 -0.09 0.00 -0.84 0.00 0.00 28.75 28.98 2doe h GLU 793 CO 0.12 -0.04 0.48 1.57 -1.40 0.00 0.00 179.01 179.74 2doe h LYS 794 N -0.06 0.71 -0.96 2.33 2.10 -1.96 -0.42 116.57 118.31 2doe h LYS 794 Ca 0.07 -0.04 0.03 0.00 -2.00 0.00 0.00 60.65 58.71 2doe h LYS 794 Cb 0.24 -0.16 -0.05 0.00 -0.90 0.00 0.00 32.23 31.36 2doe h LYS 794 CO -0.45 0.47 0.63 0.82 -2.00 0.00 0.00 179.45 178.92 2doe h ILE 795 N 0.73 1.17 -0.08 0.07 2.04 -0.70 -1.89 117.51 118.85 2doe h ILE 795 Ca 0.45 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.88 2doe h ILE 795 Cb 0.53 -0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.46 2doe h ILE 795 CO -0.31 0.22 0.02 0.50 0.00 0.00 0.00 178.15 178.59 2doe h LYS 796 N 1.22 0.13 -0.28 2.37 3.64 0.14 -2.15 116.57 121.64 2doe h LYS 796 Ca 0.38 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.78 2doe h LYS 796 Cb -0.00 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 2doe h LYS 796 CO -0.11 0.30 -0.01 1.03 -2.27 0.00 0.00 179.45 178.39 2doe h SER 797 N -0.06 -0.13 -0.56 4.20 0.87 -1.03 -2.12 113.55 114.72 2doe h SER 797 Ca 0.03 0.07 0.06 0.00 -1.23 0.00 0.00 61.79 60.71 2doe h SER 797 Cb 0.22 0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.25 2doe h SER 797 CO -0.00 -0.03 0.27 0.44 -0.53 0.00 0.00 176.83 176.98 2doe h ASP 798 N 0.07 0.37 0.23 6.23 3.32 -1.29 -1.71 116.42 123.64 2doe h ASP 798 Ca 0.13 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.23 2doe h ASP 798 Cb 0.18 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.67 2doe h ASP 798 CO -0.23 0.24 -0.50 0.15 -1.72 0.00 0.00 179.24 177.18 2doe h PHE 799 N 0.51 -1.43 -0.17 4.55 3.57 -0.75 -2.06 116.94 121.17 2doe h PHE 799 Ca 0.26 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.84 2doe h PHE 799 Cb 0.20 0.59 -0.06 0.00 2.79 0.00 0.00 35.95 39.47 2doe h PHE 799 CO -0.11 -0.61 -0.26 0.74 -2.23 0.00 0.00 178.31 175.84 2doe h PHE 800 N -0.81 -0.69 -0.77 0.41 0.04 -1.21 -2.22 116.94 111.68 2doe h PHE 800 Ca -0.02 0.03 0.10 0.00 2.80 0.00 0.00 57.97 60.89 2doe h PHE 800 Cb 0.78 0.33 -0.12 0.00 2.20 0.00 0.00 35.95 39.14 2doe h PHE 800 CO -0.38 -0.34 -0.46 0.93 -0.60 0.00 0.00 178.31 177.46 2doe h GLU 801 N -0.31 -0.12 0.13 1.51 5.08 -1.02 0.71 114.58 120.56 2doe h GLU 801 Ca 0.11 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2doe h GLU 801 Cb 0.48 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2doe h GLU 801 CO -0.34 -0.08 -0.20 1.25 -1.00 0.00 0.00 179.01 178.64 2doe h LEU 802 N -0.12 -0.56 -0.85 1.33 5.85 -0.90 0.14 115.31 120.19 2doe h LEU 802 Ca 0.22 0.05 0.08 0.00 0.84 0.00 0.00 57.88 59.07 2doe h LEU 802 Cb 0.54 0.19 -0.11 