#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 5.18 -0.12 1.61 1.04 -1.26 -5.05 113.70 115.10 2doe s SER 778 Ca 0.00 -0.13 -0.23 0.00 0.48 0.00 0.00 55.95 56.07 2doe s SER 778 Cb 0.00 -1.28 -0.20 0.00 0.10 0.00 0.00 66.02 64.64 2doe s SER 778 CO 0.00 0.17 0.64 0.77 0.98 0.00 0.00 173.24 175.81 2doe h SER 779 N 3.39 -0.01 0.00 7.02 4.64 -2.09 -3.50 113.55 123.00 2doe h SER 779 Ca -0.47 -0.75 0.00 0.00 -0.47 0.00 0.00 61.79 60.09 2doe h SER 779 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2doe h SER 779 CO 0.62 0.85 0.00 0.61 -0.87 0.00 0.00 176.83 178.04 2doe n GLY 780 N 1.54 -2.13 2.70 -0.77 0.00 -1.26 -5.08 105.19 100.19 2doe n GLY 780 Ca -0.08 0.71 -0.29 0.00 0.00 0.00 0.00 46.02 46.36 2doe n GLY 780 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2doe s SER 781 N 2.00 3.54 0.64 1.61 1.04 -1.26 -5.12 113.70 116.16 2doe s SER 781 Ca 0.00 -2.88 -0.11 0.00 0.48 0.00 0.00 55.95 53.44 2doe s SER 781 Cb 0.00 -1.06 -0.03 0.00 0.10 0.00 0.00 66.02 65.04 2doe s SER 781 CO 0.00 -0.23 1.04 -0.44 0.98 0.00 0.00 173.24 174.60 2doe s SER 782 N 0.03 6.03 -0.05 7.02 0.01 -1.26 -4.76 113.70 120.72 2doe s SER 782 Ca 0.21 1.33 -0.04 0.00 1.31 0.00 0.00 55.95 58.76 2doe s SER 782 Cb -0.18 -2.32 0.01 0.00 0.21 0.00 0.00 66.02 63.75 2doe s SER 782 CO -0.05 -0.98 0.08 0.61 0.41 0.00 0.00 173.24 173.30 2doe n GLY 783 N -2.81 -4.75 0.09 3.44 0.00 -1.26 -5.00 105.19 94.91 2doe n GLY 783 Ca 0.06 0.60 -0.13 0.00 0.00 0.00 0.00 46.02 46.55 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 1.88 0.52 -2.98 1.61 1.02 -1.26 -4.99 120.64 116.43 2doe n GLU 784 Ca -0.13 0.39 -0.24 0.00 -0.02 0.00 0.00 57.16 57.17 2doe n GLU 784 Cb 0.20 -1.59 0.01 0.00 -0.02 0.00 0.00 31.44 30.04 2doe n GLU 784 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2doe s LYS 785 N -2.52 3.14 -0.10 3.49 1.02 -1.26 -4.98 119.74 118.53 2doe s LYS 785 Ca -0.26 -0.39 0.05 0.00 0.02 0.00 0.00 55.97 55.39 2doe s LYS 785 Cb 0.05 -2.54 0.30 0.00 -0.52 0.00 0.00 37.83 35.12 2doe s LYS 785 CO 0.39 -0.23 1.03 -0.85 -0.92 0.00 0.00 175.35 174.76 2doe n GLU 786 N -2.08 2.31 -1.13 1.68 0.00 -1.26 -4.97 120.64 115.19 2doe n GLU 786 Ca 0.01 -1.17 -0.38 0.00 0.00 0.00 0.00 57.16 55.61 2doe n GLU 786 Cb 0.57 -1.73 -0.02 0.00 0.00 0.00 0.00 31.44 30.26 2doe n GLU 786 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2doe n ASP 787 N 0.18 -1.24 -0.04 -1.84 -0.08 -1.26 -4.91 116.55 107.35 2doe n ASP 787 Ca 0.12 0.88 -0.07 0.00 -1.51 0.00 0.00 54.79 54.21 2doe n ASP 787 Cb 0.66 -0.77 -0.04 0.00 2.34 0.00 0.00 41.12 43.32 2doe n ASP 787 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2doe n SER 788 N 1.68 2.34 -0.27 1.67 7.64 -1.26 -4.68 113.62 120.74 2doe n SER 788 Ca 0.14 0.01 0.10 0.00 1.01 0.00 0.00 58.87 60.13 2doe n SER 788 Cb 0.22 -0.18 0.19 0.00 -1.01 0.00 0.00 