0.00 0.37 0.00 0.00 40.66 41.66 2doe h LEU 802 CO -0.82 -0.24 -0.56 -0.07 -0.34 0.00 0.00 178.44 176.42 2doe h LEU 803 N -0.34 -2.03 -0.79 2.25 3.38 -0.83 0.35 115.31 117.30 2doe h LEU 803 Ca -0.02 0.30 0.14 0.00 0.09 0.00 0.00 57.88 58.39 2doe h LEU 803 Cb 0.31 0.89 -0.09 0.00 0.09 0.00 0.00 40.66 41.86 2doe h LEU 803 CO -0.06 -0.25 0.37 0.77 0.09 0.00 0.00 178.44 179.36 2doe h SER 804 N -0.07 0.41 -0.21 -0.43 4.64 -0.76 0.27 113.55 117.41 2doe h SER 804 Ca 0.14 0.10 0.06 0.00 -0.47 0.00 0.00 61.79 61.61 2doe h SER 804 Cb 0.42 0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 2doe h SER 804 CO -0.84 0.18 0.19 0.78 -0.87 0.00 0.00 176.83 176.27 2doe h ASN 805 N 0.54 0.00 -0.18 4.97 2.35 0.26 -0.76 115.58 122.76 2doe h ASN 805 Ca 0.43 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 56.08 2doe h ASN 805 Cb 0.61 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.92 2doe h ASN 805 CO -0.37 0.00 0.12 1.41 -1.65 0.00 0.00 177.43 176.94 2doe n HIS 806 N -4.04 0.55 -3.87 1.19 8.25 0.96 -4.85 115.22 113.42 2doe n HIS 806 Ca 0.02 -0.78 -0.27 0.00 -0.26 0.00 0.00 57.72 56.43 2doe n HIS 806 Cb 0.32 -0.39 -0.03 0.00 1.12 0.00 0.00 29.99 31.01 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 0.26 -0.90 -1.34 4.41 8.25 -0.29 -4.73 115.22 120.88 2doe n HIS 807 Ca 0.11 0.23 -0.40 0.00 -0.26 0.00 0.00 57.72 57.40 2doe n HIS 807 Cb 0.70 -1.92 0.01 0.00 1.12 0.00 0.00 29.99 29.91 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 -3.65 -2.04 -4.16 2.41 4.77 -1.25 -4.99 117.00 108.08 2doe n LEU 808 Ca -0.15 0.75 -0.15 0.00 -0.03 0.00 0.00 56.01 56.43 2doe n LEU 808 Cb 0.44 -0.96 -0.11 0.00 -2.33 0.00 0.00 43.42 40.45 2doe n LEU 808 CO 0.55 -4.02 -0.42 -1.81 -1.33 0.00 0.00 177.39 170.36 2doe s ASP 809 N -1.03 1.40 0.36 -1.43 1.01 -1.26 -5.03 116.67 110.70 2doe s ASP 809 Ca 0.61 -0.74 0.15 0.00 0.71 0.00 0.00 52.55 53.28 2doe s ASP 809 Cb -0.54 0.00 1.04 0.00 1.01 0.00 0.00 42.92 44.44 2doe s ASP 809 CO 0.62 -0.22 1.73 0.77 0.21 0.00 0.00 175.17 178.27 2doe h SER 810 N 3.82 0.53 -0.21 0.27 4.64 -1.93 0.90 113.55 121.58 2doe h SER 810 Ca -0.38 0.12 -0.09 0.00 -0.47 0.00 0.00 61.79 60.98 2doe h SER 810 Cb 1.19 0.05 -0.05 0.00 -0.31 0.00 0.00 62.40 63.28 2doe h SER 810 CO 0.49 0.04 0.11 0.00 -0.87 0.00 0.00 176.83 176.60 2doe n GLN 811 N -4.79 1.49 -2.04 4.77 6.02 -1.26 -4.91 117.38 116.66 2doe n GLN 811 Ca 0.28 -0.73 -0.41 0.00 -0.01 0.00 0.00 57.00 56.13 2doe n GLN 811 Cb 0.88 -1.40 -0.02 0.00 1.02 0.00 0.00 30.24 30.72 2doe n GLN 811 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2doe s SER 812 N 0.26 6.68 -0.14 1.08 0.01 0.31 -5.02 113.70 116.88 2doe s SER 812 Ca 0.13 2.74 0.00 0.00 1.31 0.00 0.00 55.95 60.13 2doe s SER 812 Cb 0.11 -2.65 0.02 0.00 0.21 0.00 0.00 66.02 63.72 2doe s SER 812 CO 0.03 -0.63 -0.13 -0.13 0.41 0.00 0.00 173.24 172.79 2doe s ARG 813 N -1.47 2.19 0.23 12.44 3.00 -1.26 -5.02 118.95 129.05 2doe s ARG 813 Ca 0.52 -0.52 -0.13 0.00 0.00 0.00 0.00 55.73 55.60 2doe s ARG 813 Cb -0.41 -2.00 0.28 0.00 0.00 0.00 0.00 34.95 32.82 2doe s ARG 813 CO 0.52 -0.21 1.59 2.35 0.00 0.00 0.00 175.30 179.55 2doe h TRP 814 N 7.96 -0.56 -0.99 -0.53 -0.00 -1.98 0.52 115.95 120.37 2doe h TRP 814 Ca -0.36 0.07 0.20 0.00 -0.00 0.00 0.00 58.89 58.81 2doe h TRP 814 Cb 1.14 0.36 -0.11 0.00 -0.00 0.00 0.00 29.16 30.55 2doe h TRP 814 CO 0.47 -0.35 0.58 0.66 -0.00 0.00 0.00 178.44 179.80 2doe h SER 815 N -0.03 0.71 0.29 2.65 4.64 -1.98 0.41 113.55 120.23 2doe h SER 815 Ca 0.35 0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.77 2doe h SER 815 Cb 0.57 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 2doe h SER 815 CO -0.80 0.20 -0.14 0.11 -0.87 0.00 0.00 176.83 175.34 2doe h LYS 816 N 0.68 -0.38 -1.02 4.77 1.79 -0.51 -2.14 116.57 119.77 2doe h LYS 816 Ca 0.59 0.03 0.27 0.00 -2.18 0.00 0.00 60.65 59.36 2doe h LYS 816 Cb 0.99 0.09 -0.07 0.00 -1.58 0.00 0.00 32.23 31.66 2doe h LYS 816 CO -0.42 -0.25 0.69 -0.24 -1.08 0.00 0.00 179.45 178.15 2doe h VAL 817 N -1.00 0.53 -0.10 0.50 3.04 -0.57 0.97 116.25 119.62 2doe h VAL 817 Ca -0.04 -0.08 -0.11 0.00 -1.01 0.00 0.00 66.70 65.47 2doe h VAL 817 Cb 0.30 0.29 0.00 0.00 -2.01 0.00 0.00 31.29 29.87 2doe h VAL 817 CO 0.07 0.04 -0.35 0.50 -1.01 0.00 0.00 177.57 176.82 2doe h LYS 818 N 0.22 0.41 0.00 4.17 3.64 -0.25 0.24 116.57 125.01 2doe h LYS 818 Ca 0.53 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2doe h LYS 818 Cb 1.66 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.54 2doe h LYS 818 CO -0.15 0.94 0.00 -3.47 -2.27 0.00 0.00 179.45 174.50 2doe n ASP 819 N -4.38 0.64 -0.12 4.20 2.03 0.16 -0.20 116.55 118.88 2doe n ASP 819 Ca -0.08 0.68 -0.18 0.00 0.52 0.00 0.00 54.79 55.73 2doe n ASP 819 Cb 0.51 -0.81 -0.12 0.00 -0.72 0.00 0.00 41.12 39.98 2doe n ASP 819 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2doe n LYS 820 N -2.24 0.66 0.10 -0.67 4.76 -0.15 -4.44 118.16 116.17 2doe n LYS 820 Ca 0.01 0.16 -0.04 0.00 -2.87 0.00 0.00 58.31 55.57 2doe n LYS 820 Cb 0.19 -1.53 0.01 0.00 -1.84 0.00 0.00 35.03 31.86 2doe n LYS 820 CO 0.00 0.00 0.00 -0.39 -1.37 0.00 0.00 177.40 175.64 2doe h VAL 821 N -0.01 1.54 -0.89 -0.18 -1.51 -0.36 -3.28 116.25 111.57 2doe h VAL 821 Ca -0.57 -2.81 0.23 0.00 -1.23 0.00 0.00 66.70 62.31 2doe h VAL 