64.21 63.44 2doe n SER 788 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2doe n LYS 789 N -2.98 -0.06 -3.66 1.43 4.76 -1.26 -3.88 118.16 112.51 2doe n LYS 789 Ca -0.15 1.15 -0.24 0.00 -2.87 0.00 0.00 58.31 56.20 2doe n LYS 789 Cb 0.64 -1.80 -0.17 0.00 -1.84 0.00 0.00 35.03 31.86 2doe n LYS 789 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2doe s THR 790 N -5.75 -0.01 -0.48 -0.18 -1.32 -1.26 -5.02 115.64 101.61 2doe s THR 790 Ca -0.10 0.06 0.03 0.00 -1.21 0.00 0.00 61.69 60.47 2doe s THR 790 Cb 0.22 -0.44 0.44 0.00 -1.51 0.00 0.00 72.50 71.20 2doe s THR 790 CO 0.59 -0.05 1.48 -2.11 -2.21 0.00 0.00 174.62 172.32 2doe n ARG 791 N 5.26 3.25 -0.35 7.08 1.85 -1.25 -4.87 116.66 127.63 2doe n ARG 791 Ca -0.06 -3.95 -0.09 0.00 -1.00 0.00 0.00 57.85 52.75 2doe n ARG 791 Cb 0.49 -2.27 -0.08 0.00 -1.05 0.00 0.00 32.46 29.55 2doe n ARG 791 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2doe n GLY 792 N -0.69 -2.46 0.38 2.89 0.00 -1.26 -0.90 105.19 103.15 2doe n GLY 792 Ca 0.49 1.04 -0.09 0.00 0.00 0.00 0.00 46.02 47.46 2doe n GLY 792 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2doe n GLU 793 N -4.91 -0.37 -0.01 1.61 4.07 -1.26 -0.89 120.64 118.87 2doe n GLU 793 Ca 0.02 1.40 -0.15 0.00 -0.06 0.00 0.00 57.16 58.37 2doe n GLU 793 Cb 0.21 -2.06 -0.10 0.00 -0.06 0.00 0.00 31.44 29.44 2doe n GLU 793 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 2doe h LYS 794 N 0.00 -0.54 -0.72 5.31 1.63 -1.43 -0.50 116.57 120.32 2doe h LYS 794 Ca 0.18 0.04 0.13 0.00 -0.85 0.00 0.00 60.65 60.15 2doe h LYS 794 Cb 0.41 0.12 -0.13 0.00 -0.60 0.00 0.00 32.23 32.03 2doe h LYS 794 CO -0.88 -0.36 -0.30 0.82 -3.45 0.00 0.00 179.45 175.28 2doe h ILE 795 N -0.56 0.16 -0.33 2.00 2.04 -0.50 0.69 117.51 121.01 2doe h ILE 795 Ca 0.03 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.95 2doe h ILE 795 Cb 0.66 0.16 -0.06 0.00 -0.74 0.00 0.00 36.82 36.85 2doe h ILE 795 CO -0.43 0.00 -0.03 0.50 0.00 0.00 0.00 178.15 178.19 2doe h LYS 796 N -0.08 0.06 -0.11 2.37 3.64 -0.34 -0.53 116.57 121.58 2doe h LYS 796 Ca 0.30 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.72 2doe h LYS 796 Cb 0.56 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.31 2doe h LYS 796 CO -0.77 0.04 -0.31 1.03 -2.27 0.00 0.00 179.45 177.17 2doe h SER 797 N 0.06 -0.97 -0.93 4.20 0.87 0.69 -0.97 113.55 116.50 2doe h SER 797 Ca 0.16 0.14 0.07 0.00 -1.23 0.00 0.00 61.79 60.93 2doe h SER 797 Cb 0.23 0.41 -0.07 0.00 -0.44 0.00 0.00 62.40 62.53 2doe h SER 797 CO -0.29 -0.36 0.59 -0.78 -0.53 0.00 0.00 176.83 175.46 2doe h ASP 798 N -0.40 0.93 0.38 6.23 1.82 -0.87 -2.10 116.42 122.41 2doe h ASP 798 Ca 0.09 0.02 -0.00 0.00 -0.39 0.00 0.00 57.03 56.74 2doe h ASP 798 Cb 0.54 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 40.35 2doe h ASP 798 CO -0.33 0.59 -0.35 0.15 -1.61 