821 Cb 1.91 2.53 -0.13 0.00 -2.13 0.00 0.00 31.29 33.47 2doe h VAL 821 CO -0.08 0.79 0.35 1.05 -1.23 0.00 0.00 177.57 178.45 2doe h GLU 822 N 0.00 0.31 -0.59 5.19 -0.00 -0.79 0.70 114.58 119.40 2doe h GLU 822 Ca -0.01 -0.02 0.17 0.00 -0.00 0.00 0.00 59.36 59.50 2doe h GLU 822 Cb 1.47 -0.07 -0.02 0.00 -0.00 0.00 0.00 28.75 30.12 2doe h GLU 822 CO 0.11 0.21 0.42 1.03 -0.00 0.00 0.00 179.01 180.78 2doe h SER 823 N 0.32 0.02 -3.53 3.06 0.87 -1.80 -3.41 113.55 109.08 2doe h SER 823 Ca 0.57 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 60.60 2doe h SER 823 Cb 1.12 -0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.04 2doe h SER 823 CO -0.58 0.01 0.19 -0.62 -0.53 0.00 0.00 176.83 175.30 2doe s ASP 824 N -6.13 7.40 0.45 6.23 2.15 0.24 -4.96 116.67 122.05 2doe s ASP 824 Ca -0.05 1.66 0.23 0.00 0.43 0.00 0.00 52.55 54.82 2doe s ASP 824 Cb 0.20 -2.50 1.00 0.00 -0.30 0.00 0.00 42.92 41.32 2doe s ASP 824 CO 0.74 0.21 1.87 1.55 -0.17 0.00 0.00 175.17 179.37 2doe h PRO 825 N 4.31 0.00 -1.00 4.34 0.13 -1.81 -3.07 132.00 134.89 2doe h PRO 825 Ca -0.47 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.69 2doe h PRO 825 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 2doe h PRO 825 CO 0.66 0.23 0.66 0.00 -0.23 0.00 0.00 178.00 179.32 2doe h ARG 826 N 0.00 1.26 0.00 0.86 3.08 -1.93 -1.05 114.38 116.61 2doe h ARG 826 Ca -0.00 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 2doe h ARG 826 Cb 0.67 -0.29 -0.00 0.00 0.08 0.00 0.00 29.97 30.43 2doe h ARG 826 CO 0.03 0.84 -0.09 -0.92 -1.07 0.00 0.00 179.97 178.76 2doe h TYR 827 N 1.30 0.00 0.00 3.04 5.03 -1.77 -0.92 116.97 123.65 2doe h TYR 827 Ca 0.38 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.65 2doe h TYR 827 Cb -0.06 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.21 2doe h TYR 827 CO -0.00 0.09 -0.20 0.87 -1.32 0.00 0.00 178.16 177.59 2doe h LYS 828 N 0.00 0.00 -0.48 1.82 1.57 -1.32 -3.18 116.57 114.99 2doe h LYS 828 Ca -0.00 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.82 2doe h LYS 828 Cb 0.18 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 2doe h LYS 828 CO 0.01 0.20 0.22 0.00 -0.57 0.00 0.00 179.45 179.32 2doe h ALA 829 N 1.80 0.60 -2.06 3.86 0.00 -1.06 -3.39 119.26 119.00 2doe h ALA 829 Ca -0.00 0.03 -0.56 0.00 0.00 0.00 0.00 54.91 54.37 2doe h ALA 829 Cb 0.80 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2doe h ALA 829 CO 0.03 -0.14 1.07 0.08 0.00 0.00 0.00 179.25 180.29 2doe s VAL 830 N -6.14 3.83 -0.16 0.00 1.01 -1.20 -4.88 120.40 112.86 2doe s VAL 830 Ca -0.13 0.95 -0.07 0.00 0.00 0.00 0.00 61.98 62.73 2doe s VAL 830 Cb 0.13 -3.79 -0.23 0.00 0.00 0.00 0.00 36.38 32.49 2doe s VAL 830 CO 0.73 -0.28 0.23 0.47 0.00 0.00 0.00 175.10 176.24 2doe n ASP 831 N 7.96 2.07 -4.68 3.32 8.00 -1.26 -4.87 116.55 127.09 2doe n ASP 831 Ca 0.17 0.18 -0.42 0.00 0.71 0.00 0.00 54.79 55.43 2doe n ASP 831 Cb 0.45 -0.80 -0.03 0.00 -0.02 0.00 0.00 41.12 40.73 2doe n ASP 831 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2doe s SER 832 N -6.95 6.96 0.04 -2.24 0.15 -1.26 -4.93 113.70 105.47 2doe s SER 832 Ca -0.26 1.86 -0.23 0.00 0.70 0.00 0.00 55.95 58.02 2doe s SER 832 Cb 0.07 -2.55 -0.15 0.00 -1.71 0.00 0.00 66.02 61.68 2doe s SER 832 CO 0.71 -0.68 1.47 0.28 1.20 0.00 0.00 173.24 176.23 2doe h SER 833 N 7.84 0.14 -0.93 5.45 0.02 -2.01 -3.06 113.55 121.01 2doe h SER 833 Ca -0.33 -0.30 0.27 0.00 -0.84 0.00 0.00 61.79 60.59 2doe h SER 833 Cb 1.15 -0.04 -0.16 0.00 0.14 0.00 0.00 62.40 63.49 2doe h SER 833 CO 0.91 0.41 0.23 0.28 -1.14 0.00 0.00 176.83 177.53 2doe h SER 834 N -0.13 -0.07 -0.82 3.07 0.02 -2.00 0.93 113.55 114.56 2doe h SER 834 Ca 0.02 0.23 0.01 0.00 -0.84 0.00 0.00 61.79 61.21 2doe h SER 834 Cb 0.34 0.32 -0.04 0.00 0.14 0.00 0.00 62.40 63.16 2doe h SER 834 CO 0.00 -0.25 0.53 0.24 -1.14 0.00 0.00 176.83 176.22 2doe h MET 835 N 0.13 1.08 0.44 3.45 2.07 -1.95 0.10 114.93 120.26 2doe h MET 835 Ca 0.61 -0.07 -0.02 0.00 -2.07 0.00 0.00 59.70 58.15 2doe h MET 835 Cb 1.31 -0.24 0.00 0.00 -1.87 0.00 0.00 31.60 30.80 2doe h MET 835 CO -0.74 0.73 -0.21 0.00 1.07 0.00 0.00 176.91 177.76 2doe h ARG 836 N 1.11 -0.56 -0.30 1.72 3.08 0.86 0.21 114.38 120.50 2doe h ARG 836 Ca 0.30 0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.45 2doe h ARG 836 Cb -0.11 0.13 -0.06 0.00 0.08 0.00 0.00 29.97 30.01 2doe h ARG 836 CO -0.06 -0.38 -0.08 0.93 -1.07 0.00 0.00 179.97 179.32 2doe h GLU 837 N -0.71 -0.00 0.80 0.04 5.08 -1.34 0.29 114.58 118.74 2doe h GLU 837 Ca -0.06 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 2doe h GLU 837 Cb 0.45 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 2doe h GLU 837 CO 0.10 -0.00 -0.48 0.22 -1.00 0.00 0.00 179.01 177.84 2doe h ASP 838 N -0.00 -1.22 0.32 1.42 1.82 -0.85 0.28 116.42 118.18 2doe h ASP 838 Ca 0.15 0.07 -0.00 0.00 -0.39 0.00 0.00 57.03 56.85 2doe h ASP 838 Cb 0.22 0.35 -0.03 0.00 0.68 0.00 0.00 39.33 40.55 2doe h ASP 838 CO -0.31 -0.75 -0.51 -0.07 -1.61 0.00 0.00 179.24 175.99 2doe h LEU 839 N -1.20 -1.46 -0.33 2.28 3.38 -0.37 0.32 115.31 117.92 2doe h LEU 839 Ca -0.11 0.14 0.07 0.00 0.09 0.00 0.00 57.88 58.07 2doe h LEU 839 Cb 0.96 0.51 -0.08 0.00 0.09 0.00 0.00 40.66 42.14 2doe h LEU 839 CO 0.11 -0.61 -0.22 0.15 0.09 0.00 0.00 178.44 177.97 2doe