0.00 0.00 179.24 177.68 2doe h PHE 799 N 1.06 -0.95 -0.63 0.28 3.57 0.00 -2.35 116.94 117.93 2doe h PHE 799 Ca 0.41 0.00 0.10 0.00 3.53 0.00 0.00 57.97 62.02 2doe h PHE 799 Cb 0.19 0.37 -0.08 0.00 2.79 0.00 0.00 35.95 39.22 2doe h PHE 799 CO -0.02 -0.50 0.22 0.74 -2.23 0.00 0.00 178.31 176.52 2doe h PHE 800 N -0.75 0.38 -0.24 0.41 0.04 -0.92 -2.17 116.94 113.69 2doe h PHE 800 Ca -0.03 0.03 0.06 0.00 2.80 0.00 0.00 57.97 60.83 2doe h PHE 800 Cb 0.67 -0.08 -0.08 0.00 2.20 0.00 0.00 35.95 38.67 2doe h PHE 800 CO -0.19 0.07 -0.34 0.93 -0.60 0.00 0.00 178.31 178.19 2doe h GLU 801 N 0.39 -0.33 0.30 1.51 5.08 -1.04 -0.95 114.58 119.53 2doe h GLU 801 Ca 0.32 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.70 2doe h GLU 801 Cb 0.43 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2doe h GLU 801 CO -0.33 -0.22 -0.30 1.25 -1.00 0.00 0.00 179.01 178.40 2doe h LEU 802 N -0.35 -0.84 -0.91 1.33 5.85 -0.89 0.22 115.31 119.73 2doe h LEU 802 Ca 0.12 0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.99 2doe h LEU 802 Cb 0.55 0.28 -0.11 0.00 0.37 0.00 0.00 40.66 41.75 2doe h LEU 802 CO -0.44 -0.40 -0.54 0.18 -0.34 0.00 0.00 178.44 176.91 2doe n LEU 803 N -4.21 -0.96 -0.23 2.25 4.77 -0.88 0.10 117.00 117.82 2doe n LEU 803 Ca -0.07 1.71 0.03 0.00 -0.03 0.00 0.00 56.01 57.64 2doe n LEU 803 Cb 0.28 -0.25 0.15 0.00 -2.33 0.00 0.00 43.42 41.26 2doe n LEU 803 CO 0.16 -1.36 1.01 -1.28 -1.33 0.00 0.00 177.39 174.58 2doe h SER 804 N 0.00 0.27 -0.35 -1.43 0.87 -1.08 0.20 113.55 112.03 2doe h SER 804 Ca 0.15 0.09 0.10 0.00 -1.23 0.00 0.00 61.79 60.90 2doe h SER 804 Cb 0.37 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.38 2doe h SER 804 CO -0.85 0.13 0.34 0.78 -0.53 0.00 0.00 176.83 176.70 2doe h ASN 805 N 0.45 0.00 -0.14 6.23 4.21 0.18 -0.59 115.58 125.91 2doe h ASN 805 Ca 0.36 0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.79 2doe h ASN 805 Cb 0.49 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.65 2doe h ASN 805 CO -0.35 0.00 0.10 1.41 -1.29 0.00 0.00 177.43 177.31 2doe n HIS 806 N -3.91 0.45 -3.85 1.19 8.25 0.71 -4.84 115.22 113.22 2doe n HIS 806 Ca 0.06 -0.89 -0.26 0.00 -0.26 0.00 0.00 57.72 56.36 2doe n HIS 806 Cb 0.51 -0.44 -0.03 0.00 1.12 0.00 0.00 29.99 31.15 2doe n HIS 806 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2doe n HIS 807 N 0.56 -0.88 -0.93 4.41 1.44 -0.23 -4.78 115.22 114.82 2doe n HIS 807 Ca 0.09 0.22 -0.36 0.00 -2.01 0.00 0.00 57.72 55.66 2doe n HIS 807 Cb 0.62 -1.86 0.07 0.00 0.12 0.00 0.00 29.99 28.94 2doe n HIS 807 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2doe n LEU 808 N -3.57 -3.87 -4.05 2.39 4.77 -1.24 -5.02 117.00 106.40 2doe n LEU 808 Ca -0.15 0.16 -0.10 0.00 -0.03 0.00 0.00 56.01 55.89 2doe n LEU 808 Cb 0.42 -0.83 -0.07 0.00 -2.33 0.00 0.00 43.42 40.61 2doe n LEU 808 CO 0.54 -4.63 -0.00 1.51 -1.33 0.00 0.00 177.39 173.48 2doe s ASP 809 N -1.30 0.02 0.29 -1.43 1.47 -1.26 -5.03 116.67 109.42 2doe s ASP 809 Ca 0.44 -1.06 -0.00 0.00 1.18 0.00 0.00 52.55 53.11 2doe s ASP 809 Cb -0.13 0.49 0.43 0.00 -0.34 0.00 0.00 42.92 43.36 2doe s ASP 809 CO 0.75 -0.99 1.82 0.77 0.68 0.00 0.00 175.17 178.20 2doe h SER 810 N 2.44 0.70 -0.24 2.11 4.64 -1.95 -1.74 113.55 119.51 2doe h SER 810 Ca -0.30 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2doe h SER 810 Cb 1.24 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2doe h SER 810 CO 0.44 0.73 0.00 0.00 -0.87 0.00 0.00 176.83 177.13 2doe n GLN 811 N -4.26 2.36 -1.82 4.77 6.02 -1.26 -4.92 117.38 118.27 2doe n GLN 811 Ca 0.03 -1.19 -0.42 0.00 -0.01 0.00 0.00 57.00 55.41 2doe n GLN 811 Cb 0.25 -1.69 -0.03 0.00 1.02 0.00 0.00 30.24 29.79 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 -0.43 6.46 0.09 1.08 0.01 -0.66 -5.00 113.70 115.25 2doe s SER 812 Ca 0.21 2.78 0.07 0.00 1.31 0.00 0.00 55.95 60.32 2doe s SER 812 Cb 0.15 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.74 2doe s SER 812 CO 0.07 -0.90 -0.11 -0.13 0.41 0.00 0.00 173.24 172.59 2doe s ARG 813 N 0.92 2.13 0.00 12.44 1.81 -1.26 -5.01 118.95 129.97 2doe s ARG 813 Ca 0.71 -1.01 -0.02 0.00 -1.72 0.00 0.00 55.73 53.69 2doe s ARG 813 Cb -0.47 -2.30 -0.01 0.00 -0.45 0.00 0.00 34.95 31.72 2doe s ARG 813 CO 0.34 0.51 0.72 2.35 -0.68 0.00 0.00 175.30 178.54 2doe h TRP 814 N 3.73 -0.08 -0.76 -0.53 -0.00 -1.98 -0.49 115.95 115.84 2doe h TRP 814 Ca -0.49 -0.00 0.32 0.00 -0.00 0.00 0.00 58.89 58.72 2doe h TRP 814 Cb 1.17 0.03 -0.13 0.00 -0.00 0.00 0.00 29.16 30.22 2doe h TRP 814 CO 0.60 -0.05 0.41 0.43 -0.00 0.00 0.00 178.44 179.83 2doe n SER 815 N -2.32 0.26 0.09 2.65 7.64 -1.26 0.07 113.62 120.75 2doe n SER 815 Ca -0.01 1.25 -0.04 0.00 1.01 0.00 0.00 58.87 61.07 2doe n SER 815 Cb 0.03 -0.61 -0.02 0.00 -1.01 0.00 0.00 64.21 62.61 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 -0.26 -1.10 1.43 6.56 -1.98 -2.22 116.57 119.00 2doe h LYS 816 Ca 0.64 0.02 0.32 0.00 -1.06 0.00 0.00 60.65 60.57 2doe h LYS 816 Cb 1.71 0.06 -0.04 0.00 -0.57 0.00 0.00 32.23 33.38 2doe h LYS 816 CO -0.57 -0.17 0.87 -0.24 -2.06 0.00 0.00 179.45 177.28 2doe h VAL 817 N -0.66 0.32 0.00 0.50 3.04 0.96 0.21 116.25 120.63 2doe h VAL 817 Ca -0.03 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.62 2doe h VAL 817 Cb 0.20 0.37 0.00 0.00 -2.01 0.00 0.00 31.29 29.86 2doe h VAL 817 CO 0.04 0.00 -0.18 0.50 -1.01 0.00 0.00 177.57 176.93 2doe h LYS 818 N 0.00 0.12 0.00 4.17 3.64 -0.41 -0.66 116.57 123.44 2doe h LYS 818 Ca 0.52 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 2doe h LYS 818 Cb 2.26 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 34.12 2doe h LYS 818 CO -0.01 0.89 0.00 0.22 -2.27 0.00 0.00 179.45 178.28 