h PHE 840 N -0.87 -0.56 -0.82 1.13 3.57 -0.44 -0.80 116.94 118.15 2doe h PHE 840 Ca -0.04 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.58 2doe h PHE 840 Cb 0.81 0.30 -0.06 0.00 2.79 0.00 0.00 35.95 39.78 2doe h PHE 840 CO -0.35 -0.29 0.49 0.87 -2.23 0.00 0.00 178.31 176.80 2doe h LYS 841 N -0.18 0.85 0.42 1.11 1.57 -0.13 -1.91 116.57 118.30 2doe h LYS 841 Ca 0.17 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 2doe h LYS 841 Cb 0.44 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 2doe h LYS 841 CO -0.44 0.56 -0.47 1.96 -0.57 0.00 0.00 179.45 180.49 2doe h GLN 842 N 0.87 -0.88 0.08 3.15 4.20 0.10 0.28 115.11 122.92 2doe h GLN 842 Ca 0.37 0.06 0.02 0.00 0.06 0.00 0.00 58.65 59.16 2doe h GLN 842 Cb 0.23 0.20 -0.05 0.00 0.30 0.00 0.00 27.48 28.16 2doe h GLN 842 CO -0.20 -0.59 -0.41 -0.92 -0.67 0.00 0.00 178.83 176.05 2doe h TYR 843 N -0.91 -1.14 -0.72 2.96 5.03 -1.09 -1.89 116.97 119.21 2doe h TYR 843 Ca -0.04 0.03 0.12 0.00 2.58 0.00 0.00 58.73 61.42 2doe h TYR 843 Cb 0.81 0.49 -0.09 0.00 1.55 0.00 0.00 36.73 39.50 2doe h TYR 843 CO -0.26 -0.50 0.30 0.82 -1.32 0.00 0.00 178.16 177.20 2doe h ILE 844 N -0.61 0.73 -0.72 1.81 1.08 -1.23 -0.97 117.51 117.59 2doe h ILE 844 Ca 0.03 -0.17 0.12 0.00 -0.39 0.00 0.00 64.86 64.46 2doe h ILE 844 Cb 0.66 0.20 -0.09 0.00 -3.07 0.00 0.00 36.82 34.53 2doe h ILE 844 CO -0.26 0.09 0.30 -0.08 -0.69 0.00 0.00 178.15 177.50 2doe h GLU 845 N 0.48 0.46 -0.32 2.37 4.81 0.31 -1.33 114.58 121.37 2doe h GLU 845 Ca 0.38 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.57 2doe h GLU 845 Cb 0.52 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2doe h GLU 845 CO -0.35 0.30 0.15 -0.22 -0.73 0.00 0.00 179.01 178.16 2doe h LYS 846 N 0.47 0.46 0.30 1.92 3.64 -0.51 -2.66 116.57 120.20 2doe h LYS 846 Ca 0.38 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.68 2doe h LYS 846 Cb 0.52 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 2doe h LYS 846 CO -0.35 0.43 -0.27 0.82 -2.27 0.00 0.00 179.45 177.80 2doe h ILE 847 N 0.38 0.00 -0.90 2.00 2.04 -0.73 -2.97 117.51 117.32 2doe h ILE 847 Ca 0.11 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.12 2doe h ILE 847 Cb 0.12 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.05 2doe h ILE 847 CO -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 178.15 177.78 2doe h ALA 848 N -1.34 0.17 -2.33 1.87 0.00 -1.32 -3.39 119.26 112.93 2doe h ALA 848 Ca -0.04 0.26 -0.50 0.00 0.00 0.00 0.00 54.91 54.63 2doe h ALA 848 Cb 0.48 0.92 0.13 0.00 0.00 0.00 0.00 17.79 19.33 2doe h ALA 848 CO -0.02 -0.61 0.30 -1.59 0.00 0.00 0.00 179.25 177.34 2doe s LYS 849 N -6.00 1.97 -0.48 0.00 -2.85 -1.01 -4.81 119.74 106.56 2doe s LYS 849 Ca -0.14 1.03 -0.43 0.00 -1.00 0.00 0.00 55.97 55.44 2doe s LYS 849 Cb 0.20 -1.87 -0.18 0.00 -2.06 0.00 0.00 37.83 33.91 2doe s LYS 849 CO 0.72 -1.81 1.96 0.09 0.10 0.00 0.00 175.35 176.41 2doe n ASN 850 N -3.62 0.80 -4.77 0.03 4.13 -1.26 -4.83 115.26 105.74 2doe n ASN 850 Ca 0.08 0.74 -0.39 0.00 1.68 0.00 0.00 54.58 56.69 2doe n ASN 850 Cb 0.54 -0.86 -0.00 0.00 -1.54 0.00 0.00 39.78 37.92 2doe n ASN 850 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2doe s LEU 851 N 5.25 4.17 -0.83 3.41 1.02 -1.26 -4.89 118.68 125.54 2doe s LEU 851 Ca 1.12 2.66 -0.25 0.00 0.02 0.00 0.00 54.13 57.68 2doe s LEU 851 Cb -1.44 -3.95 -0.04 0.00 0.02 0.00 0.00 46.19 40.79 2doe s LEU 851 CO 0.66 -0.92 1.90 -1.81 0.02 0.00 0.00 176.35 176.19 2doe s ASP 852 N -0.77 5.24 -0.28 2.29 1.11 -1.26 -4.93 116.67 118.07 2doe s ASP 852 Ca 0.58 -0.46 -0.03 0.00 0.18 0.00 0.00 52.55 52.83 2doe s ASP 852 Cb -0.38 -2.55 0.03 0.00 1.07 0.00 0.00 42.92 41.09 2doe s ASP 852 CO 0.48 -2.59 -0.00 -0.55 1.18 0.00 0.00 175.17 173.69 2doe s SER 853 N 7.86 4.73 -0.25 0.27 0.15 -1.26 -5.07 113.70 120.14 2doe s SER 853 Ca 0.68 -1.00 -0.25 0.00 0.70 0.00 0.00 55.95 56.08 2doe s SER 853 Cb -0.08 -1.73 0.07 0.00 -1.71 0.00 0.00 66.02 62.57 2doe s SER 853 CO 0.04 -0.20 0.70 -0.55 1.20 0.00 0.00 173.24 174.43 2doe s SER 854 N 1.34 -0.73 0.00 5.45 0.15 -1.26 -5.10 113.70 113.55 2doe s SER 854 Ca -0.01 1.36 0.00 0.00 0.70 0.00 0.00 55.95 58.00 2doe s SER 854 Cb -0.18 1.37 0.00 0.00 -1.71 0.00 0.00 66.02 65.50 2doe s SER 854 CO -0.01 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.76 2doe n GLY 855 N 2.56 -1.50 0.00 9.45 0.00 -1.26 -4.25 105.19 110.19 2doe n GLY 855 Ca -0.14 -1.86 0.06 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.33 1.61 -0.04 -1.26 -3.87 135.00 131.60 2doe n PRO 856 Ca 0.00 0.00 0.26 0.00 -0.04 0.00 0.00 63.50 63.72 2doe n PRO 856 Cb 0.00 -1.36 0.50 0.00 -0.04 0.00 0.00 33.50 32.59 2doe n PRO 856 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2doe h SER 857 N 0.00 0.23 -3.21 3.54 0.87 -2.00 -3.36 113.55 109.62 2doe h SER 857 Ca 0.00 0.24 -0.58 0.00 -1.23 0.00 0.00 61.79 60.22 2doe h SER 857 Cb 0.00 0.27 -0.06 0.00 -0.44 0.00 0.00 62.40 62.17 2doe h SER 857 CO 0.00 -0.33 -0.12 -0.44 -0.53 0.00 0.00 176.83 175.41 2doe s SER 858 N -4.73 6.84 0.00 6.23 0.01 -1.25 -5.10 113.70 115.70 2doe s SER 858 Ca -0.10 1.00 0.00 0.00 1.31 0.00 0.00 55.95 58.16 2doe s SER 858 Cb 0.32 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 64.25 2doe s SER 858 CO 0.78 0.17 0.40 0.61 0.41 0.00 0.00 173.24 175.61