2doe h ASP 819 N -0.60 0.00 0.08 4.20 3.58 -0.03 0.33 116.42 123.98 2doe h ASP 819 Ca -0.02 0.00 -0.36 0.00 0.42 0.00 0.00 57.03 57.07 2doe h ASP 819 Cb 0.95 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.97 2doe h ASP 819 CO 0.03 0.00 -2.05 0.29 -2.88 0.00 0.00 179.24 174.63 2doe n LYS 820 N -2.56 0.71 0.08 0.28 4.76 -0.05 -4.34 118.16 117.05 2doe n LYS 820 Ca 0.00 0.27 -0.09 0.00 -2.87 0.00 0.00 58.31 55.63 2doe n LYS 820 Cb 0.18 -1.66 -0.05 0.00 -1.84 0.00 0.00 35.03 31.66 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 -0.10 1.57 -1.45 -0.18 -1.51 -0.88 -3.27 116.25 110.43 2doe h VAL 821 Ca -0.46 -2.91 0.42 0.00 -1.23 0.00 0.00 66.70 62.51 2doe h VAL 821 Cb 1.91 2.64 -0.06 0.00 -2.13 0.00 0.00 31.29 33.66 2doe h VAL 821 CO -0.00 0.84 1.27 -1.84 -1.23 0.00 0.00 177.57 176.61 2doe n GLU 822 N -3.55 0.01 -0.27 5.19 0.28 0.11 0.22 120.64 122.64 2doe n GLU 822 Ca -0.03 1.01 -0.04 0.00 -0.16 0.00 0.00 57.16 57.94 2doe n GLU 822 Cb 0.87 -2.42 0.06 0.00 1.43 0.00 0.00 31.44 31.38 2doe n GLU 822 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2doe n SER 823 N -3.50 2.89 -3.96 -1.84 2.88 -1.23 -4.79 113.62 104.07 2doe n SER 823 Ca 0.33 -2.33 -0.16 0.00 -1.33 0.00 0.00 58.87 55.37 2doe n SER 823 Cb 1.71 -0.57 -0.14 0.00 -0.75 0.00 0.00 64.21 64.45 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 0.29 0.60 0.30 -3.46 -1.08 0.61 -5.04 116.67 108.88 2doe s ASP 824 Ca 0.13 -0.09 0.08 0.00 -0.52 0.00 0.00 52.55 52.15 2doe s ASP 824 Cb 0.11 -0.07 0.46 0.00 -1.46 0.00 0.00 42.92 41.96 2doe s ASP 824 CO 0.03 0.06 1.69 1.55 0.52 0.00 0.00 175.17 179.02 2doe h PRO 825 N 6.04 0.14 -0.60 4.34 0.13 -1.86 -3.03 132.00 137.15 2doe h PRO 825 Ca -0.28 -0.07 0.04 0.00 -0.87 0.00 0.00 66.00 64.81 2doe h PRO 825 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2doe h PRO 825 CO 0.50 0.59 0.40 0.00 -0.23 0.00 0.00 178.00 179.26 2doe h ARG 826 N 0.11 0.67 -0.06 0.86 3.08 -1.96 -0.88 114.38 116.20 2doe h ARG 826 Ca 0.01 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 2doe h ARG 826 Cb 0.88 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 2doe h ARG 826 CO 0.07 0.44 -0.16 -0.92 -1.07 0.00 0.00 179.97 178.33 2doe h TYR 827 N 0.69 0.10 0.00 3.04 5.03 -1.83 -1.46 116.97 122.55 2doe h TYR 827 Ca 0.24 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.54 2doe h TYR 827 Cb 0.10 -0.03 0.00 0.00 1.55 0.00 0.00 36.73 38.35 2doe h TYR 827 CO -0.00 0.27 0.00 0.87 -1.32 0.00 0.00 178.16 177.98 2doe h LYS 828 N 0.10 0.00 -0.46 1.82 1.57 -1.27 -3.27 116.57 115.05 2doe h LYS 828 Ca 0.02 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.89 2doe h LYS 828 Cb 0.35 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.58 2doe h LYS 828 CO 0.02 0.00 -0.04 0.00 -0.57 0.00 0.00 179.45 178.86 2doe h ALA 829 N 2.11 0.39 -2.54 3.86 0.00 -1.05 -3.40 119.26 118.63 2doe h ALA 829 Ca 0.00 0.15 -0.53 0.00 0.00 0.00 0.00 54.91 54.53 2doe h ALA 829 Cb 0.75 0.28 0.02 0.00 0.00 0.00 0.00 17.79 18.83 2doe h ALA 829 CO 0.00 -0.41 0.71 0.08 0.00 0.00 0.00 179.25 179.63 2doe s VAL 830 N -6.19 3.37 -0.20 0.00 1.01 -1.24 -4.94 120.40 112.22 2doe s VAL 830 Ca -0.14 0.98 -0.23 0.00 0.00 0.00 0.00 61.98 62.60 2doe s VAL 830 Cb 0.15 -3.63 -0.20 0.00 0.00 0.00 0.00 36.38 32.70 2doe s VAL 830 CO 0.72 0.08 0.31 -0.78 0.00 0.00 0.00 175.10 175.43 2doe h ASP 831 N 6.80 0.00 -4.04 3.32 1.82 -1.91 -3.47 116.42 118.95 2doe h ASP 831 Ca -0.42 -0.59 -0.48 0.00 -0.39 0.00 0.00 57.03 55.15 2doe h ASP 831 Cb 1.21 0.00 0.03 0.00 0.68 0.00 0.00 39.33 41.25 2doe h ASP 831 CO 0.86 1.40 0.41 -0.44 -1.61 0.00 0.00 179.24 179.85 2doe s SER 832 N -6.73 6.39 -0.13 2.28 0.01 -1.26 -4.99 113.70 109.27 2doe s SER 832 Ca -0.27 2.01 -0.25 0.00 1.31 0.00 0.00 55.95 58.76 2doe s SER 832 Cb 0.04 -2.57 -0.26 0.00 0.21 0.00 0.00 66.02 63.44 2doe s SER 832 CO 0.61 -0.75 0.65 0.28 0.41 0.00 0.00 173.24 174.44 2doe h SER 833 N 1.84 0.13 -0.92 2.44 0.02 -2.01 -3.32 113.55 111.73 2doe h SER 833 Ca -0.49 -0.87 0.26 0.00 -0.84 0.00 0.00 61.79 59.85 2doe h SER 833 Cb 1.22 -0.04 -0.15 0.00 0.14 0.00 0.00 62.40 63.58 2doe h SER 833 CO 0.60 1.25 0.33 0.28 -1.14 0.00 0.00 176.83 178.14 2doe h SER 834 N -0.81 0.14 -0.36 3.07 0.02 -2.00 0.28 113.55 113.89 2doe h SER 834 Ca -0.14 0.20 0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2doe h SER 834 Cb 1.27 0.24 -0.02 0.00 0.14 0.00 0.00 62.40 64.02 2doe h SER 834 CO -0.01 -0.16 0.22 0.24 -1.14 0.00 0.00 176.83 175.98 2doe h MET 835 N 0.24 0.43 0.31 3.45 2.07 -1.99 0.24 114.93 119.67 2doe h MET 835 Ca 0.61 -0.03 0.00 0.00 -2.07 0.00 0.00 59.70 58.21 2doe h MET 835 Cb 1.28 -0.10 -0.03 0.00 -1.87 0.00 0.00 31.60 30.88 2doe h MET 835 CO -0.65 0.29 -0.37 0.00 1.07 0.00 0.00 176.91 177.25 2doe h ARG 836 N 0.44 -0.69 0.47 1.72 3.08 -0.55 0.32 114.38 119.16 2doe h ARG 836 Ca 0.14 0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 2doe h ARG 836 Cb -0.01 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2doe h ARG 836 CO -0.06 -0.46 -0.22 0.93 -1.07 0.00 0.00 179.97 179.08 2doe h GLU 837 N -0.72 -0.60 0.09 0.04 5.08 -1.27 -2.05 114.58 115.15 2doe h GLU 837 Ca -0.01 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2doe h GLU 837 Cb 0.67 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 2doe h GLU 837 CO -0.10 -0.38 -0.29 0.22 -1.00 0.00 0.00 179.01 177.46 2doe h ASP 838 N -0.67 -0.85 -0.80 1.42 1.82 -0.44 0.11 116.42 117.01 2doe h ASP 838 Ca -0.06 0.09 0.12 0.00 -0.39 0.00 0.00 57.03 56.78 2doe h ASP 838 Cb 0.50 0.31 -0.13 0.00 0.68 0.00 0.00 39.33 40.69 2doe h ASP 838 CO 0.11 -0.31 -0.41 -0.07 -1.61 0.00 0.00 179.24 176.95 2doe h LEU 839 N -0.43 -1.46 0.41 2.28 3.38 -0.41 0.19 115.31 119.27 2doe h LEU 839 Ca -0.01 0.28 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 2doe h LEU 839 Cb 0.42 0.72 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 2doe h LEU 839 CO -0.14 -0.30 -0.50 0.15 0.09 0.00 0.00 178.44 177.74 2doe h PHE 840 N -0.09 -1.41 -0.79 1.13 3.57 -1.05 -2.31 116.94 115.98 2doe h PHE 840 Ca 0.26 0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.97 2doe h PHE 840 Cb 0.56 0.56 -0.13 0.00 2.79 0.00 0.00 35.95 39.74 2doe h PHE 840 CO -0.79 -0.65 0.16 0.87 -2.23 0.00 0.00 178.31 175.67 2doe h LYS 841 N -0.94 0.21 0.09 1.11 1.57 0.33 -1.39 116.57 117.54 2doe h LYS 841 Ca -0.05 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2doe h LYS 841 Cb 0.84 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.05 2doe h LYS 841 CO -0.11 0.14 -0.50 1.96 -0.57 0.00 0.00 179.45 180.37 2doe h GLN 842 N 0.21 -0.68 -0.14 3.15 4.20 -0.15 0.14 115.11 121.84 2doe h GLN 842 Ca 0.46 0.05 0.05 0.00 0.06 0.00 0.00 58.65 59.27 2doe h GLN 842 Cb 0.85 0.15 -0.07 0.00 0.30 0.00 0.00 27.48 28.72 2doe h GLN 842 CO -0.60 -0.45 -0.35 -0.92 -0.67 0.00 0.00 178.83 175.84 2doe h TYR 843 N -0.71 -0.99 -0.43 2.96 5.03 -0.77 -1.94 116.97 120.13 2doe h TYR 843 Ca 0.01 0.04 0.09 0.00 2.58 0.00 0.00 58.73 61.45 2doe h TYR 843 Cb 0.73 0.46 -0.08 0.00 1.55 0.00 0.00 36.73 39.39 2doe h TYR 843 CO -0.45 -0.42 -0.11 0.82 -1.32 0.00 0.00 178.16 176.68 2doe h ILE 844 N -0.42 0.57 -0.76 1.81 1.08 -1.03 -1.01 117.51 117.74 2doe h ILE 844 Ca 0.09 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.73 2doe h ILE 844 Cb 0.57 0.57 -0.11 0.00 -3.07 0.00 0.00 36.82 34.78 2doe h ILE 844 CO -0.38 0.00 0.20 -0.33 -0.69 0.00 0.00 178.15 176.96 2doe h GLU 845 N -0.00 0.27 -0.55 2.37 5.08 0.01 0.43 114.58 122.19 2doe h GLU 845 Ca 0.21 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2doe h GLU 845 Cb 0.32 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 2doe h GLU 845 CO -0.44 0.18 0.34 -0.22 -1.00 0.00 0.00 179.01 177.87 2doe h LYS 846 N 0.28 0.75 0.32 2.33 3.64 -0.58 0.44 116.57 123.75 2doe h LYS 846 Ca 0.44 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.74 2doe h LYS 846 Cb 0.76 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2doe h LYS 846 CO -0.52 0.53 -0.21 0.82 -2.27 0.00 0.00 179.45 177.80 2doe h ILE 847 N 0.75 0.00 -0.68 2.00 2.04 -0.34 -0.66 117.51 120.62 2doe h ILE 847 Ca 0.20 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.17 2doe h ILE 847 Cb -0.03 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 35.97 2doe h ILE 847 CO -0.04 0.00 0.26 0.00 0.00 0.00 0.00 178.15 178.37 2doe h ALA 848 N -1.56 0.91 0.24 1.87 0.00 -1.32 -2.66 119.26 116.73 2doe h ALA 848 Ca -0.04 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2doe h ALA 848 Cb 0.41 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2doe h ALA 848 CO 0.03 -0.19 -0.49 0.87 0.00 0.00 0.00 179.25 179.47 2doe h LYS 849 N 0.43 -0.76 -4.91 0.00 1.57 -0.79 -3.29 116.57 108.83 2doe h LYS 849 Ca 0.35 0.05 -0.71 0.00 -1.87 0.00 0.00 60.65 58.48 2doe h LYS 849 Cb 0.48 0.17 -0.18 0.00 0.08 0.00 0.00 32.23 32.78 2doe h LYS 849 CO -0.35 -0.51 0.97 1.21 -0.57 0.00 0.00 179.45 180.21 2doe s ASN 850 N -4.42 6.77 0.59 0.86 2.47 -0.26 -5.02 114.94 115.93 2doe s ASN 850 Ca -0.16 -2.36 -0.19 0.00 0.42 0.00 0.00 52.86 50.57 2doe s ASN 850 Cb 0.05 -2.39 -0.04 0.00 -1.45 0.00 0.00 41.25 37.42 2doe s ASN 850 CO 0.57 -0.95 1.16 0.18 -3.72 0.00 0.00 177.10 174.34 2doe n LEU 851 N 6.19 4.77 -4.88 3.21 4.77 -1.24 -4.80 117.00 125.02 2doe n LEU 851 Ca 0.28 0.87 -0.21 0.00 -0.03 0.00 0.00 56.01 56.91 2doe n LEU 851 Cb 0.47 -1.48 -0.03 0.00 -2.33 0.00 0.00 43.42 40.05 2doe n LEU 851 CO 0.54 -1.28 -0.09 -1.81 -1.33 0.00 0.00 177.39 173.41 2doe s ASP 852 N -1.18 5.66 -1.21 -1.43 1.01 -1.26 -5.04 116.67 113.22 2doe s ASP 852 Ca 0.76 -0.25 -0.09 0.00 0.71 0.00 0.00 52.55 53.68 2doe s ASP 852 Cb -0.41 -1.35 0.21 0.00 1.01 0.00 0.00 42.92 42.37 2doe s ASP 852 CO 0.46 -0.17 1.63 -1.54 0.21 0.00 0.00 175.17 175.75 2doe n SER 853 N -1.33 5.42 -4.33 0.27 3.41 -1.26 -4.87 113.62 110.93 2doe n SER 853 Ca -0.06 -3.13 -0.21 0.00 -0.26 0.00 0.00 58.87 55.21 2doe n SER 853 Cb 0.58 -1.45 -0.11 0.00 -0.26 0.00 0.00 64.21 62.97 2doe n SER 853 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2doe s SER 854 N 0.88 2.63 0.00 4.04 0.01 -1.26 -5.08 113.70 114.93 2doe s SER 854 Ca 0.38 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.78 2doe s SER 854 Cb 0.04 -0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.12 2doe s SER 854 CO 0.02 -0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2doe n GLY 855 N 0.29 -0.17 0.18 3.44 0.00 -1.26 -4.62 105.19 103.05 2doe n GLY 855 Ca -0.13 -1.84 -0.02 0.00 0.00 0.00 0.00 46.02 44.03 2doe n GLY 855 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2doe h PRO 856 N 0.00 0.18 -6.85 1.61 0.13 -2.04 -3.44 132.00 121.60 2doe h PRO 856 Ca 0.00 -0.10 -0.47 0.00 -0.87 0.00 0.00 66.00 64.56 2doe h PRO 856 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 2doe h PRO 856 CO 0.00 0.62 0.32 -1.12 -0.23 0.00 0.00 178.00 177.58 2doe s SER 857 N -6.88 7.30 -0.27 1.44 0.01 -1.26 -5.05 113.70 108.99 2doe s SER 857 Ca -0.04 1.78 -0.07 0.00 1.31 0.00 0.00 55.95 58.93 2doe s SER 857 Cb 0.13 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 2doe s SER 857 CO 0.77 -0.06 0.08 -0.44 0.41 0.00 0.00 173.24 174.00 2doe s SER 858 N -1.62 5.11 0.00 2.44 0.01 -1.26 -4.71 113.70 113.66 2doe s SER 858 Ca 0.49 -0.48 0.08 0.00 1.31 0.00 0.00 55.95 57.35 2doe s SER 858 Cb -0.18 -1.90 0.47 0.00 0.21 0.00 0.00 66.02 64.61 2doe s SER 858 CO 0.23 -0.12 0.92 0.61 0.41 0.00 0.00 173.24 175.29